USER MOD reduce.3.24.130724 H: found=0, std=0, add=931, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 930 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 59 MET CE :methyl -172:sc= -2.14 (180deg=-2.52) USER MOD Set 1.2: A 115 HIS : no HD1:sc= -8.89! K(o=-11!,f=-8.4) USER MOD Set 2.1: A 53 HIS : no HD1:sc= -2.35! C(o=1.1!,f=-20!) USER MOD Set 2.2: A 57 LYS NZ :NH3+ -178:sc= 1.85 (180deg=-0.0302) USER MOD Set 2.3: A 76 HIS : no HE2:sc= 0.915 K(o=1.1,f=-11!) USER MOD Set 2.4: A 99 TYR OH : rot 136:sc= 0.695 USER MOD Set 3.1: A 6 THR OG1 : rot 180:sc= 0.279 USER MOD Set 3.2: A 35 GLN : amide:sc= -0.47 K(o=-0.19,f=-5.1!) USER MOD Single : A 10 HIS : no HD1:sc= -0.376 K(o=-0.38,f=-1.2) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 180:sc= -0.232 USER MOD Single : A 29 MET CE :methyl -166:sc= -0.632 (180deg=-1.27) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0.277 USER MOD Single : A 40 LYS NZ :NH3+ -129:sc= 2.38 (180deg=-0.712) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.0349) USER MOD Single : A 55 THR OG1 : rot 75:sc= 1.05 USER MOD Single : A 68 ASN : amide:sc= -0.751 K(o=-0.75,f=-0.13) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN : amide:sc= 1.11 K(o=1.1,f=-6.1!) USER MOD Single : A 93 GLN : amide:sc= -0.155 X(o=-0.15,f=0) USER MOD Single : A 95 THR OG1 : rot 83:sc= 0.46 USER MOD Single : A 97 THR OG1 : rot 130:sc= 1.16 USER MOD Single : A 100 CYS SG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 92:sc= 0.0384 USER MOD Single : A 102 THR OG1 : rot 78:sc= 0.486 USER MOD Single : A 104 MET CE :methyl 174:sc= -0.304 (180deg=-0.444) USER MOD Single : A 105 SER OG : rot -41:sc= 0.031 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.205 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0.117 USER MOD Single : A 113 CYS SG : rot 180:sc=-0.00117 USER MOD Single : A 121 LYS NZ :NH3+ -150:sc= 1.51 (180deg=0.614) USER MOD ----------------------------------------------------------------- ATOM 38 N GLY A 4 -2.905 6.114 1.939 1.00 0.00 N ATOM 39 CA GLY A 4 -3.831 5.907 3.047 1.00 0.00 C ATOM 40 C GLY A 4 -3.602 6.963 4.109 1.00 0.00 C ATOM 41 O GLY A 4 -3.498 6.662 5.296 1.00 0.00 O ATOM 0 HA2 GLY A 4 -4.859 5.956 2.688 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -3.688 4.913 3.472 1.00 0.00 H new ATOM 45 N ASP A 5 -3.533 8.205 3.635 1.00 0.00 N ATOM 46 CA ASP A 5 -3.337 9.404 4.424 1.00 0.00 C ATOM 47 C ASP A 5 -3.511 10.601 3.482 1.00 0.00 C ATOM 48 O ASP A 5 -4.179 11.571 3.830 1.00 0.00 O ATOM 49 CB ASP A 5 -1.941 9.411 5.100 1.00 0.00 C ATOM 50 CG ASP A 5 -1.902 10.391 6.269 1.00 0.00 C ATOM 51 OD1 ASP A 5 -2.351 10.002 7.373 1.00 0.00 O ATOM 52 OD2 ASP A 5 -1.413 11.517 6.051 1.00 0.00 O ATOM 0 H ASP A 5 -3.617 8.405 2.638 1.00 0.00 H new ATOM 0 HA ASP A 5 -4.066 9.451 5.233 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.700 8.409 5.454 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -1.180 9.683 4.368 1.00 0.00 H new ATOM 57 N THR A 6 -2.920 10.487 2.279 1.00 0.00 N ATOM 58 CA THR A 6 -2.925 11.421 1.168 1.00 0.00 C ATOM 59 C THR A 6 -2.517 12.811 1.602 1.00 0.00 C ATOM 60 O THR A 6 -1.768 12.935 2.564 1.00 0.00 O ATOM 61 CB THR A 6 -4.189 11.312 0.323 1.00 0.00 C ATOM 62 OG1 THR A 6 -4.034 11.968 -0.921 1.00 0.00 O ATOM 63 CG2 THR A 6 -5.351 11.924 1.062 1.00 0.00 C ATOM 0 H THR A 6 -2.378 9.654 2.051 1.00 0.00 H new ATOM 0 HA THR A 6 -2.142 11.133 0.466 1.00 0.00 H new ATOM 0 HB THR A 6 -4.377 10.255 0.137 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.859 11.880 -1.442 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.252 11.844 0.454 1.00 0.00 H new ATOM 0 HG22 THR A 6 -5.501 11.397 2.004 1.00 0.00 H new ATOM 0 HG23 THR A 6 -5.142 12.975 1.263 1.00 0.00 H new ATOM 71 N PHE A 7 -2.938 13.821 0.830 1.00 0.00 N ATOM 72 CA PHE A 7 -2.495 15.199 0.974 1.00 0.00 C ATOM 73 C PHE A 7 -3.617 16.225 0.861 1.00 0.00 C ATOM 74 O PHE A 7 -4.760 15.850 0.617 1.00 0.00 O ATOM 75 CB PHE A 7 -1.321 15.326 0.006 1.00 0.00 C ATOM 76 CG PHE A 7 -0.437 14.046 0.123 1.00 0.00 C ATOM 77 CD1 PHE A 7 0.467 13.870 1.202 1.00 0.00 C ATOM 78 CD2 PHE A 7 -0.576 12.966 -0.791 1.00 0.00 C ATOM 79 CE1 PHE A 7 1.244 12.705 1.321 1.00 0.00 C ATOM 80 CE2 PHE A 7 0.205 11.803 -0.669 1.00 0.00 C ATOM 81 CZ PHE A 7 1.125 11.675 0.379 1.00 0.00 C ATOM 0 H PHE A 7 -3.610 13.692 0.074 1.00 0.00 H new ATOM 0 HA PHE A 7 -2.156 15.438 1.982 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -1.684 15.443 -1.015 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -0.733 16.214 0.239 1.00 0.00 H new ATOM 0 HD1 PHE A 7 0.560 14.647 1.947 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -1.295 13.040 -1.594 1.00 0.00 H new ATOM 0 HE1 PHE A 7 1.937 12.603 2.143 1.00 0.00 H new ATOM 0 HE2 PHE A 7 0.095 11.004 -1.387 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.738 10.789 0.460 1.00 0.00 H new ATOM 91 N ILE A 8 -3.308 17.511 1.088 1.00 0.00 N ATOM 92 CA ILE A 8 -4.290 18.587 1.116 1.00 0.00 C ATOM 93 C ILE A 8 -4.282 19.460 -0.138 1.00 0.00 C ATOM 94 O ILE A 8 -3.226 19.653 -0.739 1.00 0.00 O ATOM 95 CB ILE A 8 -3.999 19.491 2.339 1.00 0.00 C ATOM 96 CG1 ILE A 8 -3.778 18.706 3.642 1.00 0.00 C ATOM 97 CG2 ILE A 8 -5.096 20.540 2.554 1.00 0.00 C ATOM 98 CD1 ILE A 8 -5.034 17.974 4.121 1.00 0.00 C ATOM 0 H ILE A 8 -2.354 17.829 1.259 1.00 0.00 H new ATOM 0 HA ILE A 8 -5.271 18.116 1.173 1.00 0.00 H new ATOM 0 HB ILE A 8 -3.064 19.996 2.095 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -2.977 17.982 3.492 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -3.445 19.392 4.421 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -4.850 21.151 3.422 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -5.169 21.176 1.672 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -6.050 20.040 2.721 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -4.813 17.439 5.045 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -5.830 18.697 4.302 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -5.355 17.264 3.358 1.00 0.00 H new ATOM 110 N ARG A 9 -5.446 20.034 -0.497 1.00 0.00 N ATOM 111 CA ARG A 9 -5.551 20.973 -1.601 1.00 0.00 C ATOM 112 C ARG A 9 -5.310 22.334 -0.947 1.00 0.00 C ATOM 113 O ARG A 9 -4.324 22.999 -1.269 1.00 0.00 O ATOM 114 CB ARG A 9 -6.937 20.870 -2.302 1.00 0.00 C ATOM 115 CG ARG A 9 -6.870 21.117 -3.821 1.00 0.00 C ATOM 116 CD ARG A 9 -6.775 22.592 -4.242 1.00 0.00 C ATOM 117 NE ARG A 9 -5.511 23.208 -3.823 1.00 0.00 N ATOM 118 CZ ARG A 9 -5.161 24.492 -3.993 1.00 0.00 C ATOM 119 NH1 ARG A 9 -5.880 25.300 -4.783 1.00 0.00 N ATOM 120 NH2 ARG A 9 -4.085 24.957 -3.346 1.00 0.00 N ATOM 0 H ARG A 9 -6.331 19.852 -0.023 1.00 0.00 H new ATOM 0 HA ARG A 9 -4.835 20.780 -2.400 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -7.356 19.880 -2.120 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -7.618 21.593 -1.853 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -6.007 20.585 -4.221 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -7.755 20.680 -4.283 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -6.872 22.666 -5.325 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -7.608 23.146 -3.809 1.00 0.00 H new ATOM 0 HE ARG A 9 -4.834 22.603 -3.358 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -6.705 24.941 -5.264 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -5.603 26.274 -4.904 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -3.549 24.338 -2.738 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -3.802 25.930 -3.461 1.00 0.00 H new ATOM 134 N HIS A 10 -6.202 22.725 -0.026 1.00 0.00 N ATOM 135 CA HIS A 10 -6.140 23.970 0.727 1.00 0.00 C ATOM 136 C HIS A 10 -7.255 24.050 1.778 1.00 0.00 C ATOM 137 O HIS A 10 -8.071 23.130 1.900 1.00 0.00 O ATOM 138 CB HIS A 10 -6.246 25.159 -0.255 1.00 0.00 C ATOM 139 CG HIS A 10 -7.648 25.674 -0.498 1.00 0.00 C ATOM 140 ND1 HIS A 10 -8.684 24.846 -0.898 1.00 0.00 N ATOM 141 CD2 HIS A 10 -8.211 26.925 -0.395 1.00 0.00 C ATOM 142 CE1 HIS A 10 -9.787 25.608 -1.008 1.00 0.00 C ATOM 143 NE2 HIS A 10 -9.563 26.887 -0.717 1.00 0.00 N ATOM 0 H HIS A 10 -7.013 22.157 0.218 1.00 0.00 H new ATOM 0 HA HIS A 10 -5.189 24.008 1.258 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -5.636 25.979 0.126 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -5.816 24.859 -1.211 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -7.675 27.816 -0.103 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -10.752 25.223 -1.301 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -10.229 27.660 -0.728 1.00 0.00 H new ATOM 151 N ILE A 11 -7.274 25.174 2.513 1.00 0.00 N ATOM 152 CA ILE A 11 -8.239 25.488 3.550 1.00 0.00 C ATOM 153 C ILE A 11 -9.083 26.697 3.140 1.00 0.00 C ATOM 154 O ILE A 11 -8.583 27.588 2.456 1.00 0.00 O ATOM 155 CB ILE A 11 -7.562 25.766 4.906 1.00 0.00 C ATOM 156 CG1 ILE A 11 -6.318 24.915 5.208 1.00 0.00 C ATOM 157 CG2 ILE A 11 -8.576 25.523 6.034 1.00 0.00 C ATOM 158 CD1 ILE A 11 -5.084 25.254 4.385 1.00 0.00 C ATOM 0 H ILE A 11 -6.582 25.913 2.386 1.00 0.00 H new ATOM 0 HA ILE A 11 -8.880 24.614 3.669 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.225 26.801 4.847 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.071 25.023 6.264 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -6.567 23.866 5.045 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.103 25.718 6.997 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -9.429 26.190 5.907 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -8.917 24.488 6.000 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.263 24.598 4.674 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.304 25.116 3.326 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -4.800 26.291 4.565 1.00 0.00 H new ATOM 170 N ALA A 12 -10.346 26.745 3.580 1.00 0.00 N ATOM 171 CA ALA A 12 -11.276 27.830 3.337 1.00 0.00 C ATOM 172 C ALA A 12 -12.071 27.887 4.633 1.00 0.00 C ATOM 173 O ALA A 12 -12.566 26.849 5.061 1.00 0.00 O ATOM 174 CB ALA A 12 -12.189 27.507 2.154 1.00 0.00 C ATOM 0 H ALA A 12 -10.755 25.994 4.136 1.00 0.00 H new ATOM 0 HA ALA A 12 -10.788 28.772 3.086 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.879 28.335 1.990 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -11.585 27.355 1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -12.755 26.600 2.368 1.00 0.00 H new ATOM 180 N LEU A 13 -12.189 29.042 5.288 1.00 0.00 N ATOM 181 CA LEU A 13 -12.911 29.130 6.551 1.00 0.00 C ATOM 182 C LEU A 13 -14.339 29.552 6.239 1.00 0.00 C ATOM 183 O LEU A 13 -14.550 30.313 5.295 1.00 0.00 O ATOM 184 CB LEU A 13 -12.165 30.086 7.482 1.00 0.00 C ATOM 185 CG LEU A 13 -12.355 30.008 9.025 1.00 0.00 C ATOM 186 CD1 LEU A 13 -11.448 31.111 9.562 1.00 0.00 C ATOM 187 CD2 LEU A 13 -13.722 30.198 9.682 1.00 0.00 C ATOM 0 H LEU A 13 -11.794 29.925 4.964 1.00 0.00 H new ATOM 0 HA LEU A 13 -12.962 28.176 7.075 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -11.101 29.960 7.284 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -12.428 31.099 7.178 1.00 0.00 H new ATOM 0 HG LEU A 13 -12.149 28.966 9.268 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -11.512 31.137 10.650 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -10.418 30.913 9.264 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -11.765 32.072 9.157 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -13.622 30.103 10.763 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -14.108 31.188 9.439 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -14.412 29.439 9.313 1.00 0.00 H new ATOM 199 N LEU A 14 -15.314 29.058 7.006 1.00 0.00 N ATOM 200 CA LEU A 14 -16.714 29.386 6.778 1.00 0.00 C ATOM 201 C LEU A 14 -17.133 30.461 7.753 1.00 0.00 C ATOM 202 O LEU A 14 -17.701 31.476 7.354 1.00 0.00 O ATOM 203 CB LEU A 14 -17.602 28.131 6.942 1.00 0.00 C ATOM 204 CG LEU A 14 -18.638 28.094 5.799 1.00 0.00 C ATOM 205 CD1 LEU A 14 -18.013 27.743 4.432 1.00 0.00 C ATOM 206 CD2 LEU A 14 -19.769 27.115 6.133 1.00 0.00 C ATOM 0 H LEU A 14 -15.154 28.428 7.792 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.837 29.751 5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -16.988 27.231 6.923 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -18.108 28.151 7.907 1.00 0.00 H new ATOM 0 HG LEU A 14 -19.043 29.102 5.712 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -18.791 27.732 3.668 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -17.261 28.488 4.174 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -17.545 26.760 4.487 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -20.491 27.101 5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -19.356 26.115 6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -20.265 27.431 7.051 1.00 0.00 H new ATOM 218 N GLY A 15 -16.840 30.231 9.031 1.00 0.00 N ATOM 219 CA GLY A 15 -17.202 31.242 10.014 1.00 0.00 C ATOM 220 C GLY A 15 -17.199 30.787 11.465 1.00 0.00 C ATOM 221 O GLY A 15 -16.188 30.314 11.973 1.00 0.00 O ATOM 0 H GLY A 15 -16.377 29.398 9.395 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -16.513 32.081 9.915 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -18.197 31.616 9.773 1.00 0.00 H new ATOM 225 N PHE A 16 -18.345 30.971 12.126 1.00 0.00 N ATOM 226 CA PHE A 16 -18.545 30.703 13.541 1.00 0.00 C ATOM 227 C PHE A 16 -18.995 29.261 13.784 1.00 0.00 C ATOM 228 O PHE A 16 -19.108 28.493 12.835 1.00 0.00 O ATOM 229 CB PHE A 16 -19.625 31.683 14.039 1.00 0.00 C ATOM 230 CG PHE A 16 -19.339 33.161 13.666 1.00 0.00 C ATOM 231 CD1 PHE A 16 -18.252 33.864 14.246 1.00 0.00 C ATOM 232 CD2 PHE A 16 -20.140 33.855 12.724 1.00 0.00 C ATOM 233 CE1 PHE A 16 -17.986 35.201 13.904 1.00 0.00 C ATOM 234 CE2 PHE A 16 -19.869 35.192 12.386 1.00 0.00 C ATOM 235 CZ PHE A 16 -18.794 35.869 12.975 1.00 0.00 C ATOM 0 H PHE A 16 -19.186 31.324 11.668 1.00 0.00 H new ATOM 0 HA PHE A 16 -17.606 30.837 14.079 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.589 31.391 13.622 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -19.708 31.600 15.123 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -17.618 33.363 14.963 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -20.972 33.348 12.259 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -17.154 35.716 14.360 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.494 35.701 11.667 1.00 0.00 H new ATOM 0 HZ PHE A 16 -18.590 36.897 12.715 1.00 0.00 H new ATOM 245 N GLU A 17 -19.263 28.930 15.054 1.00 0.00 N ATOM 246 CA GLU A 17 -19.774 27.669 15.587 1.00 0.00 C ATOM 247 C GLU A 17 -19.976 27.836 17.109 1.00 0.00 C ATOM 248 O GLU A 17 -19.380 28.721 17.723 1.00 0.00 O ATOM 249 CB GLU A 17 -18.918 26.461 15.170 1.00 0.00 C ATOM 250 CG GLU A 17 -19.259 25.113 15.833 1.00 0.00 C ATOM 251 CD GLU A 17 -20.646 24.569 15.499 1.00 0.00 C ATOM 252 OE1 GLU A 17 -21.625 25.322 15.682 1.00 0.00 O ATOM 253 OE2 GLU A 17 -20.717 23.361 15.177 1.00 0.00 O ATOM 0 H GLU A 17 -19.111 29.606 15.802 1.00 0.00 H new ATOM 0 HA GLU A 17 -20.745 27.436 15.149 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -19.002 26.340 14.090 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -17.875 26.692 15.385 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -18.513 24.377 15.532 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -19.179 25.225 16.914 1.00 0.00 H new ATOM 260 N LYS A 18 -20.851 27.017 17.707 1.00 0.00 N ATOM 261 CA LYS A 18 -21.287 26.988 19.083 1.00 0.00 C ATOM 262 C LYS A 18 -20.965 25.626 19.726 1.00 0.00 C ATOM 263 O LYS A 18 -21.685 24.645 19.524 1.00 0.00 O ATOM 264 CB LYS A 18 -22.807 27.261 19.176 1.00 0.00 C ATOM 265 CG LYS A 18 -23.483 27.897 17.957 1.00 0.00 C ATOM 266 CD LYS A 18 -23.095 29.363 17.739 1.00 0.00 C ATOM 267 CE LYS A 18 -23.431 29.808 16.312 1.00 0.00 C ATOM 268 NZ LYS A 18 -23.122 31.235 16.099 1.00 0.00 N ATOM 0 H LYS A 18 -21.312 26.285 17.168 1.00 0.00 H new ATOM 0 HA LYS A 18 -20.752 27.769 19.623 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -23.307 26.315 19.384 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -22.981 27.909 20.035 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -23.223 27.324 17.067 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -24.565 27.829 18.075 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -23.622 29.994 18.455 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -22.029 29.493 17.924 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -22.869 29.204 15.600 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -24.488 29.631 16.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -23.362 31.500 15.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -23.677 31.813 16.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -22.108 31.399 16.263 1.00 0.00 H new ATOM 282 N ARG A 19 -19.899 25.563 20.525 1.00 0.00 N ATOM 283 CA ARG A 19 -19.489 24.397 21.287 1.00 0.00 C ATOM 284 C ARG A 19 -19.580 24.805 22.752 1.00 0.00 C ATOM 285 O ARG A 19 -18.735 25.537 23.258 1.00 0.00 O ATOM 286 CB ARG A 19 -18.089 23.915 20.887 1.00 0.00 C ATOM 287 CG ARG A 19 -17.940 22.401 21.093 1.00 0.00 C ATOM 288 CD ARG A 19 -18.230 21.631 19.803 1.00 0.00 C ATOM 289 NE ARG A 19 -19.590 21.880 19.309 1.00 0.00 N ATOM 290 CZ ARG A 19 -19.937 22.015 18.022 1.00 0.00 C ATOM 291 NH1 ARG A 19 -19.108 21.650 17.035 1.00 0.00 N ATOM 292 NH2 ARG A 19 -21.129 22.543 17.726 1.00 0.00 N ATOM 0 H ARG A 19 -19.276 26.359 20.660 1.00 0.00 H new ATOM 0 HA ARG A 19 -20.134 23.541 21.088 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -17.902 24.162 19.842 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -17.339 24.440 21.478 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -16.929 22.176 21.433 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -18.621 22.070 21.877 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -17.508 21.919 19.039 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.098 20.564 19.980 1.00 0.00 H new ATOM 0 HE ARG A 19 -20.333 21.957 20.004 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -18.192 21.260 17.256 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -19.393 21.762 16.062 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -21.757 22.835 18.474 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -21.410 22.653 16.752 1.00 0.00 H new ATOM 401 N TYR A 26 -17.116 29.523 22.232 1.00 0.00 N ATOM 402 CA TYR A 26 -17.538 29.374 20.837 1.00 0.00 C ATOM 403 C TYR A 26 -16.319 28.975 20.001 1.00 0.00 C ATOM 404 O TYR A 26 -15.180 29.204 20.411 1.00 0.00 O ATOM 405 CB TYR A 26 -18.294 30.593 20.277 1.00 0.00 C ATOM 406 CG TYR A 26 -19.830 30.610 20.537 1.00 0.00 C ATOM 407 CD1 TYR A 26 -20.444 29.779 21.515 1.00 0.00 C ATOM 408 CD2 TYR A 26 -20.683 31.463 19.790 1.00 0.00 C ATOM 409 CE1 TYR A 26 -21.829 29.819 21.743 1.00 0.00 C ATOM 410 CE2 TYR A 26 -22.068 31.502 20.025 1.00 0.00 C ATOM 411 CZ TYR A 26 -22.643 30.682 21.003 1.00 0.00 C ATOM 412 OH TYR A 26 -23.987 30.714 21.232 1.00 0.00 O ATOM 0 HA TYR A 26 -18.283 28.580 20.784 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -17.861 31.496 20.707 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -18.125 30.640 19.201 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -19.832 29.103 22.094 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -20.259 32.096 19.024 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -22.268 29.179 22.494 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -22.692 32.168 19.448 1.00 0.00 H new ATOM 0 HH TYR A 26 -24.405 31.368 20.634 1.00 0.00 H new ATOM 422 N VAL A 27 -16.563 28.335 18.851 1.00 0.00 N ATOM 423 CA VAL A 27 -15.509 27.813 17.986 1.00 0.00 C ATOM 424 C VAL A 27 -15.784 28.226 16.538 1.00 0.00 C ATOM 425 O VAL A 27 -16.825 28.827 16.291 1.00 0.00 O ATOM 426 CB VAL A 27 -15.399 26.289 18.241 1.00 0.00 C ATOM 427 CG1 VAL A 27 -15.263 25.971 19.735 1.00 0.00 C ATOM 428 CG2 VAL A 27 -16.579 25.495 17.689 1.00 0.00 C ATOM 0 H VAL A 27 -17.504 28.166 18.496 1.00 0.00 H new ATOM 0 HA VAL A 27 -14.529 28.234 18.209 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.499 25.984 17.708 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -15.189 24.892 19.872 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.366 26.450 20.129 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -16.137 26.345 20.268 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -16.437 24.436 17.903 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -17.501 25.839 18.158 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -16.644 25.642 16.611 1.00 0.00 H new ATOM 438 N TYR A 28 -14.874 27.950 15.587 1.00 0.00 N ATOM 439 CA TYR A 28 -15.016 28.314 14.193 1.00 0.00 C ATOM 440 C TYR A 28 -15.274 27.132 13.258 1.00 0.00 C ATOM 441 O TYR A 28 -14.533 26.145 13.293 1.00 0.00 O ATOM 442 CB TYR A 28 -13.834 29.152 13.674 1.00 0.00 C ATOM 443 CG TYR A 28 -12.640 29.374 14.575 1.00 0.00 C ATOM 444 CD1 TYR A 28 -11.750 28.322 14.829 1.00 0.00 C ATOM 445 CD2 TYR A 28 -12.416 30.640 15.147 1.00 0.00 C ATOM 446 CE1 TYR A 28 -10.648 28.522 15.676 1.00 0.00 C ATOM 447 CE2 TYR A 28 -11.309 30.845 15.987 1.00 0.00 C ATOM 448 CZ TYR A 28 -10.429 29.785 16.254 1.00 0.00 C ATOM 449 OH TYR A 28 -9.355 29.994 17.062 1.00 0.00 O ATOM 0 H TYR A 28 -14.004 27.456 15.786 1.00 0.00 H new ATOM 0 HA TYR A 28 -15.914 28.932 14.175 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -13.473 28.681 12.760 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -14.223 30.132 13.396 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -11.912 27.356 14.373 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -13.095 31.454 14.940 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -9.970 27.707 15.883 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -11.136 31.816 16.426 1.00 0.00 H new ATOM 0 HH TYR A 28 -9.356 30.923 17.374 1.00 0.00 H new ATOM 459 N MET A 29 -16.304 27.258 12.405 1.00 0.00 N ATOM 460 CA MET A 29 -16.636 26.238 11.408 1.00 0.00 C ATOM 461 C MET A 29 -15.690 26.384 10.201 1.00 0.00 C ATOM 462 O MET A 29 -15.780 27.381 9.476 1.00 0.00 O ATOM 463 CB MET A 29 -18.112 26.380 11.020 1.00 0.00 C ATOM 464 CG MET A 29 -18.834 25.286 10.227 1.00 0.00 C ATOM 465 SD MET A 29 -18.077 24.700 8.701 1.00 0.00 S ATOM 466 CE MET A 29 -17.377 23.182 9.368 1.00 0.00 C ATOM 0 H MET A 29 -16.925 28.067 12.390 1.00 0.00 H new ATOM 0 HA MET A 29 -16.497 25.235 11.812 1.00 0.00 H new ATOM 0 HB2 MET A 29 -18.671 26.524 11.944 1.00 0.00 H new ATOM 0 HB3 MET A 29 -18.203 27.302 10.445 1.00 0.00 H new ATOM 0 HG2 MET A 29 -18.963 24.427 10.886 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.831 25.654 9.984 1.00 0.00 H new ATOM 0 HE1 MET A 29 -16.652 22.775 8.663 1.00 0.00 H new ATOM 0 HE2 MET A 29 -16.881 23.395 10.315 1.00 0.00 H new ATOM 0 HE3 MET A 29 -18.173 22.455 9.531 1.00 0.00 H new ATOM 476 N PHE A 30 -14.779 25.415 9.988 1.00 0.00 N ATOM 477 CA PHE A 30 -13.790 25.413 8.927 1.00 0.00 C ATOM 478 C PHE A 30 -14.053 24.408 7.801 1.00 0.00 C ATOM 479 O PHE A 30 -14.433 23.272 8.086 1.00 0.00 O ATOM 480 CB PHE A 30 -12.405 25.057 9.505 1.00 0.00 C ATOM 481 CG PHE A 30 -11.465 26.227 9.914 1.00 0.00 C ATOM 482 CD1 PHE A 30 -11.465 26.860 11.192 1.00 0.00 C ATOM 483 CD2 PHE A 30 -10.525 26.706 8.969 1.00 0.00 C ATOM 484 CE1 PHE A 30 -10.528 27.863 11.482 1.00 0.00 C ATOM 485 CE2 PHE A 30 -9.600 27.711 9.262 1.00 0.00 C ATOM 486 CZ PHE A 30 -9.589 28.284 10.528 1.00 0.00 C ATOM 0 H PHE A 30 -14.721 24.587 10.580 1.00 0.00 H new ATOM 0 HA PHE A 30 -13.840 26.417 8.506 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.560 24.430 10.383 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -11.881 24.449 8.768 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -12.188 26.566 11.938 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -10.523 26.275 7.979 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -10.529 28.321 12.460 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -8.898 28.040 8.510 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.865 29.046 10.775 1.00 0.00 H new ATOM 496 N LEU A 31 -13.787 24.790 6.536 1.00 0.00 N ATOM 497 CA LEU A 31 -13.907 23.903 5.398 1.00 0.00 C ATOM 498 C LEU A 31 -12.530 23.427 4.938 1.00 0.00 C ATOM 499 O LEU A 31 -11.713 24.255 4.530 1.00 0.00 O ATOM 500 CB LEU A 31 -14.665 24.583 4.245 1.00 0.00 C ATOM 501 CG LEU A 31 -16.171 24.304 4.255 1.00 0.00 C ATOM 502 CD1 LEU A 31 -16.459 22.875 3.812 1.00 0.00 C ATOM 503 CD2 LEU A 31 -16.803 24.570 5.623 1.00 0.00 C ATOM 0 H LEU A 31 -13.482 25.732 6.290 1.00 0.00 H new ATOM 0 HA LEU A 31 -14.483 23.031 5.708 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -14.503 25.659 4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -14.247 24.245 3.297 1.00 0.00 H new ATOM 0 HG LEU A 31 -16.624 24.996 3.545 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -17.535 22.699 3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -16.081 22.724 2.801 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -15.968 22.178 4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -17.871 24.357 5.578 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -16.337 23.928 6.370 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -16.652 25.614 5.897 1.00 0.00 H new ATOM 515 N VAL A 32 -12.271 22.106 4.969 1.00 0.00 N ATOM 516 CA VAL A 32 -11.022 21.564 4.471 1.00 0.00 C ATOM 517 C VAL A 32 -11.335 20.990 3.094 1.00 0.00 C ATOM 518 O VAL A 32 -12.335 20.282 2.934 1.00 0.00 O ATOM 519 CB VAL A 32 -10.317 20.593 5.427 1.00 0.00 C ATOM 520 CG1 VAL A 32 -11.248 19.673 6.212 1.00 0.00 C ATOM 521 CG2 VAL A 32 -9.253 19.765 4.696 1.00 0.00 C ATOM 0 H VAL A 32 -12.917 21.407 5.336 1.00 0.00 H new ATOM 0 HA VAL A 32 -10.271 22.350 4.393 1.00 0.00 H new ATOM 0 HB VAL A 32 -9.842 21.237 6.167 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -10.658 19.025 6.859 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -11.925 20.273 6.820 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -11.827 19.063 5.518 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -8.772 19.087 5.401 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -9.724 19.187 3.901 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -8.505 20.431 4.266 1.00 0.00 H new ATOM 531 N LYS A 33 -10.493 21.307 2.102 1.00 0.00 N ATOM 532 CA LYS A 33 -10.692 20.835 0.749 1.00 0.00 C ATOM 533 C LYS A 33 -9.595 19.834 0.435 1.00 0.00 C ATOM 534 O LYS A 33 -8.436 20.238 0.310 1.00 0.00 O ATOM 535 CB LYS A 33 -10.739 21.996 -0.248 1.00 0.00 C ATOM 536 CG LYS A 33 -11.128 21.471 -1.642 1.00 0.00 C ATOM 537 CD LYS A 33 -11.483 22.577 -2.646 1.00 0.00 C ATOM 538 CE LYS A 33 -12.819 23.257 -2.305 1.00 0.00 C ATOM 539 NZ LYS A 33 -13.221 24.231 -3.338 1.00 0.00 N ATOM 0 H LYS A 33 -9.667 21.892 2.225 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.659 20.340 0.659 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.460 22.743 0.084 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.768 22.488 -0.293 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -10.302 20.883 -2.041 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -11.979 20.798 -1.542 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.689 23.324 -2.659 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -11.538 22.153 -3.649 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.595 22.499 -2.199 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -12.734 23.763 -1.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -14.126 24.667 -3.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.493 24.969 -3.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -13.328 23.745 -4.251 1.00 0.00 H new ATOM 553 N TRP A 34 -9.938 18.543 0.304 1.00 0.00 N ATOM 554 CA TRP A 34 -8.926 17.561 -0.013 1.00 0.00 C ATOM 555 C TRP A 34 -8.895 17.385 -1.527 1.00 0.00 C ATOM 556 O TRP A 34 -9.933 17.537 -2.171 1.00 0.00 O ATOM 557 CB TRP A 34 -9.207 16.235 0.675 1.00 0.00 C ATOM 558 CG TRP A 34 -9.163 16.191 2.170 1.00 0.00 C ATOM 559 CD1 TRP A 34 -10.092 16.655 3.033 1.00 0.00 C ATOM 560 CD2 TRP A 34 -8.111 15.627 2.993 1.00 0.00 C ATOM 561 NE1 TRP A 34 -9.684 16.416 4.334 1.00 0.00 N ATOM 562 CE2 TRP A 34 -8.456 15.778 4.367 1.00 0.00 C ATOM 563 CE3 TRP A 34 -6.892 14.998 2.695 1.00 0.00 C ATOM 564 CZ2 TRP A 34 -7.616 15.319 5.398 1.00 0.00 C ATOM 565 CZ3 TRP A 34 -6.044 14.538 3.714 1.00 0.00 C ATOM 566 CH2 TRP A 34 -6.403 14.695 5.061 1.00 0.00 C ATOM 0 H TRP A 34 -10.884 18.176 0.412 1.00 0.00 H new ATOM 0 HA TRP A 34 -7.957 17.907 0.347 1.00 0.00 H new ATOM 0 HB2 TRP A 34 -10.196 15.900 0.361 1.00 0.00 H new ATOM 0 HB3 TRP A 34 -8.489 15.506 0.299 1.00 0.00 H new ATOM 0 HD1 TRP A 34 -11.015 17.140 2.751 1.00 0.00 H new ATOM 0 HE1 TRP A 34 -10.220 16.677 5.162 1.00 0.00 H new ATOM 0 HE3 TRP A 34 -6.602 14.866 1.663 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 -7.899 15.444 6.433 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 -5.109 14.060 3.460 1.00 0.00 H new ATOM 0 HH2 TRP A 34 -5.746 14.336 5.840 1.00 0.00 H new ATOM 577 N GLN A 35 -7.726 17.062 -2.099 1.00 0.00 N ATOM 578 CA GLN A 35 -7.631 16.873 -3.555 1.00 0.00 C ATOM 579 C GLN A 35 -8.048 15.456 -3.972 1.00 0.00 C ATOM 580 O GLN A 35 -8.085 15.162 -5.164 1.00 0.00 O ATOM 581 CB GLN A 35 -6.203 17.247 -4.092 1.00 0.00 C ATOM 582 CG GLN A 35 -5.160 16.124 -3.994 1.00 0.00 C ATOM 583 CD GLN A 35 -4.748 15.880 -2.553 1.00 0.00 C ATOM 584 OE1 GLN A 35 -3.892 16.589 -2.036 1.00 0.00 O ATOM 585 NE2 GLN A 35 -5.366 14.899 -1.897 1.00 0.00 N ATOM 0 H GLN A 35 -6.852 16.929 -1.591 1.00 0.00 H new ATOM 0 HA GLN A 35 -8.338 17.560 -4.019 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -6.291 17.551 -5.135 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -5.838 18.112 -3.538 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.569 15.207 -4.418 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.283 16.386 -4.586 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -6.072 14.335 -2.370 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -5.133 14.712 -0.922 1.00 0.00 H new ATOM 594 N ASP A 36 -8.353 14.589 -2.997 1.00 0.00 N ATOM 595 CA ASP A 36 -8.757 13.207 -3.179 1.00 0.00 C ATOM 596 C ASP A 36 -10.083 12.981 -2.457 1.00 0.00 C ATOM 597 O ASP A 36 -11.098 12.688 -3.086 1.00 0.00 O ATOM 598 CB ASP A 36 -7.624 12.303 -2.628 1.00 0.00 C ATOM 599 CG ASP A 36 -7.973 10.822 -2.707 1.00 0.00 C ATOM 600 OD1 ASP A 36 -8.564 10.423 -3.732 1.00 0.00 O ATOM 601 OD2 ASP A 36 -7.616 10.112 -1.741 1.00 0.00 O ATOM 0 H ASP A 36 -8.320 14.856 -2.013 1.00 0.00 H new ATOM 0 HA ASP A 36 -8.912 12.963 -4.230 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -6.709 12.488 -3.190 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -7.421 12.571 -1.591 1.00 0.00 H new ATOM 606 N LEU A 37 -10.085 13.147 -1.132 1.00 0.00 N ATOM 607 CA LEU A 37 -11.283 12.992 -0.315 1.00 0.00 C ATOM 608 C LEU A 37 -12.352 14.047 -0.640 1.00 0.00 C ATOM 609 O LEU A 37 -13.481 13.908 -0.174 1.00 0.00 O ATOM 610 CB LEU A 37 -10.958 13.010 1.178 1.00 0.00 C ATOM 611 CG LEU A 37 -10.219 11.771 1.759 1.00 0.00 C ATOM 612 CD1 LEU A 37 -8.771 11.703 1.276 1.00 0.00 C ATOM 613 CD2 LEU A 37 -10.256 11.853 3.275 1.00 0.00 C ATOM 0 H LEU A 37 -9.252 13.393 -0.598 1.00 0.00 H new ATOM 0 HA LEU A 37 -11.694 12.014 -0.565 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.350 13.892 1.381 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -11.892 13.134 1.726 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.721 10.868 1.413 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.286 10.825 1.702 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.753 11.635 0.188 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.239 12.600 1.593 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -9.741 10.991 3.699 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.761 12.767 3.602 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -11.292 11.860 3.614 1.00 0.00 H new ATOM 625 N SER A 38 -12.026 15.092 -1.417 1.00 0.00 N ATOM 626 CA SER A 38 -12.965 16.152 -1.790 1.00 0.00 C ATOM 627 C SER A 38 -13.309 16.996 -0.561 1.00 0.00 C ATOM 628 O SER A 38 -12.526 17.080 0.387 1.00 0.00 O ATOM 629 CB SER A 38 -14.225 15.541 -2.469 1.00 0.00 C ATOM 630 OG SER A 38 -14.914 16.542 -3.190 1.00 0.00 O ATOM 0 H SER A 38 -11.092 15.222 -1.806 1.00 0.00 H new ATOM 0 HA SER A 38 -12.503 16.816 -2.521 1.00 0.00 H new ATOM 0 HB2 SER A 38 -13.932 14.733 -3.140 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.881 15.107 -1.715 1.00 0.00 H new ATOM 0 HG SER A 38 -15.705 16.152 -3.617 1.00 0.00 H new ATOM 636 N GLU A 39 -14.480 17.635 -0.594 1.00 0.00 N ATOM 637 CA GLU A 39 -14.965 18.501 0.459 1.00 0.00 C ATOM 638 C GLU A 39 -15.120 17.737 1.777 1.00 0.00 C ATOM 639 O GLU A 39 -15.681 16.638 1.792 1.00 0.00 O ATOM 640 CB GLU A 39 -16.309 19.176 0.024 1.00 0.00 C ATOM 641 CG GLU A 39 -17.400 18.161 -0.357 1.00 0.00 C ATOM 642 CD GLU A 39 -18.688 18.875 -0.752 1.00 0.00 C ATOM 643 OE1 GLU A 39 -18.662 19.544 -1.808 1.00 0.00 O ATOM 644 OE2 GLU A 39 -19.669 18.749 0.013 1.00 0.00 O ATOM 0 H GLU A 39 -15.127 17.556 -1.379 1.00 0.00 H new ATOM 0 HA GLU A 39 -14.229 19.286 0.630 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -16.673 19.803 0.838 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -16.120 19.833 -0.825 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -17.054 17.541 -1.184 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -17.592 17.493 0.483 1.00 0.00 H new ATOM 651 N LYS A 40 -14.632 18.308 2.888 1.00 0.00 N ATOM 652 CA LYS A 40 -14.746 17.717 4.213 1.00 0.00 C ATOM 653 C LYS A 40 -14.880 18.895 5.176 1.00 0.00 C ATOM 654 O LYS A 40 -14.260 19.935 4.953 1.00 0.00 O ATOM 655 CB LYS A 40 -13.553 16.803 4.551 1.00 0.00 C ATOM 656 CG LYS A 40 -13.501 15.492 3.746 1.00 0.00 C ATOM 657 CD LYS A 40 -14.629 14.526 4.151 1.00 0.00 C ATOM 658 CE LYS A 40 -14.878 13.406 3.134 1.00 0.00 C ATOM 659 NZ LYS A 40 -15.325 13.932 1.829 1.00 0.00 N ATOM 0 H LYS A 40 -14.143 19.203 2.883 1.00 0.00 H new ATOM 0 HA LYS A 40 -15.611 17.057 4.281 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -12.629 17.356 4.380 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -13.588 16.561 5.613 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -13.579 15.716 2.682 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -12.536 15.009 3.900 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -14.385 14.081 5.116 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -15.550 15.093 4.286 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -13.963 12.830 2.998 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -15.630 12.721 3.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -16.188 13.433 1.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -15.525 14.949 1.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.578 13.785 1.121 1.00 0.00 H new ATOM 673 N VAL A 41 -15.712 18.766 6.215 1.00 0.00 N ATOM 674 CA VAL A 41 -15.984 19.843 7.141 1.00 0.00 C ATOM 675 C VAL A 41 -15.372 19.531 8.499 1.00 0.00 C ATOM 676 O VAL A 41 -15.359 18.364 8.881 1.00 0.00 O ATOM 677 CB VAL A 41 -17.495 20.113 7.145 1.00 0.00 C ATOM 678 CG1 VAL A 41 -18.097 19.873 5.747 1.00 0.00 C ATOM 679 CG2 VAL A 41 -18.226 19.329 8.235 1.00 0.00 C ATOM 0 H VAL A 41 -16.212 17.903 6.428 1.00 0.00 H new ATOM 0 HA VAL A 41 -15.509 20.775 6.834 1.00 0.00 H new ATOM 0 HB VAL A 41 -17.639 21.165 7.390 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -19.169 20.070 5.774 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -17.623 20.540 5.027 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -17.926 18.838 5.450 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -19.291 19.556 8.194 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -18.076 18.261 8.077 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -17.832 19.610 9.212 1.00 0.00 H new ATOM 689 N VAL A 42 -14.860 20.539 9.224 1.00 0.00 N ATOM 690 CA VAL A 42 -14.259 20.315 10.531 1.00 0.00 C ATOM 691 C VAL A 42 -14.483 21.541 11.417 1.00 0.00 C ATOM 692 O VAL A 42 -14.627 22.656 10.920 1.00 0.00 O ATOM 693 CB VAL A 42 -12.770 19.925 10.447 1.00 0.00 C ATOM 694 CG1 VAL A 42 -12.496 18.718 9.535 1.00 0.00 C ATOM 695 CG2 VAL A 42 -11.851 21.087 10.046 1.00 0.00 C ATOM 0 H VAL A 42 -14.854 21.513 8.920 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.755 19.458 10.986 1.00 0.00 H new ATOM 0 HB VAL A 42 -12.528 19.637 11.470 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.427 18.504 9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.037 17.849 9.909 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.829 18.944 8.522 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.819 20.738 10.007 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.144 21.461 9.065 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.936 21.888 10.780 1.00 0.00 H new ATOM 705 N TYR A 43 -14.533 21.330 12.734 1.00 0.00 N ATOM 706 CA TYR A 43 -14.812 22.323 13.739 1.00 0.00 C ATOM 707 C TYR A 43 -13.513 22.595 14.481 1.00 0.00 C ATOM 708 O TYR A 43 -12.854 21.634 14.858 1.00 0.00 O ATOM 709 CB TYR A 43 -15.880 21.748 14.664 1.00 0.00 C ATOM 710 CG TYR A 43 -17.011 20.953 13.905 1.00 0.00 C ATOM 711 CD1 TYR A 43 -16.802 19.709 13.238 1.00 0.00 C ATOM 712 CD2 TYR A 43 -18.322 21.473 13.826 1.00 0.00 C ATOM 713 CE1 TYR A 43 -17.839 19.052 12.552 1.00 0.00 C ATOM 714 CE2 TYR A 43 -19.358 20.814 13.148 1.00 0.00 C ATOM 715 CZ TYR A 43 -19.121 19.598 12.506 1.00 0.00 C ATOM 716 OH TYR A 43 -20.124 18.958 11.841 1.00 0.00 O ATOM 0 H TYR A 43 -14.369 20.407 13.136 1.00 0.00 H new ATOM 0 HA TYR A 43 -15.179 23.260 13.320 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.404 21.085 15.387 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -16.336 22.561 15.229 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -15.820 19.260 13.261 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -18.535 22.416 14.307 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -17.640 18.114 12.055 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -20.346 21.251 13.123 1.00 0.00 H new ATOM 0 HH TYR A 43 -20.950 19.481 11.913 1.00 0.00 H new ATOM 726 N ARG A 44 -13.122 23.856 14.679 1.00 0.00 N ATOM 727 CA ARG A 44 -11.840 24.183 15.323 1.00 0.00 C ATOM 728 C ARG A 44 -11.973 25.236 16.429 1.00 0.00 C ATOM 729 O ARG A 44 -12.819 26.111 16.306 1.00 0.00 O ATOM 730 CB ARG A 44 -10.868 24.674 14.243 1.00 0.00 C ATOM 731 CG ARG A 44 -10.283 23.532 13.395 1.00 0.00 C ATOM 732 CD ARG A 44 -8.756 23.612 13.229 1.00 0.00 C ATOM 733 NE ARG A 44 -8.040 22.597 14.022 1.00 0.00 N ATOM 734 CZ ARG A 44 -7.867 22.592 15.355 1.00 0.00 C ATOM 735 NH1 ARG A 44 -8.452 23.519 16.114 1.00 0.00 N ATOM 736 NH2 ARG A 44 -7.109 21.654 15.939 1.00 0.00 N ATOM 0 H ARG A 44 -13.672 24.670 14.404 1.00 0.00 H new ATOM 0 HA ARG A 44 -11.467 23.280 15.807 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -11.385 25.376 13.589 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -10.053 25.221 14.717 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -10.541 22.579 13.856 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -10.749 23.546 12.410 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -8.503 23.488 12.176 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -8.415 24.604 13.525 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.633 21.817 13.506 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -9.035 24.237 15.684 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -8.317 23.510 17.125 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.658 20.936 15.371 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -6.983 21.658 16.951 1.00 0.00 H new ATOM 750 N ARG A 45 -11.147 25.161 17.494 1.00 0.00 N ATOM 751 CA ARG A 45 -11.162 26.073 18.640 1.00 0.00 C ATOM 752 C ARG A 45 -9.827 26.810 18.826 1.00 0.00 C ATOM 753 O ARG A 45 -8.804 26.401 18.280 1.00 0.00 O ATOM 754 CB ARG A 45 -11.485 25.318 19.946 1.00 0.00 C ATOM 755 CG ARG A 45 -12.141 23.947 19.752 1.00 0.00 C ATOM 756 CD ARG A 45 -12.430 23.284 21.106 1.00 0.00 C ATOM 757 NE ARG A 45 -12.180 21.840 21.010 1.00 0.00 N ATOM 758 CZ ARG A 45 -13.077 20.848 20.939 1.00 0.00 C ATOM 759 NH1 ARG A 45 -14.370 21.047 21.217 1.00 0.00 N ATOM 760 NH2 ARG A 45 -12.639 19.648 20.545 1.00 0.00 N ATOM 0 H ARG A 45 -10.432 24.439 17.575 1.00 0.00 H new ATOM 0 HA ARG A 45 -11.939 26.807 18.425 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -10.562 25.186 20.511 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -12.145 25.938 20.553 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -13.069 24.059 19.192 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -11.487 23.306 19.161 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -11.799 23.722 21.879 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -13.464 23.466 21.398 1.00 0.00 H new ATOM 0 HE ARG A 45 -11.200 21.557 20.996 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -14.696 21.974 21.492 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -15.030 20.272 21.154 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -11.655 19.516 20.312 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.289 18.865 20.477 1.00 0.00 H new ATOM 774 N PHE A 46 -9.840 27.888 19.621 1.00 0.00 N ATOM 775 CA PHE A 46 -8.677 28.716 19.907 1.00 0.00 C ATOM 776 C PHE A 46 -7.548 27.967 20.612 1.00 0.00 C ATOM 777 O PHE A 46 -6.467 27.816 20.047 1.00 0.00 O ATOM 778 CB PHE A 46 -9.101 30.009 20.618 1.00 0.00 C ATOM 779 CG PHE A 46 -10.018 29.889 21.823 1.00 0.00 C ATOM 780 CD1 PHE A 46 -11.414 29.842 21.642 1.00 0.00 C ATOM 781 CD2 PHE A 46 -9.483 29.836 23.126 1.00 0.00 C ATOM 782 CE1 PHE A 46 -12.268 29.738 22.753 1.00 0.00 C ATOM 783 CE2 PHE A 46 -10.339 29.729 24.236 1.00 0.00 C ATOM 784 CZ PHE A 46 -11.731 29.679 24.051 1.00 0.00 C ATOM 0 H PHE A 46 -10.685 28.211 20.092 1.00 0.00 H new ATOM 0 HA PHE A 46 -8.237 29.001 18.951 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -8.197 30.528 20.936 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -9.594 30.648 19.885 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -11.829 29.886 20.646 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -8.414 29.878 23.272 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.338 29.703 22.610 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -9.926 29.685 25.233 1.00 0.00 H new ATOM 0 HZ PHE A 46 -12.387 29.595 24.905 1.00 0.00 H new ATOM 794 N THR A 47 -7.788 27.490 21.836 1.00 0.00 N ATOM 795 CA THR A 47 -6.791 26.754 22.614 1.00 0.00 C ATOM 796 C THR A 47 -6.257 25.527 21.876 1.00 0.00 C ATOM 797 O THR A 47 -5.146 25.084 22.154 1.00 0.00 O ATOM 798 CB THR A 47 -7.327 26.422 24.016 1.00 0.00 C ATOM 799 OG1 THR A 47 -6.292 25.889 24.818 1.00 0.00 O ATOM 800 CG2 THR A 47 -8.503 25.441 23.978 1.00 0.00 C ATOM 0 H THR A 47 -8.681 27.604 22.315 1.00 0.00 H new ATOM 0 HA THR A 47 -5.929 27.408 22.744 1.00 0.00 H new ATOM 0 HB THR A 47 -7.691 27.355 24.446 1.00 0.00 H new ATOM 0 HG1 THR A 47 -6.643 25.682 25.709 1.00 0.00 H new ATOM 0 HG21 THR A 47 -8.843 25.241 24.994 1.00 0.00 H new ATOM 0 HG22 THR A 47 -9.320 25.874 23.401 1.00 0.00 H new ATOM 0 HG23 THR A 47 -8.184 24.509 23.512 1.00 0.00 H new ATOM 808 N GLU A 48 -7.028 24.994 20.928 1.00 0.00 N ATOM 809 CA GLU A 48 -6.632 23.866 20.122 1.00 0.00 C ATOM 810 C GLU A 48 -5.628 24.349 19.081 1.00 0.00 C ATOM 811 O GLU A 48 -4.583 23.728 18.911 1.00 0.00 O ATOM 812 CB GLU A 48 -7.840 23.251 19.413 1.00 0.00 C ATOM 813 CG GLU A 48 -8.679 22.195 20.156 1.00 0.00 C ATOM 814 CD GLU A 48 -9.181 21.118 19.192 1.00 0.00 C ATOM 815 OE1 GLU A 48 -8.420 20.762 18.264 1.00 0.00 O ATOM 816 OE2 GLU A 48 -10.340 20.678 19.357 1.00 0.00 O ATOM 0 H GLU A 48 -7.958 25.348 20.704 1.00 0.00 H new ATOM 0 HA GLU A 48 -6.189 23.104 20.763 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -8.508 24.066 19.133 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.484 22.798 18.488 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.079 21.735 20.941 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -9.527 22.676 20.644 1.00 0.00 H new ATOM 823 N ILE A 49 -5.935 25.448 18.382 1.00 0.00 N ATOM 824 CA ILE A 49 -5.014 25.989 17.385 1.00 0.00 C ATOM 825 C ILE A 49 -3.697 26.368 18.071 1.00 0.00 C ATOM 826 O ILE A 49 -2.617 26.137 17.527 1.00 0.00 O ATOM 827 CB ILE A 49 -5.666 27.124 16.582 1.00 0.00 C ATOM 828 CG1 ILE A 49 -6.767 26.470 15.724 1.00 0.00 C ATOM 829 CG2 ILE A 49 -4.648 27.834 15.684 1.00 0.00 C ATOM 830 CD1 ILE A 49 -7.542 27.451 14.869 1.00 0.00 C ATOM 0 H ILE A 49 -6.804 25.972 18.488 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.774 25.232 16.639 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.072 27.881 17.253 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -6.312 25.720 15.077 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -7.462 25.946 16.380 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -5.145 28.631 15.131 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.854 28.259 16.299 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -4.220 27.118 14.983 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -8.298 26.915 14.295 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -8.027 28.188 15.509 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.859 27.957 14.186 1.00 0.00 H new ATOM 842 N TYR A 50 -3.785 26.923 19.284 1.00 0.00 N ATOM 843 CA TYR A 50 -2.614 27.286 20.064 1.00 0.00 C ATOM 844 C TYR A 50 -1.864 26.028 20.446 1.00 0.00 C ATOM 845 O TYR A 50 -0.652 25.996 20.294 1.00 0.00 O ATOM 846 CB TYR A 50 -3.017 28.077 21.314 1.00 0.00 C ATOM 847 CG TYR A 50 -3.962 29.270 21.039 1.00 0.00 C ATOM 848 CD1 TYR A 50 -4.036 29.885 19.760 1.00 0.00 C ATOM 849 CD2 TYR A 50 -4.797 29.780 22.062 1.00 0.00 C ATOM 850 CE1 TYR A 50 -4.899 30.966 19.527 1.00 0.00 C ATOM 851 CE2 TYR A 50 -5.659 30.862 21.824 1.00 0.00 C ATOM 852 CZ TYR A 50 -5.708 31.456 20.555 1.00 0.00 C ATOM 853 OH TYR A 50 -6.547 32.500 20.314 1.00 0.00 O ATOM 0 H TYR A 50 -4.671 27.130 19.745 1.00 0.00 H new ATOM 0 HA TYR A 50 -1.966 27.925 19.464 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -3.502 27.400 22.017 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -2.115 28.448 21.800 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -3.418 29.514 18.955 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -4.770 29.329 23.043 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -4.938 31.421 18.549 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -6.285 31.237 22.620 1.00 0.00 H new ATOM 0 HH TYR A 50 -7.040 32.719 21.132 1.00 0.00 H new ATOM 863 N GLU A 51 -2.568 25.000 20.924 1.00 0.00 N ATOM 864 CA GLU A 51 -1.912 23.749 21.287 1.00 0.00 C ATOM 865 C GLU A 51 -1.198 23.142 20.068 1.00 0.00 C ATOM 866 O GLU A 51 -0.077 22.660 20.197 1.00 0.00 O ATOM 867 CB GLU A 51 -2.862 22.766 21.984 1.00 0.00 C ATOM 868 CG GLU A 51 -2.120 21.564 22.586 1.00 0.00 C ATOM 869 CD GLU A 51 -1.159 21.991 23.692 1.00 0.00 C ATOM 870 OE1 GLU A 51 -1.650 22.185 24.825 1.00 0.00 O ATOM 871 OE2 GLU A 51 0.041 22.147 23.379 1.00 0.00 O ATOM 0 H GLU A 51 -3.578 25.010 21.066 1.00 0.00 H new ATOM 0 HA GLU A 51 -1.147 23.974 22.030 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -3.405 23.287 22.773 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -3.603 22.411 21.268 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.843 20.853 22.986 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.566 21.048 21.802 1.00 0.00 H new ATOM 878 N PHE A 52 -1.818 23.188 18.879 1.00 0.00 N ATOM 879 CA PHE A 52 -1.205 22.682 17.645 1.00 0.00 C ATOM 880 C PHE A 52 0.116 23.380 17.436 1.00 0.00 C ATOM 881 O PHE A 52 1.174 22.762 17.378 1.00 0.00 O ATOM 882 CB PHE A 52 -2.042 22.970 16.385 1.00 0.00 C ATOM 883 CG PHE A 52 -1.260 22.833 15.039 1.00 0.00 C ATOM 884 CD1 PHE A 52 -0.455 23.850 14.430 1.00 0.00 C ATOM 885 CD2 PHE A 52 -1.347 21.605 14.361 1.00 0.00 C ATOM 886 CE1 PHE A 52 0.194 23.607 13.203 1.00 0.00 C ATOM 887 CE2 PHE A 52 -0.708 21.375 13.139 1.00 0.00 C ATOM 888 CZ PHE A 52 0.063 22.380 12.549 1.00 0.00 C ATOM 0 H PHE A 52 -2.753 23.575 18.748 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.112 21.603 17.771 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -2.893 22.289 16.367 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.444 23.981 16.455 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.345 24.809 14.914 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -1.930 20.809 14.801 1.00 0.00 H new ATOM 0 HE1 PHE A 52 0.803 24.382 12.761 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -0.811 20.418 12.650 1.00 0.00 H new ATOM 0 HZ PHE A 52 0.551 22.210 11.600 1.00 0.00 H new ATOM 898 N HIS A 53 0.010 24.695 17.287 1.00 0.00 N ATOM 899 CA HIS A 53 1.135 25.543 17.013 1.00 0.00 C ATOM 900 C HIS A 53 2.232 25.366 18.034 1.00 0.00 C ATOM 901 O HIS A 53 3.412 25.277 17.700 1.00 0.00 O ATOM 902 CB HIS A 53 0.638 26.978 16.913 1.00 0.00 C ATOM 903 CG HIS A 53 1.610 27.798 16.142 1.00 0.00 C ATOM 904 ND1 HIS A 53 2.056 27.307 14.947 1.00 0.00 N ATOM 905 CD2 HIS A 53 2.236 29.009 16.298 1.00 0.00 C ATOM 906 CE1 HIS A 53 2.892 28.181 14.411 1.00 0.00 C ATOM 907 NE2 HIS A 53 3.056 29.254 15.192 1.00 0.00 N ATOM 0 H HIS A 53 -0.876 25.196 17.356 1.00 0.00 H new ATOM 0 HA HIS A 53 1.590 25.265 16.062 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -0.337 27.001 16.426 1.00 0.00 H new ATOM 0 HB3 HIS A 53 0.506 27.397 17.911 1.00 0.00 H new ATOM 0 HD2 HIS A 53 2.114 29.670 17.143 1.00 0.00 H new ATOM 0 HE1 HIS A 53 3.382 28.045 13.458 1.00 0.00 H new ATOM 0 HE2 HIS A 53 3.646 30.068 15.020 1.00 0.00 H new ATOM 915 N LYS A 54 1.798 25.286 19.282 1.00 0.00 N ATOM 916 CA LYS A 54 2.708 25.057 20.390 1.00 0.00 C ATOM 917 C LYS A 54 3.416 23.717 20.220 1.00 0.00 C ATOM 918 O LYS A 54 4.608 23.608 20.483 1.00 0.00 O ATOM 919 CB LYS A 54 1.982 25.088 21.735 1.00 0.00 C ATOM 920 CG LYS A 54 1.781 26.510 22.265 1.00 0.00 C ATOM 921 CD LYS A 54 1.022 26.438 23.597 1.00 0.00 C ATOM 922 CE LYS A 54 0.969 27.795 24.308 1.00 0.00 C ATOM 923 NZ LYS A 54 0.184 28.789 23.555 1.00 0.00 N ATOM 0 H LYS A 54 0.819 25.377 19.552 1.00 0.00 H new ATOM 0 HA LYS A 54 3.441 25.863 20.384 1.00 0.00 H new ATOM 0 HB2 LYS A 54 1.011 24.603 21.631 1.00 0.00 H new ATOM 0 HB3 LYS A 54 2.551 24.510 22.464 1.00 0.00 H new ATOM 0 HG2 LYS A 54 2.744 27.000 22.405 1.00 0.00 H new ATOM 0 HG3 LYS A 54 1.222 27.106 21.544 1.00 0.00 H new ATOM 0 HD2 LYS A 54 0.007 26.085 23.416 1.00 0.00 H new ATOM 0 HD3 LYS A 54 1.502 25.707 24.248 1.00 0.00 H new ATOM 0 HE2 LYS A 54 0.534 27.667 25.299 1.00 0.00 H new ATOM 0 HE3 LYS A 54 1.983 28.168 24.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 0.775 29.622 23.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -0.135 28.372 22.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -0.643 29.076 24.117 1.00 0.00 H new ATOM 937 N THR A 55 2.681 22.700 19.773 1.00 0.00 N ATOM 938 CA THR A 55 3.240 21.370 19.584 1.00 0.00 C ATOM 939 C THR A 55 4.240 21.404 18.450 1.00 0.00 C ATOM 940 O THR A 55 5.297 20.793 18.555 1.00 0.00 O ATOM 941 CB THR A 55 2.134 20.327 19.413 1.00 0.00 C ATOM 942 OG1 THR A 55 1.330 20.283 20.573 1.00 0.00 O ATOM 943 CG2 THR A 55 2.682 18.932 19.152 1.00 0.00 C ATOM 0 H THR A 55 1.692 22.777 19.535 1.00 0.00 H new ATOM 0 HA THR A 55 3.784 21.059 20.476 1.00 0.00 H new ATOM 0 HB THR A 55 1.549 20.630 18.545 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.742 21.067 20.593 1.00 0.00 H new ATOM 0 HG21 THR A 55 1.855 18.231 19.039 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.278 18.940 18.240 1.00 0.00 H new ATOM 0 HG23 THR A 55 3.306 18.623 19.991 1.00 0.00 H new ATOM 951 N LEU A 56 3.936 22.142 17.385 1.00 0.00 N ATOM 952 CA LEU A 56 4.866 22.284 16.288 1.00 0.00 C ATOM 953 C LEU A 56 6.147 22.854 16.859 1.00 0.00 C ATOM 954 O LEU A 56 7.209 22.283 16.660 1.00 0.00 O ATOM 955 CB LEU A 56 4.274 23.175 15.177 1.00 0.00 C ATOM 956 CG LEU A 56 4.945 23.217 13.799 1.00 0.00 C ATOM 957 CD1 LEU A 56 6.321 23.862 13.851 1.00 0.00 C ATOM 958 CD2 LEU A 56 5.098 21.867 13.070 1.00 0.00 C ATOM 0 H LEU A 56 3.056 22.645 17.266 1.00 0.00 H new ATOM 0 HA LEU A 56 5.070 21.321 15.820 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.240 22.864 15.026 1.00 0.00 H new ATOM 0 HB3 LEU A 56 4.248 24.196 15.558 1.00 0.00 H new ATOM 0 HG LEU A 56 4.238 23.815 13.224 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.757 23.869 12.852 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.230 24.885 14.215 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.964 23.294 14.524 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.585 22.026 12.108 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.703 21.193 13.676 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.114 21.427 12.910 1.00 0.00 H new ATOM 970 N LYS A 57 6.049 23.963 17.589 1.00 0.00 N ATOM 971 CA LYS A 57 7.235 24.564 18.168 1.00 0.00 C ATOM 972 C LYS A 57 7.970 23.675 19.175 1.00 0.00 C ATOM 973 O LYS A 57 9.180 23.819 19.339 1.00 0.00 O ATOM 974 CB LYS A 57 6.885 25.882 18.876 1.00 0.00 C ATOM 975 CG LYS A 57 6.143 27.017 18.137 1.00 0.00 C ATOM 976 CD LYS A 57 6.203 27.068 16.597 1.00 0.00 C ATOM 977 CE LYS A 57 6.528 28.481 16.078 1.00 0.00 C ATOM 978 NZ LYS A 57 5.530 29.487 16.494 1.00 0.00 N ATOM 0 H LYS A 57 5.176 24.452 17.788 1.00 0.00 H new ATOM 0 HA LYS A 57 7.901 24.726 17.321 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.284 25.624 19.748 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.820 26.302 19.246 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.093 26.966 18.424 1.00 0.00 H new ATOM 0 HG3 LYS A 57 6.531 27.964 18.513 1.00 0.00 H new ATOM 0 HD2 LYS A 57 6.959 26.368 16.240 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.248 26.742 16.186 1.00 0.00 H new ATOM 0 HE2 LYS A 57 7.511 28.779 16.442 1.00 0.00 H new ATOM 0 HE3 LYS A 57 6.584 28.459 14.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.780 30.412 16.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 4.589 29.203 16.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.518 29.555 17.532 1.00 0.00 H new ATOM 992 N GLU A 58 7.256 22.785 19.863 1.00 0.00 N ATOM 993 CA GLU A 58 7.835 21.922 20.876 1.00 0.00 C ATOM 994 C GLU A 58 8.594 20.795 20.201 1.00 0.00 C ATOM 995 O GLU A 58 9.778 20.598 20.468 1.00 0.00 O ATOM 996 CB GLU A 58 6.750 21.353 21.822 1.00 0.00 C ATOM 997 CG GLU A 58 6.289 22.477 22.803 1.00 0.00 C ATOM 998 CD GLU A 58 7.238 22.578 23.993 1.00 0.00 C ATOM 999 OE1 GLU A 58 7.334 21.571 24.728 1.00 0.00 O ATOM 1000 OE2 GLU A 58 7.849 23.656 24.152 1.00 0.00 O ATOM 0 H GLU A 58 6.255 22.646 19.728 1.00 0.00 H new ATOM 0 HA GLU A 58 8.521 22.512 21.484 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.902 20.987 21.244 1.00 0.00 H new ATOM 0 HB3 GLU A 58 7.145 20.505 22.381 1.00 0.00 H new ATOM 0 HG2 GLU A 58 6.253 23.432 22.278 1.00 0.00 H new ATOM 0 HG3 GLU A 58 5.279 22.268 23.154 1.00 0.00 H new ATOM 1007 N MET A 59 7.910 20.052 19.323 1.00 0.00 N ATOM 1008 CA MET A 59 8.539 18.957 18.624 1.00 0.00 C ATOM 1009 C MET A 59 9.656 19.489 17.735 1.00 0.00 C ATOM 1010 O MET A 59 10.774 18.978 17.769 1.00 0.00 O ATOM 1011 CB MET A 59 7.521 18.210 17.768 1.00 0.00 C ATOM 1012 CG MET A 59 6.253 17.662 18.446 1.00 0.00 C ATOM 1013 SD MET A 59 5.080 16.848 17.321 1.00 0.00 S ATOM 1014 CE MET A 59 4.822 18.146 16.082 1.00 0.00 C ATOM 0 H MET A 59 6.928 20.198 19.090 1.00 0.00 H new ATOM 0 HA MET A 59 8.952 18.268 19.361 1.00 0.00 H new ATOM 0 HB2 MET A 59 7.206 18.880 16.968 1.00 0.00 H new ATOM 0 HB3 MET A 59 8.035 17.371 17.298 1.00 0.00 H new ATOM 0 HG2 MET A 59 6.549 16.951 19.217 1.00 0.00 H new ATOM 0 HG3 MET A 59 5.743 18.483 18.949 1.00 0.00 H new ATOM 0 HE1 MET A 59 4.020 17.849 15.406 1.00 0.00 H new ATOM 0 HE2 MET A 59 4.550 19.076 16.581 1.00 0.00 H new ATOM 0 HE3 MET A 59 5.740 18.294 15.513 1.00 0.00 H new ATOM 1024 N PHE A 60 9.342 20.515 16.940 1.00 0.00 N ATOM 1025 CA PHE A 60 10.264 21.148 16.037 1.00 0.00 C ATOM 1026 C PHE A 60 10.772 22.473 16.661 1.00 0.00 C ATOM 1027 O PHE A 60 10.123 23.499 16.452 1.00 0.00 O ATOM 1028 CB PHE A 60 9.512 21.453 14.746 1.00 0.00 C ATOM 1029 CG PHE A 60 8.889 20.246 13.968 1.00 0.00 C ATOM 1030 CD1 PHE A 60 9.690 19.438 13.125 1.00 0.00 C ATOM 1031 CD2 PHE A 60 7.511 19.898 14.053 1.00 0.00 C ATOM 1032 CE1 PHE A 60 9.162 18.360 12.397 1.00 0.00 C ATOM 1033 CE2 PHE A 60 6.984 18.820 13.314 1.00 0.00 C ATOM 1034 CZ PHE A 60 7.803 18.049 12.485 1.00 0.00 C ATOM 0 H PHE A 60 8.410 20.928 16.918 1.00 0.00 H new ATOM 0 HA PHE A 60 11.117 20.498 15.842 1.00 0.00 H new ATOM 0 HB2 PHE A 60 8.709 22.151 14.982 1.00 0.00 H new ATOM 0 HB3 PHE A 60 10.196 21.970 14.073 1.00 0.00 H new ATOM 0 HD1 PHE A 60 10.744 19.659 13.039 1.00 0.00 H new ATOM 0 HD2 PHE A 60 6.858 20.470 14.695 1.00 0.00 H new ATOM 0 HE1 PHE A 60 9.809 17.769 11.766 1.00 0.00 H new ATOM 0 HE2 PHE A 60 5.932 18.586 13.389 1.00 0.00 H new ATOM 0 HZ PHE A 60 7.392 17.225 11.921 1.00 0.00 H new ATOM 1044 N PRO A 61 11.894 22.555 17.409 1.00 0.00 N ATOM 1045 CA PRO A 61 12.321 23.836 17.962 1.00 0.00 C ATOM 1046 C PRO A 61 12.930 24.723 16.876 1.00 0.00 C ATOM 1047 O PRO A 61 12.997 25.937 17.031 1.00 0.00 O ATOM 1048 CB PRO A 61 13.305 23.503 19.080 1.00 0.00 C ATOM 1049 CG PRO A 61 13.953 22.216 18.587 1.00 0.00 C ATOM 1050 CD PRO A 61 12.847 21.521 17.788 1.00 0.00 C ATOM 0 HA PRO A 61 11.485 24.411 18.360 1.00 0.00 H new ATOM 0 HB2 PRO A 61 14.039 24.296 19.223 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.799 23.361 20.035 1.00 0.00 H new ATOM 0 HG2 PRO A 61 14.824 22.422 17.965 1.00 0.00 H new ATOM 0 HG3 PRO A 61 14.293 21.598 19.418 1.00 0.00 H new ATOM 0 HD2 PRO A 61 13.257 21.030 16.905 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.363 20.749 18.387 1.00 0.00 H new ATOM 1058 N ILE A 62 13.349 24.119 15.763 1.00 0.00 N ATOM 1059 CA ILE A 62 13.909 24.785 14.604 1.00 0.00 C ATOM 1060 C ILE A 62 12.799 25.576 13.936 1.00 0.00 C ATOM 1061 O ILE A 62 12.985 26.735 13.568 1.00 0.00 O ATOM 1062 CB ILE A 62 14.464 23.745 13.631 1.00 0.00 C ATOM 1063 CG1 ILE A 62 15.486 22.775 14.252 1.00 0.00 C ATOM 1064 CG2 ILE A 62 14.974 24.381 12.350 1.00 0.00 C ATOM 1065 CD1 ILE A 62 16.679 23.476 14.911 1.00 0.00 C ATOM 0 H ILE A 62 13.302 23.107 15.648 1.00 0.00 H new ATOM 0 HA ILE A 62 14.720 25.450 14.902 1.00 0.00 H new ATOM 0 HB ILE A 62 13.613 23.117 13.369 1.00 0.00 H new ATOM 0 HG12 ILE A 62 14.982 22.158 14.996 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.854 22.103 13.476 1.00 0.00 H new ATOM 0 HG21 ILE A 62 15.359 23.606 11.687 1.00 0.00 H new ATOM 0 HG22 ILE A 62 14.158 24.908 11.856 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.771 25.086 12.586 1.00 0.00 H new ATOM 0 HD11 ILE A 62 17.356 22.729 15.326 1.00 0.00 H new ATOM 0 HD12 ILE A 62 17.208 24.071 14.167 1.00 0.00 H new ATOM 0 HD13 ILE A 62 16.323 24.127 15.710 1.00 0.00 H new ATOM 1077 N GLU A 63 11.624 24.955 13.809 1.00 0.00 N ATOM 1078 CA GLU A 63 10.477 25.617 13.226 1.00 0.00 C ATOM 1079 C GLU A 63 10.045 26.789 14.124 1.00 0.00 C ATOM 1080 O GLU A 63 9.186 27.579 13.734 1.00 0.00 O ATOM 1081 CB GLU A 63 9.357 24.601 13.031 1.00 0.00 C ATOM 1082 CG GLU A 63 9.582 23.486 11.982 1.00 0.00 C ATOM 1083 CD GLU A 63 11.024 23.059 11.696 1.00 0.00 C ATOM 1084 OE1 GLU A 63 11.749 23.863 11.073 1.00 0.00 O ATOM 1085 OE2 GLU A 63 11.380 21.924 12.078 1.00 0.00 O ATOM 0 H GLU A 63 11.452 23.994 14.105 1.00 0.00 H new ATOM 0 HA GLU A 63 10.730 26.029 12.249 1.00 0.00 H new ATOM 0 HB2 GLU A 63 9.163 24.125 13.992 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.453 25.145 12.756 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.029 22.604 12.306 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.137 23.814 11.043 1.00 0.00 H new ATOM 1092 N ALA A 64 10.658 26.914 15.313 1.00 0.00 N ATOM 1093 CA ALA A 64 10.431 27.974 16.270 1.00 0.00 C ATOM 1094 C ALA A 64 11.742 28.603 16.713 1.00 0.00 C ATOM 1095 O ALA A 64 11.842 29.110 17.829 1.00 0.00 O ATOM 1096 CB ALA A 64 9.689 27.414 17.480 1.00 0.00 C ATOM 0 H ALA A 64 11.354 26.241 15.634 1.00 0.00 H new ATOM 0 HA ALA A 64 9.830 28.748 15.793 1.00 0.00 H new ATOM 0 HB1 ALA A 64 9.517 28.212 18.203 1.00 0.00 H new ATOM 0 HB2 ALA A 64 8.732 27.001 17.161 1.00 0.00 H new ATOM 0 HB3 ALA A 64 10.287 26.629 17.942 1.00 0.00 H new ATOM 1102 N GLY A 65 12.749 28.567 15.840 1.00 0.00 N ATOM 1103 CA GLY A 65 14.051 29.101 16.147 1.00 0.00 C ATOM 1104 C GLY A 65 14.786 29.511 14.897 1.00 0.00 C ATOM 1105 O GLY A 65 15.215 30.657 14.791 1.00 0.00 O ATOM 0 H GLY A 65 12.673 28.165 14.906 1.00 0.00 H new ATOM 0 HA2 GLY A 65 13.946 29.961 16.808 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.634 28.354 16.686 1.00 0.00 H new ATOM 1109 N ALA A 66 14.915 28.585 13.946 1.00 0.00 N ATOM 1110 CA ALA A 66 15.556 28.900 12.691 1.00 0.00 C ATOM 1111 C ALA A 66 14.543 29.512 11.748 1.00 0.00 C ATOM 1112 O ALA A 66 14.920 30.220 10.820 1.00 0.00 O ATOM 1113 CB ALA A 66 16.235 27.681 12.074 1.00 0.00 C ATOM 0 H ALA A 66 14.585 27.624 14.029 1.00 0.00 H new ATOM 0 HA ALA A 66 16.347 29.626 12.879 1.00 0.00 H new ATOM 0 HB1 ALA A 66 16.704 27.964 11.132 1.00 0.00 H new ATOM 0 HB2 ALA A 66 16.994 27.302 12.758 1.00 0.00 H new ATOM 0 HB3 ALA A 66 15.492 26.905 11.891 1.00 0.00 H new ATOM 1119 N ILE A 67 13.263 29.236 12.011 1.00 0.00 N ATOM 1120 CA ILE A 67 12.161 29.746 11.203 1.00 0.00 C ATOM 1121 C ILE A 67 11.426 30.864 11.935 1.00 0.00 C ATOM 1122 O ILE A 67 10.435 31.384 11.449 1.00 0.00 O ATOM 1123 CB ILE A 67 11.283 28.574 10.729 1.00 0.00 C ATOM 1124 CG1 ILE A 67 12.225 27.526 10.089 1.00 0.00 C ATOM 1125 CG2 ILE A 67 10.218 29.010 9.710 1.00 0.00 C ATOM 1126 CD1 ILE A 67 11.526 26.411 9.314 1.00 0.00 C ATOM 0 H ILE A 67 12.965 28.652 12.792 1.00 0.00 H new ATOM 0 HA ILE A 67 12.533 30.219 10.294 1.00 0.00 H new ATOM 0 HB ILE A 67 10.743 28.165 11.583 1.00 0.00 H new ATOM 0 HG12 ILE A 67 12.910 28.040 9.415 1.00 0.00 H new ATOM 0 HG13 ILE A 67 12.830 27.076 10.876 1.00 0.00 H new ATOM 0 HG21 ILE A 67 9.627 28.145 9.409 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.565 29.756 10.163 1.00 0.00 H new ATOM 0 HG23 ILE A 67 10.706 29.438 8.835 1.00 0.00 H new ATOM 0 HD11 ILE A 67 12.272 25.729 8.905 1.00 0.00 H new ATOM 0 HD12 ILE A 67 10.862 25.864 9.983 1.00 0.00 H new ATOM 0 HD13 ILE A 67 10.944 26.843 8.500 1.00 0.00 H new ATOM 1138 N ASN A 68 11.927 31.289 13.092 1.00 0.00 N ATOM 1139 CA ASN A 68 11.281 32.358 13.846 1.00 0.00 C ATOM 1140 C ASN A 68 11.745 33.768 13.470 1.00 0.00 C ATOM 1141 O ASN A 68 10.881 34.595 13.201 1.00 0.00 O ATOM 1142 CB ASN A 68 11.330 32.084 15.359 1.00 0.00 C ATOM 1143 CG ASN A 68 9.932 31.860 15.940 1.00 0.00 C ATOM 1144 OD1 ASN A 68 9.595 32.408 16.984 1.00 0.00 O ATOM 1145 ND2 ASN A 68 9.100 31.069 15.257 1.00 0.00 N ATOM 0 H ASN A 68 12.771 30.913 13.524 1.00 0.00 H new ATOM 0 HA ASN A 68 10.233 32.345 13.548 1.00 0.00 H new ATOM 0 HB2 ASN A 68 11.948 31.207 15.550 1.00 0.00 H new ATOM 0 HB3 ASN A 68 11.804 32.925 15.866 1.00 0.00 H new ATOM 0 HD21 ASN A 68 8.154 30.906 15.601 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.411 30.628 14.392 1.00 0.00 H new ATOM 1152 N PRO A 69 13.038 34.104 13.430 1.00 0.00 N ATOM 1153 CA PRO A 69 13.475 35.444 13.089 1.00 0.00 C ATOM 1154 C PRO A 69 13.376 35.775 11.610 1.00 0.00 C ATOM 1155 O PRO A 69 12.855 36.823 11.236 1.00 0.00 O ATOM 1156 CB PRO A 69 14.905 35.544 13.618 1.00 0.00 C ATOM 1157 CG PRO A 69 15.416 34.102 13.552 1.00 0.00 C ATOM 1158 CD PRO A 69 14.159 33.250 13.746 1.00 0.00 C ATOM 0 HA PRO A 69 12.817 36.185 13.543 1.00 0.00 H new ATOM 0 HB2 PRO A 69 15.512 36.213 13.008 1.00 0.00 H new ATOM 0 HB3 PRO A 69 14.929 35.932 14.636 1.00 0.00 H new ATOM 0 HG2 PRO A 69 15.896 33.893 12.596 1.00 0.00 H new ATOM 0 HG3 PRO A 69 16.155 33.905 14.329 1.00 0.00 H new ATOM 0 HD2 PRO A 69 14.177 32.376 13.095 1.00 0.00 H new ATOM 0 HD3 PRO A 69 14.092 32.883 14.770 1.00 0.00 H new ATOM 1166 N GLU A 70 13.882 34.886 10.768 1.00 0.00 N ATOM 1167 CA GLU A 70 13.860 35.075 9.326 1.00 0.00 C ATOM 1168 C GLU A 70 12.415 35.122 8.843 1.00 0.00 C ATOM 1169 O GLU A 70 12.078 35.920 7.969 1.00 0.00 O ATOM 1170 CB GLU A 70 14.662 33.922 8.638 1.00 0.00 C ATOM 1171 CG GLU A 70 13.934 32.536 8.732 1.00 0.00 C ATOM 1172 CD GLU A 70 13.105 32.188 7.495 1.00 0.00 C ATOM 1173 OE1 GLU A 70 12.884 33.092 6.661 1.00 0.00 O ATOM 1174 OE2 GLU A 70 12.696 31.010 7.414 1.00 0.00 O ATOM 0 H GLU A 70 14.319 34.014 11.066 1.00 0.00 H new ATOM 0 HA GLU A 70 14.335 36.020 9.061 1.00 0.00 H new ATOM 0 HB2 GLU A 70 14.823 34.173 7.589 1.00 0.00 H new ATOM 0 HB3 GLU A 70 15.646 33.843 9.101 1.00 0.00 H new ATOM 0 HG2 GLU A 70 14.678 31.755 8.890 1.00 0.00 H new ATOM 0 HG3 GLU A 70 13.282 32.537 9.606 1.00 0.00 H new ATOM 1181 N ASN A 71 11.578 34.273 9.445 1.00 0.00 N ATOM 1182 CA ASN A 71 10.169 34.156 9.132 1.00 0.00 C ATOM 1183 C ASN A 71 9.339 34.710 10.285 1.00 0.00 C ATOM 1184 O ASN A 71 8.331 34.116 10.655 1.00 0.00 O ATOM 1185 CB ASN A 71 9.800 32.690 8.780 1.00 0.00 C ATOM 1186 CG ASN A 71 8.891 32.595 7.563 1.00 0.00 C ATOM 1187 OD1 ASN A 71 9.256 32.991 6.460 1.00 0.00 O ATOM 1188 ND2 ASN A 71 7.692 32.052 7.758 1.00 0.00 N ATOM 0 H ASN A 71 11.879 33.635 10.182 1.00 0.00 H new ATOM 0 HA ASN A 71 9.942 34.750 8.247 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.712 32.124 8.593 1.00 0.00 H new ATOM 0 HB3 ASN A 71 9.307 32.227 9.635 1.00 0.00 H new ATOM 0 HD21 ASN A 71 7.043 31.954 6.977 1.00 0.00 H new ATOM 0 HD22 ASN A 71 7.422 31.734 8.689 1.00 0.00 H new ATOM 1195 N ARG A 72 9.747 35.869 10.821 1.00 0.00 N ATOM 1196 CA ARG A 72 9.046 36.603 11.883 1.00 0.00 C ATOM 1197 C ARG A 72 7.686 37.181 11.433 1.00 0.00 C ATOM 1198 O ARG A 72 7.427 38.373 11.582 1.00 0.00 O ATOM 1199 CB ARG A 72 9.969 37.699 12.451 1.00 0.00 C ATOM 1200 CG ARG A 72 10.420 38.738 11.407 1.00 0.00 C ATOM 1201 CD ARG A 72 11.528 39.635 11.970 1.00 0.00 C ATOM 1202 NE ARG A 72 11.997 40.604 10.967 1.00 0.00 N ATOM 1203 CZ ARG A 72 12.758 40.319 9.895 1.00 0.00 C ATOM 1204 NH1 ARG A 72 13.192 39.072 9.667 1.00 0.00 N ATOM 1205 NH2 ARG A 72 13.083 41.297 9.041 1.00 0.00 N ATOM 0 H ARG A 72 10.601 36.336 10.517 1.00 0.00 H new ATOM 0 HA ARG A 72 8.807 35.889 12.671 1.00 0.00 H new ATOM 0 HB2 ARG A 72 9.451 38.213 13.260 1.00 0.00 H new ATOM 0 HB3 ARG A 72 10.851 37.228 12.885 1.00 0.00 H new ATOM 0 HG2 ARG A 72 10.779 38.228 10.513 1.00 0.00 H new ATOM 0 HG3 ARG A 72 9.569 39.350 11.106 1.00 0.00 H new ATOM 0 HD2 ARG A 72 11.157 40.167 12.846 1.00 0.00 H new ATOM 0 HD3 ARG A 72 12.364 39.019 12.301 1.00 0.00 H new ATOM 0 HE ARG A 72 11.721 41.577 11.096 1.00 0.00 H new ATOM 0 HH11 ARG A 72 12.946 38.321 10.311 1.00 0.00 H new ATOM 0 HH12 ARG A 72 13.768 38.874 8.849 1.00 0.00 H new ATOM 0 HH21 ARG A 72 12.754 42.248 9.206 1.00 0.00 H new ATOM 0 HH22 ARG A 72 13.660 41.091 8.225 1.00 0.00 H new ATOM 1219 N ILE A 73 6.805 36.330 10.898 1.00 0.00 N ATOM 1220 CA ILE A 73 5.462 36.633 10.428 1.00 0.00 C ATOM 1221 C ILE A 73 4.540 35.443 10.748 1.00 0.00 C ATOM 1222 O ILE A 73 3.494 35.283 10.126 1.00 0.00 O ATOM 1223 CB ILE A 73 5.459 36.994 8.923 1.00 0.00 C ATOM 1224 CG1 ILE A 73 6.072 35.906 8.015 1.00 0.00 C ATOM 1225 CG2 ILE A 73 6.070 38.378 8.662 1.00 0.00 C ATOM 1226 CD1 ILE A 73 7.563 36.077 7.697 1.00 0.00 C ATOM 0 H ILE A 73 7.034 35.344 10.776 1.00 0.00 H new ATOM 0 HA ILE A 73 5.083 37.513 10.947 1.00 0.00 H new ATOM 0 HB ILE A 73 4.407 37.042 8.640 1.00 0.00 H new ATOM 0 HG12 ILE A 73 5.928 34.936 8.491 1.00 0.00 H new ATOM 0 HG13 ILE A 73 5.518 35.885 7.077 1.00 0.00 H new ATOM 0 HG21 ILE A 73 6.047 38.590 7.593 1.00 0.00 H new ATOM 0 HG22 ILE A 73 5.495 39.136 9.194 1.00 0.00 H new ATOM 0 HG23 ILE A 73 7.102 38.392 9.013 1.00 0.00 H new ATOM 0 HD11 ILE A 73 7.894 35.261 7.054 1.00 0.00 H new ATOM 0 HD12 ILE A 73 7.720 37.028 7.187 1.00 0.00 H new ATOM 0 HD13 ILE A 73 8.137 36.064 8.624 1.00 0.00 H new ATOM 1238 N ILE A 74 4.927 34.610 11.725 1.00 0.00 N ATOM 1239 CA ILE A 74 4.155 33.455 12.174 1.00 0.00 C ATOM 1240 C ILE A 74 3.187 34.007 13.233 1.00 0.00 C ATOM 1241 O ILE A 74 3.608 34.834 14.045 1.00 0.00 O ATOM 1242 CB ILE A 74 5.094 32.360 12.726 1.00 0.00 C ATOM 1243 CG1 ILE A 74 6.109 31.854 11.682 1.00 0.00 C ATOM 1244 CG2 ILE A 74 4.269 31.157 13.207 1.00 0.00 C ATOM 1245 CD1 ILE A 74 7.414 31.360 12.327 1.00 0.00 C ATOM 0 H ILE A 74 5.804 34.728 12.232 1.00 0.00 H new ATOM 0 HA ILE A 74 3.602 32.973 11.368 1.00 0.00 H new ATOM 0 HB ILE A 74 5.647 32.818 13.546 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.661 31.044 11.107 1.00 0.00 H new ATOM 0 HG13 ILE A 74 6.335 32.656 10.980 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.938 30.389 13.595 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.587 31.476 13.995 1.00 0.00 H new ATOM 0 HG23 ILE A 74 3.696 30.752 12.373 1.00 0.00 H new ATOM 0 HD11 ILE A 74 8.096 31.014 11.550 1.00 0.00 H new ATOM 0 HD12 ILE A 74 7.878 32.176 12.880 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.195 30.539 13.009 1.00 0.00 H new ATOM 1257 N PRO A 75 1.903 33.609 13.245 1.00 0.00 N ATOM 1258 CA PRO A 75 0.924 34.148 14.169 1.00 0.00 C ATOM 1259 C PRO A 75 1.174 33.743 15.627 1.00 0.00 C ATOM 1260 O PRO A 75 0.834 32.629 16.027 1.00 0.00 O ATOM 1261 CB PRO A 75 -0.436 33.634 13.702 1.00 0.00 C ATOM 1262 CG PRO A 75 -0.057 32.313 13.060 1.00 0.00 C ATOM 1263 CD PRO A 75 1.250 32.662 12.365 1.00 0.00 C ATOM 0 HA PRO A 75 0.983 35.236 14.160 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -1.131 33.502 14.531 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -0.910 34.313 12.993 1.00 0.00 H new ATOM 0 HG2 PRO A 75 0.073 31.523 13.799 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.815 31.970 12.356 1.00 0.00 H new ATOM 0 HD2 PRO A 75 1.865 31.775 12.214 1.00 0.00 H new ATOM 0 HD3 PRO A 75 1.070 33.097 11.382 1.00 0.00 H new ATOM 1271 N HIS A 76 1.744 34.644 16.433 1.00 0.00 N ATOM 1272 CA HIS A 76 1.999 34.439 17.850 1.00 0.00 C ATOM 1273 C HIS A 76 0.867 35.156 18.614 1.00 0.00 C ATOM 1274 O HIS A 76 -0.277 35.064 18.172 1.00 0.00 O ATOM 1275 CB HIS A 76 3.454 34.861 18.121 1.00 0.00 C ATOM 1276 CG HIS A 76 4.446 34.000 17.370 1.00 0.00 C ATOM 1277 ND1 HIS A 76 5.746 34.404 17.111 1.00 0.00 N ATOM 1278 CD2 HIS A 76 4.346 32.747 16.810 1.00 0.00 C ATOM 1279 CE1 HIS A 76 6.348 33.410 16.434 1.00 0.00 C ATOM 1280 NE2 HIS A 76 5.547 32.362 16.218 1.00 0.00 N ATOM 0 H HIS A 76 2.047 35.560 16.102 1.00 0.00 H new ATOM 0 HA HIS A 76 1.957 33.409 18.205 1.00 0.00 H new ATOM 0 HB2 HIS A 76 3.588 35.904 17.832 1.00 0.00 H new ATOM 0 HB3 HIS A 76 3.656 34.798 19.190 1.00 0.00 H new ATOM 0 HD1 HIS A 76 6.168 35.292 17.384 1.00 0.00 H new ATOM 0 HD2 HIS A 76 3.452 32.141 16.827 1.00 0.00 H new ATOM 0 HE1 HIS A 76 7.374 33.454 16.099 1.00 0.00 H new ATOM 1288 N LEU A 77 1.141 35.855 19.727 1.00 0.00 N ATOM 1289 CA LEU A 77 0.169 36.581 20.551 1.00 0.00 C ATOM 1290 C LEU A 77 -0.583 35.627 21.491 1.00 0.00 C ATOM 1291 O LEU A 77 -0.829 34.477 21.128 1.00 0.00 O ATOM 1292 CB LEU A 77 -0.810 37.449 19.729 1.00 0.00 C ATOM 1293 CG LEU A 77 -0.145 38.382 18.701 1.00 0.00 C ATOM 1294 CD1 LEU A 77 -1.238 39.159 17.958 1.00 0.00 C ATOM 1295 CD2 LEU A 77 0.819 39.371 19.365 1.00 0.00 C ATOM 0 H LEU A 77 2.091 35.931 20.091 1.00 0.00 H new ATOM 0 HA LEU A 77 0.748 37.278 21.157 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.503 36.791 19.205 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -1.402 38.053 20.417 1.00 0.00 H new ATOM 0 HG LEU A 77 0.434 37.769 18.010 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.779 39.824 17.227 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.899 38.459 17.447 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.815 39.748 18.671 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.266 40.010 18.604 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.273 39.986 20.081 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.604 38.821 19.884 1.00 0.00 H new ATOM 1307 N PRO A 78 -0.950 36.075 22.707 1.00 0.00 N ATOM 1308 CA PRO A 78 -1.655 35.251 23.678 1.00 0.00 C ATOM 1309 C PRO A 78 -3.129 35.065 23.301 1.00 0.00 C ATOM 1310 O PRO A 78 -3.597 35.578 22.285 1.00 0.00 O ATOM 1311 CB PRO A 78 -1.506 36.001 25.006 1.00 0.00 C ATOM 1312 CG PRO A 78 -1.494 37.463 24.565 1.00 0.00 C ATOM 1313 CD PRO A 78 -0.706 37.401 23.256 1.00 0.00 C ATOM 0 HA PRO A 78 -1.245 34.242 23.728 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -2.332 35.790 25.685 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.588 35.727 25.525 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -2.502 37.851 24.415 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.011 38.106 25.301 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -1.035 38.177 22.565 1.00 0.00 H new ATOM 0 HD3 PRO A 78 0.358 37.561 23.432 1.00 0.00 H new ATOM 1321 N ALA A 79 -3.857 34.322 24.142 1.00 0.00 N ATOM 1322 CA ALA A 79 -5.273 34.028 23.975 1.00 0.00 C ATOM 1323 C ALA A 79 -6.128 35.289 24.200 1.00 0.00 C ATOM 1324 O ALA A 79 -5.691 36.211 24.890 1.00 0.00 O ATOM 1325 CB ALA A 79 -5.636 32.898 24.946 1.00 0.00 C ATOM 0 H ALA A 79 -3.459 33.899 24.981 1.00 0.00 H new ATOM 0 HA ALA A 79 -5.479 33.704 22.955 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -6.694 32.656 24.843 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.038 32.016 24.718 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.435 33.218 25.968 1.00 0.00 H new ATOM 1430 N GLN A 86 -12.955 44.615 22.559 1.00 0.00 N ATOM 1431 CA GLN A 86 -12.720 44.643 21.119 1.00 0.00 C ATOM 1432 C GLN A 86 -11.315 44.199 20.723 1.00 0.00 C ATOM 1433 O GLN A 86 -11.117 43.733 19.605 1.00 0.00 O ATOM 1434 CB GLN A 86 -13.052 46.026 20.545 1.00 0.00 C ATOM 1435 CG GLN A 86 -14.534 46.374 20.738 1.00 0.00 C ATOM 1436 CD GLN A 86 -14.893 47.704 20.082 1.00 0.00 C ATOM 1437 OE1 GLN A 86 -15.659 47.741 19.124 1.00 0.00 O ATOM 1438 NE2 GLN A 86 -14.349 48.805 20.600 1.00 0.00 N ATOM 0 HA GLN A 86 -13.395 43.908 20.680 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -12.434 46.781 21.031 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -12.807 46.049 19.483 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -15.152 45.582 20.315 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -14.761 46.421 21.803 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -13.716 48.735 21.397 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -14.565 49.718 20.199 1.00 0.00 H new ATOM 1447 N ARG A 87 -10.351 44.294 21.643 1.00 0.00 N ATOM 1448 CA ARG A 87 -8.977 43.889 21.367 1.00 0.00 C ATOM 1449 C ARG A 87 -8.780 42.410 21.690 1.00 0.00 C ATOM 1450 O ARG A 87 -7.751 41.836 21.340 1.00 0.00 O ATOM 1451 CB ARG A 87 -8.002 44.780 22.172 1.00 0.00 C ATOM 1452 CG ARG A 87 -6.571 44.703 21.609 1.00 0.00 C ATOM 1453 CD ARG A 87 -5.642 43.945 22.562 1.00 0.00 C ATOM 1454 NE ARG A 87 -4.337 43.642 21.954 1.00 0.00 N ATOM 1455 CZ ARG A 87 -4.020 42.499 21.321 1.00 0.00 C ATOM 1456 NH1 ARG A 87 -4.958 41.587 21.037 1.00 0.00 N ATOM 1457 NH2 ARG A 87 -2.749 42.261 20.974 1.00 0.00 N ATOM 0 H ARG A 87 -10.501 44.649 22.587 1.00 0.00 H new ATOM 0 HA ARG A 87 -8.767 44.022 20.306 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -8.348 45.813 22.149 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -8.000 44.468 23.216 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -6.585 44.206 20.639 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -6.187 45.710 21.446 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -5.490 44.538 23.464 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -6.121 43.015 22.868 1.00 0.00 H new ATOM 0 HE ARG A 87 -3.613 44.358 22.018 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.929 41.755 21.301 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -4.702 40.725 20.556 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -2.025 42.946 21.190 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -2.505 41.395 20.494 1.00 0.00 H new ATOM 1471 N ALA A 88 -9.798 41.783 22.284 1.00 0.00 N ATOM 1472 CA ALA A 88 -9.831 40.350 22.522 1.00 0.00 C ATOM 1473 C ALA A 88 -10.471 39.727 21.285 1.00 0.00 C ATOM 1474 O ALA A 88 -10.072 38.658 20.826 1.00 0.00 O ATOM 1475 CB ALA A 88 -10.588 39.980 23.790 1.00 0.00 C ATOM 0 H ALA A 88 -10.631 42.269 22.615 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.821 39.972 22.682 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.580 38.897 23.916 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -10.109 40.449 24.650 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -11.618 40.328 23.714 1.00 0.00 H new ATOM 1481 N ALA A 89 -11.456 40.439 20.734 1.00 0.00 N ATOM 1482 CA ALA A 89 -12.171 40.053 19.531 1.00 0.00 C ATOM 1483 C ALA A 89 -11.188 40.058 18.369 1.00 0.00 C ATOM 1484 O ALA A 89 -10.986 39.040 17.714 1.00 0.00 O ATOM 1485 CB ALA A 89 -13.371 40.976 19.300 1.00 0.00 C ATOM 0 H ALA A 89 -11.782 41.322 21.128 1.00 0.00 H new ATOM 0 HA ALA A 89 -12.580 39.048 19.630 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -13.895 40.672 18.394 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.049 40.911 20.151 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.024 42.003 19.191 1.00 0.00 H new ATOM 1491 N GLU A 90 -10.556 41.208 18.142 1.00 0.00 N ATOM 1492 CA GLU A 90 -9.562 41.395 17.090 1.00 0.00 C ATOM 1493 C GLU A 90 -8.269 40.606 17.319 1.00 0.00 C ATOM 1494 O GLU A 90 -7.399 40.627 16.451 1.00 0.00 O ATOM 1495 CB GLU A 90 -9.286 42.890 16.896 1.00 0.00 C ATOM 1496 CG GLU A 90 -10.525 43.624 16.371 1.00 0.00 C ATOM 1497 CD GLU A 90 -10.257 45.120 16.258 1.00 0.00 C ATOM 1498 OE1 GLU A 90 -9.704 45.515 15.209 1.00 0.00 O ATOM 1499 OE2 GLU A 90 -10.598 45.836 17.223 1.00 0.00 O ATOM 0 H GLU A 90 -10.724 42.049 18.694 1.00 0.00 H new ATOM 0 HA GLU A 90 -9.985 40.985 16.173 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -8.975 43.330 17.843 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -8.460 43.021 16.197 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -10.804 43.225 15.396 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -11.368 43.450 17.040 1.00 0.00 H new ATOM 1506 N ASN A 91 -8.130 39.888 18.442 1.00 0.00 N ATOM 1507 CA ASN A 91 -6.952 39.066 18.670 1.00 0.00 C ATOM 1508 C ASN A 91 -7.263 37.774 17.950 1.00 0.00 C ATOM 1509 O ASN A 91 -6.565 37.414 17.018 1.00 0.00 O ATOM 1510 CB ASN A 91 -6.705 38.766 20.164 1.00 0.00 C ATOM 1511 CG ASN A 91 -5.328 38.150 20.385 1.00 0.00 C ATOM 1512 OD1 ASN A 91 -4.353 38.878 20.568 1.00 0.00 O ATOM 1513 ND2 ASN A 91 -5.250 36.820 20.398 1.00 0.00 N ATOM 0 H ASN A 91 -8.817 39.865 19.196 1.00 0.00 H new ATOM 0 HA ASN A 91 -6.054 39.574 18.319 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.791 39.687 20.741 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -7.473 38.086 20.532 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -4.353 36.363 20.565 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.087 36.258 20.241 1.00 0.00 H new ATOM 1520 N ARG A 92 -8.328 37.080 18.364 1.00 0.00 N ATOM 1521 CA ARG A 92 -8.703 35.833 17.717 1.00 0.00 C ATOM 1522 C ARG A 92 -9.096 36.028 16.255 1.00 0.00 C ATOM 1523 O ARG A 92 -8.782 35.184 15.415 1.00 0.00 O ATOM 1524 CB ARG A 92 -9.763 35.075 18.532 1.00 0.00 C ATOM 1525 CG ARG A 92 -11.092 35.830 18.687 1.00 0.00 C ATOM 1526 CD ARG A 92 -12.107 34.991 19.473 1.00 0.00 C ATOM 1527 NE ARG A 92 -13.405 35.673 19.600 1.00 0.00 N ATOM 1528 CZ ARG A 92 -13.737 36.568 20.548 1.00 0.00 C ATOM 1529 NH1 ARG A 92 -12.832 36.989 21.441 1.00 0.00 N ATOM 1530 NH2 ARG A 92 -14.985 37.050 20.592 1.00 0.00 N ATOM 0 H ARG A 92 -8.934 37.361 19.134 1.00 0.00 H new ATOM 0 HA ARG A 92 -7.816 35.200 17.695 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.956 34.115 18.053 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -9.361 34.862 19.522 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -10.920 36.776 19.201 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -11.496 36.070 17.703 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -12.248 34.032 18.974 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.710 34.778 20.466 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.118 35.447 18.906 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.878 36.631 21.408 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -13.097 37.668 22.155 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.676 36.738 19.910 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -15.245 37.729 21.308 1.00 0.00 H new ATOM 1544 N GLN A 93 -9.766 37.144 15.955 1.00 0.00 N ATOM 1545 CA GLN A 93 -10.206 37.442 14.593 1.00 0.00 C ATOM 1546 C GLN A 93 -9.054 37.897 13.690 1.00 0.00 C ATOM 1547 O GLN A 93 -9.278 38.090 12.498 1.00 0.00 O ATOM 1548 CB GLN A 93 -11.362 38.450 14.575 1.00 0.00 C ATOM 1549 CG GLN A 93 -12.629 37.904 15.250 1.00 0.00 C ATOM 1550 CD GLN A 93 -13.755 38.934 15.279 1.00 0.00 C ATOM 1551 OE1 GLN A 93 -14.870 38.651 14.850 1.00 0.00 O ATOM 1552 NE2 GLN A 93 -13.480 40.131 15.798 1.00 0.00 N ATOM 0 H GLN A 93 -10.015 37.857 16.641 1.00 0.00 H new ATOM 0 HA GLN A 93 -10.579 36.505 14.180 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -11.050 39.364 15.080 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.590 38.718 13.543 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -12.967 37.014 14.719 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -12.393 37.597 16.269 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.543 40.333 16.146 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -14.207 40.845 15.848 1.00 0.00 H new ATOM 1561 N GLY A 94 -7.836 38.053 14.226 1.00 0.00 N ATOM 1562 CA GLY A 94 -6.659 38.437 13.455 1.00 0.00 C ATOM 1563 C GLY A 94 -5.686 37.262 13.440 1.00 0.00 C ATOM 1564 O GLY A 94 -5.162 36.901 12.393 1.00 0.00 O ATOM 0 H GLY A 94 -7.644 37.913 15.218 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -6.944 38.706 12.438 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -6.187 39.314 13.897 1.00 0.00 H new ATOM 1568 N THR A 95 -5.464 36.656 14.607 1.00 0.00 N ATOM 1569 CA THR A 95 -4.591 35.515 14.820 1.00 0.00 C ATOM 1570 C THR A 95 -5.066 34.332 14.009 1.00 0.00 C ATOM 1571 O THR A 95 -4.244 33.682 13.374 1.00 0.00 O ATOM 1572 CB THR A 95 -4.516 35.180 16.324 1.00 0.00 C ATOM 1573 OG1 THR A 95 -3.919 36.264 17.005 1.00 0.00 O ATOM 1574 CG2 THR A 95 -3.724 33.901 16.647 1.00 0.00 C ATOM 0 H THR A 95 -5.913 36.968 15.468 1.00 0.00 H new ATOM 0 HA THR A 95 -3.585 35.764 14.482 1.00 0.00 H new ATOM 0 HB THR A 95 -5.541 35.003 16.650 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.596 36.949 17.187 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.720 33.738 17.725 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.191 33.049 16.153 1.00 0.00 H new ATOM 0 HG23 THR A 95 -2.699 34.008 16.292 1.00 0.00 H new ATOM 1582 N LEU A 96 -6.372 34.048 14.010 1.00 0.00 N ATOM 1583 CA LEU A 96 -6.835 32.929 13.206 1.00 0.00 C ATOM 1584 C LEU A 96 -6.757 33.318 11.741 1.00 0.00 C ATOM 1585 O LEU A 96 -6.201 32.589 10.933 1.00 0.00 O ATOM 1586 CB LEU A 96 -8.265 32.500 13.538 1.00 0.00 C ATOM 1587 CG LEU A 96 -8.601 31.247 12.706 1.00 0.00 C ATOM 1588 CD1 LEU A 96 -7.967 30.014 13.338 1.00 0.00 C ATOM 1589 CD2 LEU A 96 -10.080 30.963 12.675 1.00 0.00 C ATOM 0 H LEU A 96 -7.090 34.551 14.531 1.00 0.00 H new ATOM 0 HA LEU A 96 -6.190 32.079 13.428 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -8.359 32.285 14.602 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -8.965 33.305 13.312 1.00 0.00 H new ATOM 0 HG LEU A 96 -8.227 31.446 11.702 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -8.210 29.134 12.743 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -6.885 30.140 13.374 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -8.352 29.885 14.350 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -10.267 30.071 12.077 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -10.441 30.801 13.691 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -10.604 31.811 12.235 1.00 0.00 H new ATOM 1601 N THR A 97 -7.316 34.484 11.427 1.00 0.00 N ATOM 1602 CA THR A 97 -7.322 35.077 10.093 1.00 0.00 C ATOM 1603 C THR A 97 -5.940 35.036 9.462 1.00 0.00 C ATOM 1604 O THR A 97 -5.820 34.841 8.254 1.00 0.00 O ATOM 1605 CB THR A 97 -7.865 36.509 10.201 1.00 0.00 C ATOM 1606 OG1 THR A 97 -9.270 36.455 10.328 1.00 0.00 O ATOM 1607 CG2 THR A 97 -7.461 37.441 9.065 1.00 0.00 C ATOM 0 H THR A 97 -7.794 35.062 12.119 1.00 0.00 H new ATOM 0 HA THR A 97 -7.970 34.499 9.434 1.00 0.00 H new ATOM 0 HB THR A 97 -7.406 36.948 11.087 1.00 0.00 H new ATOM 0 HG1 THR A 97 -9.550 37.000 11.093 1.00 0.00 H new ATOM 0 HG21 THR A 97 -7.893 38.427 9.232 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.375 37.522 9.030 1.00 0.00 H new ATOM 0 HG23 THR A 97 -7.826 37.041 8.119 1.00 0.00 H new ATOM 1615 N GLU A 98 -4.905 35.185 10.286 1.00 0.00 N ATOM 1616 CA GLU A 98 -3.548 35.159 9.810 1.00 0.00 C ATOM 1617 C GLU A 98 -3.063 33.730 9.827 1.00 0.00 C ATOM 1618 O GLU A 98 -2.422 33.331 8.861 1.00 0.00 O ATOM 1619 CB GLU A 98 -2.673 36.109 10.638 1.00 0.00 C ATOM 1620 CG GLU A 98 -1.336 36.370 9.948 1.00 0.00 C ATOM 1621 CD GLU A 98 -0.392 37.145 10.860 1.00 0.00 C ATOM 1622 OE1 GLU A 98 0.316 36.475 11.643 1.00 0.00 O ATOM 1623 OE2 GLU A 98 -0.413 38.391 10.771 1.00 0.00 O ATOM 0 H GLU A 98 -4.995 35.325 11.292 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.488 35.519 8.783 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -3.198 37.052 10.789 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.498 35.680 11.625 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -0.878 35.422 9.665 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -1.501 36.931 9.028 1.00 0.00 H new ATOM 1630 N TYR A 99 -3.375 32.936 10.858 1.00 0.00 N ATOM 1631 CA TYR A 99 -2.911 31.559 10.819 1.00 0.00 C ATOM 1632 C TYR A 99 -3.461 30.820 9.631 1.00 0.00 C ATOM 1633 O TYR A 99 -2.733 30.040 9.077 1.00 0.00 O ATOM 1634 CB TYR A 99 -3.058 30.649 12.062 1.00 0.00 C ATOM 1635 CG TYR A 99 -1.928 29.583 12.225 1.00 0.00 C ATOM 1636 CD1 TYR A 99 -0.780 29.531 11.381 1.00 0.00 C ATOM 1637 CD2 TYR A 99 -2.018 28.618 13.256 1.00 0.00 C ATOM 1638 CE1 TYR A 99 0.226 28.569 11.571 1.00 0.00 C ATOM 1639 CE2 TYR A 99 -1.007 27.645 13.443 1.00 0.00 C ATOM 1640 CZ TYR A 99 0.100 27.625 12.584 1.00 0.00 C ATOM 1641 OH TYR A 99 1.071 26.681 12.688 1.00 0.00 O ATOM 0 H TYR A 99 -3.914 33.207 11.680 1.00 0.00 H new ATOM 0 HA TYR A 99 -1.838 31.741 10.764 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -3.080 31.275 12.954 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -4.018 30.136 12.009 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.682 30.247 10.578 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -2.875 28.624 13.913 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.096 28.563 10.931 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -1.088 26.923 14.242 1.00 0.00 H new ATOM 0 HH TYR A 99 1.322 26.572 13.629 1.00 0.00 H new ATOM 1651 N CYS A 100 -4.695 31.021 9.198 1.00 0.00 N ATOM 1652 CA CYS A 100 -5.162 30.300 8.020 1.00 0.00 C ATOM 1653 C CYS A 100 -4.287 30.654 6.823 1.00 0.00 C ATOM 1654 O CYS A 100 -3.802 29.768 6.121 1.00 0.00 O ATOM 1655 CB CYS A 100 -6.635 30.606 7.734 1.00 0.00 C ATOM 1656 SG CYS A 100 -7.201 29.584 6.347 1.00 0.00 S ATOM 0 H CYS A 100 -5.372 31.653 9.624 1.00 0.00 H new ATOM 0 HA CYS A 100 -5.084 29.229 8.209 1.00 0.00 H new ATOM 0 HB2 CYS A 100 -7.239 30.405 8.619 1.00 0.00 H new ATOM 0 HB3 CYS A 100 -6.759 31.663 7.497 1.00 0.00 H new ATOM 0 HG CYS A 100 -8.452 29.839 6.102 1.00 0.00 H new ATOM 1662 N SER A 101 -4.070 31.953 6.606 1.00 0.00 N ATOM 1663 CA SER A 101 -3.231 32.398 5.499 1.00 0.00 C ATOM 1664 C SER A 101 -1.760 31.980 5.635 1.00 0.00 C ATOM 1665 O SER A 101 -1.073 31.795 4.634 1.00 0.00 O ATOM 1666 CB SER A 101 -3.344 33.921 5.375 1.00 0.00 C ATOM 1667 OG SER A 101 -4.698 34.297 5.227 1.00 0.00 O ATOM 0 H SER A 101 -4.459 32.704 7.176 1.00 0.00 H new ATOM 0 HA SER A 101 -3.595 31.907 4.596 1.00 0.00 H new ATOM 0 HB2 SER A 101 -2.921 34.398 6.259 1.00 0.00 H new ATOM 0 HB3 SER A 101 -2.766 34.268 4.518 1.00 0.00 H new ATOM 0 HG SER A 101 -5.083 34.487 6.108 1.00 0.00 H new ATOM 1673 N THR A 102 -1.276 31.856 6.870 1.00 0.00 N ATOM 1674 CA THR A 102 0.096 31.537 7.222 1.00 0.00 C ATOM 1675 C THR A 102 0.390 30.043 7.310 1.00 0.00 C ATOM 1676 O THR A 102 1.458 29.635 6.870 1.00 0.00 O ATOM 1677 CB THR A 102 0.494 32.425 8.415 1.00 0.00 C ATOM 1678 OG1 THR A 102 0.281 33.770 8.042 1.00 0.00 O ATOM 1679 CG2 THR A 102 1.944 32.323 8.851 1.00 0.00 C ATOM 0 H THR A 102 -1.867 31.983 7.692 1.00 0.00 H new ATOM 0 HA THR A 102 0.776 31.789 6.409 1.00 0.00 H new ATOM 0 HB THR A 102 -0.114 32.081 9.252 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.676 33.976 8.094 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.117 32.988 9.697 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.164 31.297 9.145 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.594 32.611 8.024 1.00 0.00 H new ATOM 1687 N LEU A 103 -0.538 29.216 7.796 1.00 0.00 N ATOM 1688 CA LEU A 103 -0.420 27.755 7.851 1.00 0.00 C ATOM 1689 C LEU A 103 -0.283 27.316 6.391 1.00 0.00 C ATOM 1690 O LEU A 103 0.382 26.330 6.093 1.00 0.00 O ATOM 1691 CB LEU A 103 -1.670 27.094 8.527 1.00 0.00 C ATOM 1692 CG LEU A 103 -1.565 26.215 9.808 1.00 0.00 C ATOM 1693 CD1 LEU A 103 -2.838 26.233 10.667 1.00 0.00 C ATOM 1694 CD2 LEU A 103 -1.235 24.728 9.590 1.00 0.00 C ATOM 0 H LEU A 103 -1.422 29.555 8.175 1.00 0.00 H new ATOM 0 HA LEU A 103 0.432 27.444 8.456 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -2.362 27.903 8.761 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.146 26.478 7.765 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.724 26.696 10.308 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.695 25.600 11.543 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.046 27.254 10.987 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -3.677 25.858 10.081 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.189 24.221 10.554 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.010 24.270 8.975 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.272 24.639 9.086 1.00 0.00 H new ATOM 1706 N MET A 104 -0.888 28.072 5.466 1.00 0.00 N ATOM 1707 CA MET A 104 -0.806 27.829 4.050 1.00 0.00 C ATOM 1708 C MET A 104 0.516 28.260 3.422 1.00 0.00 C ATOM 1709 O MET A 104 0.917 27.705 2.400 1.00 0.00 O ATOM 1710 CB MET A 104 -1.926 28.638 3.376 1.00 0.00 C ATOM 1711 CG MET A 104 -3.265 27.917 3.380 1.00 0.00 C ATOM 1712 SD MET A 104 -3.675 27.088 1.820 1.00 0.00 S ATOM 1713 CE MET A 104 -2.237 26.010 1.652 1.00 0.00 C ATOM 0 H MET A 104 -1.457 28.884 5.704 1.00 0.00 H new ATOM 0 HA MET A 104 -0.895 26.753 3.903 1.00 0.00 H new ATOM 0 HB2 MET A 104 -2.033 29.595 3.887 1.00 0.00 H new ATOM 0 HB3 MET A 104 -1.640 28.856 2.347 1.00 0.00 H new ATOM 0 HG2 MET A 104 -3.263 27.177 4.181 1.00 0.00 H new ATOM 0 HG3 MET A 104 -4.050 28.636 3.612 1.00 0.00 H new ATOM 0 HE1 MET A 104 -2.376 25.349 0.797 1.00 0.00 H new ATOM 0 HE2 MET A 104 -1.344 26.616 1.501 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.122 25.414 2.557 1.00 0.00 H new ATOM 1723 N SER A 105 1.152 29.270 4.011 1.00 0.00 N ATOM 1724 CA SER A 105 2.363 29.891 3.496 1.00 0.00 C ATOM 1725 C SER A 105 3.629 29.227 4.004 1.00 0.00 C ATOM 1726 O SER A 105 4.557 29.071 3.213 1.00 0.00 O ATOM 1727 CB SER A 105 2.379 31.421 3.863 1.00 0.00 C ATOM 1728 OG SER A 105 2.785 31.583 5.206 1.00 0.00 O ATOM 0 H SER A 105 0.828 29.688 4.883 1.00 0.00 H new ATOM 0 HA SER A 105 2.348 29.764 2.413 1.00 0.00 H new ATOM 0 HB2 SER A 105 3.058 31.957 3.200 1.00 0.00 H new ATOM 0 HB3 SER A 105 1.388 31.850 3.718 1.00 0.00 H new ATOM 0 HG SER A 105 2.368 30.890 5.760 1.00 0.00 H new ATOM 1734 N LEU A 106 3.688 28.875 5.298 1.00 0.00 N ATOM 1735 CA LEU A 106 4.848 28.324 5.927 1.00 0.00 C ATOM 1736 C LEU A 106 5.799 27.500 5.057 1.00 0.00 C ATOM 1737 O LEU A 106 5.344 26.626 4.314 1.00 0.00 O ATOM 1738 CB LEU A 106 4.537 27.713 7.293 1.00 0.00 C ATOM 1739 CG LEU A 106 3.891 28.548 8.407 1.00 0.00 C ATOM 1740 CD1 LEU A 106 4.278 27.959 9.762 1.00 0.00 C ATOM 1741 CD2 LEU A 106 4.327 30.009 8.372 1.00 0.00 C ATOM 0 H LEU A 106 2.897 28.978 5.933 1.00 0.00 H new ATOM 0 HA LEU A 106 5.471 29.200 6.109 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.886 26.857 7.118 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.475 27.324 7.689 1.00 0.00 H new ATOM 0 HG LEU A 106 2.813 28.516 8.252 1.00 0.00 H new ATOM 0 HD11 LEU A 106 3.822 28.548 10.558 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.926 26.929 9.825 1.00 0.00 H new ATOM 0 HD13 LEU A 106 5.362 27.979 9.871 1.00 0.00 H new ATOM 0 HD21 LEU A 106 3.840 30.553 9.181 1.00 0.00 H new ATOM 0 HD22 LEU A 106 5.409 30.069 8.493 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.044 30.450 7.416 1.00 0.00 H new ATOM 1753 N PRO A 107 7.124 27.765 5.139 1.00 0.00 N ATOM 1754 CA PRO A 107 8.096 27.045 4.333 1.00 0.00 C ATOM 1755 C PRO A 107 8.444 25.704 4.943 1.00 0.00 C ATOM 1756 O PRO A 107 9.267 24.957 4.418 1.00 0.00 O ATOM 1757 CB PRO A 107 9.325 27.932 4.280 1.00 0.00 C ATOM 1758 CG PRO A 107 9.312 28.603 5.655 1.00 0.00 C ATOM 1759 CD PRO A 107 7.824 28.720 6.009 1.00 0.00 C ATOM 0 HA PRO A 107 7.696 26.836 3.341 1.00 0.00 H new ATOM 0 HB2 PRO A 107 10.235 27.354 4.120 1.00 0.00 H new ATOM 0 HB3 PRO A 107 9.264 28.661 3.472 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.850 28.008 6.393 1.00 0.00 H new ATOM 0 HG3 PRO A 107 9.791 29.582 5.624 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.654 28.487 7.060 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.463 29.735 5.844 1.00 0.00 H new ATOM 1767 N THR A 108 7.781 25.389 6.046 1.00 0.00 N ATOM 1768 CA THR A 108 7.918 24.157 6.767 1.00 0.00 C ATOM 1769 C THR A 108 7.046 23.151 6.066 1.00 0.00 C ATOM 1770 O THR A 108 6.319 22.427 6.713 1.00 0.00 O ATOM 1771 CB THR A 108 7.359 24.410 8.168 1.00 0.00 C ATOM 1772 OG1 THR A 108 6.122 25.094 8.107 1.00 0.00 O ATOM 1773 CG2 THR A 108 8.322 25.221 9.001 1.00 0.00 C ATOM 0 H THR A 108 7.105 26.022 6.472 1.00 0.00 H new ATOM 0 HA THR A 108 8.948 23.805 6.819 1.00 0.00 H new ATOM 0 HB THR A 108 7.212 23.435 8.632 1.00 0.00 H new ATOM 0 HG1 THR A 108 5.785 25.242 9.015 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.898 25.385 9.991 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.265 24.682 9.095 1.00 0.00 H new ATOM 0 HG23 THR A 108 8.500 26.182 8.519 1.00 0.00 H new ATOM 1781 N LYS A 109 7.059 23.091 4.743 1.00 0.00 N ATOM 1782 CA LYS A 109 6.171 22.146 4.084 1.00 0.00 C ATOM 1783 C LYS A 109 6.530 20.692 4.364 1.00 0.00 C ATOM 1784 O LYS A 109 5.696 19.814 4.182 1.00 0.00 O ATOM 1785 CB LYS A 109 6.051 22.474 2.578 1.00 0.00 C ATOM 1786 CG LYS A 109 4.758 21.881 2.002 1.00 0.00 C ATOM 1787 CD LYS A 109 4.512 22.383 0.576 1.00 0.00 C ATOM 1788 CE LYS A 109 3.210 21.784 0.029 1.00 0.00 C ATOM 1789 NZ LYS A 109 2.907 22.276 -1.328 1.00 0.00 N ATOM 0 H LYS A 109 7.645 23.656 4.128 1.00 0.00 H new ATOM 0 HA LYS A 109 5.179 22.265 4.519 1.00 0.00 H new ATOM 0 HB2 LYS A 109 6.059 23.554 2.433 1.00 0.00 H new ATOM 0 HB3 LYS A 109 6.912 22.074 2.043 1.00 0.00 H new ATOM 0 HG2 LYS A 109 4.821 20.793 2.003 1.00 0.00 H new ATOM 0 HG3 LYS A 109 3.915 22.152 2.637 1.00 0.00 H new ATOM 0 HD2 LYS A 109 4.453 23.471 0.569 1.00 0.00 H new ATOM 0 HD3 LYS A 109 5.348 22.105 -0.066 1.00 0.00 H new ATOM 0 HE2 LYS A 109 3.289 20.697 0.012 1.00 0.00 H new ATOM 0 HE3 LYS A 109 2.386 22.033 0.698 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.020 21.848 -1.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 2.806 23.311 -1.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.681 22.016 -1.972 1.00 0.00 H new ATOM 1803 N ILE A 110 7.745 20.442 4.845 1.00 0.00 N ATOM 1804 CA ILE A 110 8.186 19.101 5.209 1.00 0.00 C ATOM 1805 C ILE A 110 7.851 18.826 6.677 1.00 0.00 C ATOM 1806 O ILE A 110 7.505 17.704 7.040 1.00 0.00 O ATOM 1807 CB ILE A 110 9.689 18.932 4.899 1.00 0.00 C ATOM 1808 CG1 ILE A 110 9.954 19.210 3.405 1.00 0.00 C ATOM 1809 CG2 ILE A 110 10.168 17.522 5.280 1.00 0.00 C ATOM 1810 CD1 ILE A 110 11.436 19.130 3.024 1.00 0.00 C ATOM 0 H ILE A 110 8.450 21.164 4.993 1.00 0.00 H new ATOM 0 HA ILE A 110 7.655 18.360 4.612 1.00 0.00 H new ATOM 0 HB ILE A 110 10.251 19.651 5.495 1.00 0.00 H new ATOM 0 HG12 ILE A 110 9.393 18.494 2.805 1.00 0.00 H new ATOM 0 HG13 ILE A 110 9.575 20.201 3.155 1.00 0.00 H new ATOM 0 HG21 ILE A 110 11.230 17.425 5.053 1.00 0.00 H new ATOM 0 HG22 ILE A 110 10.008 17.359 6.346 1.00 0.00 H new ATOM 0 HG23 ILE A 110 9.606 16.781 4.711 1.00 0.00 H new ATOM 0 HD11 ILE A 110 11.550 19.336 1.960 1.00 0.00 H new ATOM 0 HD12 ILE A 110 12.000 19.865 3.598 1.00 0.00 H new ATOM 0 HD13 ILE A 110 11.815 18.132 3.243 1.00 0.00 H new ATOM 1822 N SER A 111 7.956 19.855 7.519 1.00 0.00 N ATOM 1823 CA SER A 111 7.705 19.778 8.949 1.00 0.00 C ATOM 1824 C SER A 111 6.208 19.769 9.250 1.00 0.00 C ATOM 1825 O SER A 111 5.710 18.983 10.054 1.00 0.00 O ATOM 1826 CB SER A 111 8.403 20.953 9.662 1.00 0.00 C ATOM 1827 OG SER A 111 9.185 21.721 8.763 1.00 0.00 O ATOM 0 H SER A 111 8.226 20.789 7.211 1.00 0.00 H new ATOM 0 HA SER A 111 8.116 18.841 9.324 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.654 21.592 10.130 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.038 20.569 10.460 1.00 0.00 H new ATOM 0 HG SER A 111 9.612 22.458 9.248 1.00 0.00 H new ATOM 1833 N ARG A 112 5.515 20.698 8.599 1.00 0.00 N ATOM 1834 CA ARG A 112 4.101 20.982 8.734 1.00 0.00 C ATOM 1835 C ARG A 112 3.175 20.126 7.890 1.00 0.00 C ATOM 1836 O ARG A 112 1.979 20.154 8.154 1.00 0.00 O ATOM 1837 CB ARG A 112 3.895 22.449 8.364 1.00 0.00 C ATOM 1838 CG ARG A 112 2.610 23.095 8.876 1.00 0.00 C ATOM 1839 CD ARG A 112 2.579 24.537 8.367 1.00 0.00 C ATOM 1840 NE ARG A 112 2.225 24.625 6.940 1.00 0.00 N ATOM 1841 CZ ARG A 112 3.041 24.807 5.884 1.00 0.00 C ATOM 1842 NH1 ARG A 112 4.364 24.641 5.969 1.00 0.00 N ATOM 1843 NH2 ARG A 112 2.520 25.223 4.725 1.00 0.00 N ATOM 0 H ARG A 112 5.963 21.311 7.918 1.00 0.00 H new ATOM 0 HA ARG A 112 3.834 20.750 9.765 1.00 0.00 H new ATOM 0 HB2 ARG A 112 4.742 23.021 8.743 1.00 0.00 H new ATOM 0 HB3 ARG A 112 3.913 22.535 7.278 1.00 0.00 H new ATOM 0 HG2 ARG A 112 1.738 22.545 8.521 1.00 0.00 H new ATOM 0 HG3 ARG A 112 2.579 23.073 9.965 1.00 0.00 H new ATOM 0 HD2 ARG A 112 1.860 25.110 8.952 1.00 0.00 H new ATOM 0 HD3 ARG A 112 3.555 24.995 8.525 1.00 0.00 H new ATOM 0 HE ARG A 112 1.232 24.537 6.723 1.00 0.00 H new ATOM 0 HH11 ARG A 112 4.788 24.367 6.856 1.00 0.00 H new ATOM 0 HH12 ARG A 112 4.950 24.788 5.147 1.00 0.00 H new ATOM 0 HH21 ARG A 112 1.518 25.398 4.650 1.00 0.00 H new ATOM 0 HH22 ARG A 112 3.125 25.366 3.916 1.00 0.00 H new ATOM 1857 N CYS A 113 3.666 19.385 6.891 1.00 0.00 N ATOM 1858 CA CYS A 113 2.759 18.570 6.078 1.00 0.00 C ATOM 1859 C CYS A 113 1.942 17.633 6.969 1.00 0.00 C ATOM 1860 O CYS A 113 0.728 17.812 7.084 1.00 0.00 O ATOM 1861 CB CYS A 113 3.468 17.802 4.949 1.00 0.00 C ATOM 1862 SG CYS A 113 2.939 18.447 3.336 1.00 0.00 S ATOM 0 H CYS A 113 4.651 19.332 6.632 1.00 0.00 H new ATOM 0 HA CYS A 113 2.081 19.261 5.577 1.00 0.00 H new ATOM 0 HB2 CYS A 113 4.549 17.900 5.053 1.00 0.00 H new ATOM 0 HB3 CYS A 113 3.237 16.739 5.019 1.00 0.00 H new ATOM 0 HG CYS A 113 3.544 17.795 2.388 1.00 0.00 H new ATOM 1868 N PRO A 114 2.571 16.646 7.629 1.00 0.00 N ATOM 1869 CA PRO A 114 1.846 15.732 8.487 1.00 0.00 C ATOM 1870 C PRO A 114 1.159 16.446 9.631 1.00 0.00 C ATOM 1871 O PRO A 114 0.136 15.958 10.089 1.00 0.00 O ATOM 1872 CB PRO A 114 2.854 14.677 8.945 1.00 0.00 C ATOM 1873 CG PRO A 114 4.190 15.415 8.845 1.00 0.00 C ATOM 1874 CD PRO A 114 3.991 16.322 7.630 1.00 0.00 C ATOM 0 HA PRO A 114 1.027 15.253 7.950 1.00 0.00 H new ATOM 0 HB2 PRO A 114 2.653 14.341 9.962 1.00 0.00 H new ATOM 0 HB3 PRO A 114 2.832 13.793 8.307 1.00 0.00 H new ATOM 0 HG2 PRO A 114 4.403 15.989 9.747 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.022 14.726 8.702 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.601 17.222 7.706 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.281 15.817 6.709 1.00 0.00 H new ATOM 1882 N HIS A 115 1.679 17.592 10.073 1.00 0.00 N ATOM 1883 CA HIS A 115 1.036 18.338 11.138 1.00 0.00 C ATOM 1884 C HIS A 115 -0.336 18.812 10.629 1.00 0.00 C ATOM 1885 O HIS A 115 -1.359 18.468 11.223 1.00 0.00 O ATOM 1886 CB HIS A 115 1.976 19.420 11.712 1.00 0.00 C ATOM 1887 CG HIS A 115 1.872 19.643 13.211 1.00 0.00 C ATOM 1888 ND1 HIS A 115 1.561 18.629 14.110 1.00 0.00 N ATOM 1889 CD2 HIS A 115 2.033 20.764 13.998 1.00 0.00 C ATOM 1890 CE1 HIS A 115 1.544 19.165 15.341 1.00 0.00 C ATOM 1891 NE2 HIS A 115 1.826 20.466 15.340 1.00 0.00 N ATOM 0 H HIS A 115 2.534 18.014 9.711 1.00 0.00 H new ATOM 0 HA HIS A 115 0.835 17.716 12.010 1.00 0.00 H new ATOM 0 HB2 HIS A 115 3.004 19.149 11.472 1.00 0.00 H new ATOM 0 HB3 HIS A 115 1.769 20.363 11.206 1.00 0.00 H new ATOM 0 HD2 HIS A 115 2.286 21.744 13.621 1.00 0.00 H new ATOM 0 HE1 HIS A 115 1.325 18.601 16.236 1.00 0.00 H new ATOM 0 HE2 HIS A 115 1.878 21.098 16.139 1.00 0.00 H new ATOM 1899 N LEU A 116 -0.398 19.574 9.525 1.00 0.00 N ATOM 1900 CA LEU A 116 -1.667 20.028 8.994 1.00 0.00 C ATOM 1901 C LEU A 116 -2.623 18.854 8.764 1.00 0.00 C ATOM 1902 O LEU A 116 -3.772 18.845 9.209 1.00 0.00 O ATOM 1903 CB LEU A 116 -1.566 20.857 7.699 1.00 0.00 C ATOM 1904 CG LEU A 116 -2.768 21.813 7.507 1.00 0.00 C ATOM 1905 CD1 LEU A 116 -3.432 21.821 6.111 1.00 0.00 C ATOM 1906 CD2 LEU A 116 -3.967 21.590 8.392 1.00 0.00 C ATOM 0 H LEU A 116 0.418 19.880 8.995 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.058 20.695 9.762 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -0.644 21.438 7.715 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -1.503 20.183 6.845 1.00 0.00 H new ATOM 0 HG LEU A 116 -2.227 22.730 7.738 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -4.260 22.530 6.106 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -2.698 22.114 5.361 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -3.807 20.824 5.881 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -4.736 22.326 8.155 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.361 20.587 8.225 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.673 21.695 9.436 1.00 0.00 H new ATOM 1918 N LEU A 117 -2.133 17.831 8.072 1.00 0.00 N ATOM 1919 CA LEU A 117 -2.930 16.637 7.850 1.00 0.00 C ATOM 1920 C LEU A 117 -3.459 16.138 9.193 1.00 0.00 C ATOM 1921 O LEU A 117 -4.641 15.863 9.295 1.00 0.00 O ATOM 1922 CB LEU A 117 -2.167 15.572 7.061 1.00 0.00 C ATOM 1923 CG LEU A 117 -2.055 15.781 5.530 1.00 0.00 C ATOM 1924 CD1 LEU A 117 -0.701 16.302 5.057 1.00 0.00 C ATOM 1925 CD2 LEU A 117 -2.320 14.451 4.856 1.00 0.00 C ATOM 0 H LEU A 117 -1.200 17.806 7.661 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.785 16.882 7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -1.158 15.505 7.469 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -2.647 14.610 7.238 1.00 0.00 H new ATOM 0 HG LEU A 117 -2.784 16.546 5.264 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.714 16.418 3.973 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -0.499 17.267 5.523 1.00 0.00 H new ATOM 0 HD13 LEU A 117 0.079 15.594 5.337 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -2.247 14.570 3.775 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.584 13.720 5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -3.320 14.104 5.116 1.00 0.00 H new ATOM 1937 N ASP A 118 -2.634 16.069 10.233 1.00 0.00 N ATOM 1938 CA ASP A 118 -3.048 15.670 11.581 1.00 0.00 C ATOM 1939 C ASP A 118 -3.850 16.748 12.340 1.00 0.00 C ATOM 1940 O ASP A 118 -4.286 16.516 13.464 1.00 0.00 O ATOM 1941 CB ASP A 118 -1.779 15.411 12.408 1.00 0.00 C ATOM 1942 CG ASP A 118 -1.131 14.045 12.180 1.00 0.00 C ATOM 1943 OD1 ASP A 118 -1.855 13.103 11.782 1.00 0.00 O ATOM 1944 OD2 ASP A 118 0.088 13.952 12.437 1.00 0.00 O ATOM 0 H ASP A 118 -1.641 16.292 10.165 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.689 14.796 11.461 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -1.048 16.187 12.178 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -2.025 15.508 13.465 1.00 0.00 H new ATOM 1949 N PHE A 119 -4.049 17.924 11.750 1.00 0.00 N ATOM 1950 CA PHE A 119 -4.783 19.075 12.281 1.00 0.00 C ATOM 1951 C PHE A 119 -6.225 18.817 11.913 1.00 0.00 C ATOM 1952 O PHE A 119 -7.129 19.118 12.686 1.00 0.00 O ATOM 1953 CB PHE A 119 -4.271 20.370 11.553 1.00 0.00 C ATOM 1954 CG PHE A 119 -4.039 21.741 12.196 1.00 0.00 C ATOM 1955 CD1 PHE A 119 -4.902 22.154 13.207 1.00 0.00 C ATOM 1956 CD2 PHE A 119 -2.987 22.620 11.816 1.00 0.00 C ATOM 1957 CE1 PHE A 119 -4.761 23.375 13.878 1.00 0.00 C ATOM 1958 CE2 PHE A 119 -2.842 23.831 12.503 1.00 0.00 C ATOM 1959 CZ PHE A 119 -3.711 24.221 13.527 1.00 0.00 C ATOM 0 H PHE A 119 -3.675 18.114 10.820 1.00 0.00 H new ATOM 0 HA PHE A 119 -4.655 19.208 13.355 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -3.319 20.094 11.100 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -4.973 20.544 10.737 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -5.717 21.503 13.487 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -2.314 22.358 11.013 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -5.455 23.657 14.656 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.029 24.488 12.232 1.00 0.00 H new ATOM 0 HZ PHE A 119 -3.571 25.162 14.037 1.00 0.00 H new ATOM 1969 N PHE A 120 -6.385 18.272 10.707 1.00 0.00 N ATOM 1970 CA PHE A 120 -7.630 17.956 10.047 1.00 0.00 C ATOM 1971 C PHE A 120 -8.111 16.509 10.158 1.00 0.00 C ATOM 1972 O PHE A 120 -9.232 16.267 10.596 1.00 0.00 O ATOM 1973 CB PHE A 120 -7.353 18.300 8.579 1.00 0.00 C ATOM 1974 CG PHE A 120 -7.180 19.768 8.247 1.00 0.00 C ATOM 1975 CD1 PHE A 120 -7.404 20.776 9.207 1.00 0.00 C ATOM 1976 CD2 PHE A 120 -6.806 20.125 6.939 1.00 0.00 C ATOM 1977 CE1 PHE A 120 -7.317 22.126 8.852 1.00 0.00 C ATOM 1978 CE2 PHE A 120 -6.723 21.478 6.581 1.00 0.00 C ATOM 1979 CZ PHE A 120 -6.992 22.475 7.536 1.00 0.00 C ATOM 0 H PHE A 120 -5.580 18.025 10.131 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.437 18.514 10.521 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.451 17.772 8.270 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -8.173 17.909 7.977 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -7.645 20.504 10.224 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -6.583 19.358 6.212 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -7.499 22.894 9.589 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -6.453 21.755 5.573 1.00 0.00 H new ATOM 0 HZ PHE A 120 -6.948 23.516 7.252 1.00 0.00 H new ATOM 1989 N LYS A 121 -7.295 15.545 9.737 1.00 0.00 N ATOM 1990 CA LYS A 121 -7.670 14.133 9.746 1.00 0.00 C ATOM 1991 C LYS A 121 -7.912 13.572 11.146 1.00 0.00 C ATOM 1992 O LYS A 121 -8.489 12.495 11.280 1.00 0.00 O ATOM 1993 CB LYS A 121 -6.772 13.275 8.848 1.00 0.00 C ATOM 1994 CG LYS A 121 -5.459 12.853 9.502 1.00 0.00 C ATOM 1995 CD LYS A 121 -4.420 12.519 8.418 1.00 0.00 C ATOM 1996 CE LYS A 121 -2.986 12.571 8.954 1.00 0.00 C ATOM 1997 NZ LYS A 121 -2.626 11.378 9.731 1.00 0.00 N ATOM 0 H LYS A 121 -6.356 15.721 9.380 1.00 0.00 H new ATOM 0 HA LYS A 121 -8.654 14.076 9.280 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -7.321 12.382 8.550 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -6.550 13.831 7.937 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -5.087 13.654 10.141 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.623 11.985 10.141 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.621 11.525 8.019 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.522 13.221 7.591 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -2.294 12.677 8.118 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -2.869 13.456 9.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.927 11.635 10.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -3.476 10.993 10.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.219 10.661 9.097 1.00 0.00 H new ATOM 2011 N VAL A 122 -7.481 14.303 12.179 1.00 0.00 N ATOM 2012 CA VAL A 122 -7.648 13.914 13.566 1.00 0.00 C ATOM 2013 C VAL A 122 -8.866 14.610 14.155 1.00 0.00 C ATOM 2014 O VAL A 122 -9.688 13.917 14.750 1.00 0.00 O ATOM 2015 CB VAL A 122 -6.351 14.134 14.347 1.00 0.00 C ATOM 2016 CG1 VAL A 122 -6.464 13.628 15.791 1.00 0.00 C ATOM 2017 CG2 VAL A 122 -5.238 13.356 13.633 1.00 0.00 C ATOM 0 H VAL A 122 -7.000 15.195 12.063 1.00 0.00 H new ATOM 0 HA VAL A 122 -7.848 12.845 13.638 1.00 0.00 H new ATOM 0 HB VAL A 122 -6.138 15.202 14.385 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -5.523 13.802 16.312 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -7.266 14.161 16.302 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -6.684 12.560 15.786 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -4.298 13.493 14.167 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -5.491 12.296 13.611 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -5.133 13.725 12.613 1.00 0.00 H new ATOM 2027 N ARG A 123 -8.992 15.941 13.986 1.00 0.00 N ATOM 2028 CA ARG A 123 -10.143 16.714 14.482 1.00 0.00 C ATOM 2029 C ARG A 123 -11.046 16.079 15.546 1.00 0.00 C ATOM 2030 O ARG A 123 -12.121 15.583 15.197 1.00 0.00 O ATOM 2031 CB ARG A 123 -10.984 17.231 13.309 1.00 0.00 C ATOM 2032 CG ARG A 123 -10.233 18.343 12.578 1.00 0.00 C ATOM 2033 CD ARG A 123 -10.245 19.745 13.214 1.00 0.00 C ATOM 2034 NE ARG A 123 -11.000 19.839 14.471 1.00 0.00 N ATOM 2035 CZ ARG A 123 -10.479 19.966 15.702 1.00 0.00 C ATOM 2036 NH1 ARG A 123 -9.177 19.762 15.898 1.00 0.00 N ATOM 2037 NH2 ARG A 123 -11.263 20.299 16.734 1.00 0.00 N ATOM 0 H ARG A 123 -8.297 16.509 13.501 1.00 0.00 H new ATOM 0 HA ARG A 123 -9.664 17.524 15.031 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -11.203 16.415 12.620 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -11.940 17.606 13.674 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -9.194 18.032 12.469 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -10.648 18.426 11.574 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -9.216 20.055 13.399 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -10.667 20.451 12.498 1.00 0.00 H new ATOM 0 HE ARG A 123 -12.017 19.804 14.402 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -8.577 19.509 15.113 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -8.781 19.858 16.833 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -12.260 20.457 16.587 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -10.864 20.395 17.668 1.00 0.00 H new ATOM 2051 N PRO A 124 -10.657 16.111 16.838 1.00 0.00 N ATOM 2052 CA PRO A 124 -11.457 15.577 17.924 1.00 0.00 C ATOM 2053 C PRO A 124 -12.596 16.533 18.308 1.00 0.00 C ATOM 2054 O PRO A 124 -12.734 16.974 19.449 1.00 0.00 O ATOM 2055 CB PRO A 124 -10.466 15.298 19.055 1.00 0.00 C ATOM 2056 CG PRO A 124 -9.468 16.440 18.889 1.00 0.00 C ATOM 2057 CD PRO A 124 -9.413 16.645 17.373 1.00 0.00 C ATOM 0 HA PRO A 124 -11.977 14.659 17.650 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -10.947 15.315 20.033 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -9.991 14.322 18.950 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -9.799 17.341 19.405 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -8.490 16.181 19.295 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -9.308 17.702 17.128 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -8.553 16.131 16.943 1.00 0.00 H new ATOM 2065 N ASP A 125 -13.428 16.803 17.304 1.00 0.00 N ATOM 2066 CA ASP A 125 -14.643 17.598 17.306 1.00 0.00 C ATOM 2067 C ASP A 125 -15.473 17.408 16.039 1.00 0.00 C ATOM 2068 O ASP A 125 -16.651 17.748 16.006 1.00 0.00 O ATOM 2069 CB ASP A 125 -14.402 19.083 17.593 1.00 0.00 C ATOM 2070 CG ASP A 125 -15.616 19.693 18.290 1.00 0.00 C ATOM 2071 OD1 ASP A 125 -15.710 19.482 19.521 1.00 0.00 O ATOM 2072 OD2 ASP A 125 -16.422 20.362 17.603 1.00 0.00 O ATOM 0 H ASP A 125 -13.243 16.428 16.374 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.227 17.212 18.141 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -13.518 19.200 18.219 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.205 19.613 16.661 1.00 0.00 H new ATOM 2077 N ASP A 126 -14.862 16.839 15.003 1.00 0.00 N ATOM 2078 CA ASP A 126 -15.523 16.528 13.758 1.00 0.00 C ATOM 2079 C ASP A 126 -16.078 15.111 13.865 1.00 0.00 C ATOM 2080 O ASP A 126 -17.266 14.894 13.641 1.00 0.00 O ATOM 2081 CB ASP A 126 -14.529 16.624 12.589 1.00 0.00 C ATOM 2082 CG ASP A 126 -15.081 16.002 11.308 1.00 0.00 C ATOM 2083 OD1 ASP A 126 -16.253 16.290 10.986 1.00 0.00 O ATOM 2084 OD2 ASP A 126 -14.322 15.227 10.688 1.00 0.00 O ATOM 0 H ASP A 126 -13.875 16.580 15.015 1.00 0.00 H new ATOM 0 HA ASP A 126 -16.330 17.237 13.570 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -14.286 17.671 12.407 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -13.600 16.124 12.863 1.00 0.00 H new