USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1137 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 3 ASN : amide:sc= -2.44 K(o=-6.3,f=-3) USER MOD Set 1.2: A 59 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 63 ASN : amide:sc= -3.83 K(o=-6.3,f=-3) USER MOD Set 2.1: A 21 MET CE :methyl 158:sc= -6.05! (180deg=-3.86!) USER MOD Set 2.2: A 24 CYS SG : rot -9:sc= -3.26! USER MOD Set 2.3: A 28 CYS SG : rot 92:sc= -5.26! USER MOD Set 3.1: A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 46 GLN : amide:sc= -8.49! C(o=-8.5!,f=-9.6!) USER MOD Single : A 6 HIS : no HD1:sc= -0.867 K(o=-0.87,f=-0.15) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -5.6! C(o=-5.6!,f=-2.6!) USER MOD Single : A 15 HIS : no HE2:sc= -4.82! C(o=-4.8!,f=-5!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot -26:sc= -2.84 USER MOD Single : A 22 LYS NZ :NH3+ -164:sc= -0.0523 (180deg=-0.386) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 174:sc= -0.432 (180deg=-0.719) USER MOD Single : A 27 GLN : amide:sc= -10.2! C(o=-10!,f=-7.6!) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 73:sc= 1.08 USER MOD Single : A 57 LYS NZ :NH3+ -144:sc= -1.41! (180deg=-2.28!) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.0772 USER MOD Single : A 62 MET CE :methyl 152:sc= -4.18 (180deg=-8.39!) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -2.55 K(o=-2.5,f=-8.1!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 SER OG : rot 47:sc= 0.00242 USER MOD Single : A 81 ASN : amide:sc= -0.286 K(o=-0.29,f=-2.1!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.968 K(o=-0.97,f=-1.5!) USER MOD Single : A 86 CYS SG : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.411 X(o=-0.41,f=-0.2) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc=-0.00165 (180deg=-0.00165) USER MOD Single : A 102 ASN : amide:sc= -7.52! C(o=-7.5!,f=-15!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 70:sc= 0.692! USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot -86:sc= 0.232 USER MOD Single : A 117 GLN : amide:sc= -1.05 X(o=-1,f=-0.61) USER MOD Single : A 120 GLN : amide:sc= -8.16! C(o=-8.2!,f=-11!) USER MOD Single : A 122 MET CE :methyl 159:sc= -6.34! (180deg=-8.59!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -5.03! C(o=-5!,f=-4.2!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.12) USER MOD Single : A 138 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.044) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 -18.086 -0.177 -5.787 1.00 0.00 N ATOM 21 CA GLU A 2 -17.626 -1.111 -6.807 1.00 0.00 C ATOM 22 C GLU A 2 -16.108 -1.265 -6.764 1.00 0.00 C ATOM 23 O GLU A 2 -15.570 -2.309 -7.136 1.00 0.00 O ATOM 24 CB GLU A 2 -18.065 -0.639 -8.195 1.00 0.00 C ATOM 25 CG GLU A 2 -18.787 -1.706 -9.001 1.00 0.00 C ATOM 26 CD GLU A 2 -19.106 -1.255 -10.412 1.00 0.00 C ATOM 27 OE1 GLU A 2 -19.466 -0.072 -10.591 1.00 0.00 O ATOM 28 OE2 GLU A 2 -18.996 -2.085 -11.340 1.00 0.00 O ATOM 0 HA GLU A 2 -18.075 -2.083 -6.602 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -18.719 0.226 -8.085 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.188 -0.307 -8.751 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -18.171 -2.604 -9.041 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -19.712 -1.976 -8.492 1.00 0.00 H new ATOM 35 N ASN A 3 -15.422 -0.221 -6.311 1.00 0.00 N ATOM 36 CA ASN A 3 -13.969 -0.241 -6.223 1.00 0.00 C ATOM 37 C ASN A 3 -13.508 -0.868 -4.913 1.00 0.00 C ATOM 38 O ASN A 3 -12.420 -1.437 -4.834 1.00 0.00 O ATOM 39 CB ASN A 3 -13.421 1.181 -6.322 1.00 0.00 C ATOM 40 CG ASN A 3 -14.010 1.954 -7.482 1.00 0.00 C ATOM 41 OD1 ASN A 3 -14.629 1.382 -8.379 1.00 0.00 O ATOM 42 ND2 ASN A 3 -13.815 3.267 -7.466 1.00 0.00 N ATOM 0 H ASN A 3 -15.851 0.650 -5.999 1.00 0.00 H new ATOM 0 HA ASN A 3 -13.590 -0.842 -7.050 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -13.630 1.712 -5.393 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -12.337 1.142 -6.430 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -14.185 3.847 -8.219 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -13.295 3.696 -6.700 1.00 0.00 H new ATOM 49 N LEU A 4 -14.341 -0.754 -3.883 1.00 0.00 N ATOM 50 CA LEU A 4 -14.018 -1.301 -2.572 1.00 0.00 C ATOM 51 C LEU A 4 -13.671 -2.780 -2.671 1.00 0.00 C ATOM 52 O LEU A 4 -12.680 -3.233 -2.106 1.00 0.00 O ATOM 53 CB LEU A 4 -15.189 -1.100 -1.609 1.00 0.00 C ATOM 54 CG LEU A 4 -15.150 0.203 -0.808 1.00 0.00 C ATOM 55 CD1 LEU A 4 -16.553 0.613 -0.385 1.00 0.00 C ATOM 56 CD2 LEU A 4 -14.244 0.053 0.404 1.00 0.00 C ATOM 0 H LEU A 4 -15.246 -0.287 -3.932 1.00 0.00 H new ATOM 0 HA LEU A 4 -13.148 -0.769 -2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -16.118 -1.131 -2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -15.214 -1.937 -0.912 1.00 0.00 H new ATOM 0 HG LEU A 4 -14.744 0.989 -1.445 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -16.505 1.542 0.184 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -17.171 0.761 -1.270 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -16.989 -0.170 0.235 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -14.227 0.988 0.963 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -14.621 -0.745 1.043 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -13.234 -0.192 0.075 1.00 0.00 H new ATOM 68 N LYS A 5 -14.490 -3.529 -3.393 1.00 0.00 N ATOM 69 CA LYS A 5 -14.253 -4.959 -3.554 1.00 0.00 C ATOM 70 C LYS A 5 -12.940 -5.213 -4.283 1.00 0.00 C ATOM 71 O LYS A 5 -12.330 -6.271 -4.132 1.00 0.00 O ATOM 72 CB LYS A 5 -15.413 -5.621 -4.305 1.00 0.00 C ATOM 73 CG LYS A 5 -16.787 -5.108 -3.900 1.00 0.00 C ATOM 74 CD LYS A 5 -16.980 -5.145 -2.391 1.00 0.00 C ATOM 75 CE LYS A 5 -18.421 -4.843 -2.005 1.00 0.00 C ATOM 76 NZ LYS A 5 -19.095 -6.026 -1.403 1.00 0.00 N ATOM 0 H LYS A 5 -15.318 -3.177 -3.874 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.186 -5.401 -2.560 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -15.278 -5.461 -5.375 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -15.374 -6.697 -4.136 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -16.914 -4.086 -4.258 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.557 -5.712 -4.380 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.699 -6.127 -2.011 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -16.317 -4.419 -1.920 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.441 -4.015 -1.297 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -18.973 -4.521 -2.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -20.074 -5.778 -1.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -19.099 -6.809 -2.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.583 -6.318 -0.546 1.00 0.00 H new ATOM 90 N HIS A 6 -12.497 -4.228 -5.054 1.00 0.00 N ATOM 91 CA HIS A 6 -11.241 -4.338 -5.784 1.00 0.00 C ATOM 92 C HIS A 6 -10.097 -3.869 -4.894 1.00 0.00 C ATOM 93 O HIS A 6 -8.972 -4.356 -4.992 1.00 0.00 O ATOM 94 CB HIS A 6 -11.288 -3.506 -7.066 1.00 0.00 C ATOM 95 CG HIS A 6 -10.560 -4.134 -8.213 1.00 0.00 C ATOM 96 ND1 HIS A 6 -10.957 -5.317 -8.800 1.00 0.00 N ATOM 97 CD2 HIS A 6 -9.452 -3.738 -8.883 1.00 0.00 C ATOM 98 CE1 HIS A 6 -10.125 -5.621 -9.780 1.00 0.00 C ATOM 99 NE2 HIS A 6 -9.204 -4.680 -9.851 1.00 0.00 N ATOM 0 H HIS A 6 -12.989 -3.345 -5.190 1.00 0.00 H new ATOM 0 HA HIS A 6 -11.082 -5.380 -6.061 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -12.329 -3.348 -7.349 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -10.859 -2.524 -6.868 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -8.872 -2.848 -8.692 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -10.188 -6.492 -10.415 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -8.432 -4.656 -10.517 1.00 0.00 H new ATOM 108 N ILE A 7 -10.415 -2.923 -4.019 1.00 0.00 N ATOM 109 CA ILE A 7 -9.451 -2.369 -3.084 1.00 0.00 C ATOM 110 C ILE A 7 -9.215 -3.331 -1.926 1.00 0.00 C ATOM 111 O ILE A 7 -8.075 -3.599 -1.550 1.00 0.00 O ATOM 112 CB ILE A 7 -9.961 -1.012 -2.549 1.00 0.00 C ATOM 113 CG1 ILE A 7 -9.651 0.096 -3.558 1.00 0.00 C ATOM 114 CG2 ILE A 7 -9.364 -0.672 -1.186 1.00 0.00 C ATOM 115 CD1 ILE A 7 -10.880 0.733 -4.166 1.00 0.00 C ATOM 0 H ILE A 7 -11.349 -2.520 -3.940 1.00 0.00 H new ATOM 0 HA ILE A 7 -8.506 -2.217 -3.605 1.00 0.00 H new ATOM 0 HB ILE A 7 -11.040 -1.092 -2.417 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -9.060 0.868 -3.065 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -9.034 -0.316 -4.357 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -9.751 0.290 -0.849 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.636 -1.444 -0.467 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -8.278 -0.618 -1.267 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -10.578 1.508 -4.870 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -11.462 -0.026 -4.689 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -11.488 1.176 -3.377 1.00 0.00 H new ATOM 127 N ILE A 8 -10.304 -3.848 -1.366 1.00 0.00 N ATOM 128 CA ILE A 8 -10.216 -4.782 -0.255 1.00 0.00 C ATOM 129 C ILE A 8 -9.556 -6.071 -0.706 1.00 0.00 C ATOM 130 O ILE A 8 -8.610 -6.555 -0.085 1.00 0.00 O ATOM 131 CB ILE A 8 -11.608 -5.111 0.303 1.00 0.00 C ATOM 132 CG1 ILE A 8 -12.354 -3.826 0.669 1.00 0.00 C ATOM 133 CG2 ILE A 8 -11.501 -6.032 1.508 1.00 0.00 C ATOM 134 CD1 ILE A 8 -13.840 -4.027 0.864 1.00 0.00 C ATOM 0 H ILE A 8 -11.256 -3.635 -1.665 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.620 -4.310 0.526 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.174 -5.630 -0.470 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.928 -3.416 1.584 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -12.195 -3.087 -0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -12.499 -6.252 1.887 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -11.012 -6.960 1.214 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.916 -5.544 2.288 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -14.305 -3.075 1.121 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -14.280 -4.408 -0.058 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.008 -4.742 1.669 1.00 0.00 H new ATOM 146 N THR A 9 -10.062 -6.615 -1.804 1.00 0.00 N ATOM 147 CA THR A 9 -9.520 -7.847 -2.359 1.00 0.00 C ATOM 148 C THR A 9 -8.054 -7.648 -2.712 1.00 0.00 C ATOM 149 O THR A 9 -7.202 -8.465 -2.361 1.00 0.00 O ATOM 150 CB THR A 9 -10.314 -8.279 -3.595 1.00 0.00 C ATOM 151 OG1 THR A 9 -10.093 -9.649 -3.879 1.00 0.00 O ATOM 152 CG2 THR A 9 -9.963 -7.490 -4.836 1.00 0.00 C ATOM 0 H THR A 9 -10.845 -6.224 -2.327 1.00 0.00 H new ATOM 0 HA THR A 9 -9.603 -8.636 -1.612 1.00 0.00 H new ATOM 0 HB THR A 9 -11.359 -8.091 -3.348 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.610 -9.906 -4.671 1.00 0.00 H new ATOM 0 HG21 THR A 9 -10.561 -7.846 -5.675 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.170 -6.433 -4.666 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.905 -7.621 -5.063 1.00 0.00 H new ATOM 160 N LEU A 10 -7.763 -6.541 -3.389 1.00 0.00 N ATOM 161 CA LEU A 10 -6.396 -6.227 -3.760 1.00 0.00 C ATOM 162 C LEU A 10 -5.588 -5.946 -2.509 1.00 0.00 C ATOM 163 O LEU A 10 -4.397 -6.252 -2.445 1.00 0.00 O ATOM 164 CB LEU A 10 -6.334 -5.032 -4.712 1.00 0.00 C ATOM 165 CG LEU A 10 -4.935 -4.704 -5.248 1.00 0.00 C ATOM 166 CD1 LEU A 10 -4.136 -5.978 -5.499 1.00 0.00 C ATOM 167 CD2 LEU A 10 -5.035 -3.878 -6.522 1.00 0.00 C ATOM 0 H LEU A 10 -8.454 -5.853 -3.688 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.975 -7.085 -4.284 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -6.995 -5.225 -5.557 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -6.724 -4.155 -4.196 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.410 -4.118 -4.493 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.148 -5.719 -5.879 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -4.032 -6.532 -4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.656 -6.595 -6.232 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -4.034 -3.654 -6.890 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -5.582 -4.441 -7.279 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.561 -2.947 -6.312 1.00 0.00 H new ATOM 179 N GLY A 11 -6.251 -5.397 -1.495 1.00 0.00 N ATOM 180 CA GLY A 11 -5.570 -5.134 -0.251 1.00 0.00 C ATOM 181 C GLY A 11 -5.086 -6.428 0.361 1.00 0.00 C ATOM 182 O GLY A 11 -4.079 -6.457 1.066 1.00 0.00 O ATOM 0 H GLY A 11 -7.236 -5.134 -1.516 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -4.726 -4.467 -0.424 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -6.242 -4.625 0.440 1.00 0.00 H new ATOM 186 N GLN A 12 -5.807 -7.511 0.061 1.00 0.00 N ATOM 187 CA GLN A 12 -5.451 -8.834 0.557 1.00 0.00 C ATOM 188 C GLN A 12 -4.338 -9.429 -0.290 1.00 0.00 C ATOM 189 O GLN A 12 -3.435 -10.088 0.227 1.00 0.00 O ATOM 190 CB GLN A 12 -6.668 -9.760 0.539 1.00 0.00 C ATOM 191 CG GLN A 12 -7.762 -9.349 1.508 1.00 0.00 C ATOM 192 CD GLN A 12 -7.250 -9.177 2.922 1.00 0.00 C ATOM 193 OE1 GLN A 12 -6.356 -9.897 3.367 1.00 0.00 O ATOM 194 NE2 GLN A 12 -7.819 -8.217 3.637 1.00 0.00 N ATOM 0 H GLN A 12 -6.642 -7.493 -0.525 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.103 -8.733 1.585 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -7.079 -9.785 -0.470 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -6.346 -10.774 0.777 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -8.209 -8.414 1.171 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -8.551 -10.101 1.500 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.557 -7.645 3.227 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -7.519 -8.051 4.598 1.00 0.00 H new ATOM 203 N VAL A 13 -4.396 -9.178 -1.593 1.00 0.00 N ATOM 204 CA VAL A 13 -3.378 -9.675 -2.502 1.00 0.00 C ATOM 205 C VAL A 13 -2.077 -8.949 -2.243 1.00 0.00 C ATOM 206 O VAL A 13 -1.072 -9.556 -1.883 1.00 0.00 O ATOM 207 CB VAL A 13 -3.797 -9.486 -3.966 1.00 0.00 C ATOM 208 CG1 VAL A 13 -2.613 -9.670 -4.907 1.00 0.00 C ATOM 209 CG2 VAL A 13 -4.919 -10.446 -4.309 1.00 0.00 C ATOM 0 H VAL A 13 -5.135 -8.635 -2.039 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.250 -10.743 -2.325 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.158 -8.465 -4.094 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.942 -9.530 -5.937 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.842 -8.937 -4.669 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -2.207 -10.675 -4.789 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.212 -10.307 -5.350 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -4.579 -11.471 -4.162 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -5.775 -10.252 -3.662 1.00 0.00 H new ATOM 219 N ILE A 14 -2.115 -7.632 -2.390 1.00 0.00 N ATOM 220 CA ILE A 14 -0.951 -6.803 -2.132 1.00 0.00 C ATOM 221 C ILE A 14 -0.304 -7.233 -0.816 1.00 0.00 C ATOM 222 O ILE A 14 0.911 -7.144 -0.642 1.00 0.00 O ATOM 223 CB ILE A 14 -1.354 -5.311 -2.065 1.00 0.00 C ATOM 224 CG1 ILE A 14 -0.866 -4.564 -3.305 1.00 0.00 C ATOM 225 CG2 ILE A 14 -0.833 -4.644 -0.803 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.728 -3.374 -3.649 1.00 0.00 C ATOM 0 H ILE A 14 -2.943 -7.116 -2.688 1.00 0.00 H new ATOM 0 HA ILE A 14 -0.236 -6.929 -2.945 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.443 -5.268 -2.036 1.00 0.00 H new ATOM 0 HG12 ILE A 14 0.159 -4.230 -3.142 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -0.847 -5.250 -4.152 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.137 -3.597 -0.793 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -1.243 -5.149 0.071 1.00 0.00 H new ATOM 0 HG23 ILE A 14 0.255 -4.706 -0.781 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.332 -2.883 -4.538 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.748 -3.707 -3.842 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -1.727 -2.671 -2.816 1.00 0.00 H new ATOM 238 N HIS A 15 -1.145 -7.708 0.103 1.00 0.00 N ATOM 239 CA HIS A 15 -0.690 -8.168 1.401 1.00 0.00 C ATOM 240 C HIS A 15 -0.203 -9.616 1.322 1.00 0.00 C ATOM 241 O HIS A 15 0.779 -9.981 1.968 1.00 0.00 O ATOM 242 CB HIS A 15 -1.826 -8.022 2.419 1.00 0.00 C ATOM 243 CG HIS A 15 -1.941 -9.151 3.391 1.00 0.00 C ATOM 244 ND1 HIS A 15 -2.914 -10.119 3.294 1.00 0.00 N ATOM 245 CD2 HIS A 15 -1.202 -9.465 4.481 1.00 0.00 C ATOM 246 CE1 HIS A 15 -2.774 -10.980 4.281 1.00 0.00 C ATOM 247 NE2 HIS A 15 -1.742 -10.609 5.017 1.00 0.00 N ATOM 0 H HIS A 15 -2.153 -7.782 -0.036 1.00 0.00 H new ATOM 0 HA HIS A 15 0.153 -7.557 1.724 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -1.681 -7.095 2.974 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -2.769 -7.927 1.880 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -3.632 -10.163 2.571 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -0.349 -8.920 4.858 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -3.398 -11.844 4.458 1.00 0.00 H new ATOM 256 N LYS A 16 -0.893 -10.439 0.531 1.00 0.00 N ATOM 257 CA LYS A 16 -0.510 -11.839 0.387 1.00 0.00 C ATOM 258 C LYS A 16 0.736 -11.974 -0.486 1.00 0.00 C ATOM 259 O LYS A 16 1.640 -12.751 -0.177 1.00 0.00 O ATOM 260 CB LYS A 16 -1.672 -12.663 -0.185 1.00 0.00 C ATOM 261 CG LYS A 16 -1.755 -12.670 -1.704 1.00 0.00 C ATOM 262 CD LYS A 16 -3.121 -13.133 -2.178 1.00 0.00 C ATOM 263 CE LYS A 16 -3.177 -14.645 -2.327 1.00 0.00 C ATOM 264 NZ LYS A 16 -4.172 -15.065 -3.353 1.00 0.00 N ATOM 0 H LYS A 16 -1.710 -10.162 -0.013 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.272 -12.230 1.376 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.579 -13.691 0.166 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.608 -12.274 0.215 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.555 -11.669 -2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.985 -13.326 -2.110 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.883 -12.808 -1.469 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.354 -12.663 -3.134 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.191 -15.020 -2.603 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -3.432 -15.095 -1.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.180 -16.103 -3.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -5.117 -14.730 -3.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -3.914 -14.656 -4.274 1.00 0.00 H new ATOM 278 N ARG A 17 0.781 -11.206 -1.568 1.00 0.00 N ATOM 279 CA ARG A 17 1.921 -11.230 -2.476 1.00 0.00 C ATOM 280 C ARG A 17 3.175 -10.754 -1.755 1.00 0.00 C ATOM 281 O ARG A 17 4.234 -11.375 -1.853 1.00 0.00 O ATOM 282 CB ARG A 17 1.650 -10.347 -3.696 1.00 0.00 C ATOM 283 CG ARG A 17 0.948 -11.076 -4.830 1.00 0.00 C ATOM 284 CD ARG A 17 0.925 -10.241 -6.101 1.00 0.00 C ATOM 285 NE ARG A 17 1.199 -11.044 -7.289 1.00 0.00 N ATOM 286 CZ ARG A 17 2.364 -11.644 -7.525 1.00 0.00 C ATOM 287 NH1 ARG A 17 3.364 -11.533 -6.660 1.00 0.00 N ATOM 288 NH2 ARG A 17 2.529 -12.358 -8.631 1.00 0.00 N ATOM 0 H ARG A 17 0.041 -10.558 -1.838 1.00 0.00 H new ATOM 0 HA ARG A 17 2.074 -12.255 -2.814 1.00 0.00 H new ATOM 0 HB2 ARG A 17 1.041 -9.496 -3.390 1.00 0.00 H new ATOM 0 HB3 ARG A 17 2.596 -9.947 -4.062 1.00 0.00 H new ATOM 0 HG2 ARG A 17 1.454 -12.022 -5.024 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -0.073 -11.316 -4.533 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -0.049 -9.763 -6.203 1.00 0.00 H new ATOM 0 HD3 ARG A 17 1.664 -9.444 -6.024 1.00 0.00 H new ATOM 0 HE ARG A 17 0.455 -11.152 -7.978 1.00 0.00 H new ATOM 0 HH11 ARG A 17 3.243 -10.985 -5.808 1.00 0.00 H new ATOM 0 HH12 ARG A 17 4.254 -11.995 -6.847 1.00 0.00 H new ATOM 0 HH21 ARG A 17 1.764 -12.447 -9.300 1.00 0.00 H new ATOM 0 HH22 ARG A 17 3.421 -12.818 -8.813 1.00 0.00 H new ATOM 302 N CYS A 18 3.044 -9.652 -1.023 1.00 0.00 N ATOM 303 CA CYS A 18 4.162 -9.097 -0.273 1.00 0.00 C ATOM 304 C CYS A 18 4.568 -10.045 0.849 1.00 0.00 C ATOM 305 O CYS A 18 5.751 -10.215 1.139 1.00 0.00 O ATOM 306 CB CYS A 18 3.793 -7.723 0.298 1.00 0.00 C ATOM 307 SG CYS A 18 2.728 -7.780 1.759 1.00 0.00 S ATOM 0 H CYS A 18 2.174 -9.127 -0.934 1.00 0.00 H new ATOM 0 HA CYS A 18 5.008 -8.975 -0.950 1.00 0.00 H new ATOM 0 HB2 CYS A 18 4.710 -7.191 0.553 1.00 0.00 H new ATOM 0 HB3 CYS A 18 3.293 -7.143 -0.478 1.00 0.00 H new ATOM 0 HG CYS A 18 2.028 -8.875 1.743 1.00 0.00 H new ATOM 313 N GLU A 19 3.572 -10.668 1.470 1.00 0.00 N ATOM 314 CA GLU A 19 3.824 -11.608 2.552 1.00 0.00 C ATOM 315 C GLU A 19 4.648 -12.784 2.042 1.00 0.00 C ATOM 316 O GLU A 19 5.441 -13.369 2.780 1.00 0.00 O ATOM 317 CB GLU A 19 2.503 -12.108 3.142 1.00 0.00 C ATOM 318 CG GLU A 19 2.097 -11.388 4.417 1.00 0.00 C ATOM 319 CD GLU A 19 2.912 -11.825 5.619 1.00 0.00 C ATOM 320 OE1 GLU A 19 4.157 -11.748 5.551 1.00 0.00 O ATOM 321 OE2 GLU A 19 2.306 -12.243 6.628 1.00 0.00 O ATOM 0 H GLU A 19 2.586 -10.538 1.242 1.00 0.00 H new ATOM 0 HA GLU A 19 4.384 -11.097 3.335 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.714 -11.988 2.399 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.587 -13.175 3.348 1.00 0.00 H new ATOM 0 HG2 GLU A 19 2.213 -10.313 4.276 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.041 -11.572 4.613 1.00 0.00 H new ATOM 328 N GLU A 20 4.454 -13.122 0.770 1.00 0.00 N ATOM 329 CA GLU A 20 5.183 -14.228 0.158 1.00 0.00 C ATOM 330 C GLU A 20 6.459 -13.746 -0.536 1.00 0.00 C ATOM 331 O GLU A 20 7.279 -14.555 -0.969 1.00 0.00 O ATOM 332 CB GLU A 20 4.292 -14.961 -0.846 1.00 0.00 C ATOM 333 CG GLU A 20 3.886 -14.108 -2.035 1.00 0.00 C ATOM 334 CD GLU A 20 3.396 -14.935 -3.207 1.00 0.00 C ATOM 335 OE1 GLU A 20 2.355 -15.611 -3.063 1.00 0.00 O ATOM 336 OE2 GLU A 20 4.052 -14.907 -4.270 1.00 0.00 O ATOM 0 H GLU A 20 3.801 -12.648 0.146 1.00 0.00 H new ATOM 0 HA GLU A 20 5.470 -14.914 0.955 1.00 0.00 H new ATOM 0 HB2 GLU A 20 4.817 -15.846 -1.207 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.394 -15.309 -0.336 1.00 0.00 H new ATOM 0 HG2 GLU A 20 3.101 -13.417 -1.730 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.737 -13.505 -2.352 1.00 0.00 H new ATOM 343 N MET A 21 6.628 -12.426 -0.641 1.00 0.00 N ATOM 344 CA MET A 21 7.812 -11.858 -1.282 1.00 0.00 C ATOM 345 C MET A 21 9.089 -12.387 -0.640 1.00 0.00 C ATOM 346 O MET A 21 9.255 -12.326 0.577 1.00 0.00 O ATOM 347 CB MET A 21 7.791 -10.329 -1.200 1.00 0.00 C ATOM 348 CG MET A 21 6.986 -9.667 -2.306 1.00 0.00 C ATOM 349 SD MET A 21 7.856 -9.653 -3.885 1.00 0.00 S ATOM 350 CE MET A 21 8.624 -8.033 -3.858 1.00 0.00 C ATOM 0 H MET A 21 5.963 -11.735 -0.292 1.00 0.00 H new ATOM 0 HA MET A 21 7.796 -12.159 -2.329 1.00 0.00 H new ATOM 0 HB2 MET A 21 7.379 -10.032 -0.236 1.00 0.00 H new ATOM 0 HB3 MET A 21 8.815 -9.958 -1.237 1.00 0.00 H new ATOM 0 HG2 MET A 21 6.037 -10.191 -2.423 1.00 0.00 H new ATOM 0 HG3 MET A 21 6.751 -8.643 -2.016 1.00 0.00 H new ATOM 0 HE1 MET A 21 9.477 -8.023 -4.537 1.00 0.00 H new ATOM 0 HE2 MET A 21 7.900 -7.282 -4.174 1.00 0.00 H new ATOM 0 HE3 MET A 21 8.963 -7.808 -2.847 1.00 0.00 H new ATOM 360 N LYS A 22 9.990 -12.903 -1.468 1.00 0.00 N ATOM 361 CA LYS A 22 11.255 -13.440 -0.980 1.00 0.00 C ATOM 362 C LYS A 22 12.316 -12.345 -0.878 1.00 0.00 C ATOM 363 O LYS A 22 13.459 -12.613 -0.507 1.00 0.00 O ATOM 364 CB LYS A 22 11.747 -14.557 -1.903 1.00 0.00 C ATOM 365 CG LYS A 22 11.298 -15.945 -1.470 1.00 0.00 C ATOM 366 CD LYS A 22 12.392 -16.669 -0.700 1.00 0.00 C ATOM 367 CE LYS A 22 11.910 -18.015 -0.184 1.00 0.00 C ATOM 368 NZ LYS A 22 10.721 -17.878 0.701 1.00 0.00 N ATOM 0 H LYS A 22 9.868 -12.961 -2.479 1.00 0.00 H new ATOM 0 HA LYS A 22 11.085 -13.846 0.017 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.387 -14.367 -2.914 1.00 0.00 H new ATOM 0 HB3 LYS A 22 12.836 -14.532 -1.942 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.407 -15.863 -0.848 1.00 0.00 H new ATOM 0 HG3 LYS A 22 11.021 -16.529 -2.347 1.00 0.00 H new ATOM 0 HD2 LYS A 22 13.258 -16.814 -1.346 1.00 0.00 H new ATOM 0 HD3 LYS A 22 12.718 -16.052 0.137 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.662 -18.659 -1.028 1.00 0.00 H new ATOM 0 HE3 LYS A 22 12.716 -18.503 0.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 10.587 -18.757 1.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 10.867 -17.086 1.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 9.876 -17.696 0.122 1.00 0.00 H new ATOM 382 N TYR A 23 11.937 -11.112 -1.209 1.00 0.00 N ATOM 383 CA TYR A 23 12.865 -9.989 -1.152 1.00 0.00 C ATOM 384 C TYR A 23 12.176 -8.730 -0.642 1.00 0.00 C ATOM 385 O TYR A 23 10.952 -8.615 -0.699 1.00 0.00 O ATOM 386 CB TYR A 23 13.467 -9.729 -2.531 1.00 0.00 C ATOM 387 CG TYR A 23 14.729 -10.519 -2.799 1.00 0.00 C ATOM 388 CD1 TYR A 23 14.677 -11.886 -3.040 1.00 0.00 C ATOM 389 CD2 TYR A 23 15.970 -9.897 -2.807 1.00 0.00 C ATOM 390 CE1 TYR A 23 15.827 -12.611 -3.284 1.00 0.00 C ATOM 391 CE2 TYR A 23 17.126 -10.615 -3.050 1.00 0.00 C ATOM 392 CZ TYR A 23 17.049 -11.971 -3.287 1.00 0.00 C ATOM 393 OH TYR A 23 18.197 -12.691 -3.529 1.00 0.00 O ATOM 0 H TYR A 23 10.996 -10.868 -1.518 1.00 0.00 H new ATOM 0 HA TYR A 23 13.662 -10.249 -0.455 1.00 0.00 H new ATOM 0 HB2 TYR A 23 12.727 -9.973 -3.293 1.00 0.00 H new ATOM 0 HB3 TYR A 23 13.686 -8.666 -2.628 1.00 0.00 H new ATOM 0 HD1 TYR A 23 13.722 -12.390 -3.037 1.00 0.00 H new ATOM 0 HD2 TYR A 23 16.033 -8.835 -2.620 1.00 0.00 H new ATOM 0 HE1 TYR A 23 15.770 -13.673 -3.471 1.00 0.00 H new ATOM 0 HE2 TYR A 23 18.084 -10.117 -3.054 1.00 0.00 H new ATOM 0 HH TYR A 23 18.972 -12.092 -3.497 1.00 0.00 H new ATOM 403 N CYS A 24 12.978 -7.787 -0.145 1.00 0.00 N ATOM 404 CA CYS A 24 12.468 -6.519 0.380 1.00 0.00 C ATOM 405 C CYS A 24 11.182 -6.712 1.177 1.00 0.00 C ATOM 406 O CYS A 24 10.294 -5.860 1.155 1.00 0.00 O ATOM 407 CB CYS A 24 12.221 -5.537 -0.767 1.00 0.00 C ATOM 408 SG CYS A 24 10.858 -6.008 -1.858 1.00 0.00 S ATOM 0 H CYS A 24 13.993 -7.879 -0.095 1.00 0.00 H new ATOM 0 HA CYS A 24 13.223 -6.115 1.054 1.00 0.00 H new ATOM 0 HB2 CYS A 24 12.015 -4.551 -0.350 1.00 0.00 H new ATOM 0 HB3 CYS A 24 13.132 -5.448 -1.358 1.00 0.00 H new ATOM 0 HG CYS A 24 10.459 -7.209 -1.560 1.00 0.00 H new ATOM 414 N LYS A 25 11.082 -7.835 1.878 1.00 0.00 N ATOM 415 CA LYS A 25 9.895 -8.127 2.672 1.00 0.00 C ATOM 416 C LYS A 25 9.624 -7.018 3.677 1.00 0.00 C ATOM 417 O LYS A 25 8.475 -6.669 3.927 1.00 0.00 O ATOM 418 CB LYS A 25 10.045 -9.454 3.406 1.00 0.00 C ATOM 419 CG LYS A 25 10.649 -10.561 2.557 1.00 0.00 C ATOM 420 CD LYS A 25 10.467 -11.922 3.208 1.00 0.00 C ATOM 421 CE LYS A 25 11.674 -12.816 2.972 1.00 0.00 C ATOM 422 NZ LYS A 25 11.460 -14.191 3.501 1.00 0.00 N ATOM 0 H LYS A 25 11.804 -8.555 1.913 1.00 0.00 H new ATOM 0 HA LYS A 25 9.051 -8.194 1.985 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.669 -9.303 4.287 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.066 -9.775 3.761 1.00 0.00 H new ATOM 0 HG2 LYS A 25 10.182 -10.562 1.572 1.00 0.00 H new ATOM 0 HG3 LYS A 25 11.711 -10.367 2.406 1.00 0.00 H new ATOM 0 HD2 LYS A 25 10.309 -11.796 4.279 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.573 -12.402 2.808 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.884 -12.867 1.904 1.00 0.00 H new ATOM 0 HE3 LYS A 25 12.550 -12.376 3.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.306 -14.768 3.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.285 -14.146 4.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.640 -14.621 3.028 1.00 0.00 H new ATOM 436 N LYS A 26 10.686 -6.461 4.250 1.00 0.00 N ATOM 437 CA LYS A 26 10.543 -5.383 5.224 1.00 0.00 C ATOM 438 C LYS A 26 9.606 -4.308 4.684 1.00 0.00 C ATOM 439 O LYS A 26 8.602 -3.966 5.313 1.00 0.00 O ATOM 440 CB LYS A 26 11.909 -4.774 5.549 1.00 0.00 C ATOM 441 CG LYS A 26 12.985 -5.809 5.832 1.00 0.00 C ATOM 442 CD LYS A 26 14.110 -5.742 4.811 1.00 0.00 C ATOM 443 CE LYS A 26 15.184 -4.753 5.230 1.00 0.00 C ATOM 444 NZ LYS A 26 14.854 -3.363 4.810 1.00 0.00 N ATOM 0 H LYS A 26 11.650 -6.735 4.059 1.00 0.00 H new ATOM 0 HA LYS A 26 10.118 -5.795 6.139 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.227 -4.150 4.714 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.809 -4.120 6.415 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.390 -5.649 6.831 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.543 -6.805 5.822 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.552 -6.731 4.690 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.706 -5.452 3.841 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.305 -4.786 6.313 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.138 -5.047 4.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 15.558 -2.706 5.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.863 -3.303 3.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.909 -3.109 5.163 1.00 0.00 H new ATOM 458 N GLN A 27 9.934 -3.797 3.505 1.00 0.00 N ATOM 459 CA GLN A 27 9.122 -2.775 2.864 1.00 0.00 C ATOM 460 C GLN A 27 7.852 -3.386 2.286 1.00 0.00 C ATOM 461 O GLN A 27 6.750 -2.895 2.527 1.00 0.00 O ATOM 462 CB GLN A 27 9.922 -2.078 1.766 1.00 0.00 C ATOM 463 CG GLN A 27 10.898 -1.050 2.305 1.00 0.00 C ATOM 464 CD GLN A 27 11.957 -0.660 1.295 1.00 0.00 C ATOM 465 OE1 GLN A 27 11.698 0.117 0.377 1.00 0.00 O ATOM 466 NE2 GLN A 27 13.157 -1.202 1.458 1.00 0.00 N ATOM 0 H GLN A 27 10.759 -4.075 2.973 1.00 0.00 H new ATOM 0 HA GLN A 27 8.839 -2.037 3.614 1.00 0.00 H new ATOM 0 HB2 GLN A 27 10.470 -2.826 1.193 1.00 0.00 H new ATOM 0 HB3 GLN A 27 9.233 -1.590 1.076 1.00 0.00 H new ATOM 0 HG2 GLN A 27 10.349 -0.160 2.611 1.00 0.00 H new ATOM 0 HG3 GLN A 27 11.382 -1.448 3.197 1.00 0.00 H new ATOM 0 HE21 GLN A 27 13.327 -1.842 2.234 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.910 -0.979 0.807 1.00 0.00 H new ATOM 475 N CYS A 28 8.011 -4.467 1.526 1.00 0.00 N ATOM 476 CA CYS A 28 6.869 -5.143 0.923 1.00 0.00 C ATOM 477 C CYS A 28 5.823 -5.508 1.976 1.00 0.00 C ATOM 478 O CYS A 28 4.676 -5.066 1.901 1.00 0.00 O ATOM 479 CB CYS A 28 7.332 -6.396 0.183 1.00 0.00 C ATOM 480 SG CYS A 28 7.542 -6.155 -1.594 1.00 0.00 S ATOM 0 H CYS A 28 8.915 -4.890 1.315 1.00 0.00 H new ATOM 0 HA CYS A 28 6.406 -4.458 0.212 1.00 0.00 H new ATOM 0 HB2 CYS A 28 8.278 -6.730 0.609 1.00 0.00 H new ATOM 0 HB3 CYS A 28 6.608 -7.194 0.349 1.00 0.00 H new ATOM 0 HG CYS A 28 8.773 -5.821 -1.844 1.00 0.00 H new ATOM 486 N ARG A 29 6.222 -6.316 2.957 1.00 0.00 N ATOM 487 CA ARG A 29 5.315 -6.738 4.024 1.00 0.00 C ATOM 488 C ARG A 29 4.540 -5.550 4.595 1.00 0.00 C ATOM 489 O ARG A 29 3.331 -5.631 4.810 1.00 0.00 O ATOM 490 CB ARG A 29 6.094 -7.448 5.139 1.00 0.00 C ATOM 491 CG ARG A 29 6.732 -6.506 6.153 1.00 0.00 C ATOM 492 CD ARG A 29 7.466 -7.268 7.248 1.00 0.00 C ATOM 493 NE ARG A 29 8.106 -8.484 6.747 1.00 0.00 N ATOM 494 CZ ARG A 29 7.502 -9.669 6.680 1.00 0.00 C ATOM 495 NH1 ARG A 29 6.239 -9.805 7.068 1.00 0.00 N ATOM 496 NH2 ARG A 29 8.162 -10.723 6.220 1.00 0.00 N ATOM 0 H ARG A 29 7.167 -6.692 3.035 1.00 0.00 H new ATOM 0 HA ARG A 29 4.596 -7.436 3.595 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.420 -8.125 5.663 1.00 0.00 H new ATOM 0 HB3 ARG A 29 6.874 -8.061 4.688 1.00 0.00 H new ATOM 0 HG2 ARG A 29 7.429 -5.841 5.643 1.00 0.00 H new ATOM 0 HG3 ARG A 29 5.962 -5.878 6.601 1.00 0.00 H new ATOM 0 HD2 ARG A 29 8.221 -6.621 7.694 1.00 0.00 H new ATOM 0 HD3 ARG A 29 6.763 -7.530 8.039 1.00 0.00 H new ATOM 0 HE ARG A 29 9.073 -8.421 6.430 1.00 0.00 H new ATOM 0 HH11 ARG A 29 5.724 -8.998 7.421 1.00 0.00 H new ATOM 0 HH12 ARG A 29 5.784 -10.716 7.013 1.00 0.00 H new ATOM 0 HH21 ARG A 29 9.131 -10.626 5.918 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.700 -11.631 6.168 1.00 0.00 H new ATOM 510 N ARG A 30 5.246 -4.450 4.842 1.00 0.00 N ATOM 511 CA ARG A 30 4.621 -3.251 5.389 1.00 0.00 C ATOM 512 C ARG A 30 3.566 -2.706 4.438 1.00 0.00 C ATOM 513 O ARG A 30 2.423 -2.489 4.828 1.00 0.00 O ATOM 514 CB ARG A 30 5.666 -2.171 5.660 1.00 0.00 C ATOM 515 CG ARG A 30 6.109 -2.097 7.113 1.00 0.00 C ATOM 516 CD ARG A 30 7.069 -3.223 7.465 1.00 0.00 C ATOM 517 NE ARG A 30 7.035 -3.544 8.890 1.00 0.00 N ATOM 518 CZ ARG A 30 6.070 -4.255 9.468 1.00 0.00 C ATOM 519 NH1 ARG A 30 5.065 -4.733 8.745 1.00 0.00 N ATOM 520 NH2 ARG A 30 6.112 -4.493 10.772 1.00 0.00 N ATOM 0 H ARG A 30 6.248 -4.365 4.672 1.00 0.00 H new ATOM 0 HA ARG A 30 4.142 -3.529 6.328 1.00 0.00 H new ATOM 0 HB2 ARG A 30 6.538 -2.357 5.033 1.00 0.00 H new ATOM 0 HB3 ARG A 30 5.261 -1.204 5.364 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.590 -1.137 7.299 1.00 0.00 H new ATOM 0 HG3 ARG A 30 5.235 -2.147 7.763 1.00 0.00 H new ATOM 0 HD2 ARG A 30 6.814 -4.111 6.887 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.082 -2.938 7.181 1.00 0.00 H new ATOM 0 HE ARG A 30 7.796 -3.203 9.477 1.00 0.00 H new ATOM 0 HH11 ARG A 30 5.030 -4.556 7.741 1.00 0.00 H new ATOM 0 HH12 ARG A 30 4.328 -5.277 9.193 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.884 -4.131 11.332 1.00 0.00 H new ATOM 0 HH22 ARG A 30 5.372 -5.038 11.215 1.00 0.00 H new ATOM 534 N LEU A 31 3.963 -2.478 3.190 1.00 0.00 N ATOM 535 CA LEU A 31 3.052 -1.949 2.179 1.00 0.00 C ATOM 536 C LEU A 31 1.705 -2.664 2.234 1.00 0.00 C ATOM 537 O LEU A 31 0.655 -2.028 2.297 1.00 0.00 O ATOM 538 CB LEU A 31 3.666 -2.093 0.783 1.00 0.00 C ATOM 539 CG LEU A 31 2.698 -1.874 -0.383 1.00 0.00 C ATOM 540 CD1 LEU A 31 1.912 -0.584 -0.190 1.00 0.00 C ATOM 541 CD2 LEU A 31 3.452 -1.857 -1.705 1.00 0.00 C ATOM 0 H LEU A 31 4.910 -2.651 2.854 1.00 0.00 H new ATOM 0 HA LEU A 31 2.890 -0.892 2.388 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.487 -1.382 0.690 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.096 -3.091 0.694 1.00 0.00 H new ATOM 0 HG LEU A 31 1.990 -2.702 -0.406 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.229 -0.445 -1.028 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.342 -0.641 0.737 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.602 0.258 -0.140 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.749 -1.700 -2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.184 -1.049 -1.696 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.964 -2.809 -1.844 1.00 0.00 H new ATOM 553 N GLY A 32 1.749 -3.990 2.214 1.00 0.00 N ATOM 554 CA GLY A 32 0.529 -4.768 2.263 1.00 0.00 C ATOM 555 C GLY A 32 -0.146 -4.701 3.616 1.00 0.00 C ATOM 556 O GLY A 32 -1.331 -4.381 3.710 1.00 0.00 O ATOM 0 H GLY A 32 2.607 -4.539 2.165 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.159 -4.407 1.499 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.755 -5.807 2.024 1.00 0.00 H new ATOM 560 N HIS A 33 0.607 -5.002 4.668 1.00 0.00 N ATOM 561 CA HIS A 33 0.067 -4.969 6.022 1.00 0.00 C ATOM 562 C HIS A 33 -0.497 -3.589 6.341 1.00 0.00 C ATOM 563 O HIS A 33 -1.472 -3.462 7.081 1.00 0.00 O ATOM 564 CB HIS A 33 1.145 -5.347 7.039 1.00 0.00 C ATOM 565 CG HIS A 33 0.595 -5.944 8.297 1.00 0.00 C ATOM 566 ND1 HIS A 33 -0.117 -5.218 9.229 1.00 0.00 N ATOM 567 CD2 HIS A 33 0.653 -7.211 8.775 1.00 0.00 C ATOM 568 CE1 HIS A 33 -0.470 -6.010 10.225 1.00 0.00 C ATOM 569 NE2 HIS A 33 -0.017 -7.223 9.974 1.00 0.00 N ATOM 0 H HIS A 33 1.589 -5.271 4.610 1.00 0.00 H new ATOM 0 HA HIS A 33 -0.741 -5.697 6.084 1.00 0.00 H new ATOM 0 HB2 HIS A 33 1.834 -6.057 6.580 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.724 -4.458 7.291 1.00 0.00 H new ATOM 0 HD2 HIS A 33 1.136 -8.053 8.302 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -1.034 -5.715 11.097 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -0.144 -8.038 10.574 1.00 0.00 H new ATOM 578 N ARG A 34 0.107 -2.556 5.758 1.00 0.00 N ATOM 579 CA ARG A 34 -0.360 -1.196 5.966 1.00 0.00 C ATOM 580 C ARG A 34 -1.560 -0.952 5.070 1.00 0.00 C ATOM 581 O ARG A 34 -2.589 -0.434 5.509 1.00 0.00 O ATOM 582 CB ARG A 34 0.752 -0.189 5.674 1.00 0.00 C ATOM 583 CG ARG A 34 1.695 0.016 6.850 1.00 0.00 C ATOM 584 CD ARG A 34 3.151 -0.122 6.433 1.00 0.00 C ATOM 585 NE ARG A 34 4.056 0.532 7.376 1.00 0.00 N ATOM 586 CZ ARG A 34 4.286 0.090 8.611 1.00 0.00 C ATOM 587 NH1 ARG A 34 3.685 -1.007 9.055 1.00 0.00 N ATOM 588 NH2 ARG A 34 5.121 0.747 9.403 1.00 0.00 N ATOM 0 H ARG A 34 0.916 -2.638 5.142 1.00 0.00 H new ATOM 0 HA ARG A 34 -0.651 -1.065 7.008 1.00 0.00 H new ATOM 0 HB2 ARG A 34 1.325 -0.529 4.812 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.306 0.768 5.403 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.531 1.004 7.280 1.00 0.00 H new ATOM 0 HG3 ARG A 34 1.469 -0.712 7.629 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.408 -1.179 6.358 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.287 0.310 5.442 1.00 0.00 H new ATOM 0 HE ARG A 34 4.540 1.376 7.070 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.042 -1.517 8.449 1.00 0.00 H new ATOM 0 HH12 ARG A 34 3.866 -1.340 10.002 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.586 1.590 9.066 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.298 0.410 10.349 1.00 0.00 H new ATOM 602 N VAL A 35 -1.436 -1.377 3.816 1.00 0.00 N ATOM 603 CA VAL A 35 -2.530 -1.253 2.864 1.00 0.00 C ATOM 604 C VAL A 35 -3.785 -1.864 3.477 1.00 0.00 C ATOM 605 O VAL A 35 -4.858 -1.261 3.470 1.00 0.00 O ATOM 606 CB VAL A 35 -2.202 -1.964 1.533 1.00 0.00 C ATOM 607 CG1 VAL A 35 -3.470 -2.328 0.771 1.00 0.00 C ATOM 608 CG2 VAL A 35 -1.292 -1.096 0.677 1.00 0.00 C ATOM 0 H VAL A 35 -0.592 -1.808 3.439 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.687 -0.196 2.647 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.679 -2.891 1.768 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.204 -2.827 -0.161 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.081 -2.996 1.379 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -4.034 -1.422 0.549 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.071 -1.612 -0.257 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.789 -0.151 0.460 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.363 -0.903 1.214 1.00 0.00 H new ATOM 618 N LEU A 36 -3.620 -3.061 4.037 1.00 0.00 N ATOM 619 CA LEU A 36 -4.717 -3.762 4.692 1.00 0.00 C ATOM 620 C LEU A 36 -5.378 -2.846 5.712 1.00 0.00 C ATOM 621 O LEU A 36 -6.603 -2.751 5.778 1.00 0.00 O ATOM 622 CB LEU A 36 -4.202 -5.022 5.398 1.00 0.00 C ATOM 623 CG LEU A 36 -3.935 -6.225 4.490 1.00 0.00 C ATOM 624 CD1 LEU A 36 -3.642 -7.462 5.324 1.00 0.00 C ATOM 625 CD2 LEU A 36 -5.118 -6.477 3.573 1.00 0.00 C ATOM 0 H LEU A 36 -2.733 -3.565 4.049 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.445 -4.052 3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.279 -4.772 5.921 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -4.929 -5.315 6.156 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.063 -6.003 3.874 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.454 -8.309 4.665 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.764 -7.283 5.944 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.498 -7.682 5.962 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.908 -7.336 2.936 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.006 -6.678 4.172 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.290 -5.598 2.952 1.00 0.00 H new ATOM 637 N GLY A 37 -4.548 -2.165 6.498 1.00 0.00 N ATOM 638 CA GLY A 37 -5.055 -1.250 7.505 1.00 0.00 C ATOM 639 C GLY A 37 -6.001 -0.222 6.918 1.00 0.00 C ATOM 640 O GLY A 37 -6.889 0.280 7.606 1.00 0.00 O ATOM 0 H GLY A 37 -3.531 -2.231 6.455 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.571 -1.816 8.281 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -4.219 -0.741 7.985 1.00 0.00 H new ATOM 644 N LEU A 38 -5.812 0.083 5.640 1.00 0.00 N ATOM 645 CA LEU A 38 -6.658 1.047 4.945 1.00 0.00 C ATOM 646 C LEU A 38 -7.996 0.413 4.597 1.00 0.00 C ATOM 647 O LEU A 38 -9.037 1.068 4.628 1.00 0.00 O ATOM 648 CB LEU A 38 -5.966 1.539 3.676 1.00 0.00 C ATOM 649 CG LEU A 38 -4.508 1.956 3.855 1.00 0.00 C ATOM 650 CD1 LEU A 38 -3.877 2.266 2.512 1.00 0.00 C ATOM 651 CD2 LEU A 38 -4.406 3.158 4.782 1.00 0.00 C ATOM 0 H LEU A 38 -5.078 -0.325 5.061 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.831 1.899 5.603 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -6.013 0.750 2.926 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.525 2.388 3.281 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.966 1.126 4.308 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.838 2.562 2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.917 1.380 1.878 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.422 3.080 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.360 3.441 4.898 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.963 3.993 4.357 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.822 2.902 5.756 1.00 0.00 H new ATOM 663 N ILE A 39 -7.953 -0.874 4.280 1.00 0.00 N ATOM 664 CA ILE A 39 -9.150 -1.624 3.938 1.00 0.00 C ATOM 665 C ILE A 39 -9.804 -2.172 5.206 1.00 0.00 C ATOM 666 O ILE A 39 -10.970 -2.566 5.198 1.00 0.00 O ATOM 667 CB ILE A 39 -8.829 -2.778 2.946 1.00 0.00 C ATOM 668 CG1 ILE A 39 -8.876 -4.149 3.632 1.00 0.00 C ATOM 669 CG2 ILE A 39 -7.465 -2.569 2.305 1.00 0.00 C ATOM 670 CD1 ILE A 39 -8.457 -5.292 2.730 1.00 0.00 C ATOM 0 H ILE A 39 -7.093 -1.423 4.253 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.847 -0.947 3.444 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.597 -2.761 2.173 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.227 -4.131 4.507 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -9.889 -4.332 3.990 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -7.258 -3.387 1.614 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.459 -1.624 1.761 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.699 -2.546 3.080 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.515 -6.231 3.281 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.121 -5.337 1.867 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -7.433 -5.132 2.392 1.00 0.00 H new ATOM 682 N LYS A 40 -9.032 -2.191 6.291 1.00 0.00 N ATOM 683 CA LYS A 40 -9.516 -2.689 7.577 1.00 0.00 C ATOM 684 C LYS A 40 -10.808 -1.989 8.006 1.00 0.00 C ATOM 685 O LYS A 40 -11.847 -2.633 8.144 1.00 0.00 O ATOM 686 CB LYS A 40 -8.443 -2.511 8.655 1.00 0.00 C ATOM 687 CG LYS A 40 -7.405 -3.625 8.689 1.00 0.00 C ATOM 688 CD LYS A 40 -8.053 -5.001 8.732 1.00 0.00 C ATOM 689 CE LYS A 40 -7.075 -6.061 9.209 1.00 0.00 C ATOM 690 NZ LYS A 40 -7.266 -7.355 8.495 1.00 0.00 N ATOM 0 H LYS A 40 -8.065 -1.866 6.305 1.00 0.00 H new ATOM 0 HA LYS A 40 -9.734 -3.750 7.456 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.935 -1.560 8.493 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -8.928 -2.451 9.629 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -6.765 -3.552 7.810 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -6.764 -3.498 9.561 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.917 -4.977 9.395 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.420 -5.263 7.740 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.055 -5.709 9.056 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.201 -6.216 10.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -6.580 -8.052 8.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.231 -7.704 8.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -7.120 -7.213 7.475 1.00 0.00 H new ATOM 704 N PRO A 41 -10.768 -0.661 8.231 1.00 0.00 N ATOM 705 CA PRO A 41 -11.953 0.095 8.653 1.00 0.00 C ATOM 706 C PRO A 41 -13.096 -0.031 7.655 1.00 0.00 C ATOM 707 O PRO A 41 -14.267 -0.046 8.038 1.00 0.00 O ATOM 708 CB PRO A 41 -11.463 1.548 8.746 1.00 0.00 C ATOM 709 CG PRO A 41 -10.168 1.585 8.005 1.00 0.00 C ATOM 710 CD PRO A 41 -9.583 0.202 8.102 1.00 0.00 C ATOM 0 HA PRO A 41 -12.354 -0.277 9.596 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -12.186 2.234 8.305 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -11.329 1.850 9.785 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.324 1.868 6.964 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.493 2.323 8.439 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -8.997 -0.049 7.218 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -8.920 0.105 8.962 1.00 0.00 H new ATOM 718 N LEU A 42 -12.756 -0.136 6.375 1.00 0.00 N ATOM 719 CA LEU A 42 -13.769 -0.278 5.338 1.00 0.00 C ATOM 720 C LEU A 42 -14.537 -1.573 5.533 1.00 0.00 C ATOM 721 O LEU A 42 -15.752 -1.623 5.343 1.00 0.00 O ATOM 722 CB LEU A 42 -13.136 -0.275 3.952 1.00 0.00 C ATOM 723 CG LEU A 42 -12.134 0.843 3.690 1.00 0.00 C ATOM 724 CD1 LEU A 42 -11.429 0.599 2.369 1.00 0.00 C ATOM 725 CD2 LEU A 42 -12.829 2.196 3.689 1.00 0.00 C ATOM 0 H LEU A 42 -11.795 -0.126 6.033 1.00 0.00 H new ATOM 0 HA LEU A 42 -14.450 0.570 5.416 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.635 -1.231 3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -13.931 -0.208 3.209 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.392 0.849 4.489 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.713 1.400 2.185 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.903 -0.355 2.408 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.163 0.576 1.564 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.097 2.981 3.500 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -13.589 2.214 2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -13.300 2.364 4.658 1.00 0.00 H new ATOM 737 N GLU A 43 -13.820 -2.624 5.918 1.00 0.00 N ATOM 738 CA GLU A 43 -14.437 -3.921 6.142 1.00 0.00 C ATOM 739 C GLU A 43 -15.627 -3.786 7.086 1.00 0.00 C ATOM 740 O GLU A 43 -16.612 -4.514 6.975 1.00 0.00 O ATOM 741 CB GLU A 43 -13.420 -4.911 6.714 1.00 0.00 C ATOM 742 CG GLU A 43 -12.337 -5.310 5.725 1.00 0.00 C ATOM 743 CD GLU A 43 -12.018 -6.791 5.776 1.00 0.00 C ATOM 744 OE1 GLU A 43 -12.925 -7.584 6.108 1.00 0.00 O ATOM 745 OE2 GLU A 43 -10.860 -7.160 5.482 1.00 0.00 O ATOM 0 H GLU A 43 -12.813 -2.600 6.080 1.00 0.00 H new ATOM 0 HA GLU A 43 -14.790 -4.302 5.184 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -12.952 -4.470 7.594 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -13.945 -5.807 7.046 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -12.655 -5.045 4.717 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.432 -4.740 5.933 1.00 0.00 H new ATOM 752 N MET A 44 -15.533 -2.836 8.011 1.00 0.00 N ATOM 753 CA MET A 44 -16.608 -2.593 8.963 1.00 0.00 C ATOM 754 C MET A 44 -17.677 -1.695 8.346 1.00 0.00 C ATOM 755 O MET A 44 -18.823 -1.676 8.794 1.00 0.00 O ATOM 756 CB MET A 44 -16.055 -1.943 10.231 1.00 0.00 C ATOM 757 CG MET A 44 -15.044 -2.807 10.967 1.00 0.00 C ATOM 758 SD MET A 44 -13.697 -1.845 11.682 1.00 0.00 S ATOM 759 CE MET A 44 -12.447 -3.111 11.882 1.00 0.00 C ATOM 0 H MET A 44 -14.725 -2.224 8.120 1.00 0.00 H new ATOM 0 HA MET A 44 -17.060 -3.551 9.221 1.00 0.00 H new ATOM 0 HB2 MET A 44 -15.587 -0.994 9.968 1.00 0.00 H new ATOM 0 HB3 MET A 44 -16.883 -1.715 10.903 1.00 0.00 H new ATOM 0 HG2 MET A 44 -15.551 -3.358 11.759 1.00 0.00 H new ATOM 0 HG3 MET A 44 -14.633 -3.545 10.278 1.00 0.00 H new ATOM 0 HE1 MET A 44 -11.549 -2.671 12.315 1.00 0.00 H new ATOM 0 HE2 MET A 44 -12.823 -3.892 12.542 1.00 0.00 H new ATOM 0 HE3 MET A 44 -12.207 -3.542 10.910 1.00 0.00 H new ATOM 769 N LEU A 45 -17.287 -0.943 7.320 1.00 0.00 N ATOM 770 CA LEU A 45 -18.200 -0.031 6.643 1.00 0.00 C ATOM 771 C LEU A 45 -18.914 -0.700 5.467 1.00 0.00 C ATOM 772 O LEU A 45 -20.143 -0.753 5.429 1.00 0.00 O ATOM 773 CB LEU A 45 -17.433 1.198 6.148 1.00 0.00 C ATOM 774 CG LEU A 45 -17.611 2.459 6.994 1.00 0.00 C ATOM 775 CD1 LEU A 45 -16.688 2.426 8.201 1.00 0.00 C ATOM 776 CD2 LEU A 45 -17.349 3.698 6.153 1.00 0.00 C ATOM 0 H LEU A 45 -16.341 -0.949 6.939 1.00 0.00 H new ATOM 0 HA LEU A 45 -18.960 0.268 7.365 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -16.372 0.953 6.109 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -17.748 1.417 5.128 1.00 0.00 H new ATOM 0 HG LEU A 45 -18.640 2.495 7.353 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -16.829 3.331 8.791 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -16.920 1.554 8.813 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -15.652 2.369 7.866 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -17.479 4.589 6.767 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -16.329 3.668 5.769 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -18.050 3.727 5.319 1.00 0.00 H new ATOM 788 N GLN A 46 -18.142 -1.181 4.492 1.00 0.00 N ATOM 789 CA GLN A 46 -18.719 -1.807 3.305 1.00 0.00 C ATOM 790 C GLN A 46 -19.085 -3.278 3.525 1.00 0.00 C ATOM 791 O GLN A 46 -20.172 -3.711 3.145 1.00 0.00 O ATOM 792 CB GLN A 46 -17.755 -1.673 2.123 1.00 0.00 C ATOM 793 CG GLN A 46 -16.513 -2.545 2.232 1.00 0.00 C ATOM 794 CD GLN A 46 -16.738 -3.950 1.709 1.00 0.00 C ATOM 795 OE1 GLN A 46 -17.393 -4.146 0.685 1.00 0.00 O ATOM 796 NE2 GLN A 46 -16.196 -4.938 2.412 1.00 0.00 N ATOM 0 H GLN A 46 -17.123 -1.149 4.501 1.00 0.00 H new ATOM 0 HA GLN A 46 -19.649 -1.281 3.087 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -18.285 -1.927 1.205 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.448 -0.631 2.035 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -15.698 -2.081 1.676 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.200 -2.596 3.275 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -15.661 -4.730 3.255 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -16.315 -5.905 2.109 1.00 0.00 H new ATOM 805 N ASP A 47 -18.177 -4.048 4.118 1.00 0.00 N ATOM 806 CA ASP A 47 -18.428 -5.469 4.351 1.00 0.00 C ATOM 807 C ASP A 47 -19.650 -5.682 5.241 1.00 0.00 C ATOM 808 O ASP A 47 -20.581 -6.394 4.868 1.00 0.00 O ATOM 809 CB ASP A 47 -17.201 -6.137 4.975 1.00 0.00 C ATOM 810 CG ASP A 47 -16.818 -7.421 4.264 1.00 0.00 C ATOM 811 OD1 ASP A 47 -16.722 -7.403 3.019 1.00 0.00 O ATOM 812 OD2 ASP A 47 -16.613 -8.443 4.952 1.00 0.00 O ATOM 0 H ASP A 47 -17.269 -3.717 4.444 1.00 0.00 H new ATOM 0 HA ASP A 47 -18.629 -5.930 3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.360 -5.444 4.947 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -17.402 -6.352 6.025 1.00 0.00 H new ATOM 928 N SER A 55 -20.749 8.279 -4.357 1.00 0.00 N ATOM 929 CA SER A 55 -20.870 9.465 -5.198 1.00 0.00 C ATOM 930 C SER A 55 -19.708 9.555 -6.181 1.00 0.00 C ATOM 931 O SER A 55 -18.765 8.766 -6.115 1.00 0.00 O ATOM 932 CB SER A 55 -20.921 10.726 -4.334 1.00 0.00 C ATOM 933 OG SER A 55 -21.997 10.670 -3.412 1.00 0.00 O ATOM 0 HA SER A 55 -21.797 9.384 -5.765 1.00 0.00 H new ATOM 0 HB2 SER A 55 -19.981 10.839 -3.794 1.00 0.00 H new ATOM 0 HB3 SER A 55 -21.030 11.603 -4.972 1.00 0.00 H new ATOM 0 HG SER A 55 -21.789 10.024 -2.705 1.00 0.00 H new ATOM 939 N GLU A 56 -19.783 10.519 -7.091 1.00 0.00 N ATOM 940 CA GLU A 56 -18.735 10.710 -8.088 1.00 0.00 C ATOM 941 C GLU A 56 -17.394 10.998 -7.422 1.00 0.00 C ATOM 942 O GLU A 56 -16.338 10.696 -7.978 1.00 0.00 O ATOM 943 CB GLU A 56 -19.104 11.853 -9.035 1.00 0.00 C ATOM 944 CG GLU A 56 -18.091 12.072 -10.148 1.00 0.00 C ATOM 945 CD GLU A 56 -18.731 12.103 -11.523 1.00 0.00 C ATOM 946 OE1 GLU A 56 -19.736 12.826 -11.693 1.00 0.00 O ATOM 947 OE2 GLU A 56 -18.227 11.406 -12.429 1.00 0.00 O ATOM 0 H GLU A 56 -20.557 11.180 -7.160 1.00 0.00 H new ATOM 0 HA GLU A 56 -18.643 9.788 -8.662 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -20.079 11.647 -9.477 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -19.203 12.773 -8.459 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.565 13.011 -9.975 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.345 11.278 -10.117 1.00 0.00 H new ATOM 954 N LYS A 57 -17.441 11.583 -6.228 1.00 0.00 N ATOM 955 CA LYS A 57 -16.228 11.911 -5.489 1.00 0.00 C ATOM 956 C LYS A 57 -15.671 10.678 -4.785 1.00 0.00 C ATOM 957 O LYS A 57 -14.490 10.357 -4.917 1.00 0.00 O ATOM 958 CB LYS A 57 -16.511 13.012 -4.467 1.00 0.00 C ATOM 959 CG LYS A 57 -16.692 14.387 -5.087 1.00 0.00 C ATOM 960 CD LYS A 57 -15.507 15.294 -4.798 1.00 0.00 C ATOM 961 CE LYS A 57 -15.580 15.877 -3.396 1.00 0.00 C ATOM 962 NZ LYS A 57 -14.228 16.086 -2.809 1.00 0.00 N ATOM 0 H LYS A 57 -18.306 11.839 -5.753 1.00 0.00 H new ATOM 0 HA LYS A 57 -15.484 12.269 -6.200 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -17.410 12.754 -3.907 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.690 13.051 -3.751 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -16.819 14.286 -6.165 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -17.603 14.844 -4.700 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -14.581 14.731 -4.911 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -15.480 16.103 -5.528 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -16.113 16.827 -3.426 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -16.155 15.209 -2.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -14.258 15.886 -1.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -13.548 15.447 -3.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -13.933 17.072 -2.960 1.00 0.00 H new ATOM 976 N LEU A 58 -16.527 9.990 -4.036 1.00 0.00 N ATOM 977 CA LEU A 58 -16.117 8.792 -3.312 1.00 0.00 C ATOM 978 C LEU A 58 -15.517 7.765 -4.265 1.00 0.00 C ATOM 979 O LEU A 58 -14.447 7.213 -4.007 1.00 0.00 O ATOM 980 CB LEU A 58 -17.307 8.182 -2.571 1.00 0.00 C ATOM 981 CG LEU A 58 -17.004 6.886 -1.816 1.00 0.00 C ATOM 982 CD1 LEU A 58 -15.798 7.065 -0.907 1.00 0.00 C ATOM 983 CD2 LEU A 58 -18.219 6.443 -1.012 1.00 0.00 C ATOM 0 H LEU A 58 -17.508 10.241 -3.915 1.00 0.00 H new ATOM 0 HA LEU A 58 -15.357 9.079 -2.585 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -17.690 8.917 -1.862 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -18.103 7.988 -3.290 1.00 0.00 H new ATOM 0 HG LEU A 58 -16.770 6.110 -2.545 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -15.599 6.132 -0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -14.928 7.336 -1.506 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -16.001 7.855 -0.184 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -17.987 5.520 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -18.482 7.219 -0.293 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -19.059 6.273 -1.686 1.00 0.00 H new ATOM 995 N THR A 59 -16.211 7.517 -5.371 1.00 0.00 N ATOM 996 CA THR A 59 -15.742 6.561 -6.365 1.00 0.00 C ATOM 997 C THR A 59 -14.380 6.982 -6.909 1.00 0.00 C ATOM 998 O THR A 59 -13.504 6.149 -7.128 1.00 0.00 O ATOM 999 CB THR A 59 -16.756 6.439 -7.507 1.00 0.00 C ATOM 1000 OG1 THR A 59 -16.507 5.275 -8.275 1.00 0.00 O ATOM 1001 CG2 THR A 59 -16.748 7.622 -8.451 1.00 0.00 C ATOM 0 H THR A 59 -17.098 7.964 -5.600 1.00 0.00 H new ATOM 0 HA THR A 59 -15.638 5.587 -5.886 1.00 0.00 H new ATOM 0 HB THR A 59 -17.731 6.393 -7.021 1.00 0.00 H new ATOM 0 HG1 THR A 59 -17.165 5.214 -8.999 1.00 0.00 H new ATOM 0 HG21 THR A 59 -17.490 7.467 -9.234 1.00 0.00 H new ATOM 0 HG22 THR A 59 -16.988 8.530 -7.898 1.00 0.00 H new ATOM 0 HG23 THR A 59 -15.760 7.721 -8.901 1.00 0.00 H new ATOM 1009 N THR A 60 -14.211 8.286 -7.120 1.00 0.00 N ATOM 1010 CA THR A 60 -12.954 8.817 -7.631 1.00 0.00 C ATOM 1011 C THR A 60 -11.820 8.532 -6.649 1.00 0.00 C ATOM 1012 O THR A 60 -10.690 8.260 -7.051 1.00 0.00 O ATOM 1013 CB THR A 60 -13.081 10.323 -7.904 1.00 0.00 C ATOM 1014 OG1 THR A 60 -12.569 10.641 -9.186 1.00 0.00 O ATOM 1015 CG2 THR A 60 -12.364 11.199 -6.898 1.00 0.00 C ATOM 0 H THR A 60 -14.928 8.990 -6.945 1.00 0.00 H new ATOM 0 HA THR A 60 -12.720 8.321 -8.573 1.00 0.00 H new ATOM 0 HB THR A 60 -14.149 10.530 -7.831 1.00 0.00 H new ATOM 0 HG1 THR A 60 -12.659 11.604 -9.345 1.00 0.00 H new ATOM 0 HG21 THR A 60 -12.504 12.247 -7.163 1.00 0.00 H new ATOM 0 HG22 THR A 60 -12.772 11.019 -5.903 1.00 0.00 H new ATOM 0 HG23 THR A 60 -11.300 10.962 -6.902 1.00 0.00 H new ATOM 1023 N ALA A 61 -12.140 8.574 -5.358 1.00 0.00 N ATOM 1024 CA ALA A 61 -11.155 8.297 -4.323 1.00 0.00 C ATOM 1025 C ALA A 61 -10.813 6.821 -4.337 1.00 0.00 C ATOM 1026 O ALA A 61 -9.655 6.437 -4.497 1.00 0.00 O ATOM 1027 CB ALA A 61 -11.678 8.700 -2.955 1.00 0.00 C ATOM 0 H ALA A 61 -13.072 8.797 -5.007 1.00 0.00 H new ATOM 0 HA ALA A 61 -10.258 8.882 -4.526 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.924 8.483 -2.199 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.900 9.767 -2.950 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -12.586 8.139 -2.733 1.00 0.00 H new ATOM 1033 N MET A 62 -11.844 5.996 -4.199 1.00 0.00 N ATOM 1034 CA MET A 62 -11.674 4.559 -4.227 1.00 0.00 C ATOM 1035 C MET A 62 -11.055 4.152 -5.557 1.00 0.00 C ATOM 1036 O MET A 62 -10.297 3.188 -5.633 1.00 0.00 O ATOM 1037 CB MET A 62 -13.019 3.868 -4.021 1.00 0.00 C ATOM 1038 CG MET A 62 -13.730 4.298 -2.748 1.00 0.00 C ATOM 1039 SD MET A 62 -15.455 3.776 -2.701 1.00 0.00 S ATOM 1040 CE MET A 62 -15.345 2.199 -3.539 1.00 0.00 C ATOM 0 H MET A 62 -12.807 6.304 -4.066 1.00 0.00 H new ATOM 0 HA MET A 62 -11.009 4.253 -3.419 1.00 0.00 H new ATOM 0 HB2 MET A 62 -13.662 4.078 -4.876 1.00 0.00 H new ATOM 0 HB3 MET A 62 -12.865 2.789 -3.996 1.00 0.00 H new ATOM 0 HG2 MET A 62 -13.206 3.883 -1.887 1.00 0.00 H new ATOM 0 HG3 MET A 62 -13.681 5.383 -2.659 1.00 0.00 H new ATOM 0 HE1 MET A 62 -16.138 1.542 -3.183 1.00 0.00 H new ATOM 0 HE2 MET A 62 -15.453 2.349 -4.613 1.00 0.00 H new ATOM 0 HE3 MET A 62 -14.377 1.744 -3.332 1.00 0.00 H new ATOM 1050 N ASN A 63 -11.358 4.924 -6.601 1.00 0.00 N ATOM 1051 CA ASN A 63 -10.796 4.661 -7.918 1.00 0.00 C ATOM 1052 C ASN A 63 -9.291 4.831 -7.843 1.00 0.00 C ATOM 1053 O ASN A 63 -8.528 3.948 -8.234 1.00 0.00 O ATOM 1054 CB ASN A 63 -11.383 5.614 -8.962 1.00 0.00 C ATOM 1055 CG ASN A 63 -12.635 5.065 -9.617 1.00 0.00 C ATOM 1056 OD1 ASN A 63 -12.668 3.916 -10.055 1.00 0.00 O ATOM 1057 ND2 ASN A 63 -13.674 5.890 -9.688 1.00 0.00 N ATOM 0 H ASN A 63 -11.984 5.728 -6.558 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.044 3.644 -8.220 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -11.614 6.568 -8.488 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -10.634 5.812 -9.729 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -14.544 5.578 -10.119 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -13.601 6.835 -9.311 1.00 0.00 H new ATOM 1064 N ARG A 64 -8.874 5.964 -7.287 1.00 0.00 N ATOM 1065 CA ARG A 64 -7.462 6.243 -7.100 1.00 0.00 C ATOM 1066 C ARG A 64 -6.877 5.183 -6.183 1.00 0.00 C ATOM 1067 O ARG A 64 -5.741 4.753 -6.348 1.00 0.00 O ATOM 1068 CB ARG A 64 -7.270 7.629 -6.480 1.00 0.00 C ATOM 1069 CG ARG A 64 -6.851 8.692 -7.476 1.00 0.00 C ATOM 1070 CD ARG A 64 -8.043 9.506 -7.954 1.00 0.00 C ATOM 1071 NE ARG A 64 -7.651 10.550 -8.898 1.00 0.00 N ATOM 1072 CZ ARG A 64 -8.489 11.134 -9.749 1.00 0.00 C ATOM 1073 NH1 ARG A 64 -9.770 10.785 -9.778 1.00 0.00 N ATOM 1074 NH2 ARG A 64 -8.048 12.073 -10.575 1.00 0.00 N ATOM 0 H ARG A 64 -9.497 6.702 -6.959 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.955 6.226 -8.065 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.202 7.936 -6.005 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.518 7.564 -5.694 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.117 9.354 -7.016 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.364 8.221 -8.330 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.768 8.844 -8.427 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.539 9.961 -7.096 1.00 0.00 H new ATOM 0 HE ARG A 64 -6.676 10.849 -8.905 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.117 10.065 -9.145 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -10.407 11.237 -10.434 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.066 12.347 -10.558 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -8.691 12.521 -11.228 1.00 0.00 H new ATOM 1088 N PHE A 65 -7.690 4.767 -5.216 1.00 0.00 N ATOM 1089 CA PHE A 65 -7.303 3.750 -4.251 1.00 0.00 C ATOM 1090 C PHE A 65 -7.023 2.430 -4.945 1.00 0.00 C ATOM 1091 O PHE A 65 -5.909 1.909 -4.894 1.00 0.00 O ATOM 1092 CB PHE A 65 -8.428 3.577 -3.236 1.00 0.00 C ATOM 1093 CG PHE A 65 -8.017 2.972 -1.924 1.00 0.00 C ATOM 1094 CD1 PHE A 65 -6.688 2.919 -1.521 1.00 0.00 C ATOM 1095 CD2 PHE A 65 -8.987 2.463 -1.084 1.00 0.00 C ATOM 1096 CE1 PHE A 65 -6.346 2.364 -0.302 1.00 0.00 C ATOM 1097 CE2 PHE A 65 -8.653 1.913 0.132 1.00 0.00 C ATOM 1098 CZ PHE A 65 -7.332 1.862 0.526 1.00 0.00 C ATOM 0 H PHE A 65 -8.635 5.127 -5.082 1.00 0.00 H new ATOM 0 HA PHE A 65 -6.391 4.066 -3.744 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.876 4.552 -3.044 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.203 2.952 -3.679 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.917 3.314 -2.165 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -10.023 2.497 -1.386 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -5.311 2.323 0.003 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.425 1.521 0.778 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.069 1.430 1.480 1.00 0.00 H new ATOM 1108 N LYS A 66 -8.043 1.898 -5.605 1.00 0.00 N ATOM 1109 CA LYS A 66 -7.913 0.642 -6.324 1.00 0.00 C ATOM 1110 C LYS A 66 -6.768 0.732 -7.331 1.00 0.00 C ATOM 1111 O LYS A 66 -6.053 -0.241 -7.566 1.00 0.00 O ATOM 1112 CB LYS A 66 -9.246 0.308 -7.005 1.00 0.00 C ATOM 1113 CG LYS A 66 -9.124 -0.394 -8.342 1.00 0.00 C ATOM 1114 CD LYS A 66 -9.254 0.580 -9.503 1.00 0.00 C ATOM 1115 CE LYS A 66 -7.967 0.668 -10.308 1.00 0.00 C ATOM 1116 NZ LYS A 66 -8.089 -0.012 -11.626 1.00 0.00 N ATOM 0 H LYS A 66 -8.971 2.319 -5.656 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.674 -0.163 -5.629 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.832 -0.320 -6.334 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.806 1.232 -7.147 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.162 -0.902 -8.400 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -9.895 -1.161 -8.422 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -10.070 0.264 -10.154 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -9.514 1.568 -9.122 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -7.706 1.715 -10.463 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -7.153 0.217 -9.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -7.191 0.071 -12.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -8.313 -1.017 -11.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -8.849 0.434 -12.178 1.00 0.00 H new ATOM 1130 N ALA A 67 -6.600 1.915 -7.907 1.00 0.00 N ATOM 1131 CA ALA A 67 -5.539 2.150 -8.875 1.00 0.00 C ATOM 1132 C ALA A 67 -4.178 2.223 -8.187 1.00 0.00 C ATOM 1133 O ALA A 67 -3.233 1.541 -8.589 1.00 0.00 O ATOM 1134 CB ALA A 67 -5.808 3.429 -9.656 1.00 0.00 C ATOM 0 H ALA A 67 -7.187 2.728 -7.720 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.522 1.311 -9.571 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -5.006 3.591 -10.376 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.757 3.340 -10.184 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -5.854 4.273 -8.968 1.00 0.00 H new ATOM 1140 N ALA A 68 -4.082 3.042 -7.139 1.00 0.00 N ATOM 1141 CA ALA A 68 -2.831 3.180 -6.402 1.00 0.00 C ATOM 1142 C ALA A 68 -2.367 1.821 -5.892 1.00 0.00 C ATOM 1143 O ALA A 68 -1.172 1.586 -5.716 1.00 0.00 O ATOM 1144 CB ALA A 68 -2.975 4.173 -5.250 1.00 0.00 C ATOM 0 H ALA A 68 -4.849 3.614 -6.786 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.076 3.572 -7.083 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -2.026 4.255 -4.719 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.255 5.150 -5.644 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.746 3.824 -4.563 1.00 0.00 H new ATOM 1150 N LEU A 69 -3.323 0.921 -5.674 1.00 0.00 N ATOM 1151 CA LEU A 69 -3.012 -0.421 -5.209 1.00 0.00 C ATOM 1152 C LEU A 69 -2.251 -1.182 -6.279 1.00 0.00 C ATOM 1153 O LEU A 69 -1.166 -1.705 -6.029 1.00 0.00 O ATOM 1154 CB LEU A 69 -4.292 -1.165 -4.849 1.00 0.00 C ATOM 1155 CG LEU A 69 -4.825 -0.851 -3.459 1.00 0.00 C ATOM 1156 CD1 LEU A 69 -6.339 -1.003 -3.414 1.00 0.00 C ATOM 1157 CD2 LEU A 69 -4.153 -1.741 -2.429 1.00 0.00 C ATOM 0 H LEU A 69 -4.318 1.100 -5.813 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.388 -0.346 -4.318 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.059 -0.922 -5.584 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.109 -2.237 -4.922 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.591 0.186 -3.220 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.698 -0.774 -2.411 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.795 -0.317 -4.128 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.610 -2.027 -3.671 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.542 -1.508 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.357 -2.786 -2.662 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.077 -1.569 -2.446 1.00 0.00 H new ATOM 1169 N GLU A 70 -2.819 -1.222 -7.485 1.00 0.00 N ATOM 1170 CA GLU A 70 -2.179 -1.898 -8.607 1.00 0.00 C ATOM 1171 C GLU A 70 -0.705 -1.525 -8.652 1.00 0.00 C ATOM 1172 O GLU A 70 0.145 -2.336 -9.020 1.00 0.00 O ATOM 1173 CB GLU A 70 -2.862 -1.523 -9.923 1.00 0.00 C ATOM 1174 CG GLU A 70 -4.009 -2.446 -10.298 1.00 0.00 C ATOM 1175 CD GLU A 70 -3.741 -3.225 -11.571 1.00 0.00 C ATOM 1176 OE1 GLU A 70 -2.555 -3.403 -11.920 1.00 0.00 O ATOM 1177 OE2 GLU A 70 -4.717 -3.657 -12.220 1.00 0.00 O ATOM 0 H GLU A 70 -3.718 -0.795 -7.707 1.00 0.00 H new ATOM 0 HA GLU A 70 -2.273 -2.975 -8.471 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.237 -0.502 -9.850 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.122 -1.534 -10.723 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -4.190 -3.144 -9.481 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.918 -1.857 -10.422 1.00 0.00 H new ATOM 1184 N GLU A 71 -0.411 -0.294 -8.238 1.00 0.00 N ATOM 1185 CA GLU A 71 0.960 0.180 -8.194 1.00 0.00 C ATOM 1186 C GLU A 71 1.739 -0.633 -7.169 1.00 0.00 C ATOM 1187 O GLU A 71 2.784 -1.203 -7.480 1.00 0.00 O ATOM 1188 CB GLU A 71 1.005 1.665 -7.839 1.00 0.00 C ATOM 1189 CG GLU A 71 2.376 2.286 -8.022 1.00 0.00 C ATOM 1190 CD GLU A 71 2.709 2.548 -9.479 1.00 0.00 C ATOM 1191 OE1 GLU A 71 1.784 2.881 -10.248 1.00 0.00 O ATOM 1192 OE2 GLU A 71 3.895 2.419 -9.848 1.00 0.00 O ATOM 0 H GLU A 71 -1.105 0.387 -7.930 1.00 0.00 H new ATOM 0 HA GLU A 71 1.413 0.055 -9.177 1.00 0.00 H new ATOM 0 HB2 GLU A 71 0.286 2.201 -8.458 1.00 0.00 H new ATOM 0 HB3 GLU A 71 0.692 1.793 -6.803 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.423 3.224 -7.468 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.130 1.625 -7.594 1.00 0.00 H new ATOM 1199 N ALA A 72 1.208 -0.706 -5.946 1.00 0.00 N ATOM 1200 CA ALA A 72 1.844 -1.480 -4.892 1.00 0.00 C ATOM 1201 C ALA A 72 1.924 -2.945 -5.304 1.00 0.00 C ATOM 1202 O ALA A 72 2.991 -3.554 -5.269 1.00 0.00 O ATOM 1203 CB ALA A 72 1.078 -1.332 -3.587 1.00 0.00 C ATOM 0 H ALA A 72 0.345 -0.240 -5.668 1.00 0.00 H new ATOM 0 HA ALA A 72 2.855 -1.103 -4.736 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.568 -1.918 -2.809 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.059 -0.283 -3.293 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.057 -1.689 -3.722 1.00 0.00 H new ATOM 1209 N ASN A 73 0.786 -3.500 -5.717 1.00 0.00 N ATOM 1210 CA ASN A 73 0.735 -4.888 -6.161 1.00 0.00 C ATOM 1211 C ASN A 73 1.698 -5.103 -7.323 1.00 0.00 C ATOM 1212 O ASN A 73 2.304 -6.166 -7.455 1.00 0.00 O ATOM 1213 CB ASN A 73 -0.685 -5.267 -6.588 1.00 0.00 C ATOM 1214 CG ASN A 73 -0.953 -6.751 -6.436 1.00 0.00 C ATOM 1215 OD1 ASN A 73 -0.416 -7.403 -5.540 1.00 0.00 O ATOM 1216 ND2 ASN A 73 -1.787 -7.295 -7.315 1.00 0.00 N ATOM 0 H ASN A 73 -0.108 -3.011 -5.753 1.00 0.00 H new ATOM 0 HA ASN A 73 1.030 -5.525 -5.327 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -1.404 -4.707 -5.990 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.840 -4.976 -7.627 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -2.005 -8.290 -7.263 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.210 -6.718 -8.042 1.00 0.00 H new ATOM 1223 N GLY A 74 1.837 -4.077 -8.157 1.00 0.00 N ATOM 1224 CA GLY A 74 2.733 -4.160 -9.295 1.00 0.00 C ATOM 1225 C GLY A 74 4.183 -4.054 -8.876 1.00 0.00 C ATOM 1226 O GLY A 74 5.029 -4.819 -9.338 1.00 0.00 O ATOM 0 H GLY A 74 1.344 -3.189 -8.064 1.00 0.00 H new ATOM 0 HA2 GLY A 74 2.573 -5.104 -9.816 1.00 0.00 H new ATOM 0 HA3 GLY A 74 2.499 -3.363 -10.001 1.00 0.00 H new ATOM 1230 N GLU A 75 4.468 -3.108 -7.986 1.00 0.00 N ATOM 1231 CA GLU A 75 5.823 -2.913 -7.492 1.00 0.00 C ATOM 1232 C GLU A 75 6.285 -4.159 -6.743 1.00 0.00 C ATOM 1233 O GLU A 75 7.437 -4.574 -6.853 1.00 0.00 O ATOM 1234 CB GLU A 75 5.886 -1.668 -6.591 1.00 0.00 C ATOM 1235 CG GLU A 75 5.708 -1.948 -5.105 1.00 0.00 C ATOM 1236 CD GLU A 75 6.990 -2.410 -4.439 1.00 0.00 C ATOM 1237 OE1 GLU A 75 8.009 -1.697 -4.554 1.00 0.00 O ATOM 1238 OE2 GLU A 75 6.974 -3.485 -3.802 1.00 0.00 O ATOM 0 H GLU A 75 3.779 -2.467 -7.594 1.00 0.00 H new ATOM 0 HA GLU A 75 6.495 -2.751 -8.335 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.847 -1.176 -6.741 1.00 0.00 H new ATOM 0 HB3 GLU A 75 5.115 -0.966 -6.909 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.351 -1.045 -4.610 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.940 -2.710 -4.972 1.00 0.00 H new ATOM 1245 N ILE A 76 5.361 -4.756 -5.998 1.00 0.00 N ATOM 1246 CA ILE A 76 5.643 -5.964 -5.241 1.00 0.00 C ATOM 1247 C ILE A 76 5.737 -7.163 -6.179 1.00 0.00 C ATOM 1248 O ILE A 76 6.454 -8.125 -5.908 1.00 0.00 O ATOM 1249 CB ILE A 76 4.551 -6.225 -4.183 1.00 0.00 C ATOM 1250 CG1 ILE A 76 4.488 -5.065 -3.190 1.00 0.00 C ATOM 1251 CG2 ILE A 76 4.808 -7.536 -3.453 1.00 0.00 C ATOM 1252 CD1 ILE A 76 3.172 -4.976 -2.451 1.00 0.00 C ATOM 0 H ILE A 76 4.404 -4.417 -5.904 1.00 0.00 H new ATOM 0 HA ILE A 76 6.596 -5.823 -4.731 1.00 0.00 H new ATOM 0 HB ILE A 76 3.591 -6.302 -4.693 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.296 -5.172 -2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.660 -4.130 -3.724 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.026 -7.699 -2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.806 -8.358 -4.169 1.00 0.00 H new ATOM 0 HG23 ILE A 76 5.776 -7.491 -2.954 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.197 -4.131 -1.763 1.00 0.00 H new ATOM 0 HD12 ILE A 76 2.362 -4.838 -3.167 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.007 -5.896 -1.890 1.00 0.00 H new ATOM 1264 N GLU A 77 5.005 -7.093 -7.286 1.00 0.00 N ATOM 1265 CA GLU A 77 5.004 -8.169 -8.271 1.00 0.00 C ATOM 1266 C GLU A 77 6.249 -8.097 -9.148 1.00 0.00 C ATOM 1267 O GLU A 77 6.879 -9.114 -9.436 1.00 0.00 O ATOM 1268 CB GLU A 77 3.746 -8.092 -9.140 1.00 0.00 C ATOM 1269 CG GLU A 77 3.675 -9.177 -10.202 1.00 0.00 C ATOM 1270 CD GLU A 77 2.475 -9.020 -11.116 1.00 0.00 C ATOM 1271 OE1 GLU A 77 1.395 -9.545 -10.774 1.00 0.00 O ATOM 1272 OE2 GLU A 77 2.616 -8.372 -12.175 1.00 0.00 O ATOM 0 H GLU A 77 4.405 -6.303 -7.524 1.00 0.00 H new ATOM 0 HA GLU A 77 5.009 -9.120 -7.738 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.867 -8.163 -8.500 1.00 0.00 H new ATOM 0 HB3 GLU A 77 3.708 -7.117 -9.625 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.587 -9.156 -10.799 1.00 0.00 H new ATOM 0 HG3 GLU A 77 3.633 -10.152 -9.717 1.00 0.00 H new ATOM 1279 N LYS A 78 6.600 -6.884 -9.565 1.00 0.00 N ATOM 1280 CA LYS A 78 7.773 -6.674 -10.405 1.00 0.00 C ATOM 1281 C LYS A 78 9.060 -6.849 -9.603 1.00 0.00 C ATOM 1282 O LYS A 78 10.134 -7.051 -10.171 1.00 0.00 O ATOM 1283 CB LYS A 78 7.730 -5.275 -11.027 1.00 0.00 C ATOM 1284 CG LYS A 78 8.830 -5.026 -12.047 1.00 0.00 C ATOM 1285 CD LYS A 78 9.142 -3.544 -12.178 1.00 0.00 C ATOM 1286 CE LYS A 78 9.789 -2.995 -10.916 1.00 0.00 C ATOM 1287 NZ LYS A 78 11.256 -2.807 -11.081 1.00 0.00 N ATOM 0 H LYS A 78 6.088 -6.032 -9.335 1.00 0.00 H new ATOM 0 HA LYS A 78 7.761 -7.421 -11.199 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.762 -5.130 -11.507 1.00 0.00 H new ATOM 0 HB3 LYS A 78 7.807 -4.532 -10.234 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.731 -5.564 -11.751 1.00 0.00 H new ATOM 0 HG3 LYS A 78 8.526 -5.422 -13.016 1.00 0.00 H new ATOM 0 HD2 LYS A 78 9.807 -3.385 -13.027 1.00 0.00 H new ATOM 0 HD3 LYS A 78 8.223 -2.995 -12.385 1.00 0.00 H new ATOM 0 HE2 LYS A 78 9.328 -2.042 -10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 78 9.601 -3.676 -10.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 11.659 -2.431 -10.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 11.700 -3.721 -11.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.435 -2.137 -11.856 1.00 0.00 H new ATOM 1301 N PHE A 79 8.949 -6.769 -8.279 1.00 0.00 N ATOM 1302 CA PHE A 79 10.107 -6.918 -7.406 1.00 0.00 C ATOM 1303 C PHE A 79 10.260 -8.358 -6.918 1.00 0.00 C ATOM 1304 O PHE A 79 11.236 -8.690 -6.246 1.00 0.00 O ATOM 1305 CB PHE A 79 9.989 -5.975 -6.207 1.00 0.00 C ATOM 1306 CG PHE A 79 10.519 -4.592 -6.468 1.00 0.00 C ATOM 1307 CD1 PHE A 79 11.699 -4.404 -7.171 1.00 0.00 C ATOM 1308 CD2 PHE A 79 9.834 -3.479 -6.009 1.00 0.00 C ATOM 1309 CE1 PHE A 79 12.185 -3.133 -7.411 1.00 0.00 C ATOM 1310 CE2 PHE A 79 10.315 -2.204 -6.246 1.00 0.00 C ATOM 1311 CZ PHE A 79 11.492 -2.031 -6.947 1.00 0.00 C ATOM 0 H PHE A 79 8.070 -6.602 -7.789 1.00 0.00 H new ATOM 0 HA PHE A 79 10.994 -6.661 -7.986 1.00 0.00 H new ATOM 0 HB2 PHE A 79 8.941 -5.903 -5.915 1.00 0.00 H new ATOM 0 HB3 PHE A 79 10.527 -6.407 -5.363 1.00 0.00 H new ATOM 0 HD1 PHE A 79 12.245 -5.261 -7.536 1.00 0.00 H new ATOM 0 HD2 PHE A 79 8.913 -3.608 -5.459 1.00 0.00 H new ATOM 0 HE1 PHE A 79 13.105 -3.001 -7.961 1.00 0.00 H new ATOM 0 HE2 PHE A 79 9.771 -1.345 -5.883 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.870 -1.037 -7.132 1.00 0.00 H new ATOM 1321 N SER A 80 9.293 -9.209 -7.252 1.00 0.00 N ATOM 1322 CA SER A 80 9.334 -10.607 -6.836 1.00 0.00 C ATOM 1323 C SER A 80 10.611 -11.285 -7.317 1.00 0.00 C ATOM 1324 O SER A 80 11.182 -12.121 -6.617 1.00 0.00 O ATOM 1325 CB SER A 80 8.113 -11.358 -7.369 1.00 0.00 C ATOM 1326 OG SER A 80 7.633 -12.292 -6.418 1.00 0.00 O ATOM 0 H SER A 80 8.475 -8.956 -7.807 1.00 0.00 H new ATOM 0 HA SER A 80 9.321 -10.632 -5.746 1.00 0.00 H new ATOM 0 HB2 SER A 80 7.324 -10.647 -7.615 1.00 0.00 H new ATOM 0 HB3 SER A 80 8.375 -11.876 -8.292 1.00 0.00 H new ATOM 0 HG SER A 80 7.570 -11.862 -5.540 1.00 0.00 H new ATOM 1332 N ASN A 81 11.057 -10.917 -8.512 1.00 0.00 N ATOM 1333 CA ASN A 81 12.271 -11.488 -9.077 1.00 0.00 C ATOM 1334 C ASN A 81 13.498 -10.989 -8.323 1.00 0.00 C ATOM 1335 O ASN A 81 13.846 -9.811 -8.396 1.00 0.00 O ATOM 1336 CB ASN A 81 12.386 -11.131 -10.562 1.00 0.00 C ATOM 1337 CG ASN A 81 12.821 -12.312 -11.408 1.00 0.00 C ATOM 1338 OD1 ASN A 81 12.608 -13.467 -11.039 1.00 0.00 O ATOM 1339 ND2 ASN A 81 13.437 -12.027 -12.549 1.00 0.00 N ATOM 0 H ASN A 81 10.597 -10.227 -9.106 1.00 0.00 H new ATOM 0 HA ASN A 81 12.218 -12.572 -8.978 1.00 0.00 H new ATOM 0 HB2 ASN A 81 11.424 -10.765 -10.921 1.00 0.00 H new ATOM 0 HB3 ASN A 81 13.101 -10.318 -10.683 1.00 0.00 H new ATOM 0 HD21 ASN A 81 13.755 -12.780 -13.159 1.00 0.00 H new ATOM 0 HD22 ASN A 81 13.593 -11.055 -12.816 1.00 0.00 H new ATOM 1346 N ARG A 82 14.150 -11.890 -7.593 1.00 0.00 N ATOM 1347 CA ARG A 82 15.338 -11.534 -6.823 1.00 0.00 C ATOM 1348 C ARG A 82 16.319 -10.736 -7.676 1.00 0.00 C ATOM 1349 O ARG A 82 16.953 -9.795 -7.198 1.00 0.00 O ATOM 1350 CB ARG A 82 16.019 -12.792 -6.283 1.00 0.00 C ATOM 1351 CG ARG A 82 16.453 -13.764 -7.368 1.00 0.00 C ATOM 1352 CD ARG A 82 17.913 -13.568 -7.740 1.00 0.00 C ATOM 1353 NE ARG A 82 18.812 -13.962 -6.659 1.00 0.00 N ATOM 1354 CZ ARG A 82 20.104 -14.238 -6.831 1.00 0.00 C ATOM 1355 NH1 ARG A 82 20.650 -14.164 -8.039 1.00 0.00 N ATOM 1356 NH2 ARG A 82 20.851 -14.589 -5.794 1.00 0.00 N ATOM 0 H ARG A 82 13.876 -12.870 -7.519 1.00 0.00 H new ATOM 0 HA ARG A 82 15.024 -10.913 -5.984 1.00 0.00 H new ATOM 0 HB2 ARG A 82 16.892 -12.500 -5.699 1.00 0.00 H new ATOM 0 HB3 ARG A 82 15.336 -13.301 -5.603 1.00 0.00 H new ATOM 0 HG2 ARG A 82 16.298 -14.787 -7.025 1.00 0.00 H new ATOM 0 HG3 ARG A 82 15.830 -13.627 -8.252 1.00 0.00 H new ATOM 0 HD2 ARG A 82 18.141 -14.152 -8.632 1.00 0.00 H new ATOM 0 HD3 ARG A 82 18.085 -12.521 -7.991 1.00 0.00 H new ATOM 0 HE ARG A 82 18.428 -14.030 -5.716 1.00 0.00 H new ATOM 0 HH11 ARG A 82 20.080 -13.895 -8.841 1.00 0.00 H new ATOM 0 HH12 ARG A 82 21.640 -14.376 -8.165 1.00 0.00 H new ATOM 0 HH21 ARG A 82 20.437 -14.648 -4.864 1.00 0.00 H new ATOM 0 HH22 ARG A 82 21.840 -14.800 -5.926 1.00 0.00 H new ATOM 1370 N SER A 83 16.431 -11.112 -8.946 1.00 0.00 N ATOM 1371 CA SER A 83 17.324 -10.423 -9.868 1.00 0.00 C ATOM 1372 C SER A 83 16.894 -8.970 -10.034 1.00 0.00 C ATOM 1373 O SER A 83 17.727 -8.081 -10.210 1.00 0.00 O ATOM 1374 CB SER A 83 17.333 -11.127 -11.227 1.00 0.00 C ATOM 1375 OG SER A 83 18.413 -12.041 -11.320 1.00 0.00 O ATOM 0 H SER A 83 15.915 -11.889 -9.359 1.00 0.00 H new ATOM 0 HA SER A 83 18.333 -10.446 -9.455 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.391 -11.656 -11.373 1.00 0.00 H new ATOM 0 HB3 SER A 83 17.409 -10.387 -12.023 1.00 0.00 H new ATOM 0 HG SER A 83 18.396 -12.479 -12.196 1.00 0.00 H new ATOM 1381 N ASN A 84 15.586 -8.740 -9.968 1.00 0.00 N ATOM 1382 CA ASN A 84 15.038 -7.396 -10.103 1.00 0.00 C ATOM 1383 C ASN A 84 15.422 -6.538 -8.903 1.00 0.00 C ATOM 1384 O ASN A 84 15.858 -5.399 -9.058 1.00 0.00 O ATOM 1385 CB ASN A 84 13.514 -7.456 -10.237 1.00 0.00 C ATOM 1386 CG ASN A 84 13.041 -7.087 -11.629 1.00 0.00 C ATOM 1387 OD1 ASN A 84 13.674 -6.293 -12.323 1.00 0.00 O ATOM 1388 ND2 ASN A 84 11.921 -7.668 -12.044 1.00 0.00 N ATOM 0 H ASN A 84 14.886 -9.468 -9.822 1.00 0.00 H new ATOM 0 HA ASN A 84 15.455 -6.944 -11.003 1.00 0.00 H new ATOM 0 HB2 ASN A 84 13.170 -8.461 -9.994 1.00 0.00 H new ATOM 0 HB3 ASN A 84 13.061 -6.780 -9.511 1.00 0.00 H new ATOM 0 HD21 ASN A 84 11.553 -7.461 -12.973 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.429 -8.321 -11.434 1.00 0.00 H new ATOM 1395 N ILE A 85 15.261 -7.093 -7.709 1.00 0.00 N ATOM 1396 CA ILE A 85 15.595 -6.378 -6.482 1.00 0.00 C ATOM 1397 C ILE A 85 17.066 -5.981 -6.466 1.00 0.00 C ATOM 1398 O ILE A 85 17.406 -4.799 -6.489 1.00 0.00 O ATOM 1399 CB ILE A 85 15.291 -7.237 -5.238 1.00 0.00 C ATOM 1400 CG1 ILE A 85 13.798 -7.583 -5.186 1.00 0.00 C ATOM 1401 CG2 ILE A 85 15.739 -6.530 -3.963 1.00 0.00 C ATOM 1402 CD1 ILE A 85 12.918 -6.493 -4.604 1.00 0.00 C ATOM 0 H ILE A 85 14.901 -8.036 -7.563 1.00 0.00 H new ATOM 0 HA ILE A 85 14.979 -5.479 -6.455 1.00 0.00 H new ATOM 0 HB ILE A 85 15.855 -8.167 -5.312 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.455 -7.808 -6.196 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.669 -8.490 -4.596 1.00 0.00 H new ATOM 0 HG21 ILE A 85 15.513 -7.157 -3.101 1.00 0.00 H new ATOM 0 HG22 ILE A 85 16.813 -6.346 -4.007 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.212 -5.581 -3.869 1.00 0.00 H new ATOM 0 HD11 ILE A 85 11.879 -6.824 -4.606 1.00 0.00 H new ATOM 0 HD12 ILE A 85 13.229 -6.282 -3.581 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.012 -5.589 -5.206 1.00 0.00 H new ATOM 1414 N CYS A 86 17.934 -6.986 -6.417 1.00 0.00 N ATOM 1415 CA CYS A 86 19.377 -6.766 -6.388 1.00 0.00 C ATOM 1416 C CYS A 86 19.814 -5.745 -7.438 1.00 0.00 C ATOM 1417 O CYS A 86 20.725 -4.953 -7.199 1.00 0.00 O ATOM 1418 CB CYS A 86 20.116 -8.085 -6.611 1.00 0.00 C ATOM 1419 SG CYS A 86 20.050 -9.216 -5.202 1.00 0.00 S ATOM 0 H CYS A 86 17.661 -7.969 -6.396 1.00 0.00 H new ATOM 0 HA CYS A 86 19.629 -6.368 -5.405 1.00 0.00 H new ATOM 0 HB2 CYS A 86 19.693 -8.583 -7.483 1.00 0.00 H new ATOM 0 HB3 CYS A 86 21.159 -7.870 -6.842 1.00 0.00 H new ATOM 0 HG CYS A 86 20.701 -10.304 -5.488 1.00 0.00 H new ATOM 1425 N ARG A 87 19.168 -5.770 -8.600 1.00 0.00 N ATOM 1426 CA ARG A 87 19.510 -4.843 -9.672 1.00 0.00 C ATOM 1427 C ARG A 87 18.834 -3.489 -9.471 1.00 0.00 C ATOM 1428 O ARG A 87 19.308 -2.472 -9.979 1.00 0.00 O ATOM 1429 CB ARG A 87 19.142 -5.435 -11.041 1.00 0.00 C ATOM 1430 CG ARG A 87 17.664 -5.322 -11.399 1.00 0.00 C ATOM 1431 CD ARG A 87 17.457 -4.597 -12.721 1.00 0.00 C ATOM 1432 NE ARG A 87 16.989 -5.498 -13.773 1.00 0.00 N ATOM 1433 CZ ARG A 87 17.791 -6.275 -14.497 1.00 0.00 C ATOM 1434 NH1 ARG A 87 19.101 -6.269 -14.288 1.00 0.00 N ATOM 1435 NH2 ARG A 87 17.280 -7.062 -15.434 1.00 0.00 N ATOM 0 H ARG A 87 18.411 -6.417 -8.822 1.00 0.00 H new ATOM 0 HA ARG A 87 20.588 -4.685 -9.644 1.00 0.00 H new ATOM 0 HB2 ARG A 87 19.729 -4.933 -11.810 1.00 0.00 H new ATOM 0 HB3 ARG A 87 19.428 -6.487 -11.057 1.00 0.00 H new ATOM 0 HG2 ARG A 87 17.227 -6.319 -11.459 1.00 0.00 H new ATOM 0 HG3 ARG A 87 17.138 -4.790 -10.606 1.00 0.00 H new ATOM 0 HD2 ARG A 87 16.734 -3.793 -12.584 1.00 0.00 H new ATOM 0 HD3 ARG A 87 18.394 -4.134 -13.031 1.00 0.00 H new ATOM 0 HE ARG A 87 15.988 -5.533 -13.963 1.00 0.00 H new ATOM 0 HH11 ARG A 87 19.500 -5.666 -13.568 1.00 0.00 H new ATOM 0 HH12 ARG A 87 19.709 -6.867 -14.847 1.00 0.00 H new ATOM 0 HH21 ARG A 87 16.273 -7.071 -15.599 1.00 0.00 H new ATOM 0 HH22 ARG A 87 17.893 -7.658 -15.990 1.00 0.00 H new ATOM 1449 N PHE A 88 17.732 -3.473 -8.726 1.00 0.00 N ATOM 1450 CA PHE A 88 17.016 -2.231 -8.468 1.00 0.00 C ATOM 1451 C PHE A 88 17.735 -1.417 -7.393 1.00 0.00 C ATOM 1452 O PHE A 88 17.876 -0.202 -7.514 1.00 0.00 O ATOM 1453 CB PHE A 88 15.560 -2.522 -8.057 1.00 0.00 C ATOM 1454 CG PHE A 88 15.159 -1.924 -6.736 1.00 0.00 C ATOM 1455 CD1 PHE A 88 15.164 -0.551 -6.552 1.00 0.00 C ATOM 1456 CD2 PHE A 88 14.792 -2.736 -5.676 1.00 0.00 C ATOM 1457 CE1 PHE A 88 14.817 0.000 -5.337 1.00 0.00 C ATOM 1458 CE2 PHE A 88 14.441 -2.196 -4.466 1.00 0.00 C ATOM 1459 CZ PHE A 88 14.455 -0.822 -4.291 1.00 0.00 C ATOM 0 H PHE A 88 17.319 -4.300 -8.294 1.00 0.00 H new ATOM 0 HA PHE A 88 16.996 -1.642 -9.385 1.00 0.00 H new ATOM 0 HB2 PHE A 88 14.893 -2.143 -8.832 1.00 0.00 H new ATOM 0 HB3 PHE A 88 15.416 -3.602 -8.013 1.00 0.00 H new ATOM 0 HD1 PHE A 88 15.443 0.096 -7.371 1.00 0.00 H new ATOM 0 HD2 PHE A 88 14.782 -3.808 -5.804 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.829 1.072 -5.205 1.00 0.00 H new ATOM 0 HE2 PHE A 88 14.154 -2.842 -3.649 1.00 0.00 H new ATOM 0 HZ PHE A 88 14.183 -0.395 -3.337 1.00 0.00 H new ATOM 1469 N LEU A 89 18.176 -2.093 -6.336 1.00 0.00 N ATOM 1470 CA LEU A 89 18.870 -1.427 -5.239 1.00 0.00 C ATOM 1471 C LEU A 89 20.101 -0.677 -5.743 1.00 0.00 C ATOM 1472 O LEU A 89 20.197 0.543 -5.604 1.00 0.00 O ATOM 1473 CB LEU A 89 19.284 -2.440 -4.168 1.00 0.00 C ATOM 1474 CG LEU A 89 18.163 -3.345 -3.645 1.00 0.00 C ATOM 1475 CD1 LEU A 89 18.684 -4.242 -2.534 1.00 0.00 C ATOM 1476 CD2 LEU A 89 16.986 -2.516 -3.148 1.00 0.00 C ATOM 0 H LEU A 89 18.065 -3.100 -6.216 1.00 0.00 H new ATOM 0 HA LEU A 89 18.180 -0.707 -4.800 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.075 -3.070 -4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 89 19.711 -1.897 -3.325 1.00 0.00 H new ATOM 0 HG LEU A 89 17.817 -3.971 -4.468 1.00 0.00 H new ATOM 0 HD11 LEU A 89 17.877 -4.879 -2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.493 -4.864 -2.918 1.00 0.00 H new ATOM 0 HD13 LEU A 89 19.056 -3.627 -1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 89 16.203 -3.179 -2.782 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.316 -1.863 -2.340 1.00 0.00 H new ATOM 0 HD23 LEU A 89 16.596 -1.911 -3.966 1.00 0.00 H new ATOM 1488 N THR A 90 21.042 -1.414 -6.326 1.00 0.00 N ATOM 1489 CA THR A 90 22.270 -0.820 -6.847 1.00 0.00 C ATOM 1490 C THR A 90 21.964 0.290 -7.849 1.00 0.00 C ATOM 1491 O THR A 90 22.483 1.401 -7.736 1.00 0.00 O ATOM 1492 CB THR A 90 23.142 -1.892 -7.508 1.00 0.00 C ATOM 1493 OG1 THR A 90 24.231 -1.298 -8.192 1.00 0.00 O ATOM 1494 CG2 THR A 90 22.390 -2.750 -8.502 1.00 0.00 C ATOM 0 H THR A 90 20.978 -2.424 -6.450 1.00 0.00 H new ATOM 0 HA THR A 90 22.812 -0.384 -6.008 1.00 0.00 H new ATOM 0 HB THR A 90 23.485 -2.528 -6.692 1.00 0.00 H new ATOM 0 HG1 THR A 90 24.778 -1.998 -8.607 1.00 0.00 H new ATOM 0 HG21 THR A 90 23.068 -3.488 -8.932 1.00 0.00 H new ATOM 0 HG22 THR A 90 21.571 -3.261 -7.995 1.00 0.00 H new ATOM 0 HG23 THR A 90 21.988 -2.120 -9.296 1.00 0.00 H new ATOM 1502 N ALA A 91 21.124 -0.018 -8.831 1.00 0.00 N ATOM 1503 CA ALA A 91 20.753 0.952 -9.854 1.00 0.00 C ATOM 1504 C ALA A 91 19.929 2.093 -9.265 1.00 0.00 C ATOM 1505 O ALA A 91 19.917 3.202 -9.798 1.00 0.00 O ATOM 1506 CB ALA A 91 19.981 0.267 -10.971 1.00 0.00 C ATOM 0 H ALA A 91 20.687 -0.933 -8.940 1.00 0.00 H new ATOM 0 HA ALA A 91 21.670 1.377 -10.262 1.00 0.00 H new ATOM 0 HB1 ALA A 91 19.709 1.002 -11.729 1.00 0.00 H new ATOM 0 HB2 ALA A 91 20.603 -0.507 -11.422 1.00 0.00 H new ATOM 0 HB3 ALA A 91 19.077 -0.186 -10.564 1.00 0.00 H new ATOM 1512 N SER A 92 19.236 1.811 -8.167 1.00 0.00 N ATOM 1513 CA SER A 92 18.404 2.813 -7.510 1.00 0.00 C ATOM 1514 C SER A 92 17.302 3.296 -8.448 1.00 0.00 C ATOM 1515 O SER A 92 17.346 4.422 -8.946 1.00 0.00 O ATOM 1516 CB SER A 92 19.258 3.996 -7.051 1.00 0.00 C ATOM 1517 OG SER A 92 18.561 4.794 -6.109 1.00 0.00 O ATOM 0 H SER A 92 19.234 0.897 -7.713 1.00 0.00 H new ATOM 0 HA SER A 92 17.940 2.353 -6.637 1.00 0.00 H new ATOM 0 HB2 SER A 92 20.184 3.630 -6.607 1.00 0.00 H new ATOM 0 HB3 SER A 92 19.536 4.604 -7.912 1.00 0.00 H new ATOM 0 HG SER A 92 19.129 5.542 -5.830 1.00 0.00 H new ATOM 1523 N GLN A 93 16.317 2.436 -8.691 1.00 0.00 N ATOM 1524 CA GLN A 93 15.208 2.778 -9.576 1.00 0.00 C ATOM 1525 C GLN A 93 14.516 4.054 -9.113 1.00 0.00 C ATOM 1526 O GLN A 93 14.353 4.997 -9.888 1.00 0.00 O ATOM 1527 CB GLN A 93 14.200 1.628 -9.631 1.00 0.00 C ATOM 1528 CG GLN A 93 13.154 1.788 -10.724 1.00 0.00 C ATOM 1529 CD GLN A 93 13.770 2.006 -12.092 1.00 0.00 C ATOM 1530 OE1 GLN A 93 13.344 2.881 -12.845 1.00 0.00 O ATOM 1531 NE2 GLN A 93 14.778 1.208 -12.421 1.00 0.00 N ATOM 0 H GLN A 93 16.264 1.500 -8.289 1.00 0.00 H new ATOM 0 HA GLN A 93 15.611 2.947 -10.574 1.00 0.00 H new ATOM 0 HB2 GLN A 93 14.737 0.692 -9.787 1.00 0.00 H new ATOM 0 HB3 GLN A 93 13.697 1.550 -8.667 1.00 0.00 H new ATOM 0 HG2 GLN A 93 12.523 0.900 -10.751 1.00 0.00 H new ATOM 0 HG3 GLN A 93 12.507 2.631 -10.482 1.00 0.00 H new ATOM 0 HE21 GLN A 93 15.099 0.495 -11.766 1.00 0.00 H new ATOM 0 HE22 GLN A 93 15.232 1.307 -13.329 1.00 0.00 H new ATOM 1540 N ASP A 94 14.111 4.084 -7.846 1.00 0.00 N ATOM 1541 CA ASP A 94 13.443 5.254 -7.293 1.00 0.00 C ATOM 1542 C ASP A 94 13.951 5.566 -5.888 1.00 0.00 C ATOM 1543 O ASP A 94 13.366 6.388 -5.181 1.00 0.00 O ATOM 1544 CB ASP A 94 11.935 5.015 -7.259 1.00 0.00 C ATOM 1545 CG ASP A 94 11.227 5.600 -8.465 1.00 0.00 C ATOM 1546 OD1 ASP A 94 11.474 6.784 -8.782 1.00 0.00 O ATOM 1547 OD2 ASP A 94 10.426 4.876 -9.093 1.00 0.00 O ATOM 0 H ASP A 94 14.234 3.315 -7.188 1.00 0.00 H new ATOM 0 HA ASP A 94 13.665 6.110 -7.931 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.741 3.943 -7.212 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.521 5.453 -6.351 1.00 0.00 H new ATOM 1552 N LYS A 95 15.031 4.893 -5.478 1.00 0.00 N ATOM 1553 CA LYS A 95 15.608 5.082 -4.151 1.00 0.00 C ATOM 1554 C LYS A 95 14.833 4.282 -3.107 1.00 0.00 C ATOM 1555 O LYS A 95 15.303 4.094 -1.987 1.00 0.00 O ATOM 1556 CB LYS A 95 15.629 6.566 -3.766 1.00 0.00 C ATOM 1557 CG LYS A 95 16.691 6.911 -2.734 1.00 0.00 C ATOM 1558 CD LYS A 95 17.261 8.302 -2.967 1.00 0.00 C ATOM 1559 CE LYS A 95 16.251 9.384 -2.618 1.00 0.00 C ATOM 1560 NZ LYS A 95 16.234 10.475 -3.630 1.00 0.00 N ATOM 0 H LYS A 95 15.523 4.209 -6.053 1.00 0.00 H new ATOM 0 HA LYS A 95 16.635 4.719 -4.181 1.00 0.00 H new ATOM 0 HB2 LYS A 95 15.797 7.163 -4.662 1.00 0.00 H new ATOM 0 HB3 LYS A 95 14.650 6.846 -3.376 1.00 0.00 H new ATOM 0 HG2 LYS A 95 16.260 6.856 -1.734 1.00 0.00 H new ATOM 0 HG3 LYS A 95 17.494 6.175 -2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 95 18.160 8.434 -2.364 1.00 0.00 H new ATOM 0 HD3 LYS A 95 17.559 8.404 -4.010 1.00 0.00 H new ATOM 0 HE2 LYS A 95 15.257 8.942 -2.544 1.00 0.00 H new ATOM 0 HE3 LYS A 95 16.489 9.801 -1.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 15.533 11.192 -3.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 17.175 10.914 -3.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 15.982 10.082 -4.559 1.00 0.00 H new ATOM 1574 N ILE A 96 13.644 3.810 -3.485 1.00 0.00 N ATOM 1575 CA ILE A 96 12.804 3.030 -2.589 1.00 0.00 C ATOM 1576 C ILE A 96 11.811 2.177 -3.378 1.00 0.00 C ATOM 1577 O ILE A 96 11.189 2.646 -4.330 1.00 0.00 O ATOM 1578 CB ILE A 96 12.015 3.934 -1.627 1.00 0.00 C ATOM 1579 CG1 ILE A 96 12.943 4.923 -0.915 1.00 0.00 C ATOM 1580 CG2 ILE A 96 11.241 3.091 -0.622 1.00 0.00 C ATOM 1581 CD1 ILE A 96 12.249 5.737 0.151 1.00 0.00 C ATOM 0 H ILE A 96 13.244 3.958 -4.411 1.00 0.00 H new ATOM 0 HA ILE A 96 13.469 2.387 -2.013 1.00 0.00 H new ATOM 0 HB ILE A 96 11.300 4.514 -2.211 1.00 0.00 H new ATOM 0 HG12 ILE A 96 13.768 4.374 -0.462 1.00 0.00 H new ATOM 0 HG13 ILE A 96 13.376 5.598 -1.653 1.00 0.00 H new ATOM 0 HG21 ILE A 96 10.688 3.745 0.052 1.00 0.00 H new ATOM 0 HG22 ILE A 96 10.544 2.442 -1.152 1.00 0.00 H new ATOM 0 HG23 ILE A 96 11.937 2.481 -0.046 1.00 0.00 H new ATOM 0 HD11 ILE A 96 12.965 6.416 0.614 1.00 0.00 H new ATOM 0 HD12 ILE A 96 11.441 6.314 -0.300 1.00 0.00 H new ATOM 0 HD13 ILE A 96 11.839 5.070 0.909 1.00 0.00 H new ATOM 1593 N LEU A 97 11.679 0.922 -2.972 1.00 0.00 N ATOM 1594 CA LEU A 97 10.775 -0.023 -3.625 1.00 0.00 C ATOM 1595 C LEU A 97 9.384 0.567 -3.872 1.00 0.00 C ATOM 1596 O LEU A 97 9.037 0.889 -5.008 1.00 0.00 O ATOM 1597 CB LEU A 97 10.667 -1.301 -2.786 1.00 0.00 C ATOM 1598 CG LEU A 97 11.984 -2.066 -2.646 1.00 0.00 C ATOM 1599 CD1 LEU A 97 12.388 -2.221 -1.196 1.00 0.00 C ATOM 1600 CD2 LEU A 97 11.910 -3.425 -3.317 1.00 0.00 C ATOM 0 H LEU A 97 12.192 0.528 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 97 11.198 -0.255 -4.602 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.302 -1.041 -1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.923 -1.958 -3.237 1.00 0.00 H new ATOM 0 HG LEU A 97 12.748 -1.474 -3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 97 13.328 -2.769 -1.137 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.513 -1.236 -0.746 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.614 -2.769 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.862 -3.942 -3.198 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.117 -4.015 -2.857 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.697 -3.296 -4.378 1.00 0.00 H new ATOM 1612 N PHE A 98 8.578 0.686 -2.816 1.00 0.00 N ATOM 1613 CA PHE A 98 7.220 1.214 -2.958 1.00 0.00 C ATOM 1614 C PHE A 98 7.076 2.620 -2.369 1.00 0.00 C ATOM 1615 O PHE A 98 6.128 2.903 -1.639 1.00 0.00 O ATOM 1616 CB PHE A 98 6.210 0.256 -2.310 1.00 0.00 C ATOM 1617 CG PHE A 98 6.146 0.343 -0.809 1.00 0.00 C ATOM 1618 CD1 PHE A 98 7.171 -0.160 -0.025 1.00 0.00 C ATOM 1619 CD2 PHE A 98 5.055 0.929 -0.187 1.00 0.00 C ATOM 1620 CE1 PHE A 98 7.108 -0.081 1.354 1.00 0.00 C ATOM 1621 CE2 PHE A 98 4.987 1.010 1.191 1.00 0.00 C ATOM 1622 CZ PHE A 98 6.015 0.504 1.963 1.00 0.00 C ATOM 0 H PHE A 98 8.837 0.428 -1.864 1.00 0.00 H new ATOM 0 HA PHE A 98 7.012 1.292 -4.025 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.220 0.462 -2.716 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.464 -0.766 -2.592 1.00 0.00 H new ATOM 0 HD1 PHE A 98 8.028 -0.619 -0.496 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.249 1.327 -0.786 1.00 0.00 H new ATOM 0 HE1 PHE A 98 7.913 -0.477 1.955 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.131 1.468 1.664 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.964 0.566 3.040 1.00 0.00 H new ATOM 1632 N LYS A 99 8.005 3.506 -2.708 1.00 0.00 N ATOM 1633 CA LYS A 99 7.953 4.878 -2.224 1.00 0.00 C ATOM 1634 C LYS A 99 6.848 5.648 -2.937 1.00 0.00 C ATOM 1635 O LYS A 99 6.054 6.347 -2.310 1.00 0.00 O ATOM 1636 CB LYS A 99 9.306 5.564 -2.440 1.00 0.00 C ATOM 1637 CG LYS A 99 9.211 7.007 -2.910 1.00 0.00 C ATOM 1638 CD LYS A 99 10.509 7.760 -2.665 1.00 0.00 C ATOM 1639 CE LYS A 99 10.323 9.258 -2.839 1.00 0.00 C ATOM 1640 NZ LYS A 99 10.084 9.944 -1.539 1.00 0.00 N ATOM 0 H LYS A 99 8.799 3.299 -3.313 1.00 0.00 H new ATOM 0 HA LYS A 99 7.733 4.866 -1.156 1.00 0.00 H new ATOM 0 HB2 LYS A 99 9.867 5.535 -1.506 1.00 0.00 H new ATOM 0 HB3 LYS A 99 9.876 4.993 -3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 99 8.971 7.029 -3.973 1.00 0.00 H new ATOM 0 HG3 LYS A 99 8.395 7.507 -2.389 1.00 0.00 H new ATOM 0 HD2 LYS A 99 10.868 7.551 -1.657 1.00 0.00 H new ATOM 0 HD3 LYS A 99 11.274 7.404 -3.356 1.00 0.00 H new ATOM 0 HE2 LYS A 99 11.208 9.681 -3.315 1.00 0.00 H new ATOM 0 HE3 LYS A 99 9.482 9.444 -3.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 9.962 10.964 -1.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 9.225 9.559 -1.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 10.897 9.789 -0.910 1.00 0.00 H new ATOM 1654 N ASP A 100 6.808 5.512 -4.255 1.00 0.00 N ATOM 1655 CA ASP A 100 5.807 6.193 -5.062 1.00 0.00 C ATOM 1656 C ASP A 100 4.404 5.771 -4.645 1.00 0.00 C ATOM 1657 O ASP A 100 3.470 6.568 -4.679 1.00 0.00 O ATOM 1658 CB ASP A 100 6.027 5.897 -6.547 1.00 0.00 C ATOM 1659 CG ASP A 100 7.485 5.996 -6.951 1.00 0.00 C ATOM 1660 OD1 ASP A 100 7.998 7.131 -7.050 1.00 0.00 O ATOM 1661 OD2 ASP A 100 8.115 4.939 -7.167 1.00 0.00 O ATOM 0 H ASP A 100 7.459 4.935 -4.788 1.00 0.00 H new ATOM 0 HA ASP A 100 5.909 7.266 -4.900 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.658 4.896 -6.773 1.00 0.00 H new ATOM 0 HB3 ASP A 100 5.440 6.595 -7.144 1.00 0.00 H new ATOM 1666 N VAL A 101 4.266 4.513 -4.249 1.00 0.00 N ATOM 1667 CA VAL A 101 2.979 3.984 -3.826 1.00 0.00 C ATOM 1668 C VAL A 101 2.601 4.507 -2.458 1.00 0.00 C ATOM 1669 O VAL A 101 1.563 5.142 -2.303 1.00 0.00 O ATOM 1670 CB VAL A 101 2.995 2.456 -3.837 1.00 0.00 C ATOM 1671 CG1 VAL A 101 1.629 1.888 -3.483 1.00 0.00 C ATOM 1672 CG2 VAL A 101 3.439 2.005 -5.208 1.00 0.00 C ATOM 0 H VAL A 101 5.031 3.840 -4.212 1.00 0.00 H new ATOM 0 HA VAL A 101 2.224 4.324 -4.535 1.00 0.00 H new ATOM 0 HB VAL A 101 3.689 2.086 -3.082 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.672 0.799 -3.499 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.342 2.225 -2.487 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.892 2.233 -4.209 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.459 0.916 -5.244 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.742 2.380 -5.958 1.00 0.00 H new ATOM 0 HG23 VAL A 101 4.436 2.394 -5.414 1.00 0.00 H new ATOM 1682 N ASN A 102 3.461 4.292 -1.468 1.00 0.00 N ATOM 1683 CA ASN A 102 3.184 4.819 -0.142 1.00 0.00 C ATOM 1684 C ASN A 102 2.935 6.319 -0.267 1.00 0.00 C ATOM 1685 O ASN A 102 2.234 6.918 0.542 1.00 0.00 O ATOM 1686 CB ASN A 102 4.341 4.524 0.824 1.00 0.00 C ATOM 1687 CG ASN A 102 5.593 5.346 0.560 1.00 0.00 C ATOM 1688 OD1 ASN A 102 5.528 6.474 0.075 1.00 0.00 O ATOM 1689 ND2 ASN A 102 6.746 4.780 0.896 1.00 0.00 N ATOM 0 H ASN A 102 4.333 3.770 -1.556 1.00 0.00 H new ATOM 0 HA ASN A 102 2.300 4.334 0.272 1.00 0.00 H new ATOM 0 HB2 ASN A 102 4.005 4.710 1.844 1.00 0.00 H new ATOM 0 HB3 ASN A 102 4.594 3.466 0.760 1.00 0.00 H new ATOM 0 HD21 ASN A 102 7.622 5.283 0.754 1.00 0.00 H new ATOM 0 HD22 ASN A 102 6.756 3.842 1.296 1.00 0.00 H new ATOM 1696 N ARG A 103 3.503 6.904 -1.326 1.00 0.00 N ATOM 1697 CA ARG A 103 3.339 8.318 -1.614 1.00 0.00 C ATOM 1698 C ARG A 103 1.953 8.577 -2.193 1.00 0.00 C ATOM 1699 O ARG A 103 1.215 9.422 -1.684 1.00 0.00 O ATOM 1700 CB ARG A 103 4.412 8.793 -2.593 1.00 0.00 C ATOM 1701 CG ARG A 103 5.679 9.287 -1.912 1.00 0.00 C ATOM 1702 CD ARG A 103 6.558 10.078 -2.868 1.00 0.00 C ATOM 1703 NE ARG A 103 6.658 9.440 -4.181 1.00 0.00 N ATOM 1704 CZ ARG A 103 5.861 9.721 -5.210 1.00 0.00 C ATOM 1705 NH1 ARG A 103 4.898 10.628 -5.091 1.00 0.00 N ATOM 1706 NH2 ARG A 103 6.027 9.091 -6.365 1.00 0.00 N ATOM 0 H ARG A 103 4.085 6.407 -2.000 1.00 0.00 H new ATOM 0 HA ARG A 103 3.446 8.876 -0.684 1.00 0.00 H new ATOM 0 HB2 ARG A 103 4.666 7.974 -3.266 1.00 0.00 H new ATOM 0 HB3 ARG A 103 4.003 9.595 -3.207 1.00 0.00 H new ATOM 0 HG2 ARG A 103 5.414 9.912 -1.059 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.238 8.436 -1.522 1.00 0.00 H new ATOM 0 HD2 ARG A 103 6.153 11.083 -2.984 1.00 0.00 H new ATOM 0 HD3 ARG A 103 7.555 10.183 -2.440 1.00 0.00 H new ATOM 0 HE ARG A 103 7.384 8.736 -4.317 1.00 0.00 H new ATOM 0 HH11 ARG A 103 4.764 11.116 -4.206 1.00 0.00 H new ATOM 0 HH12 ARG A 103 4.293 10.836 -5.885 1.00 0.00 H new ATOM 0 HH21 ARG A 103 6.764 8.393 -6.464 1.00 0.00 H new ATOM 0 HH22 ARG A 103 5.418 9.305 -7.155 1.00 0.00 H new ATOM 1720 N LYS A 104 1.575 7.829 -3.239 1.00 0.00 N ATOM 1721 CA LYS A 104 0.247 8.005 -3.817 1.00 0.00 C ATOM 1722 C LYS A 104 -0.771 7.376 -2.891 1.00 0.00 C ATOM 1723 O LYS A 104 -1.645 8.048 -2.348 1.00 0.00 O ATOM 1724 CB LYS A 104 0.126 7.348 -5.194 1.00 0.00 C ATOM 1725 CG LYS A 104 1.262 7.657 -6.148 1.00 0.00 C ATOM 1726 CD LYS A 104 1.535 6.471 -7.060 1.00 0.00 C ATOM 1727 CE LYS A 104 3.016 6.325 -7.365 1.00 0.00 C ATOM 1728 NZ LYS A 104 3.296 6.435 -8.824 1.00 0.00 N ATOM 0 H LYS A 104 2.154 7.119 -3.687 1.00 0.00 H new ATOM 0 HA LYS A 104 0.072 9.074 -3.937 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.065 6.268 -5.061 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -0.811 7.666 -5.652 1.00 0.00 H new ATOM 0 HG2 LYS A 104 1.013 8.533 -6.747 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.161 7.903 -5.583 1.00 0.00 H new ATOM 0 HD2 LYS A 104 1.169 5.558 -6.590 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.982 6.593 -7.991 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.574 7.093 -6.829 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.369 5.361 -6.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.317 6.330 -8.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.784 5.687 -9.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.983 7.365 -9.168 1.00 0.00 H new ATOM 1742 N LEU A 105 -0.616 6.069 -2.718 1.00 0.00 N ATOM 1743 CA LEU A 105 -1.476 5.270 -1.863 1.00 0.00 C ATOM 1744 C LEU A 105 -1.809 6.000 -0.558 1.00 0.00 C ATOM 1745 O LEU A 105 -2.898 5.832 -0.008 1.00 0.00 O ATOM 1746 CB LEU A 105 -0.787 3.936 -1.578 1.00 0.00 C ATOM 1747 CG LEU A 105 -1.682 2.860 -0.982 1.00 0.00 C ATOM 1748 CD1 LEU A 105 -1.066 1.481 -1.170 1.00 0.00 C ATOM 1749 CD2 LEU A 105 -1.913 3.150 0.484 1.00 0.00 C ATOM 0 H LEU A 105 0.120 5.531 -3.174 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.421 5.094 -2.377 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -0.362 3.559 -2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.045 4.113 -0.896 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.641 2.868 -1.500 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.723 0.727 -0.736 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.938 1.282 -2.234 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.096 1.445 -0.675 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -2.554 2.379 0.911 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.957 3.158 1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.394 4.122 0.591 1.00 0.00 H new ATOM 1761 N SER A 106 -0.880 6.826 -0.075 1.00 0.00 N ATOM 1762 CA SER A 106 -1.108 7.586 1.153 1.00 0.00 C ATOM 1763 C SER A 106 -2.159 8.659 0.916 1.00 0.00 C ATOM 1764 O SER A 106 -3.202 8.686 1.570 1.00 0.00 O ATOM 1765 CB SER A 106 0.183 8.251 1.635 1.00 0.00 C ATOM 1766 OG SER A 106 0.900 7.409 2.519 1.00 0.00 O ATOM 0 H SER A 106 0.029 6.985 -0.511 1.00 0.00 H new ATOM 0 HA SER A 106 -1.454 6.890 1.917 1.00 0.00 H new ATOM 0 HB2 SER A 106 0.809 8.498 0.777 1.00 0.00 H new ATOM 0 HB3 SER A 106 -0.055 9.189 2.136 1.00 0.00 H new ATOM 0 HG SER A 106 1.267 6.649 2.021 1.00 0.00 H new ATOM 1772 N ASP A 107 -1.867 9.544 -0.028 1.00 0.00 N ATOM 1773 CA ASP A 107 -2.768 10.636 -0.370 1.00 0.00 C ATOM 1774 C ASP A 107 -4.148 10.121 -0.758 1.00 0.00 C ATOM 1775 O ASP A 107 -5.140 10.841 -0.646 1.00 0.00 O ATOM 1776 CB ASP A 107 -2.193 11.438 -1.531 1.00 0.00 C ATOM 1777 CG ASP A 107 -1.175 12.467 -1.078 1.00 0.00 C ATOM 1778 OD1 ASP A 107 -1.474 13.220 -0.128 1.00 0.00 O ATOM 1779 OD2 ASP A 107 -0.079 12.520 -1.675 1.00 0.00 O ATOM 0 H ASP A 107 -1.006 9.526 -0.574 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.869 11.269 0.511 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.725 10.757 -2.242 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -3.004 11.941 -2.058 1.00 0.00 H new ATOM 1784 N VAL A 108 -4.208 8.879 -1.220 1.00 0.00 N ATOM 1785 CA VAL A 108 -5.471 8.291 -1.627 1.00 0.00 C ATOM 1786 C VAL A 108 -6.370 8.075 -0.428 1.00 0.00 C ATOM 1787 O VAL A 108 -7.550 8.425 -0.458 1.00 0.00 O ATOM 1788 CB VAL A 108 -5.277 6.951 -2.351 1.00 0.00 C ATOM 1789 CG1 VAL A 108 -6.462 6.656 -3.246 1.00 0.00 C ATOM 1790 CG2 VAL A 108 -3.994 6.952 -3.156 1.00 0.00 C ATOM 0 H VAL A 108 -3.400 8.265 -1.321 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.935 8.994 -2.319 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.205 6.166 -1.598 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -6.308 5.703 -3.751 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -7.369 6.605 -2.644 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.563 7.448 -3.988 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.880 5.992 -3.659 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -4.031 7.749 -3.899 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.147 7.116 -2.490 1.00 0.00 H new ATOM 1800 N TRP A 109 -5.812 7.511 0.638 1.00 0.00 N ATOM 1801 CA TRP A 109 -6.600 7.283 1.838 1.00 0.00 C ATOM 1802 C TRP A 109 -7.037 8.617 2.427 1.00 0.00 C ATOM 1803 O TRP A 109 -8.076 8.710 3.075 1.00 0.00 O ATOM 1804 CB TRP A 109 -5.844 6.465 2.890 1.00 0.00 C ATOM 1805 CG TRP A 109 -6.666 6.238 4.128 1.00 0.00 C ATOM 1806 CD1 TRP A 109 -6.258 6.354 5.425 1.00 0.00 C ATOM 1807 CD2 TRP A 109 -8.051 5.874 4.173 1.00 0.00 C ATOM 1808 NE1 TRP A 109 -7.308 6.097 6.276 1.00 0.00 N ATOM 1809 CE2 TRP A 109 -8.420 5.796 5.530 1.00 0.00 C ATOM 1810 CE3 TRP A 109 -9.019 5.610 3.198 1.00 0.00 C ATOM 1811 CZ2 TRP A 109 -9.719 5.467 5.931 1.00 0.00 C ATOM 1812 CZ3 TRP A 109 -10.299 5.285 3.597 1.00 0.00 C ATOM 1813 CH2 TRP A 109 -10.639 5.217 4.950 1.00 0.00 C ATOM 0 H TRP A 109 -4.839 7.210 0.694 1.00 0.00 H new ATOM 0 HA TRP A 109 -7.474 6.700 1.548 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -5.558 5.503 2.464 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.922 6.982 3.157 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -5.257 6.610 5.738 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -7.267 6.125 7.295 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -8.768 5.660 2.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -9.986 5.412 6.976 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -11.051 5.080 2.850 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -11.651 4.961 5.228 1.00 0.00 H new ATOM 1824 N LYS A 110 -6.247 9.655 2.178 1.00 0.00 N ATOM 1825 CA LYS A 110 -6.571 10.986 2.666 1.00 0.00 C ATOM 1826 C LYS A 110 -7.785 11.523 1.920 1.00 0.00 C ATOM 1827 O LYS A 110 -8.712 12.055 2.525 1.00 0.00 O ATOM 1828 CB LYS A 110 -5.381 11.927 2.478 1.00 0.00 C ATOM 1829 CG LYS A 110 -4.096 11.423 3.114 1.00 0.00 C ATOM 1830 CD LYS A 110 -3.078 12.540 3.275 1.00 0.00 C ATOM 1831 CE LYS A 110 -2.100 12.246 4.401 1.00 0.00 C ATOM 1832 NZ LYS A 110 -0.735 12.760 4.101 1.00 0.00 N ATOM 0 H LYS A 110 -5.381 9.599 1.643 1.00 0.00 H new ATOM 0 HA LYS A 110 -6.800 10.927 3.730 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.213 12.077 1.412 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.628 12.900 2.902 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -4.318 10.988 4.089 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -3.672 10.629 2.500 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -2.531 12.672 2.342 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.595 13.478 3.477 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -2.463 12.698 5.324 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.054 11.170 4.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.099 12.539 4.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.377 12.310 3.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -0.774 13.790 3.965 1.00 0.00 H new ATOM 1846 N GLU A 111 -7.769 11.360 0.599 1.00 0.00 N ATOM 1847 CA GLU A 111 -8.864 11.810 -0.254 1.00 0.00 C ATOM 1848 C GLU A 111 -10.050 10.855 -0.173 1.00 0.00 C ATOM 1849 O GLU A 111 -11.192 11.225 -0.450 1.00 0.00 O ATOM 1850 CB GLU A 111 -8.380 11.889 -1.700 1.00 0.00 C ATOM 1851 CG GLU A 111 -8.439 13.289 -2.287 1.00 0.00 C ATOM 1852 CD GLU A 111 -7.418 13.502 -3.389 1.00 0.00 C ATOM 1853 OE1 GLU A 111 -6.435 12.735 -3.443 1.00 0.00 O ATOM 1854 OE2 GLU A 111 -7.603 14.437 -4.195 1.00 0.00 O ATOM 0 H GLU A 111 -7.002 10.916 0.094 1.00 0.00 H new ATOM 0 HA GLU A 111 -9.186 12.793 0.090 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.353 11.526 -1.751 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -8.985 11.221 -2.314 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.438 13.472 -2.682 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.271 14.019 -1.495 1.00 0.00 H new ATOM 1861 N LEU A 112 -9.755 9.623 0.199 1.00 0.00 N ATOM 1862 CA LEU A 112 -10.766 8.579 0.309 1.00 0.00 C ATOM 1863 C LEU A 112 -11.414 8.588 1.687 1.00 0.00 C ATOM 1864 O LEU A 112 -12.637 8.530 1.810 1.00 0.00 O ATOM 1865 CB LEU A 112 -10.130 7.213 0.023 1.00 0.00 C ATOM 1866 CG LEU A 112 -11.094 6.024 0.016 1.00 0.00 C ATOM 1867 CD1 LEU A 112 -12.305 6.304 -0.850 1.00 0.00 C ATOM 1868 CD2 LEU A 112 -10.392 4.779 -0.485 1.00 0.00 C ATOM 0 H LEU A 112 -8.811 9.315 0.434 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.547 8.772 -0.426 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.632 7.260 -0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.358 7.028 0.770 1.00 0.00 H new ATOM 0 HG LEU A 112 -11.429 5.865 1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -12.971 5.441 -0.835 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -12.833 7.177 -0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.984 6.496 -1.874 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.090 3.942 -0.484 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.030 4.949 -1.499 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.549 4.549 0.167 1.00 0.00 H new ATOM 1880 N SER A 113 -10.588 8.673 2.722 1.00 0.00 N ATOM 1881 CA SER A 113 -11.085 8.705 4.092 1.00 0.00 C ATOM 1882 C SER A 113 -11.901 9.967 4.319 1.00 0.00 C ATOM 1883 O SER A 113 -12.957 9.934 4.953 1.00 0.00 O ATOM 1884 CB SER A 113 -9.926 8.653 5.090 1.00 0.00 C ATOM 1885 OG SER A 113 -9.321 9.926 5.236 1.00 0.00 O ATOM 0 H SER A 113 -9.572 8.721 2.639 1.00 0.00 H new ATOM 0 HA SER A 113 -11.718 7.832 4.248 1.00 0.00 H new ATOM 0 HB2 SER A 113 -10.290 8.307 6.057 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.183 7.930 4.752 1.00 0.00 H new ATOM 0 HG SER A 113 -8.643 10.048 4.539 1.00 0.00 H new ATOM 1891 N LEU A 114 -11.406 11.078 3.789 1.00 0.00 N ATOM 1892 CA LEU A 114 -12.085 12.355 3.923 1.00 0.00 C ATOM 1893 C LEU A 114 -13.435 12.312 3.216 1.00 0.00 C ATOM 1894 O LEU A 114 -14.440 12.782 3.749 1.00 0.00 O ATOM 1895 CB LEU A 114 -11.210 13.483 3.363 1.00 0.00 C ATOM 1896 CG LEU A 114 -11.385 13.789 1.872 1.00 0.00 C ATOM 1897 CD1 LEU A 114 -12.598 14.678 1.642 1.00 0.00 C ATOM 1898 CD2 LEU A 114 -10.129 14.439 1.317 1.00 0.00 C ATOM 0 H LEU A 114 -10.534 11.118 3.261 1.00 0.00 H new ATOM 0 HA LEU A 114 -12.260 12.552 4.981 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -11.418 14.392 3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -10.165 13.229 3.542 1.00 0.00 H new ATOM 0 HG LEU A 114 -11.551 12.850 1.344 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -12.703 14.882 0.576 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -13.493 14.173 2.004 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -12.468 15.617 2.180 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -10.267 14.651 0.257 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -9.934 15.369 1.851 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -9.283 13.764 1.445 1.00 0.00 H new ATOM 1910 N LEU A 115 -13.451 11.735 2.018 1.00 0.00 N ATOM 1911 CA LEU A 115 -14.680 11.623 1.247 1.00 0.00 C ATOM 1912 C LEU A 115 -15.671 10.719 1.966 1.00 0.00 C ATOM 1913 O LEU A 115 -16.870 10.997 2.000 1.00 0.00 O ATOM 1914 CB LEU A 115 -14.382 11.079 -0.152 1.00 0.00 C ATOM 1915 CG LEU A 115 -13.876 12.122 -1.151 1.00 0.00 C ATOM 1916 CD1 LEU A 115 -13.513 11.469 -2.477 1.00 0.00 C ATOM 1917 CD2 LEU A 115 -14.921 13.210 -1.355 1.00 0.00 C ATOM 0 H LEU A 115 -12.628 11.340 1.563 1.00 0.00 H new ATOM 0 HA LEU A 115 -15.121 12.615 1.147 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.639 10.286 -0.068 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -15.289 10.624 -0.551 1.00 0.00 H new ATOM 0 HG LEU A 115 -12.975 12.580 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -13.156 12.230 -3.171 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.730 10.729 -2.316 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -14.393 10.981 -2.895 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -14.547 13.945 -2.068 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.839 12.765 -1.740 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -15.127 13.700 -0.403 1.00 0.00 H new ATOM 1929 N LEU A 116 -15.161 9.641 2.551 1.00 0.00 N ATOM 1930 CA LEU A 116 -16.000 8.704 3.282 1.00 0.00 C ATOM 1931 C LEU A 116 -16.614 9.380 4.499 1.00 0.00 C ATOM 1932 O LEU A 116 -17.795 9.198 4.795 1.00 0.00 O ATOM 1933 CB LEU A 116 -15.187 7.483 3.707 1.00 0.00 C ATOM 1934 CG LEU A 116 -15.094 6.385 2.651 1.00 0.00 C ATOM 1935 CD1 LEU A 116 -14.117 5.302 3.085 1.00 0.00 C ATOM 1936 CD2 LEU A 116 -16.470 5.795 2.387 1.00 0.00 C ATOM 0 H LEU A 116 -14.171 9.396 2.532 1.00 0.00 H new ATOM 0 HA LEU A 116 -16.805 8.374 2.625 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -14.179 7.806 3.967 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -15.630 7.064 4.610 1.00 0.00 H new ATOM 0 HG LEU A 116 -14.721 6.823 1.725 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -14.066 4.529 2.318 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -13.128 5.739 3.226 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -14.456 4.861 4.022 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.392 5.013 1.632 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.867 5.371 3.309 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.139 6.578 2.030 1.00 0.00 H new ATOM 1948 N GLN A 117 -15.810 10.179 5.193 1.00 0.00 N ATOM 1949 CA GLN A 117 -16.282 10.902 6.365 1.00 0.00 C ATOM 1950 C GLN A 117 -17.458 11.803 5.994 1.00 0.00 C ATOM 1951 O GLN A 117 -18.254 12.186 6.848 1.00 0.00 O ATOM 1952 CB GLN A 117 -15.151 11.740 6.967 1.00 0.00 C ATOM 1953 CG GLN A 117 -14.334 10.999 8.011 1.00 0.00 C ATOM 1954 CD GLN A 117 -12.924 11.542 8.139 1.00 0.00 C ATOM 1955 OE1 GLN A 117 -12.667 12.454 8.925 1.00 0.00 O ATOM 1956 NE2 GLN A 117 -12.001 10.982 7.366 1.00 0.00 N ATOM 0 H GLN A 117 -14.830 10.341 4.963 1.00 0.00 H new ATOM 0 HA GLN A 117 -16.614 10.176 7.107 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -14.489 12.070 6.166 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -15.575 12.636 7.419 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -14.835 11.068 8.976 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -14.290 9.942 7.750 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -12.258 10.228 6.729 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -11.035 11.305 7.410 1.00 0.00 H new ATOM 1965 N VAL A 118 -17.553 12.140 4.710 1.00 0.00 N ATOM 1966 CA VAL A 118 -18.627 12.993 4.216 1.00 0.00 C ATOM 1967 C VAL A 118 -19.828 12.176 3.758 1.00 0.00 C ATOM 1968 O VAL A 118 -20.946 12.359 4.241 1.00 0.00 O ATOM 1969 CB VAL A 118 -18.155 13.850 3.027 1.00 0.00 C ATOM 1970 CG1 VAL A 118 -19.134 14.981 2.763 1.00 0.00 C ATOM 1971 CG2 VAL A 118 -16.753 14.383 3.267 1.00 0.00 C ATOM 0 H VAL A 118 -16.896 11.833 3.992 1.00 0.00 H new ATOM 0 HA VAL A 118 -18.916 13.634 5.049 1.00 0.00 H new ATOM 0 HB VAL A 118 -18.122 13.218 2.140 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -18.784 15.576 1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -20.115 14.566 2.532 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -19.206 15.614 3.648 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -16.442 14.985 2.413 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -16.747 14.998 4.167 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -16.063 13.549 3.393 1.00 0.00 H new ATOM 1981 N GLU A 119 -19.584 11.295 2.795 1.00 0.00 N ATOM 1982 CA GLU A 119 -20.636 10.459 2.221 1.00 0.00 C ATOM 1983 C GLU A 119 -21.236 9.486 3.235 1.00 0.00 C ATOM 1984 O GLU A 119 -22.456 9.359 3.331 1.00 0.00 O ATOM 1985 CB GLU A 119 -20.090 9.680 1.024 1.00 0.00 C ATOM 1986 CG GLU A 119 -19.253 10.527 0.077 1.00 0.00 C ATOM 1987 CD GLU A 119 -19.894 10.684 -1.288 1.00 0.00 C ATOM 1988 OE1 GLU A 119 -20.319 9.662 -1.866 1.00 0.00 O ATOM 1989 OE2 GLU A 119 -19.971 11.830 -1.779 1.00 0.00 O ATOM 0 H GLU A 119 -18.660 11.139 2.392 1.00 0.00 H new ATOM 0 HA GLU A 119 -21.434 11.129 1.902 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -19.484 8.850 1.387 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -20.924 9.248 0.471 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -19.099 11.512 0.517 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.269 10.072 -0.038 1.00 0.00 H new ATOM 1996 N GLN A 120 -20.386 8.781 3.974 1.00 0.00 N ATOM 1997 CA GLN A 120 -20.865 7.806 4.952 1.00 0.00 C ATOM 1998 C GLN A 120 -20.872 8.365 6.373 1.00 0.00 C ATOM 1999 O GLN A 120 -21.407 7.736 7.286 1.00 0.00 O ATOM 2000 CB GLN A 120 -20.013 6.536 4.898 1.00 0.00 C ATOM 2001 CG GLN A 120 -20.824 5.260 5.054 1.00 0.00 C ATOM 2002 CD GLN A 120 -20.002 4.010 4.808 1.00 0.00 C ATOM 2003 OE1 GLN A 120 -19.972 3.100 5.636 1.00 0.00 O ATOM 2004 NE2 GLN A 120 -19.330 3.960 3.664 1.00 0.00 N ATOM 0 H GLN A 120 -19.371 8.864 3.917 1.00 0.00 H new ATOM 0 HA GLN A 120 -21.895 7.568 4.687 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -19.479 6.505 3.948 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -19.260 6.578 5.685 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -21.244 5.222 6.059 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -21.663 5.281 4.359 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -19.384 4.738 3.006 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -18.760 3.144 3.443 1.00 0.00 H new ATOM 2013 N ARG A 121 -20.283 9.540 6.564 1.00 0.00 N ATOM 2014 CA ARG A 121 -20.238 10.154 7.886 1.00 0.00 C ATOM 2015 C ARG A 121 -19.509 9.259 8.883 1.00 0.00 C ATOM 2016 O ARG A 121 -19.685 9.394 10.094 1.00 0.00 O ATOM 2017 CB ARG A 121 -21.656 10.439 8.384 1.00 0.00 C ATOM 2018 CG ARG A 121 -22.219 11.758 7.883 1.00 0.00 C ATOM 2019 CD ARG A 121 -21.645 12.936 8.655 1.00 0.00 C ATOM 2020 NE ARG A 121 -22.490 14.124 8.550 1.00 0.00 N ATOM 2021 CZ ARG A 121 -23.635 14.280 9.209 1.00 0.00 C ATOM 2022 NH1 ARG A 121 -24.078 13.326 10.020 1.00 0.00 N ATOM 2023 NH2 ARG A 121 -24.340 15.392 9.058 1.00 0.00 N ATOM 0 H ARG A 121 -19.833 10.083 5.827 1.00 0.00 H new ATOM 0 HA ARG A 121 -19.690 11.092 7.803 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -22.313 9.629 8.068 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -21.656 10.443 9.474 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -21.994 11.872 6.823 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -23.305 11.752 7.980 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -21.534 12.662 9.704 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -20.648 13.166 8.278 1.00 0.00 H new ATOM 0 HE ARG A 121 -22.184 14.878 7.935 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -23.540 12.468 10.140 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -24.957 13.451 10.523 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -24.005 16.128 8.437 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -25.218 15.512 9.563 1.00 0.00 H new ATOM 2037 N MET A 122 -18.686 8.345 8.372 1.00 0.00 N ATOM 2038 CA MET A 122 -17.934 7.437 9.227 1.00 0.00 C ATOM 2039 C MET A 122 -16.709 8.141 9.813 1.00 0.00 C ATOM 2040 O MET A 122 -15.822 8.572 9.078 1.00 0.00 O ATOM 2041 CB MET A 122 -17.516 6.188 8.441 1.00 0.00 C ATOM 2042 CG MET A 122 -16.419 6.431 7.410 1.00 0.00 C ATOM 2043 SD MET A 122 -14.882 5.578 7.818 1.00 0.00 S ATOM 2044 CE MET A 122 -13.848 6.034 6.427 1.00 0.00 C ATOM 0 H MET A 122 -18.525 8.216 7.373 1.00 0.00 H new ATOM 0 HA MET A 122 -18.575 7.127 10.052 1.00 0.00 H new ATOM 0 HB2 MET A 122 -17.175 5.428 9.144 1.00 0.00 H new ATOM 0 HB3 MET A 122 -18.392 5.783 7.934 1.00 0.00 H new ATOM 0 HG2 MET A 122 -16.765 6.099 6.431 1.00 0.00 H new ATOM 0 HG3 MET A 122 -16.227 7.501 7.334 1.00 0.00 H new ATOM 0 HE1 MET A 122 -12.799 5.913 6.698 1.00 0.00 H new ATOM 0 HE2 MET A 122 -14.079 5.393 5.576 1.00 0.00 H new ATOM 0 HE3 MET A 122 -14.036 7.074 6.160 1.00 0.00 H new ATOM 2054 N PRO A 123 -16.644 8.283 11.149 1.00 0.00 N ATOM 2055 CA PRO A 123 -15.520 8.951 11.812 1.00 0.00 C ATOM 2056 C PRO A 123 -14.197 8.234 11.581 1.00 0.00 C ATOM 2057 O PRO A 123 -14.075 7.034 11.825 1.00 0.00 O ATOM 2058 CB PRO A 123 -15.892 8.921 13.300 1.00 0.00 C ATOM 2059 CG PRO A 123 -17.359 8.654 13.332 1.00 0.00 C ATOM 2060 CD PRO A 123 -17.654 7.824 12.116 1.00 0.00 C ATOM 0 HA PRO A 123 -15.371 9.958 11.422 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -15.339 8.144 13.828 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -15.654 9.868 13.785 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -17.640 8.125 14.243 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -17.926 9.585 13.316 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -17.560 6.758 12.322 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -18.667 7.990 11.750 1.00 0.00 H new ATOM 2068 N VAL A 124 -13.210 8.983 11.104 1.00 0.00 N ATOM 2069 CA VAL A 124 -11.891 8.428 10.834 1.00 0.00 C ATOM 2070 C VAL A 124 -10.807 9.214 11.553 1.00 0.00 C ATOM 2071 O VAL A 124 -11.003 10.373 11.919 1.00 0.00 O ATOM 2072 CB VAL A 124 -11.580 8.427 9.327 1.00 0.00 C ATOM 2073 CG1 VAL A 124 -10.340 7.595 9.037 1.00 0.00 C ATOM 2074 CG2 VAL A 124 -12.771 7.916 8.537 1.00 0.00 C ATOM 0 H VAL A 124 -13.299 9.978 10.896 1.00 0.00 H new ATOM 0 HA VAL A 124 -11.902 7.402 11.201 1.00 0.00 H new ATOM 0 HB VAL A 124 -11.381 9.452 9.016 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -10.136 7.606 7.966 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -9.488 8.013 9.573 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -10.506 6.568 9.364 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -12.532 7.923 7.474 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -13.006 6.899 8.850 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -13.632 8.559 8.720 1.00 0.00 H new ATOM 2084 N SER A 125 -9.656 8.581 11.741 1.00 0.00 N ATOM 2085 CA SER A 125 -8.532 9.228 12.406 1.00 0.00 C ATOM 2086 C SER A 125 -7.426 9.520 11.398 1.00 0.00 C ATOM 2087 O SER A 125 -7.535 9.143 10.232 1.00 0.00 O ATOM 2088 CB SER A 125 -7.998 8.345 13.535 1.00 0.00 C ATOM 2089 OG SER A 125 -8.377 8.853 14.803 1.00 0.00 O ATOM 0 H SER A 125 -9.476 7.622 11.443 1.00 0.00 H new ATOM 0 HA SER A 125 -8.876 10.169 12.836 1.00 0.00 H new ATOM 0 HB2 SER A 125 -8.378 7.330 13.418 1.00 0.00 H new ATOM 0 HB3 SER A 125 -6.911 8.287 13.473 1.00 0.00 H new ATOM 0 HG SER A 125 -8.025 8.270 15.508 1.00 0.00 H new ATOM 2095 N PRO A 126 -6.343 10.194 11.829 1.00 0.00 N ATOM 2096 CA PRO A 126 -5.219 10.519 10.946 1.00 0.00 C ATOM 2097 C PRO A 126 -4.548 9.255 10.423 1.00 0.00 C ATOM 2098 O PRO A 126 -3.418 8.934 10.791 1.00 0.00 O ATOM 2099 CB PRO A 126 -4.259 11.311 11.845 1.00 0.00 C ATOM 2100 CG PRO A 126 -5.082 11.746 13.010 1.00 0.00 C ATOM 2101 CD PRO A 126 -6.127 10.683 13.198 1.00 0.00 C ATOM 0 HA PRO A 126 -5.531 11.078 10.064 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -3.420 10.694 12.165 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -3.841 12.168 11.316 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -4.468 11.852 13.904 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -5.542 12.716 12.823 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -5.782 9.890 13.861 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -7.041 11.087 13.632 1.00 0.00 H new ATOM 2109 N ILE A 127 -5.271 8.532 9.578 1.00 0.00 N ATOM 2110 CA ILE A 127 -4.779 7.288 9.013 1.00 0.00 C ATOM 2111 C ILE A 127 -4.414 6.298 10.112 1.00 0.00 C ATOM 2112 O ILE A 127 -3.236 6.030 10.347 1.00 0.00 O ATOM 2113 CB ILE A 127 -3.547 7.497 8.109 1.00 0.00 C ATOM 2114 CG1 ILE A 127 -3.805 8.604 7.086 1.00 0.00 C ATOM 2115 CG2 ILE A 127 -3.190 6.192 7.406 1.00 0.00 C ATOM 2116 CD1 ILE A 127 -2.653 8.816 6.125 1.00 0.00 C ATOM 0 H ILE A 127 -6.208 8.791 9.268 1.00 0.00 H new ATOM 0 HA ILE A 127 -5.591 6.891 8.404 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.707 7.803 8.732 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.703 8.361 6.517 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -4.005 9.537 7.614 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -2.319 6.348 6.770 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -2.964 5.428 8.150 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -4.032 5.866 6.795 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -2.904 9.615 5.427 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -1.758 9.090 6.684 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.467 7.896 5.571 1.00 0.00 H new ATOM 2128 N SER A 128 -5.426 5.744 10.774 1.00 0.00 N ATOM 2129 CA SER A 128 -5.196 4.763 11.830 1.00 0.00 C ATOM 2130 C SER A 128 -4.726 3.458 11.203 1.00 0.00 C ATOM 2131 O SER A 128 -5.362 2.413 11.345 1.00 0.00 O ATOM 2132 CB SER A 128 -6.472 4.535 12.642 1.00 0.00 C ATOM 2133 OG SER A 128 -6.170 4.138 13.969 1.00 0.00 O ATOM 0 H SER A 128 -6.408 5.956 10.599 1.00 0.00 H new ATOM 0 HA SER A 128 -4.430 5.138 12.508 1.00 0.00 H new ATOM 0 HB2 SER A 128 -7.064 5.450 12.659 1.00 0.00 H new ATOM 0 HB3 SER A 128 -7.081 3.770 12.160 1.00 0.00 H new ATOM 0 HG SER A 128 -7.003 4.000 14.467 1.00 0.00 H new ATOM 2139 N GLN A 129 -3.618 3.546 10.479 1.00 0.00 N ATOM 2140 CA GLN A 129 -3.050 2.407 9.778 1.00 0.00 C ATOM 2141 C GLN A 129 -1.536 2.562 9.662 1.00 0.00 C ATOM 2142 O GLN A 129 -0.912 2.004 8.760 1.00 0.00 O ATOM 2143 CB GLN A 129 -3.676 2.292 8.379 1.00 0.00 C ATOM 2144 CG GLN A 129 -4.707 3.373 8.064 1.00 0.00 C ATOM 2145 CD GLN A 129 -6.135 2.894 8.238 1.00 0.00 C ATOM 2146 OE1 GLN A 129 -6.443 2.144 9.163 1.00 0.00 O ATOM 2147 NE2 GLN A 129 -7.016 3.326 7.342 1.00 0.00 N ATOM 0 H GLN A 129 -3.089 4.410 10.362 1.00 0.00 H new ATOM 0 HA GLN A 129 -3.267 1.500 10.342 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -2.882 2.335 7.633 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -4.150 1.315 8.284 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -4.535 4.232 8.713 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -4.566 3.715 7.039 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -6.716 3.948 6.591 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -7.992 3.036 7.405 1.00 0.00 H new ATOM 2156 N GLY A 130 -0.951 3.341 10.574 1.00 0.00 N ATOM 2157 CA GLY A 130 0.481 3.571 10.543 1.00 0.00 C ATOM 2158 C GLY A 130 0.916 4.211 9.243 1.00 0.00 C ATOM 2159 O GLY A 130 1.474 3.545 8.379 1.00 0.00 O ATOM 0 H GLY A 130 -1.445 3.814 11.331 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.765 4.212 11.377 1.00 0.00 H new ATOM 0 HA3 GLY A 130 1.005 2.624 10.676 1.00 0.00 H new ATOM 2163 N ALA A 131 0.642 5.506 9.099 1.00 0.00 N ATOM 2164 CA ALA A 131 0.986 6.242 7.883 1.00 0.00 C ATOM 2165 C ALA A 131 2.474 6.582 7.793 1.00 0.00 C ATOM 2166 O ALA A 131 2.861 7.491 7.059 1.00 0.00 O ATOM 2167 CB ALA A 131 0.156 7.514 7.794 1.00 0.00 C ATOM 0 H ALA A 131 0.181 6.070 9.813 1.00 0.00 H new ATOM 0 HA ALA A 131 0.759 5.588 7.041 1.00 0.00 H new ATOM 0 HB1 ALA A 131 0.418 8.057 6.886 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -0.903 7.257 7.770 1.00 0.00 H new ATOM 0 HB3 ALA A 131 0.357 8.141 8.662 1.00 0.00 H new ATOM 2173 N SER A 132 3.309 5.856 8.527 1.00 0.00 N ATOM 2174 CA SER A 132 4.747 6.099 8.504 1.00 0.00 C ATOM 2175 C SER A 132 5.440 5.238 7.449 1.00 0.00 C ATOM 2176 O SER A 132 6.660 5.081 7.474 1.00 0.00 O ATOM 2177 CB SER A 132 5.351 5.805 9.872 1.00 0.00 C ATOM 2178 OG SER A 132 4.975 6.787 10.822 1.00 0.00 O ATOM 0 H SER A 132 3.017 5.097 9.143 1.00 0.00 H new ATOM 0 HA SER A 132 4.902 7.148 8.251 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.024 4.822 10.213 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.438 5.770 9.792 1.00 0.00 H new ATOM 0 HG SER A 132 5.375 6.572 11.690 1.00 0.00 H new ATOM 2184 N TRP A 133 4.657 4.678 6.531 1.00 0.00 N ATOM 2185 CA TRP A 133 5.202 3.825 5.471 1.00 0.00 C ATOM 2186 C TRP A 133 6.452 4.441 4.850 1.00 0.00 C ATOM 2187 O TRP A 133 7.484 3.787 4.727 1.00 0.00 O ATOM 2188 CB TRP A 133 4.178 3.593 4.354 1.00 0.00 C ATOM 2189 CG TRP A 133 2.755 3.481 4.809 1.00 0.00 C ATOM 2190 CD1 TRP A 133 2.297 2.921 5.962 1.00 0.00 C ATOM 2191 CD2 TRP A 133 1.599 3.933 4.096 1.00 0.00 C ATOM 2192 NE1 TRP A 133 0.925 3.005 6.014 1.00 0.00 N ATOM 2193 CE2 TRP A 133 0.474 3.619 4.879 1.00 0.00 C ATOM 2194 CE3 TRP A 133 1.408 4.574 2.871 1.00 0.00 C ATOM 2195 CZ2 TRP A 133 -0.823 3.925 4.476 1.00 0.00 C ATOM 2196 CZ3 TRP A 133 0.122 4.876 2.472 1.00 0.00 C ATOM 2197 CH2 TRP A 133 -0.980 4.551 3.271 1.00 0.00 C ATOM 0 H TRP A 133 3.645 4.797 6.497 1.00 0.00 H new ATOM 0 HA TRP A 133 5.453 2.874 5.941 1.00 0.00 H new ATOM 0 HB2 TRP A 133 4.251 4.413 3.639 1.00 0.00 H new ATOM 0 HB3 TRP A 133 4.446 2.681 3.821 1.00 0.00 H new ATOM 0 HD1 TRP A 133 2.919 2.476 6.724 1.00 0.00 H new ATOM 0 HE1 TRP A 133 0.339 2.664 6.776 1.00 0.00 H new ATOM 0 HE3 TRP A 133 2.251 4.829 2.247 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -1.674 3.677 5.093 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -0.037 5.372 1.526 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -1.974 4.800 2.929 1.00 0.00 H new ATOM 2208 N ALA A 134 6.336 5.701 4.445 1.00 0.00 N ATOM 2209 CA ALA A 134 7.440 6.415 3.814 1.00 0.00 C ATOM 2210 C ALA A 134 8.674 6.448 4.707 1.00 0.00 C ATOM 2211 O ALA A 134 9.788 6.200 4.248 1.00 0.00 O ATOM 2212 CB ALA A 134 7.005 7.826 3.451 1.00 0.00 C ATOM 0 H ALA A 134 5.483 6.252 4.543 1.00 0.00 H new ATOM 0 HA ALA A 134 7.712 5.879 2.905 1.00 0.00 H new ATOM 0 HB1 ALA A 134 7.835 8.353 2.980 1.00 0.00 H new ATOM 0 HB2 ALA A 134 6.164 7.781 2.759 1.00 0.00 H new ATOM 0 HB3 ALA A 134 6.703 8.357 4.354 1.00 0.00 H new ATOM 2218 N GLN A 135 8.470 6.759 5.979 1.00 0.00 N ATOM 2219 CA GLN A 135 9.572 6.829 6.932 1.00 0.00 C ATOM 2220 C GLN A 135 10.327 5.503 6.992 1.00 0.00 C ATOM 2221 O GLN A 135 11.556 5.477 7.074 1.00 0.00 O ATOM 2222 CB GLN A 135 9.049 7.194 8.322 1.00 0.00 C ATOM 2223 CG GLN A 135 8.393 8.563 8.385 1.00 0.00 C ATOM 2224 CD GLN A 135 9.289 9.663 7.848 1.00 0.00 C ATOM 2225 OE1 GLN A 135 8.955 10.326 6.865 1.00 0.00 O ATOM 2226 NE2 GLN A 135 10.433 9.861 8.491 1.00 0.00 N ATOM 0 H GLN A 135 7.554 6.967 6.376 1.00 0.00 H new ATOM 0 HA GLN A 135 10.261 7.603 6.595 1.00 0.00 H new ATOM 0 HB2 GLN A 135 8.329 6.440 8.639 1.00 0.00 H new ATOM 0 HB3 GLN A 135 9.876 7.164 9.032 1.00 0.00 H new ATOM 0 HG2 GLN A 135 7.465 8.544 7.814 1.00 0.00 H new ATOM 0 HG3 GLN A 135 8.127 8.788 9.418 1.00 0.00 H new ATOM 0 HE21 GLN A 135 10.669 9.288 9.301 1.00 0.00 H new ATOM 0 HE22 GLN A 135 11.077 10.587 8.175 1.00 0.00 H new ATOM 2235 N GLU A 136 9.582 4.405 6.955 1.00 0.00 N ATOM 2236 CA GLU A 136 10.176 3.074 7.012 1.00 0.00 C ATOM 2237 C GLU A 136 10.629 2.608 5.632 1.00 0.00 C ATOM 2238 O GLU A 136 11.595 1.855 5.509 1.00 0.00 O ATOM 2239 CB GLU A 136 9.175 2.075 7.588 1.00 0.00 C ATOM 2240 CG GLU A 136 8.862 2.304 9.058 1.00 0.00 C ATOM 2241 CD GLU A 136 9.639 1.378 9.971 1.00 0.00 C ATOM 2242 OE1 GLU A 136 9.372 0.158 9.947 1.00 0.00 O ATOM 2243 OE2 GLU A 136 10.517 1.872 10.710 1.00 0.00 O ATOM 0 H GLU A 136 8.564 4.410 6.886 1.00 0.00 H new ATOM 0 HA GLU A 136 11.051 3.128 7.660 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.249 2.130 7.015 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.568 1.066 7.462 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.089 3.338 9.317 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.794 2.161 9.225 1.00 0.00 H new ATOM 2250 N ASP A 137 9.925 3.051 4.596 1.00 0.00 N ATOM 2251 CA ASP A 137 10.259 2.666 3.231 1.00 0.00 C ATOM 2252 C ASP A 137 11.668 3.110 2.871 1.00 0.00 C ATOM 2253 O ASP A 137 12.452 2.337 2.322 1.00 0.00 O ATOM 2254 CB ASP A 137 9.259 3.262 2.241 1.00 0.00 C ATOM 2255 CG ASP A 137 8.919 2.303 1.115 1.00 0.00 C ATOM 2256 OD1 ASP A 137 9.539 1.221 1.046 1.00 0.00 O ATOM 2257 OD2 ASP A 137 8.030 2.635 0.302 1.00 0.00 O ATOM 0 H ASP A 137 9.122 3.675 4.676 1.00 0.00 H new ATOM 0 HA ASP A 137 10.210 1.579 3.171 1.00 0.00 H new ATOM 0 HB2 ASP A 137 8.346 3.535 2.770 1.00 0.00 H new ATOM 0 HB3 ASP A 137 9.670 4.180 1.821 1.00 0.00 H new ATOM 2262 N GLN A 138 11.988 4.360 3.183 1.00 0.00 N ATOM 2263 CA GLN A 138 13.308 4.891 2.886 1.00 0.00 C ATOM 2264 C GLN A 138 14.335 4.337 3.867 1.00 0.00 C ATOM 2265 O GLN A 138 15.482 4.082 3.501 1.00 0.00 O ATOM 2266 CB GLN A 138 13.298 6.423 2.900 1.00 0.00 C ATOM 2267 CG GLN A 138 13.392 7.039 4.285 1.00 0.00 C ATOM 2268 CD GLN A 138 14.725 7.721 4.538 1.00 0.00 C ATOM 2269 OE1 GLN A 138 14.791 8.738 5.229 1.00 0.00 O ATOM 2270 NE2 GLN A 138 15.797 7.168 3.977 1.00 0.00 N ATOM 0 H GLN A 138 11.356 5.019 3.638 1.00 0.00 H new ATOM 0 HA GLN A 138 13.590 4.573 1.882 1.00 0.00 H new ATOM 0 HB2 GLN A 138 14.131 6.785 2.297 1.00 0.00 H new ATOM 0 HB3 GLN A 138 12.383 6.773 2.422 1.00 0.00 H new ATOM 0 HG2 GLN A 138 12.589 7.765 4.410 1.00 0.00 H new ATOM 0 HG3 GLN A 138 13.239 6.262 5.034 1.00 0.00 H new ATOM 0 HE21 GLN A 138 15.699 6.325 3.411 1.00 0.00 H new ATOM 0 HE22 GLN A 138 16.717 7.587 4.112 1.00 0.00 H new ATOM 2279 N GLN A 139 13.909 4.130 5.110 1.00 0.00 N ATOM 2280 CA GLN A 139 14.791 3.580 6.127 1.00 0.00 C ATOM 2281 C GLN A 139 15.179 2.163 5.740 1.00 0.00 C ATOM 2282 O GLN A 139 16.320 1.739 5.926 1.00 0.00 O ATOM 2283 CB GLN A 139 14.105 3.586 7.495 1.00 0.00 C ATOM 2284 CG GLN A 139 14.335 4.865 8.285 1.00 0.00 C ATOM 2285 CD GLN A 139 14.936 4.608 9.653 1.00 0.00 C ATOM 2286 OE1 GLN A 139 14.224 4.552 10.656 1.00 0.00 O ATOM 2287 NE2 GLN A 139 16.253 4.450 9.700 1.00 0.00 N ATOM 0 H GLN A 139 12.963 4.334 5.433 1.00 0.00 H new ATOM 0 HA GLN A 139 15.687 4.197 6.194 1.00 0.00 H new ATOM 0 HB2 GLN A 139 13.034 3.443 7.356 1.00 0.00 H new ATOM 0 HB3 GLN A 139 14.467 2.739 8.078 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.996 5.522 7.720 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.387 5.390 8.402 1.00 0.00 H new ATOM 0 HE21 GLN A 139 16.804 4.504 8.843 1.00 0.00 H new ATOM 0 HE22 GLN A 139 16.714 4.274 10.593 1.00 0.00 H new ATOM 2296 N ASP A 140 14.216 1.443 5.172 1.00 0.00 N ATOM 2297 CA ASP A 140 14.443 0.077 4.726 1.00 0.00 C ATOM 2298 C ASP A 140 15.057 0.073 3.329 1.00 0.00 C ATOM 2299 O ASP A 140 15.702 -0.894 2.929 1.00 0.00 O ATOM 2300 CB ASP A 140 13.130 -0.707 4.727 1.00 0.00 C ATOM 2301 CG ASP A 140 12.655 -1.038 6.128 1.00 0.00 C ATOM 2302 OD1 ASP A 140 13.511 -1.301 7.000 1.00 0.00 O ATOM 2303 OD2 ASP A 140 11.426 -1.032 6.355 1.00 0.00 O ATOM 0 H ASP A 140 13.269 1.786 5.011 1.00 0.00 H new ATOM 0 HA ASP A 140 15.137 -0.403 5.416 1.00 0.00 H new ATOM 0 HB2 ASP A 140 12.363 -0.127 4.214 1.00 0.00 H new ATOM 0 HB3 ASP A 140 13.261 -1.631 4.163 1.00 0.00 H new ATOM 2308 N ALA A 141 14.860 1.171 2.600 1.00 0.00 N ATOM 2309 CA ALA A 141 15.401 1.314 1.255 1.00 0.00 C ATOM 2310 C ALA A 141 16.892 1.595 1.324 1.00 0.00 C ATOM 2311 O ALA A 141 17.703 0.848 0.773 1.00 0.00 O ATOM 2312 CB ALA A 141 14.683 2.429 0.505 1.00 0.00 C ATOM 0 H ALA A 141 14.326 1.977 2.924 1.00 0.00 H new ATOM 0 HA ALA A 141 15.243 0.382 0.713 1.00 0.00 H new ATOM 0 HB1 ALA A 141 15.101 2.521 -0.498 1.00 0.00 H new ATOM 0 HB2 ALA A 141 13.621 2.195 0.435 1.00 0.00 H new ATOM 0 HB3 ALA A 141 14.813 3.370 1.040 1.00 0.00 H new ATOM 2318 N ASP A 142 17.251 2.666 2.023 1.00 0.00 N ATOM 2319 CA ASP A 142 18.649 3.031 2.187 1.00 0.00 C ATOM 2320 C ASP A 142 19.405 1.879 2.835 1.00 0.00 C ATOM 2321 O ASP A 142 20.575 1.642 2.539 1.00 0.00 O ATOM 2322 CB ASP A 142 18.778 4.298 3.038 1.00 0.00 C ATOM 2323 CG ASP A 142 19.246 5.491 2.230 1.00 0.00 C ATOM 2324 OD1 ASP A 142 18.705 5.709 1.126 1.00 0.00 O ATOM 2325 OD2 ASP A 142 20.155 6.207 2.700 1.00 0.00 O ATOM 0 H ASP A 142 16.593 3.294 2.484 1.00 0.00 H new ATOM 0 HA ASP A 142 19.079 3.235 1.206 1.00 0.00 H new ATOM 0 HB2 ASP A 142 17.814 4.526 3.493 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.480 4.116 3.852 1.00 0.00 H new ATOM 2330 N GLU A 143 18.711 1.155 3.711 1.00 0.00 N ATOM 2331 CA GLU A 143 19.297 0.012 4.394 1.00 0.00 C ATOM 2332 C GLU A 143 19.275 -1.213 3.489 1.00 0.00 C ATOM 2333 O GLU A 143 20.183 -2.044 3.532 1.00 0.00 O ATOM 2334 CB GLU A 143 18.540 -0.282 5.691 1.00 0.00 C ATOM 2335 CG GLU A 143 18.978 0.583 6.862 1.00 0.00 C ATOM 2336 CD GLU A 143 18.402 0.110 8.182 1.00 0.00 C ATOM 2337 OE1 GLU A 143 17.277 -0.431 8.179 1.00 0.00 O ATOM 2338 OE2 GLU A 143 19.076 0.281 9.219 1.00 0.00 O ATOM 0 H GLU A 143 17.741 1.343 3.962 1.00 0.00 H new ATOM 0 HA GLU A 143 20.332 0.251 4.639 1.00 0.00 H new ATOM 0 HB2 GLU A 143 17.474 -0.135 5.521 1.00 0.00 H new ATOM 0 HB3 GLU A 143 18.679 -1.331 5.953 1.00 0.00 H new ATOM 0 HG2 GLU A 143 20.066 0.582 6.923 1.00 0.00 H new ATOM 0 HG3 GLU A 143 18.670 1.613 6.683 1.00 0.00 H new ATOM 2345 N ASP A 144 18.234 -1.320 2.663 1.00 0.00 N ATOM 2346 CA ASP A 144 18.107 -2.450 1.745 1.00 0.00 C ATOM 2347 C ASP A 144 19.307 -2.518 0.806 1.00 0.00 C ATOM 2348 O ASP A 144 20.015 -3.524 0.754 1.00 0.00 O ATOM 2349 CB ASP A 144 16.817 -2.338 0.927 1.00 0.00 C ATOM 2350 CG ASP A 144 15.704 -3.214 1.473 1.00 0.00 C ATOM 2351 OD1 ASP A 144 15.919 -3.870 2.513 1.00 0.00 O ATOM 2352 OD2 ASP A 144 14.618 -3.245 0.857 1.00 0.00 O ATOM 0 H ASP A 144 17.472 -0.643 2.611 1.00 0.00 H new ATOM 0 HA ASP A 144 18.071 -3.363 2.339 1.00 0.00 H new ATOM 0 HB2 ASP A 144 16.486 -1.300 0.917 1.00 0.00 H new ATOM 0 HB3 ASP A 144 17.021 -2.617 -0.107 1.00 0.00 H new ATOM 2357 N ARG A 145 19.526 -1.439 0.065 1.00 0.00 N ATOM 2358 CA ARG A 145 20.636 -1.367 -0.876 1.00 0.00 C ATOM 2359 C ARG A 145 21.968 -1.553 -0.156 1.00 0.00 C ATOM 2360 O ARG A 145 22.868 -2.227 -0.657 1.00 0.00 O ATOM 2361 CB ARG A 145 20.615 -0.029 -1.617 1.00 0.00 C ATOM 2362 CG ARG A 145 20.641 1.176 -0.693 1.00 0.00 C ATOM 2363 CD ARG A 145 20.744 2.478 -1.472 1.00 0.00 C ATOM 2364 NE ARG A 145 21.046 3.612 -0.603 1.00 0.00 N ATOM 2365 CZ ARG A 145 21.438 4.804 -1.049 1.00 0.00 C ATOM 2366 NH1 ARG A 145 21.577 5.021 -2.350 1.00 0.00 N ATOM 2367 NH2 ARG A 145 21.693 5.782 -0.190 1.00 0.00 N ATOM 0 H ARG A 145 18.948 -0.600 0.098 1.00 0.00 H new ATOM 0 HA ARG A 145 20.524 -2.173 -1.602 1.00 0.00 H new ATOM 0 HB2 ARG A 145 21.473 0.019 -2.288 1.00 0.00 H new ATOM 0 HB3 ARG A 145 19.721 0.019 -2.239 1.00 0.00 H new ATOM 0 HG2 ARG A 145 19.738 1.187 -0.083 1.00 0.00 H new ATOM 0 HG3 ARG A 145 21.486 1.093 -0.009 1.00 0.00 H new ATOM 0 HD2 ARG A 145 21.521 2.386 -2.231 1.00 0.00 H new ATOM 0 HD3 ARG A 145 19.806 2.662 -1.996 1.00 0.00 H new ATOM 0 HE ARG A 145 20.951 3.484 0.404 1.00 0.00 H new ATOM 0 HH11 ARG A 145 21.383 4.273 -3.015 1.00 0.00 H new ATOM 0 HH12 ARG A 145 21.878 5.936 -2.685 1.00 0.00 H new ATOM 0 HH21 ARG A 145 21.589 5.621 0.812 1.00 0.00 H new ATOM 0 HH22 ARG A 145 21.993 6.695 -0.531 1.00 0.00 H new