USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 950 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 30 HIS : no HE2:sc= -6.51! C(o=-6.1!,f=-7.8!) USER MOD Set 1.2: A 124 SER OG : rot 94:sc= 0.458 USER MOD Set 2.1: A 104 SER OG : rot -136:sc= 1.16 USER MOD Set 2.2: A 106 THR OG1 : rot -72:sc= 1.69 USER MOD Set 2.3: A 107 ASN : amide:sc= -5.02! C(o=-2.2!,f=-2.4!) USER MOD Set 3.1: A 85 ASN : amide:sc= -5.74! C(o=-12!,f=-14!) USER MOD Set 3.2: A 97 MET CE :methyl 162:sc= -6.51! (180deg=-6.79!) USER MOD Set 4.1: A 59 ASN : amide:sc= -3.52! K(o=-4.6!,f=-7.1) USER MOD Set 4.2: A 62 LYS NZ :NH3+ -155:sc= -1.12 (180deg=-1.9!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -1.56 K(o=-1.6,f=-5.3!) USER MOD Single : A 11 ASN : amide:sc= -2.62! C(o=-2.6!,f=-3.3!) USER MOD Single : A 12 GLN : amide:sc= -1.94 K(o=-1.9,f=-1.1) USER MOD Single : A 14 LYS NZ :NH3+ 166:sc= -9.67! (180deg=-10.1!) USER MOD Single : A 15 SER OG : rot 117:sc= 0.551 USER MOD Single : A 20 SER OG : rot 103:sc= -5.97! USER MOD Single : A 25 ASN : amide:sc= -1.01 K(o=-1,f=-4.3!) USER MOD Single : A 29 TYR OH : rot 165:sc= -1.39! USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -168:sc= 1.15 (180deg=1.12) USER MOD Single : A 38 THR OG1 : rot 180:sc= -2.78! USER MOD Single : A 42 ASN : amide:sc= -2.57! K(o=-2.6!,f=-1.4) USER MOD Single : A 43 LYS NZ :NH3+ -124:sc= -0.137 (180deg=-0.784) USER MOD Single : A 49 ASN : amide:sc= -2.11 K(o=-2.1,f=-3.4!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= -0.242! USER MOD Single : A 64 SER OG : rot 180:sc= -0.702 USER MOD Single : A 73 ASN : amide:sc= -2.85 K(o=-2.8,f=-0.43) USER MOD Single : A 74 SER OG : rot 180:sc= -0.0408 USER MOD Single : A 80 SER OG : rot 62:sc= 0.623 USER MOD Single : A 81 THR OG1 : rot -4:sc= -0.0504 USER MOD Single : A 87 ASN : amide:sc= -5.89 K(o=-5.9,f=-13!) USER MOD Single : A 89 LYS NZ :NH3+ 175:sc= -0.745 (180deg=-0.931) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= -7.12! C(o=-7.1!,f=-7.2!) USER MOD Single : A 105 THR OG1 : rot 68:sc= 0.22 USER MOD Single : A 108 THR OG1 : rot 110:sc= -2.92 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -4.3! C(o=-4.3!,f=-10!) USER MOD Single : A 114 LYS NZ :NH3+ -164:sc= -0.965 (180deg=-1.3) USER MOD Single : A 117 SER OG : rot 180:sc= -1.13 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -6.48! C(o=-6.5!,f=-7.9!) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD ----------------------------------------------------------------- ATOM 32 N LYS A 3 -16.146 21.199 -0.848 1.00 0.00 N ATOM 33 CA LYS A 3 -15.620 19.976 -0.251 1.00 0.00 C ATOM 34 C LYS A 3 -15.612 18.835 -1.263 1.00 0.00 C ATOM 35 O LYS A 3 -16.007 17.712 -0.952 1.00 0.00 O ATOM 36 CB LYS A 3 -16.451 19.582 0.969 1.00 0.00 C ATOM 37 CG LYS A 3 -16.492 20.650 2.048 1.00 0.00 C ATOM 38 CD LYS A 3 -17.643 21.621 1.832 1.00 0.00 C ATOM 39 CE LYS A 3 -17.143 22.993 1.409 1.00 0.00 C ATOM 40 NZ LYS A 3 -18.111 23.685 0.513 1.00 0.00 N ATOM 0 HA LYS A 3 -14.594 20.168 0.062 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -17.469 19.362 0.649 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -16.045 18.664 1.394 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -16.593 20.177 3.025 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -15.550 21.198 2.055 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -18.315 21.227 1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -18.222 21.711 2.751 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -16.967 23.604 2.294 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.186 22.889 0.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -17.733 24.617 0.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -18.260 23.115 -0.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -19.017 23.808 1.009 1.00 0.00 H new ATOM 54 N THR A 4 -15.161 19.131 -2.476 1.00 0.00 N ATOM 55 CA THR A 4 -15.103 18.129 -3.531 1.00 0.00 C ATOM 56 C THR A 4 -13.892 17.219 -3.353 1.00 0.00 C ATOM 57 O THR A 4 -13.932 16.044 -3.712 1.00 0.00 O ATOM 58 CB THR A 4 -15.049 18.806 -4.903 1.00 0.00 C ATOM 59 OG1 THR A 4 -16.214 19.581 -5.125 1.00 0.00 O ATOM 60 CG2 THR A 4 -14.924 17.827 -6.052 1.00 0.00 C ATOM 0 H THR A 4 -14.831 20.056 -2.752 1.00 0.00 H new ATOM 0 HA THR A 4 -16.004 17.520 -3.468 1.00 0.00 H new ATOM 0 HB THR A 4 -14.156 19.430 -4.881 1.00 0.00 H new ATOM 0 HG1 THR A 4 -16.160 20.007 -6.006 1.00 0.00 H new ATOM 0 HG21 THR A 4 -14.891 18.374 -6.994 1.00 0.00 H new ATOM 0 HG22 THR A 4 -14.009 17.246 -5.937 1.00 0.00 H new ATOM 0 HG23 THR A 4 -15.782 17.155 -6.052 1.00 0.00 H new ATOM 68 N ASN A 5 -12.816 17.772 -2.803 1.00 0.00 N ATOM 69 CA ASN A 5 -11.593 17.008 -2.587 1.00 0.00 C ATOM 70 C ASN A 5 -11.793 15.932 -1.523 1.00 0.00 C ATOM 71 O ASN A 5 -11.188 14.862 -1.592 1.00 0.00 O ATOM 72 CB ASN A 5 -10.443 17.937 -2.194 1.00 0.00 C ATOM 73 CG ASN A 5 -9.293 17.871 -3.179 1.00 0.00 C ATOM 74 OD1 ASN A 5 -8.126 17.855 -2.790 1.00 0.00 O ATOM 75 ND2 ASN A 5 -9.622 17.832 -4.466 1.00 0.00 N ATOM 0 H ASN A 5 -12.766 18.744 -2.499 1.00 0.00 H new ATOM 0 HA ASN A 5 -11.339 16.512 -3.524 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -10.810 18.962 -2.134 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -10.084 17.668 -1.200 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -8.893 17.787 -5.178 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -10.604 17.847 -4.742 1.00 0.00 H new ATOM 82 N LEU A 6 -12.649 16.211 -0.545 1.00 0.00 N ATOM 83 CA LEU A 6 -12.925 15.257 0.510 1.00 0.00 C ATOM 84 C LEU A 6 -14.050 14.334 0.088 1.00 0.00 C ATOM 85 O LEU A 6 -13.882 13.118 0.053 1.00 0.00 O ATOM 86 CB LEU A 6 -13.292 15.983 1.800 1.00 0.00 C ATOM 87 CG LEU A 6 -12.094 16.442 2.632 1.00 0.00 C ATOM 88 CD1 LEU A 6 -12.014 17.960 2.658 1.00 0.00 C ATOM 89 CD2 LEU A 6 -12.174 15.874 4.044 1.00 0.00 C ATOM 0 H LEU A 6 -13.160 17.090 -0.466 1.00 0.00 H new ATOM 0 HA LEU A 6 -12.029 14.663 0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -13.901 16.853 1.552 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -13.911 15.324 2.409 1.00 0.00 H new ATOM 0 HG LEU A 6 -11.183 16.064 2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -11.156 18.269 3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -11.903 18.336 1.641 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -12.926 18.365 3.097 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -11.313 16.211 4.621 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -13.090 16.219 4.524 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -12.176 14.785 3.999 1.00 0.00 H new ATOM 101 N GLY A 7 -15.193 14.923 -0.256 1.00 0.00 N ATOM 102 CA GLY A 7 -16.331 14.138 -0.696 1.00 0.00 C ATOM 103 C GLY A 7 -15.956 13.141 -1.774 1.00 0.00 C ATOM 104 O GLY A 7 -16.626 12.127 -1.950 1.00 0.00 O ATOM 0 H GLY A 7 -15.350 15.931 -0.237 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.755 13.607 0.156 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.106 14.805 -1.074 1.00 0.00 H new ATOM 108 N GLU A 8 -14.876 13.431 -2.493 1.00 0.00 N ATOM 109 CA GLU A 8 -14.406 12.553 -3.557 1.00 0.00 C ATOM 110 C GLU A 8 -13.398 11.539 -3.023 1.00 0.00 C ATOM 111 O GLU A 8 -13.181 10.490 -3.631 1.00 0.00 O ATOM 112 CB GLU A 8 -13.777 13.376 -4.688 1.00 0.00 C ATOM 113 CG GLU A 8 -12.392 13.915 -4.364 1.00 0.00 C ATOM 114 CD GLU A 8 -11.284 13.069 -4.961 1.00 0.00 C ATOM 115 OE1 GLU A 8 -11.508 11.859 -5.171 1.00 0.00 O ATOM 116 OE2 GLU A 8 -10.191 13.618 -5.217 1.00 0.00 O ATOM 0 H GLU A 8 -14.310 14.269 -2.357 1.00 0.00 H new ATOM 0 HA GLU A 8 -15.264 12.008 -3.950 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -13.715 12.757 -5.583 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -14.435 14.212 -4.924 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -12.307 14.935 -4.737 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -12.267 13.960 -3.282 1.00 0.00 H new ATOM 123 N LEU A 9 -12.785 11.853 -1.883 1.00 0.00 N ATOM 124 CA LEU A 9 -11.805 10.962 -1.278 1.00 0.00 C ATOM 125 C LEU A 9 -12.427 10.161 -0.140 1.00 0.00 C ATOM 126 O LEU A 9 -11.870 9.155 0.296 1.00 0.00 O ATOM 127 CB LEU A 9 -10.608 11.762 -0.756 1.00 0.00 C ATOM 128 CG LEU A 9 -9.515 12.049 -1.787 1.00 0.00 C ATOM 129 CD1 LEU A 9 -8.340 12.762 -1.134 1.00 0.00 C ATOM 130 CD2 LEU A 9 -9.055 10.759 -2.449 1.00 0.00 C ATOM 0 H LEU A 9 -12.951 12.715 -1.364 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.463 10.267 -2.045 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -10.970 12.711 -0.361 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -10.164 11.218 0.078 1.00 0.00 H new ATOM 0 HG LEU A 9 -9.929 12.702 -2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -7.572 12.958 -1.882 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -8.679 13.705 -0.706 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -7.926 12.134 -0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -8.277 10.982 -3.179 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -8.658 10.083 -1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -9.899 10.286 -2.951 1.00 0.00 H new ATOM 142 N ILE A 10 -13.577 10.620 0.350 1.00 0.00 N ATOM 143 CA ILE A 10 -14.246 9.944 1.450 1.00 0.00 C ATOM 144 C ILE A 10 -15.248 8.913 0.961 1.00 0.00 C ATOM 145 O ILE A 10 -15.393 7.849 1.566 1.00 0.00 O ATOM 146 CB ILE A 10 -14.922 10.936 2.413 1.00 0.00 C ATOM 147 CG1 ILE A 10 -15.896 11.889 1.702 1.00 0.00 C ATOM 148 CG2 ILE A 10 -13.844 11.716 3.133 1.00 0.00 C ATOM 149 CD1 ILE A 10 -16.238 13.126 2.526 1.00 0.00 C ATOM 0 H ILE A 10 -14.058 11.450 0.004 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.467 9.419 2.002 1.00 0.00 H new ATOM 0 HB ILE A 10 -15.522 10.367 3.123 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -15.460 12.202 0.753 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -16.815 11.351 1.468 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -14.305 12.425 3.821 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -13.209 11.028 3.692 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.239 12.257 2.406 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.929 13.756 1.966 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -16.703 12.821 3.464 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.327 13.686 2.737 1.00 0.00 H new ATOM 161 N ASN A 11 -15.924 9.208 -0.143 1.00 0.00 N ATOM 162 CA ASN A 11 -16.888 8.264 -0.707 1.00 0.00 C ATOM 163 C ASN A 11 -16.258 6.880 -0.790 1.00 0.00 C ATOM 164 O ASN A 11 -16.924 5.861 -0.611 1.00 0.00 O ATOM 165 CB ASN A 11 -17.329 8.707 -2.101 1.00 0.00 C ATOM 166 CG ASN A 11 -18.204 9.940 -2.068 1.00 0.00 C ATOM 167 OD1 ASN A 11 -18.814 10.257 -1.046 1.00 0.00 O ATOM 168 ND2 ASN A 11 -18.271 10.641 -3.190 1.00 0.00 N ATOM 0 H ASN A 11 -15.827 10.081 -0.662 1.00 0.00 H new ATOM 0 HA ASN A 11 -17.763 8.234 -0.058 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -16.448 8.907 -2.711 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -17.872 7.893 -2.582 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -18.846 11.482 -3.232 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -17.748 10.339 -4.012 1.00 0.00 H new ATOM 175 N GLN A 12 -14.955 6.868 -1.055 1.00 0.00 N ATOM 176 CA GLN A 12 -14.198 5.627 -1.156 1.00 0.00 C ATOM 177 C GLN A 12 -13.512 5.301 0.169 1.00 0.00 C ATOM 178 O GLN A 12 -13.352 4.134 0.525 1.00 0.00 O ATOM 179 CB GLN A 12 -13.156 5.728 -2.274 1.00 0.00 C ATOM 180 CG GLN A 12 -11.990 6.650 -1.947 1.00 0.00 C ATOM 181 CD GLN A 12 -11.127 6.951 -3.156 1.00 0.00 C ATOM 182 OE1 GLN A 12 -11.167 6.234 -4.155 1.00 0.00 O ATOM 183 NE2 GLN A 12 -10.339 8.016 -3.069 1.00 0.00 N ATOM 0 H GLN A 12 -14.399 7.710 -1.204 1.00 0.00 H new ATOM 0 HA GLN A 12 -14.895 4.823 -1.392 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.770 4.732 -2.489 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -13.644 6.083 -3.182 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.374 7.584 -1.538 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -11.376 6.192 -1.172 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.339 8.582 -2.221 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.734 8.268 -3.851 1.00 0.00 H new ATOM 192 N GLY A 13 -13.108 6.341 0.897 1.00 0.00 N ATOM 193 CA GLY A 13 -12.445 6.139 2.175 1.00 0.00 C ATOM 194 C GLY A 13 -13.292 5.331 3.138 1.00 0.00 C ATOM 195 O GLY A 13 -12.937 4.210 3.499 1.00 0.00 O ATOM 0 H GLY A 13 -13.228 7.317 0.625 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -11.495 5.629 2.013 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -12.215 7.107 2.620 1.00 0.00 H new ATOM 199 N LYS A 14 -14.424 5.899 3.541 1.00 0.00 N ATOM 200 CA LYS A 14 -15.338 5.225 4.452 1.00 0.00 C ATOM 201 C LYS A 14 -15.782 3.893 3.857 1.00 0.00 C ATOM 202 O LYS A 14 -16.131 2.961 4.581 1.00 0.00 O ATOM 203 CB LYS A 14 -16.555 6.114 4.729 1.00 0.00 C ATOM 204 CG LYS A 14 -16.236 7.339 5.574 1.00 0.00 C ATOM 205 CD LYS A 14 -16.079 8.596 4.725 1.00 0.00 C ATOM 206 CE LYS A 14 -14.737 9.276 4.973 1.00 0.00 C ATOM 207 NZ LYS A 14 -14.865 10.545 5.736 1.00 0.00 N ATOM 0 H LYS A 14 -14.730 6.827 3.249 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.822 5.034 5.393 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.981 6.439 3.780 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -17.318 5.523 5.235 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -17.031 7.492 6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.318 7.163 6.134 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.167 8.337 3.670 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -16.887 9.292 4.951 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.085 8.594 5.519 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.256 9.480 4.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -13.929 10.839 6.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -15.255 11.284 5.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -15.501 10.400 6.546 1.00 0.00 H new ATOM 221 N SER A 15 -15.744 3.809 2.529 1.00 0.00 N ATOM 222 CA SER A 15 -16.120 2.588 1.827 1.00 0.00 C ATOM 223 C SER A 15 -14.983 1.574 1.899 1.00 0.00 C ATOM 224 O SER A 15 -15.208 0.365 1.853 1.00 0.00 O ATOM 225 CB SER A 15 -16.460 2.893 0.367 1.00 0.00 C ATOM 226 OG SER A 15 -17.821 3.264 0.227 1.00 0.00 O ATOM 0 H SER A 15 -15.456 4.574 1.919 1.00 0.00 H new ATOM 0 HA SER A 15 -17.003 2.167 2.308 1.00 0.00 H new ATOM 0 HB2 SER A 15 -15.821 3.697 0.002 1.00 0.00 H new ATOM 0 HB3 SER A 15 -16.253 2.017 -0.248 1.00 0.00 H new ATOM 0 HG SER A 15 -17.877 4.189 -0.092 1.00 0.00 H new ATOM 232 N LEU A 16 -13.763 2.085 2.033 1.00 0.00 N ATOM 233 CA LEU A 16 -12.583 1.244 2.137 1.00 0.00 C ATOM 234 C LEU A 16 -12.560 0.577 3.502 1.00 0.00 C ATOM 235 O LEU A 16 -12.697 -0.637 3.615 1.00 0.00 O ATOM 236 CB LEU A 16 -11.323 2.092 1.945 1.00 0.00 C ATOM 237 CG LEU A 16 -10.076 1.332 1.488 1.00 0.00 C ATOM 238 CD1 LEU A 16 -9.041 2.302 0.929 1.00 0.00 C ATOM 239 CD2 LEU A 16 -9.490 0.520 2.637 1.00 0.00 C ATOM 0 H LEU A 16 -13.569 3.086 2.072 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.612 0.478 1.362 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -11.539 2.871 1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -11.097 2.592 2.887 1.00 0.00 H new ATOM 0 HG LEU A 16 -10.363 0.640 0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.159 1.748 0.608 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.464 2.835 0.078 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.758 3.017 1.701 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -8.604 -0.013 2.291 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -9.216 1.189 3.453 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -10.230 -0.198 2.990 1.00 0.00 H new ATOM 251 N LEU A 17 -12.411 1.395 4.539 1.00 0.00 N ATOM 252 CA LEU A 17 -12.390 0.913 5.911 1.00 0.00 C ATOM 253 C LEU A 17 -13.554 -0.043 6.167 1.00 0.00 C ATOM 254 O LEU A 17 -13.445 -0.971 6.967 1.00 0.00 O ATOM 255 CB LEU A 17 -12.469 2.105 6.867 1.00 0.00 C ATOM 256 CG LEU A 17 -11.381 2.162 7.939 1.00 0.00 C ATOM 257 CD1 LEU A 17 -10.103 2.778 7.379 1.00 0.00 C ATOM 258 CD2 LEU A 17 -11.878 2.953 9.137 1.00 0.00 C ATOM 0 H LEU A 17 -12.302 2.405 4.450 1.00 0.00 H new ATOM 0 HA LEU A 17 -11.461 0.369 6.080 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -12.425 3.023 6.280 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -13.441 2.089 7.361 1.00 0.00 H new ATOM 0 HG LEU A 17 -11.151 1.146 8.260 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -9.342 2.809 8.159 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -9.744 2.175 6.545 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -10.309 3.791 7.033 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -11.098 2.990 9.898 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -12.129 3.967 8.825 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -12.764 2.471 9.549 1.00 0.00 H new ATOM 270 N ASP A 18 -14.670 0.199 5.484 1.00 0.00 N ATOM 271 CA ASP A 18 -15.861 -0.632 5.641 1.00 0.00 C ATOM 272 C ASP A 18 -15.734 -1.957 4.888 1.00 0.00 C ATOM 273 O ASP A 18 -16.332 -2.959 5.282 1.00 0.00 O ATOM 274 CB ASP A 18 -17.097 0.124 5.153 1.00 0.00 C ATOM 275 CG ASP A 18 -17.712 0.988 6.237 1.00 0.00 C ATOM 276 OD1 ASP A 18 -16.961 1.459 7.117 1.00 0.00 O ATOM 277 OD2 ASP A 18 -18.943 1.193 6.206 1.00 0.00 O ATOM 0 H ASP A 18 -14.775 0.963 4.817 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.965 -0.859 6.702 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.824 0.751 4.304 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.839 -0.590 4.797 1.00 0.00 H new ATOM 282 N GLU A 19 -14.963 -1.961 3.805 1.00 0.00 N ATOM 283 CA GLU A 19 -14.776 -3.169 3.005 1.00 0.00 C ATOM 284 C GLU A 19 -13.418 -3.814 3.277 1.00 0.00 C ATOM 285 O GLU A 19 -13.172 -4.952 2.878 1.00 0.00 O ATOM 286 CB GLU A 19 -14.915 -2.850 1.515 1.00 0.00 C ATOM 287 CG GLU A 19 -13.796 -1.980 0.967 1.00 0.00 C ATOM 288 CD GLU A 19 -14.135 -1.372 -0.379 1.00 0.00 C ATOM 289 OE1 GLU A 19 -15.181 -0.697 -0.479 1.00 0.00 O ATOM 290 OE2 GLU A 19 -13.354 -1.570 -1.333 1.00 0.00 O ATOM 0 H GLU A 19 -14.458 -1.144 3.461 1.00 0.00 H new ATOM 0 HA GLU A 19 -15.552 -3.879 3.292 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -14.944 -3.784 0.954 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.868 -2.348 1.348 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -13.580 -1.182 1.678 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -12.889 -2.577 0.873 1.00 0.00 H new ATOM 297 N SER A 20 -12.542 -3.083 3.960 1.00 0.00 N ATOM 298 CA SER A 20 -11.221 -3.581 4.286 1.00 0.00 C ATOM 299 C SER A 20 -11.150 -3.943 5.757 1.00 0.00 C ATOM 300 O SER A 20 -11.088 -3.071 6.622 1.00 0.00 O ATOM 301 CB SER A 20 -10.161 -2.535 3.965 1.00 0.00 C ATOM 302 OG SER A 20 -10.555 -1.256 4.429 1.00 0.00 O ATOM 0 H SER A 20 -12.730 -2.139 4.298 1.00 0.00 H new ATOM 0 HA SER A 20 -11.031 -4.471 3.686 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.214 -2.818 4.426 1.00 0.00 H new ATOM 0 HB3 SER A 20 -9.993 -2.500 2.889 1.00 0.00 H new ATOM 0 HG SER A 20 -10.070 -1.044 5.254 1.00 0.00 H new ATOM 308 N VAL A 21 -11.172 -5.231 6.032 1.00 0.00 N ATOM 309 CA VAL A 21 -11.120 -5.712 7.399 1.00 0.00 C ATOM 310 C VAL A 21 -9.736 -6.221 7.753 1.00 0.00 C ATOM 311 O VAL A 21 -9.059 -6.824 6.929 1.00 0.00 O ATOM 312 CB VAL A 21 -12.138 -6.839 7.618 1.00 0.00 C ATOM 313 CG1 VAL A 21 -11.807 -8.041 6.747 1.00 0.00 C ATOM 314 CG2 VAL A 21 -12.203 -7.229 9.087 1.00 0.00 C ATOM 0 H VAL A 21 -11.226 -5.965 5.326 1.00 0.00 H new ATOM 0 HA VAL A 21 -11.363 -4.869 8.046 1.00 0.00 H new ATOM 0 HB VAL A 21 -13.122 -6.473 7.324 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -12.542 -8.828 6.918 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.829 -7.747 5.698 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -10.813 -8.411 7.000 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -12.931 -8.029 9.219 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.222 -7.572 9.416 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.502 -6.365 9.680 1.00 0.00 H new ATOM 324 N GLU A 22 -9.323 -5.984 8.985 1.00 0.00 N ATOM 325 CA GLU A 22 -8.018 -6.437 9.438 1.00 0.00 C ATOM 326 C GLU A 22 -8.062 -7.930 9.760 1.00 0.00 C ATOM 327 O GLU A 22 -8.676 -8.343 10.744 1.00 0.00 O ATOM 328 CB GLU A 22 -7.588 -5.652 10.679 1.00 0.00 C ATOM 329 CG GLU A 22 -8.485 -5.874 11.884 1.00 0.00 C ATOM 330 CD GLU A 22 -7.873 -6.818 12.900 1.00 0.00 C ATOM 331 OE1 GLU A 22 -6.745 -6.546 13.359 1.00 0.00 O ATOM 332 OE2 GLU A 22 -8.524 -7.830 13.237 1.00 0.00 O ATOM 0 H GLU A 22 -9.868 -5.483 9.687 1.00 0.00 H new ATOM 0 HA GLU A 22 -7.294 -6.266 8.641 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.568 -5.933 10.940 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -7.574 -4.589 10.439 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.690 -4.916 12.361 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -9.442 -6.275 11.551 1.00 0.00 H new ATOM 339 N GLY A 23 -7.408 -8.736 8.928 1.00 0.00 N ATOM 340 CA GLY A 23 -7.386 -10.169 9.145 1.00 0.00 C ATOM 341 C GLY A 23 -5.978 -10.728 9.151 1.00 0.00 C ATOM 342 O GLY A 23 -5.297 -10.698 10.176 1.00 0.00 O ATOM 0 H GLY A 23 -6.893 -8.420 8.107 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -7.869 -10.398 10.095 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.967 -10.661 8.365 1.00 0.00 H new ATOM 346 N PHE A 24 -5.537 -11.235 8.003 1.00 0.00 N ATOM 347 CA PHE A 24 -4.197 -11.799 7.880 1.00 0.00 C ATOM 348 C PHE A 24 -3.996 -12.445 6.512 1.00 0.00 C ATOM 349 O PHE A 24 -3.394 -13.514 6.402 1.00 0.00 O ATOM 350 CB PHE A 24 -3.948 -12.834 8.983 1.00 0.00 C ATOM 351 CG PHE A 24 -5.098 -13.776 9.195 1.00 0.00 C ATOM 352 CD1 PHE A 24 -5.292 -14.857 8.350 1.00 0.00 C ATOM 353 CD2 PHE A 24 -5.987 -13.582 10.242 1.00 0.00 C ATOM 354 CE1 PHE A 24 -6.350 -15.725 8.543 1.00 0.00 C ATOM 355 CE2 PHE A 24 -7.046 -14.446 10.440 1.00 0.00 C ATOM 356 CZ PHE A 24 -7.227 -15.520 9.589 1.00 0.00 C ATOM 0 H PHE A 24 -6.088 -11.267 7.145 1.00 0.00 H new ATOM 0 HA PHE A 24 -3.482 -10.983 7.986 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.058 -13.411 8.733 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.739 -12.313 9.918 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -4.608 -15.023 7.531 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -5.849 -12.745 10.911 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -6.490 -16.563 7.876 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -7.732 -14.283 11.258 1.00 0.00 H new ATOM 0 HZ PHE A 24 -8.054 -16.198 9.742 1.00 0.00 H new ATOM 366 N ASN A 25 -4.500 -11.792 5.469 1.00 0.00 N ATOM 367 CA ASN A 25 -4.367 -12.315 4.110 1.00 0.00 C ATOM 368 C ASN A 25 -4.951 -11.346 3.087 1.00 0.00 C ATOM 369 O ASN A 25 -5.527 -10.320 3.449 1.00 0.00 O ATOM 370 CB ASN A 25 -5.059 -13.673 3.995 1.00 0.00 C ATOM 371 CG ASN A 25 -6.539 -13.597 4.319 1.00 0.00 C ATOM 372 OD1 ASN A 25 -7.223 -12.650 3.931 1.00 0.00 O ATOM 373 ND2 ASN A 25 -7.040 -14.598 5.034 1.00 0.00 N ATOM 0 H ASN A 25 -5.001 -10.906 5.536 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.304 -12.435 3.900 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -4.931 -14.059 2.984 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -4.578 -14.381 4.670 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -8.029 -14.602 5.283 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -6.436 -15.363 5.334 1.00 0.00 H new ATOM 380 N VAL A 26 -4.805 -11.681 1.807 1.00 0.00 N ATOM 381 CA VAL A 26 -5.324 -10.840 0.732 1.00 0.00 C ATOM 382 C VAL A 26 -6.793 -10.508 0.969 1.00 0.00 C ATOM 383 O VAL A 26 -7.640 -11.398 1.026 1.00 0.00 O ATOM 384 CB VAL A 26 -5.166 -11.516 -0.645 1.00 0.00 C ATOM 385 CG1 VAL A 26 -5.996 -12.790 -0.720 1.00 0.00 C ATOM 386 CG2 VAL A 26 -5.548 -10.553 -1.760 1.00 0.00 C ATOM 0 H VAL A 26 -4.332 -12.527 1.490 1.00 0.00 H new ATOM 0 HA VAL A 26 -4.740 -9.920 0.734 1.00 0.00 H new ATOM 0 HB VAL A 26 -4.119 -11.789 -0.774 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.869 -13.250 -1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -5.666 -13.485 0.052 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.048 -12.549 -0.566 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -5.430 -11.048 -2.724 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -6.586 -10.245 -1.635 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.902 -9.676 -1.721 1.00 0.00 H new ATOM 396 N GLY A 27 -7.082 -9.223 1.122 1.00 0.00 N ATOM 397 CA GLY A 27 -8.444 -8.794 1.373 1.00 0.00 C ATOM 398 C GLY A 27 -8.614 -8.262 2.782 1.00 0.00 C ATOM 399 O GLY A 27 -9.518 -7.473 3.053 1.00 0.00 O ATOM 0 H GLY A 27 -6.397 -8.469 1.077 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -8.720 -8.020 0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -9.124 -9.631 1.216 1.00 0.00 H new ATOM 403 N GLU A 28 -7.729 -8.691 3.679 1.00 0.00 N ATOM 404 CA GLU A 28 -7.763 -8.255 5.063 1.00 0.00 C ATOM 405 C GLU A 28 -6.361 -7.888 5.526 1.00 0.00 C ATOM 406 O GLU A 28 -5.400 -8.588 5.223 1.00 0.00 O ATOM 407 CB GLU A 28 -8.350 -9.351 5.955 1.00 0.00 C ATOM 408 CG GLU A 28 -9.633 -9.957 5.407 1.00 0.00 C ATOM 409 CD GLU A 28 -10.352 -10.818 6.427 1.00 0.00 C ATOM 410 OE1 GLU A 28 -9.666 -11.518 7.203 1.00 0.00 O ATOM 411 OE2 GLU A 28 -11.600 -10.794 6.450 1.00 0.00 O ATOM 0 H GLU A 28 -6.976 -9.345 3.465 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.401 -7.374 5.138 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -7.610 -10.141 6.081 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.547 -8.937 6.944 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -10.297 -9.157 5.079 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -9.400 -10.559 4.528 1.00 0.00 H new ATOM 418 N TYR A 29 -6.246 -6.778 6.242 1.00 0.00 N ATOM 419 CA TYR A 29 -4.940 -6.318 6.713 1.00 0.00 C ATOM 420 C TYR A 29 -4.660 -6.765 8.142 1.00 0.00 C ATOM 421 O TYR A 29 -5.509 -7.360 8.794 1.00 0.00 O ATOM 422 CB TYR A 29 -4.847 -4.798 6.603 1.00 0.00 C ATOM 423 CG TYR A 29 -5.661 -4.064 7.635 1.00 0.00 C ATOM 424 CD1 TYR A 29 -7.023 -3.844 7.454 1.00 0.00 C ATOM 425 CD2 TYR A 29 -5.064 -3.585 8.795 1.00 0.00 C ATOM 426 CE1 TYR A 29 -7.763 -3.167 8.398 1.00 0.00 C ATOM 427 CE2 TYR A 29 -5.804 -2.908 9.742 1.00 0.00 C ATOM 428 CZ TYR A 29 -7.149 -2.701 9.539 1.00 0.00 C ATOM 429 OH TYR A 29 -7.883 -2.028 10.485 1.00 0.00 O ATOM 0 H TYR A 29 -7.030 -6.183 6.509 1.00 0.00 H new ATOM 0 HA TYR A 29 -4.181 -6.772 6.076 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -3.803 -4.499 6.697 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.177 -4.494 5.610 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.507 -4.209 6.560 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.008 -3.745 8.957 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -8.819 -3.003 8.244 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -5.329 -2.542 10.640 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.373 -1.978 11.320 1.00 0.00 H new ATOM 439 N HIS A 30 -3.455 -6.485 8.623 1.00 0.00 N ATOM 440 CA HIS A 30 -3.079 -6.877 9.977 1.00 0.00 C ATOM 441 C HIS A 30 -3.694 -5.955 11.027 1.00 0.00 C ATOM 442 O HIS A 30 -4.588 -6.360 11.771 1.00 0.00 O ATOM 443 CB HIS A 30 -1.563 -6.895 10.125 1.00 0.00 C ATOM 444 CG HIS A 30 -1.081 -7.883 11.140 1.00 0.00 C ATOM 445 ND1 HIS A 30 -0.952 -7.585 12.480 1.00 0.00 N ATOM 446 CD2 HIS A 30 -0.707 -9.178 11.007 1.00 0.00 C ATOM 447 CE1 HIS A 30 -0.521 -8.652 13.127 1.00 0.00 C ATOM 448 NE2 HIS A 30 -0.365 -9.635 12.258 1.00 0.00 N ATOM 0 H HIS A 30 -2.728 -5.994 8.103 1.00 0.00 H new ATOM 0 HA HIS A 30 -3.469 -7.881 10.144 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.113 -7.127 9.160 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -1.220 -5.899 10.406 1.00 0.00 H new ATOM 0 HD1 HIS A 30 -1.158 -6.681 12.905 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -0.682 -9.746 10.089 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -0.328 -8.711 14.188 1.00 0.00 H new ATOM 457 N LYS A 31 -3.208 -4.719 11.093 1.00 0.00 N ATOM 458 CA LYS A 31 -3.713 -3.755 12.065 1.00 0.00 C ATOM 459 C LYS A 31 -3.127 -2.367 11.821 1.00 0.00 C ATOM 460 O LYS A 31 -1.962 -2.234 11.445 1.00 0.00 O ATOM 461 CB LYS A 31 -3.382 -4.215 13.486 1.00 0.00 C ATOM 462 CG LYS A 31 -4.356 -3.702 14.534 1.00 0.00 C ATOM 463 CD LYS A 31 -3.656 -3.422 15.854 1.00 0.00 C ATOM 464 CE LYS A 31 -4.528 -2.590 16.781 1.00 0.00 C ATOM 465 NZ LYS A 31 -5.251 -3.435 17.772 1.00 0.00 N ATOM 0 H LYS A 31 -2.468 -4.363 10.488 1.00 0.00 H new ATOM 0 HA LYS A 31 -4.795 -3.696 11.947 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.373 -5.305 13.513 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.377 -3.881 13.742 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.834 -2.791 14.174 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -5.146 -4.437 14.688 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.402 -4.364 16.340 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.719 -2.898 15.666 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.908 -1.864 17.307 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -5.250 -2.025 16.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -5.834 -2.830 18.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -5.862 -4.111 17.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -4.563 -3.955 18.353 1.00 0.00 H new ATOM 479 N GLY A 32 -3.938 -1.337 12.043 1.00 0.00 N ATOM 480 CA GLY A 32 -3.476 0.026 11.849 1.00 0.00 C ATOM 481 C GLY A 32 -4.259 0.771 10.783 1.00 0.00 C ATOM 482 O GLY A 32 -4.400 1.992 10.851 1.00 0.00 O ATOM 0 H GLY A 32 -4.906 -1.422 12.353 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -3.551 0.567 12.792 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -2.421 0.011 11.574 1.00 0.00 H new ATOM 486 N ALA A 33 -4.762 0.040 9.793 1.00 0.00 N ATOM 487 CA ALA A 33 -5.524 0.647 8.709 1.00 0.00 C ATOM 488 C ALA A 33 -6.791 1.326 9.223 1.00 0.00 C ATOM 489 O ALA A 33 -6.994 2.521 9.012 1.00 0.00 O ATOM 490 CB ALA A 33 -5.871 -0.401 7.667 1.00 0.00 C ATOM 0 H ALA A 33 -4.656 -0.972 9.720 1.00 0.00 H new ATOM 0 HA ALA A 33 -4.902 1.416 8.251 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -6.440 0.062 6.861 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -4.954 -0.830 7.263 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.468 -1.188 8.127 1.00 0.00 H new ATOM 496 N LYS A 34 -7.647 0.555 9.892 1.00 0.00 N ATOM 497 CA LYS A 34 -8.905 1.076 10.433 1.00 0.00 C ATOM 498 C LYS A 34 -8.716 2.382 11.223 1.00 0.00 C ATOM 499 O LYS A 34 -9.692 3.052 11.547 1.00 0.00 O ATOM 500 CB LYS A 34 -9.576 0.029 11.324 1.00 0.00 C ATOM 501 CG LYS A 34 -10.983 0.411 11.756 1.00 0.00 C ATOM 502 CD LYS A 34 -12.009 -0.610 11.289 1.00 0.00 C ATOM 503 CE LYS A 34 -12.494 -0.316 9.877 1.00 0.00 C ATOM 504 NZ LYS A 34 -13.682 -1.138 9.518 1.00 0.00 N ATOM 0 H LYS A 34 -7.493 -0.437 10.074 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.543 1.300 9.578 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.614 -0.920 10.790 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -8.962 -0.128 12.211 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -11.021 0.495 12.842 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -11.235 1.392 11.352 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -11.571 -1.608 11.323 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.858 -0.611 11.972 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -12.744 0.741 9.792 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -11.689 -0.511 9.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -13.859 -1.064 8.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -13.505 -2.132 9.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -14.513 -0.793 10.039 1.00 0.00 H new ATOM 518 N ASP A 35 -7.472 2.738 11.537 1.00 0.00 N ATOM 519 CA ASP A 35 -7.187 3.963 12.279 1.00 0.00 C ATOM 520 C ASP A 35 -6.831 5.110 11.328 1.00 0.00 C ATOM 521 O ASP A 35 -7.593 6.052 11.172 1.00 0.00 O ATOM 522 CB ASP A 35 -6.042 3.733 13.259 1.00 0.00 C ATOM 523 CG ASP A 35 -6.494 3.035 14.527 1.00 0.00 C ATOM 524 OD1 ASP A 35 -7.319 3.619 15.263 1.00 0.00 O ATOM 525 OD2 ASP A 35 -6.026 1.907 14.785 1.00 0.00 O ATOM 0 H ASP A 35 -6.645 2.195 11.289 1.00 0.00 H new ATOM 0 HA ASP A 35 -8.085 4.238 12.833 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -5.269 3.136 12.776 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.591 4.691 13.517 1.00 0.00 H new ATOM 530 N GLY A 36 -5.664 5.020 10.695 1.00 0.00 N ATOM 531 CA GLY A 36 -5.227 6.051 9.766 1.00 0.00 C ATOM 532 C GLY A 36 -6.311 6.445 8.782 1.00 0.00 C ATOM 533 O GLY A 36 -6.891 7.525 8.895 1.00 0.00 O ATOM 0 H GLY A 36 -5.009 4.247 10.809 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -4.913 6.931 10.327 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.355 5.695 9.217 1.00 0.00 H new ATOM 537 N LEU A 37 -6.599 5.568 7.817 1.00 0.00 N ATOM 538 CA LEU A 37 -7.631 5.844 6.827 1.00 0.00 C ATOM 539 C LEU A 37 -8.917 6.316 7.501 1.00 0.00 C ATOM 540 O LEU A 37 -9.727 6.997 6.893 1.00 0.00 O ATOM 541 CB LEU A 37 -7.907 4.608 5.971 1.00 0.00 C ATOM 542 CG LEU A 37 -9.159 4.687 5.087 1.00 0.00 C ATOM 543 CD1 LEU A 37 -9.251 6.037 4.393 1.00 0.00 C ATOM 544 CD2 LEU A 37 -9.156 3.567 4.062 1.00 0.00 C ATOM 0 H LEU A 37 -6.133 4.668 7.704 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.267 6.641 6.178 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.042 4.429 5.332 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.001 3.744 6.629 1.00 0.00 H new ATOM 0 HG LEU A 37 -10.033 4.573 5.728 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -10.147 6.067 3.773 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -9.301 6.828 5.141 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.371 6.185 3.767 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -10.051 3.638 3.443 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -8.271 3.653 3.431 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -9.144 2.605 4.574 1.00 0.00 H new ATOM 556 N THR A 38 -9.103 5.966 8.764 1.00 0.00 N ATOM 557 CA THR A 38 -10.292 6.394 9.482 1.00 0.00 C ATOM 558 C THR A 38 -10.040 7.748 10.124 1.00 0.00 C ATOM 559 O THR A 38 -10.919 8.599 10.187 1.00 0.00 O ATOM 560 CB THR A 38 -10.692 5.354 10.520 1.00 0.00 C ATOM 561 OG1 THR A 38 -12.098 5.192 10.548 1.00 0.00 O ATOM 562 CG2 THR A 38 -10.259 5.668 11.927 1.00 0.00 C ATOM 0 H THR A 38 -8.455 5.395 9.307 1.00 0.00 H new ATOM 0 HA THR A 38 -11.121 6.493 8.781 1.00 0.00 H new ATOM 0 HB THR A 38 -10.176 4.448 10.202 1.00 0.00 H new ATOM 0 HG1 THR A 38 -12.336 4.519 11.219 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.588 4.872 12.595 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.173 5.747 11.964 1.00 0.00 H new ATOM 0 HG23 THR A 38 -10.702 6.613 12.242 1.00 0.00 H new ATOM 570 N VAL A 39 -8.810 7.940 10.570 1.00 0.00 N ATOM 571 CA VAL A 39 -8.396 9.188 11.177 1.00 0.00 C ATOM 572 C VAL A 39 -8.627 10.314 10.183 1.00 0.00 C ATOM 573 O VAL A 39 -9.002 11.426 10.552 1.00 0.00 O ATOM 574 CB VAL A 39 -6.916 9.088 11.602 1.00 0.00 C ATOM 575 CG1 VAL A 39 -6.218 10.437 11.648 1.00 0.00 C ATOM 576 CG2 VAL A 39 -6.827 8.389 12.945 1.00 0.00 C ATOM 0 H VAL A 39 -8.074 7.236 10.521 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.981 9.396 12.073 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.393 8.505 10.843 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -5.181 10.300 11.953 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.248 10.896 10.660 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.724 11.084 12.364 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -5.783 8.316 13.249 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.383 8.959 13.689 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.252 7.388 12.863 1.00 0.00 H new ATOM 586 N GLU A 40 -8.461 9.982 8.909 1.00 0.00 N ATOM 587 CA GLU A 40 -8.716 10.924 7.841 1.00 0.00 C ATOM 588 C GLU A 40 -10.218 10.958 7.598 1.00 0.00 C ATOM 589 O GLU A 40 -10.776 11.995 7.265 1.00 0.00 O ATOM 590 CB GLU A 40 -7.976 10.512 6.568 1.00 0.00 C ATOM 591 CG GLU A 40 -8.214 9.064 6.195 1.00 0.00 C ATOM 592 CD GLU A 40 -8.294 8.839 4.694 1.00 0.00 C ATOM 593 OE1 GLU A 40 -7.235 8.734 4.045 1.00 0.00 O ATOM 594 OE2 GLU A 40 -9.423 8.766 4.165 1.00 0.00 O ATOM 0 H GLU A 40 -8.150 9.063 8.595 1.00 0.00 H new ATOM 0 HA GLU A 40 -8.356 11.914 8.121 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.294 11.152 5.745 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.907 10.676 6.705 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.410 8.453 6.605 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -9.141 8.724 6.657 1.00 0.00 H new ATOM 601 N ILE A 41 -10.870 9.806 7.813 1.00 0.00 N ATOM 602 CA ILE A 41 -12.317 9.693 7.666 1.00 0.00 C ATOM 603 C ILE A 41 -12.987 10.541 8.736 1.00 0.00 C ATOM 604 O ILE A 41 -13.603 11.565 8.438 1.00 0.00 O ATOM 605 CB ILE A 41 -12.797 8.225 7.822 1.00 0.00 C ATOM 606 CG1 ILE A 41 -12.430 7.358 6.600 1.00 0.00 C ATOM 607 CG2 ILE A 41 -14.301 8.169 8.083 1.00 0.00 C ATOM 608 CD1 ILE A 41 -11.717 8.094 5.477 1.00 0.00 C ATOM 0 H ILE A 41 -10.410 8.939 8.090 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.584 10.036 6.667 1.00 0.00 H new ATOM 0 HB ILE A 41 -12.274 7.811 8.684 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.797 6.536 6.934 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -13.343 6.915 6.201 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -14.614 7.130 8.189 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -14.532 8.712 8.999 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -14.832 8.625 7.247 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -11.502 7.399 4.665 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -12.353 8.898 5.108 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.783 8.513 5.852 1.00 0.00 H new ATOM 620 N ASN A 42 -12.841 10.114 9.995 1.00 0.00 N ATOM 621 CA ASN A 42 -13.410 10.845 11.121 1.00 0.00 C ATOM 622 C ASN A 42 -13.158 12.341 10.963 1.00 0.00 C ATOM 623 O ASN A 42 -14.013 13.168 11.281 1.00 0.00 O ATOM 624 CB ASN A 42 -12.787 10.361 12.433 1.00 0.00 C ATOM 625 CG ASN A 42 -12.808 8.851 12.570 1.00 0.00 C ATOM 626 OD1 ASN A 42 -13.709 8.181 12.067 1.00 0.00 O ATOM 627 ND2 ASN A 42 -11.809 8.311 13.258 1.00 0.00 N ATOM 0 H ASN A 42 -12.334 9.268 10.254 1.00 0.00 H new ATOM 0 HA ASN A 42 -14.484 10.663 11.142 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.757 10.713 12.493 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -13.324 10.805 13.271 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -11.767 7.300 13.387 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -11.084 8.907 13.657 1.00 0.00 H new ATOM 634 N LYS A 43 -11.965 12.673 10.481 1.00 0.00 N ATOM 635 CA LYS A 43 -11.572 14.067 10.288 1.00 0.00 C ATOM 636 C LYS A 43 -12.011 14.630 8.930 1.00 0.00 C ATOM 637 O LYS A 43 -12.054 15.847 8.751 1.00 0.00 O ATOM 638 CB LYS A 43 -10.056 14.195 10.416 1.00 0.00 C ATOM 639 CG LYS A 43 -9.579 15.621 10.638 1.00 0.00 C ATOM 640 CD LYS A 43 -8.067 15.690 10.767 1.00 0.00 C ATOM 641 CE LYS A 43 -7.385 15.576 9.413 1.00 0.00 C ATOM 642 NZ LYS A 43 -6.854 14.206 9.173 1.00 0.00 N ATOM 0 H LYS A 43 -11.251 11.995 10.216 1.00 0.00 H new ATOM 0 HA LYS A 43 -12.077 14.648 11.060 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -9.717 13.575 11.246 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -9.590 13.802 9.513 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.903 16.247 9.807 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.041 16.024 11.540 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.784 16.630 11.240 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.720 14.888 11.419 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -8.094 15.834 8.626 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.569 16.297 9.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -5.837 14.260 8.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -7.004 13.622 10.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.351 13.778 8.366 1.00 0.00 H new ATOM 656 N ALA A 44 -12.312 13.760 7.968 1.00 0.00 N ATOM 657 CA ALA A 44 -12.713 14.212 6.640 1.00 0.00 C ATOM 658 C ALA A 44 -14.194 14.551 6.578 1.00 0.00 C ATOM 659 O ALA A 44 -14.559 15.702 6.353 1.00 0.00 O ATOM 660 CB ALA A 44 -12.366 13.172 5.592 1.00 0.00 C ATOM 0 H ALA A 44 -12.286 12.747 8.083 1.00 0.00 H new ATOM 0 HA ALA A 44 -12.157 15.125 6.429 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -12.674 13.529 4.609 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -11.290 12.998 5.594 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -12.885 12.240 5.818 1.00 0.00 H new ATOM 666 N GLU A 45 -15.050 13.552 6.772 1.00 0.00 N ATOM 667 CA GLU A 45 -16.492 13.779 6.731 1.00 0.00 C ATOM 668 C GLU A 45 -16.870 14.952 7.625 1.00 0.00 C ATOM 669 O GLU A 45 -17.795 15.706 7.324 1.00 0.00 O ATOM 670 CB GLU A 45 -17.247 12.524 7.157 1.00 0.00 C ATOM 671 CG GLU A 45 -17.480 11.559 6.013 1.00 0.00 C ATOM 672 CD GLU A 45 -18.924 11.538 5.547 1.00 0.00 C ATOM 673 OE1 GLU A 45 -19.821 11.778 6.381 1.00 0.00 O ATOM 674 OE2 GLU A 45 -19.155 11.284 4.345 1.00 0.00 O ATOM 0 H GLU A 45 -14.775 12.587 6.957 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.772 14.017 5.705 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.687 12.019 7.944 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.208 12.812 7.584 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -16.837 11.832 5.176 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.189 10.556 6.325 1.00 0.00 H new ATOM 681 N GLU A 46 -16.124 15.114 8.711 1.00 0.00 N ATOM 682 CA GLU A 46 -16.356 16.212 9.636 1.00 0.00 C ATOM 683 C GLU A 46 -16.118 17.536 8.925 1.00 0.00 C ATOM 684 O GLU A 46 -16.708 18.555 9.277 1.00 0.00 O ATOM 685 CB GLU A 46 -15.436 16.094 10.852 1.00 0.00 C ATOM 686 CG GLU A 46 -16.018 15.251 11.975 1.00 0.00 C ATOM 687 CD GLU A 46 -16.708 16.087 13.035 1.00 0.00 C ATOM 688 OE1 GLU A 46 -16.081 17.041 13.541 1.00 0.00 O ATOM 689 OE2 GLU A 46 -17.877 15.790 13.357 1.00 0.00 O ATOM 0 H GLU A 46 -15.354 14.498 8.971 1.00 0.00 H new ATOM 0 HA GLU A 46 -17.388 16.169 9.983 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -14.486 15.661 10.538 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -15.220 17.092 11.232 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -16.731 14.539 11.558 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -15.221 14.670 12.438 1.00 0.00 H new ATOM 696 N VAL A 47 -15.256 17.499 7.909 1.00 0.00 N ATOM 697 CA VAL A 47 -14.940 18.679 7.120 1.00 0.00 C ATOM 698 C VAL A 47 -15.793 18.715 5.853 1.00 0.00 C ATOM 699 O VAL A 47 -16.302 19.763 5.464 1.00 0.00 O ATOM 700 CB VAL A 47 -13.428 18.737 6.768 1.00 0.00 C ATOM 701 CG1 VAL A 47 -13.182 18.875 5.270 1.00 0.00 C ATOM 702 CG2 VAL A 47 -12.774 19.889 7.502 1.00 0.00 C ATOM 0 H VAL A 47 -14.763 16.656 7.615 1.00 0.00 H new ATOM 0 HA VAL A 47 -15.172 19.558 7.721 1.00 0.00 H new ATOM 0 HB VAL A 47 -12.987 17.792 7.083 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -12.109 18.911 5.079 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -13.615 18.020 4.750 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -13.646 19.793 4.908 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.714 19.925 7.252 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -13.249 20.825 7.207 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -12.888 19.747 8.577 1.00 0.00 H new ATOM 712 N PHE A 48 -15.946 17.554 5.215 1.00 0.00 N ATOM 713 CA PHE A 48 -16.738 17.446 3.992 1.00 0.00 C ATOM 714 C PHE A 48 -18.081 18.151 4.153 1.00 0.00 C ATOM 715 O PHE A 48 -18.476 18.956 3.309 1.00 0.00 O ATOM 716 CB PHE A 48 -16.958 15.973 3.630 1.00 0.00 C ATOM 717 CG PHE A 48 -17.957 15.762 2.525 1.00 0.00 C ATOM 718 CD1 PHE A 48 -17.758 16.325 1.276 1.00 0.00 C ATOM 719 CD2 PHE A 48 -19.096 15.002 2.741 1.00 0.00 C ATOM 720 CE1 PHE A 48 -18.677 16.135 0.261 1.00 0.00 C ATOM 721 CE2 PHE A 48 -20.017 14.808 1.730 1.00 0.00 C ATOM 722 CZ PHE A 48 -19.807 15.375 0.488 1.00 0.00 C ATOM 0 H PHE A 48 -15.531 16.676 5.526 1.00 0.00 H new ATOM 0 HA PHE A 48 -16.188 17.931 3.186 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -16.005 15.535 3.334 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -17.293 15.437 4.518 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -16.875 16.919 1.093 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -19.265 14.557 3.710 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -18.511 16.581 -0.709 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -20.900 14.214 1.910 1.00 0.00 H new ATOM 0 HZ PHE A 48 -20.526 15.224 -0.304 1.00 0.00 H new ATOM 732 N ASN A 49 -18.773 17.846 5.243 1.00 0.00 N ATOM 733 CA ASN A 49 -20.068 18.457 5.515 1.00 0.00 C ATOM 734 C ASN A 49 -19.914 19.679 6.416 1.00 0.00 C ATOM 735 O ASN A 49 -20.884 20.146 7.013 1.00 0.00 O ATOM 736 CB ASN A 49 -21.007 17.442 6.170 1.00 0.00 C ATOM 737 CG ASN A 49 -20.418 16.836 7.428 1.00 0.00 C ATOM 738 OD1 ASN A 49 -19.990 17.552 8.334 1.00 0.00 O ATOM 739 ND2 ASN A 49 -20.391 15.510 7.491 1.00 0.00 N ATOM 0 H ASN A 49 -18.461 17.182 5.951 1.00 0.00 H new ATOM 0 HA ASN A 49 -20.497 18.779 4.566 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -21.951 17.929 6.413 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -21.232 16.648 5.458 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -20.005 15.046 8.313 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -20.757 14.955 6.717 1.00 0.00 H new ATOM 746 N LYS A 50 -18.688 20.190 6.519 1.00 0.00 N ATOM 747 CA LYS A 50 -18.416 21.353 7.361 1.00 0.00 C ATOM 748 C LYS A 50 -18.553 22.659 6.584 1.00 0.00 C ATOM 749 O LYS A 50 -18.549 22.666 5.352 1.00 0.00 O ATOM 750 CB LYS A 50 -17.013 21.249 7.946 1.00 0.00 C ATOM 751 CG LYS A 50 -16.806 22.053 9.217 1.00 0.00 C ATOM 752 CD LYS A 50 -15.406 21.851 9.774 1.00 0.00 C ATOM 753 CE LYS A 50 -14.751 23.174 10.142 1.00 0.00 C ATOM 754 NZ LYS A 50 -14.290 23.191 11.558 1.00 0.00 N ATOM 0 H LYS A 50 -17.872 19.819 6.033 1.00 0.00 H new ATOM 0 HA LYS A 50 -19.154 21.362 8.163 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -16.795 20.201 8.153 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -16.294 21.583 7.198 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -16.969 23.111 9.012 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -17.543 21.755 9.963 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -15.454 21.211 10.655 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -14.792 21.334 9.037 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -13.903 23.355 9.482 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -15.459 23.987 9.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -13.850 24.109 11.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -15.103 23.044 12.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -13.595 22.432 11.706 1.00 0.00 H new ATOM 768 N GLU A 51 -18.664 23.766 7.316 1.00 0.00 N ATOM 769 CA GLU A 51 -18.792 25.083 6.703 1.00 0.00 C ATOM 770 C GLU A 51 -17.430 25.715 6.501 1.00 0.00 C ATOM 771 O GLU A 51 -17.217 26.440 5.528 1.00 0.00 O ATOM 772 CB GLU A 51 -19.680 25.992 7.554 1.00 0.00 C ATOM 773 CG GLU A 51 -20.984 25.339 7.984 1.00 0.00 C ATOM 774 CD GLU A 51 -22.169 25.808 7.163 1.00 0.00 C ATOM 775 OE1 GLU A 51 -21.967 26.185 5.990 1.00 0.00 O ATOM 776 OE2 GLU A 51 -23.300 25.799 7.694 1.00 0.00 O ATOM 0 H GLU A 51 -18.668 23.775 8.336 1.00 0.00 H new ATOM 0 HA GLU A 51 -19.262 24.958 5.727 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -19.127 26.299 8.442 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -19.905 26.897 6.990 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.891 24.257 7.895 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -21.166 25.558 9.036 1.00 0.00 H new ATOM 783 N ASP A 52 -16.493 25.424 7.394 1.00 0.00 N ATOM 784 CA ASP A 52 -15.154 25.963 7.246 1.00 0.00 C ATOM 785 C ASP A 52 -14.331 25.082 6.327 1.00 0.00 C ATOM 786 O ASP A 52 -13.113 25.224 6.243 1.00 0.00 O ATOM 787 CB ASP A 52 -14.440 26.134 8.583 1.00 0.00 C ATOM 788 CG ASP A 52 -15.358 26.644 9.678 1.00 0.00 C ATOM 789 OD1 ASP A 52 -16.405 26.007 9.920 1.00 0.00 O ATOM 790 OD2 ASP A 52 -15.030 27.680 10.292 1.00 0.00 O ATOM 0 H ASP A 52 -16.633 24.830 8.211 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.258 26.955 6.807 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -14.015 25.178 8.888 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -13.608 26.828 8.460 1.00 0.00 H new ATOM 795 N ALA A 53 -15.010 24.205 5.596 1.00 0.00 N ATOM 796 CA ALA A 53 -14.354 23.346 4.642 1.00 0.00 C ATOM 797 C ALA A 53 -14.039 24.178 3.419 1.00 0.00 C ATOM 798 O ALA A 53 -14.354 23.816 2.289 1.00 0.00 O ATOM 799 CB ALA A 53 -15.233 22.159 4.293 1.00 0.00 C ATOM 0 H ALA A 53 -16.020 24.077 5.653 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.434 22.940 5.062 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.718 21.524 3.572 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.444 21.585 5.195 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -16.169 22.514 3.861 1.00 0.00 H new ATOM 805 N THR A 54 -13.438 25.324 3.691 1.00 0.00 N ATOM 806 CA THR A 54 -13.065 26.285 2.675 1.00 0.00 C ATOM 807 C THR A 54 -11.633 26.054 2.214 1.00 0.00 C ATOM 808 O THR A 54 -11.262 24.954 1.810 1.00 0.00 O ATOM 809 CB THR A 54 -13.256 27.700 3.236 1.00 0.00 C ATOM 810 OG1 THR A 54 -12.241 28.012 4.176 1.00 0.00 O ATOM 811 CG2 THR A 54 -14.591 27.891 3.927 1.00 0.00 C ATOM 0 H THR A 54 -13.193 25.614 4.638 1.00 0.00 H new ATOM 0 HA THR A 54 -13.704 26.163 1.800 1.00 0.00 H new ATOM 0 HB THR A 54 -13.209 28.362 2.371 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.381 28.919 4.520 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.664 28.912 4.301 1.00 0.00 H new ATOM 0 HG22 THR A 54 -15.398 27.706 3.218 1.00 0.00 H new ATOM 0 HG23 THR A 54 -14.673 27.192 4.760 1.00 0.00 H new ATOM 819 N GLU A 55 -10.846 27.098 2.266 1.00 0.00 N ATOM 820 CA GLU A 55 -9.451 27.031 1.844 1.00 0.00 C ATOM 821 C GLU A 55 -8.530 26.616 2.990 1.00 0.00 C ATOM 822 O GLU A 55 -7.363 26.298 2.770 1.00 0.00 O ATOM 823 CB GLU A 55 -9.005 28.385 1.286 1.00 0.00 C ATOM 824 CG GLU A 55 -9.479 28.643 -0.135 1.00 0.00 C ATOM 825 CD GLU A 55 -8.868 29.895 -0.733 1.00 0.00 C ATOM 826 OE1 GLU A 55 -9.207 31.002 -0.267 1.00 0.00 O ATOM 827 OE2 GLU A 55 -8.050 29.767 -1.669 1.00 0.00 O ATOM 0 H GLU A 55 -11.141 28.016 2.598 1.00 0.00 H new ATOM 0 HA GLU A 55 -9.380 26.271 1.066 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -9.379 29.177 1.935 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -7.917 28.439 1.313 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -9.227 27.786 -0.760 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -10.565 28.734 -0.141 1.00 0.00 H new ATOM 834 N GLU A 56 -9.042 26.646 4.216 1.00 0.00 N ATOM 835 CA GLU A 56 -8.237 26.289 5.381 1.00 0.00 C ATOM 836 C GLU A 56 -8.446 24.842 5.837 1.00 0.00 C ATOM 837 O GLU A 56 -7.491 24.073 5.945 1.00 0.00 O ATOM 838 CB GLU A 56 -8.540 27.240 6.541 1.00 0.00 C ATOM 839 CG GLU A 56 -7.416 28.220 6.830 1.00 0.00 C ATOM 840 CD GLU A 56 -7.067 29.079 5.630 1.00 0.00 C ATOM 841 OE1 GLU A 56 -6.410 28.564 4.702 1.00 0.00 O ATOM 842 OE2 GLU A 56 -7.453 30.268 5.619 1.00 0.00 O ATOM 0 H GLU A 56 -10.003 26.912 4.429 1.00 0.00 H new ATOM 0 HA GLU A 56 -7.194 26.382 5.077 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -9.449 27.798 6.315 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.740 26.654 7.438 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.705 28.864 7.661 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.531 27.668 7.147 1.00 0.00 H new ATOM 849 N GLU A 57 -9.689 24.502 6.168 1.00 0.00 N ATOM 850 CA GLU A 57 -10.023 23.174 6.693 1.00 0.00 C ATOM 851 C GLU A 57 -9.916 22.034 5.673 1.00 0.00 C ATOM 852 O GLU A 57 -9.548 20.920 6.041 1.00 0.00 O ATOM 853 CB GLU A 57 -11.430 23.198 7.287 1.00 0.00 C ATOM 854 CG GLU A 57 -11.567 22.379 8.558 1.00 0.00 C ATOM 855 CD GLU A 57 -11.141 23.144 9.796 1.00 0.00 C ATOM 856 OE1 GLU A 57 -11.470 24.345 9.893 1.00 0.00 O ATOM 857 OE2 GLU A 57 -10.477 22.543 10.666 1.00 0.00 O ATOM 0 H GLU A 57 -10.488 25.130 6.082 1.00 0.00 H new ATOM 0 HA GLU A 57 -9.274 22.960 7.455 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -11.709 24.230 7.498 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -12.135 22.823 6.545 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.604 22.062 8.671 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.965 21.475 8.469 1.00 0.00 H new ATOM 864 N ILE A 58 -10.256 22.282 4.412 1.00 0.00 N ATOM 865 CA ILE A 58 -10.202 21.223 3.404 1.00 0.00 C ATOM 866 C ILE A 58 -8.803 20.643 3.278 1.00 0.00 C ATOM 867 O ILE A 58 -8.564 19.495 3.645 1.00 0.00 O ATOM 868 CB ILE A 58 -10.670 21.717 2.027 1.00 0.00 C ATOM 869 CG1 ILE A 58 -12.067 22.323 2.148 1.00 0.00 C ATOM 870 CG2 ILE A 58 -10.659 20.577 1.014 1.00 0.00 C ATOM 871 CD1 ILE A 58 -12.696 22.697 0.825 1.00 0.00 C ATOM 0 H ILE A 58 -10.567 23.190 4.065 1.00 0.00 H new ATOM 0 HA ILE A 58 -10.882 20.443 3.745 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.982 22.484 1.672 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -12.717 21.612 2.658 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -12.012 23.212 2.776 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -10.994 20.948 0.045 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -9.647 20.182 0.922 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -11.328 19.785 1.350 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -13.685 23.120 0.999 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -12.071 23.433 0.320 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -12.786 21.808 0.201 1.00 0.00 H new ATOM 883 N ASN A 59 -7.878 21.441 2.761 1.00 0.00 N ATOM 884 CA ASN A 59 -6.496 20.988 2.599 1.00 0.00 C ATOM 885 C ASN A 59 -5.987 20.408 3.912 1.00 0.00 C ATOM 886 O ASN A 59 -5.132 19.523 3.930 1.00 0.00 O ATOM 887 CB ASN A 59 -5.578 22.131 2.150 1.00 0.00 C ATOM 888 CG ASN A 59 -6.269 23.114 1.228 1.00 0.00 C ATOM 889 OD1 ASN A 59 -6.202 22.992 0.004 1.00 0.00 O ATOM 890 ND2 ASN A 59 -6.937 24.095 1.817 1.00 0.00 N ATOM 0 H ASN A 59 -8.053 22.396 2.448 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.483 20.221 1.825 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.210 22.661 3.028 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.708 21.714 1.642 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.425 24.791 1.253 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -6.964 24.154 2.835 1.00 0.00 H new ATOM 897 N LEU A 60 -6.538 20.915 5.009 1.00 0.00 N ATOM 898 CA LEU A 60 -6.171 20.461 6.338 1.00 0.00 C ATOM 899 C LEU A 60 -6.799 19.099 6.625 1.00 0.00 C ATOM 900 O LEU A 60 -6.217 18.273 7.329 1.00 0.00 O ATOM 901 CB LEU A 60 -6.628 21.486 7.377 1.00 0.00 C ATOM 902 CG LEU A 60 -5.524 22.391 7.928 1.00 0.00 C ATOM 903 CD1 LEU A 60 -6.077 23.771 8.256 1.00 0.00 C ATOM 904 CD2 LEU A 60 -4.887 21.762 9.158 1.00 0.00 C ATOM 0 H LEU A 60 -7.247 21.648 4.999 1.00 0.00 H new ATOM 0 HA LEU A 60 -5.087 20.359 6.392 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.400 22.112 6.931 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -7.090 20.955 8.209 1.00 0.00 H new ATOM 0 HG LEU A 60 -4.756 22.505 7.163 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -5.277 24.400 8.646 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.486 24.223 7.353 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.864 23.679 9.004 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.104 22.418 9.538 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.645 21.619 9.928 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.455 20.798 8.891 1.00 0.00 H new ATOM 916 N ALA A 61 -7.994 18.875 6.080 1.00 0.00 N ATOM 917 CA ALA A 61 -8.702 17.616 6.283 1.00 0.00 C ATOM 918 C ALA A 61 -8.389 16.602 5.181 1.00 0.00 C ATOM 919 O ALA A 61 -8.609 15.403 5.350 1.00 0.00 O ATOM 920 CB ALA A 61 -10.198 17.872 6.350 1.00 0.00 C ATOM 0 H ALA A 61 -8.490 19.549 5.496 1.00 0.00 H new ATOM 0 HA ALA A 61 -8.361 17.189 7.226 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.722 16.928 6.502 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -10.415 18.545 7.179 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -10.532 18.326 5.417 1.00 0.00 H new ATOM 926 N LYS A 62 -7.887 17.089 4.050 1.00 0.00 N ATOM 927 CA LYS A 62 -7.558 16.227 2.920 1.00 0.00 C ATOM 928 C LYS A 62 -6.165 15.613 3.072 1.00 0.00 C ATOM 929 O LYS A 62 -5.871 14.569 2.490 1.00 0.00 O ATOM 930 CB LYS A 62 -7.650 17.021 1.608 1.00 0.00 C ATOM 931 CG LYS A 62 -6.344 17.675 1.177 1.00 0.00 C ATOM 932 CD LYS A 62 -6.521 18.491 -0.091 1.00 0.00 C ATOM 933 CE LYS A 62 -5.181 18.882 -0.694 1.00 0.00 C ATOM 934 NZ LYS A 62 -4.742 20.233 -0.246 1.00 0.00 N ATOM 0 H LYS A 62 -7.699 18.079 3.892 1.00 0.00 H new ATOM 0 HA LYS A 62 -8.280 15.411 2.897 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.987 16.353 0.816 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.411 17.794 1.718 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -5.977 18.319 1.977 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -5.588 16.907 1.014 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -7.094 17.916 -0.818 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -7.097 19.389 0.131 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.428 18.145 -0.414 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.254 18.866 -1.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -4.096 20.640 -0.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -5.572 20.850 -0.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -4.250 20.153 0.667 1.00 0.00 H new ATOM 948 N GLU A 63 -5.309 16.276 3.848 1.00 0.00 N ATOM 949 CA GLU A 63 -3.941 15.810 4.070 1.00 0.00 C ATOM 950 C GLU A 63 -3.889 14.306 4.337 1.00 0.00 C ATOM 951 O GLU A 63 -3.140 13.578 3.686 1.00 0.00 O ATOM 952 CB GLU A 63 -3.311 16.565 5.242 1.00 0.00 C ATOM 953 CG GLU A 63 -2.608 17.848 4.832 1.00 0.00 C ATOM 954 CD GLU A 63 -1.241 17.597 4.225 1.00 0.00 C ATOM 955 OE1 GLU A 63 -0.522 16.709 4.730 1.00 0.00 O ATOM 956 OE2 GLU A 63 -0.890 18.286 3.245 1.00 0.00 O ATOM 0 H GLU A 63 -5.540 17.142 4.336 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.376 16.008 3.159 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.087 16.802 5.970 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.595 15.912 5.741 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -3.228 18.383 4.113 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.501 18.494 5.704 1.00 0.00 H new ATOM 963 N SER A 64 -4.682 13.849 5.298 1.00 0.00 N ATOM 964 CA SER A 64 -4.719 12.437 5.650 1.00 0.00 C ATOM 965 C SER A 64 -5.741 11.678 4.807 1.00 0.00 C ATOM 966 O SER A 64 -5.748 10.453 4.791 1.00 0.00 O ATOM 967 CB SER A 64 -5.046 12.271 7.135 1.00 0.00 C ATOM 968 OG SER A 64 -4.763 10.954 7.576 1.00 0.00 O ATOM 0 H SER A 64 -5.308 14.437 5.848 1.00 0.00 H new ATOM 0 HA SER A 64 -3.733 12.018 5.447 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.467 12.986 7.720 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.099 12.497 7.306 1.00 0.00 H new ATOM 0 HG SER A 64 -4.979 10.874 8.529 1.00 0.00 H new ATOM 974 N LEU A 65 -6.602 12.406 4.105 1.00 0.00 N ATOM 975 CA LEU A 65 -7.613 11.780 3.270 1.00 0.00 C ATOM 976 C LEU A 65 -6.972 11.176 2.037 1.00 0.00 C ATOM 977 O LEU A 65 -7.376 10.118 1.565 1.00 0.00 O ATOM 978 CB LEU A 65 -8.672 12.803 2.865 1.00 0.00 C ATOM 979 CG LEU A 65 -10.120 12.367 3.082 1.00 0.00 C ATOM 980 CD1 LEU A 65 -11.069 13.371 2.451 1.00 0.00 C ATOM 981 CD2 LEU A 65 -10.364 10.974 2.517 1.00 0.00 C ATOM 0 H LEU A 65 -6.618 13.426 4.099 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.094 10.986 3.841 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.499 13.722 3.426 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -8.537 13.043 1.810 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.308 12.330 4.155 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -12.098 13.050 2.612 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.919 14.350 2.907 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -10.872 13.435 1.381 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -11.403 10.690 2.686 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -10.157 10.974 1.447 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.707 10.260 3.014 1.00 0.00 H new ATOM 993 N GLU A 66 -5.970 11.868 1.520 1.00 0.00 N ATOM 994 CA GLU A 66 -5.257 11.416 0.340 1.00 0.00 C ATOM 995 C GLU A 66 -3.985 10.652 0.706 1.00 0.00 C ATOM 996 O GLU A 66 -3.395 9.977 -0.137 1.00 0.00 O ATOM 997 CB GLU A 66 -4.912 12.604 -0.559 1.00 0.00 C ATOM 998 CG GLU A 66 -3.939 13.584 0.075 1.00 0.00 C ATOM 999 CD GLU A 66 -3.245 14.462 -0.949 1.00 0.00 C ATOM 1000 OE1 GLU A 66 -3.911 15.356 -1.513 1.00 0.00 O ATOM 1001 OE2 GLU A 66 -2.037 14.256 -1.185 1.00 0.00 O ATOM 0 H GLU A 66 -5.631 12.751 1.903 1.00 0.00 H new ATOM 0 HA GLU A 66 -5.914 10.734 -0.199 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -4.485 12.232 -1.490 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -5.830 13.132 -0.817 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -4.475 14.214 0.785 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -3.190 13.031 0.642 1.00 0.00 H new ATOM 1008 N GLY A 67 -3.548 10.781 1.959 1.00 0.00 N ATOM 1009 CA GLY A 67 -2.333 10.113 2.388 1.00 0.00 C ATOM 1010 C GLY A 67 -2.574 8.904 3.275 1.00 0.00 C ATOM 1011 O GLY A 67 -1.684 8.070 3.440 1.00 0.00 O ATOM 0 H GLY A 67 -4.013 11.334 2.679 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -1.773 9.799 1.507 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.708 10.827 2.925 1.00 0.00 H new ATOM 1015 N ALA A 68 -3.767 8.800 3.854 1.00 0.00 N ATOM 1016 CA ALA A 68 -4.078 7.671 4.724 1.00 0.00 C ATOM 1017 C ALA A 68 -4.645 6.503 3.926 1.00 0.00 C ATOM 1018 O ALA A 68 -4.283 5.352 4.167 1.00 0.00 O ATOM 1019 CB ALA A 68 -5.031 8.087 5.829 1.00 0.00 C ATOM 0 H ALA A 68 -4.524 9.474 3.739 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.149 7.338 5.187 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -5.248 7.229 6.465 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -4.573 8.875 6.427 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.958 8.457 5.390 1.00 0.00 H new ATOM 1025 N ILE A 69 -5.505 6.796 2.945 1.00 0.00 N ATOM 1026 CA ILE A 69 -6.061 5.743 2.105 1.00 0.00 C ATOM 1027 C ILE A 69 -4.915 5.047 1.431 1.00 0.00 C ATOM 1028 O ILE A 69 -4.849 3.820 1.362 1.00 0.00 O ATOM 1029 CB ILE A 69 -6.992 6.262 0.986 1.00 0.00 C ATOM 1030 CG1 ILE A 69 -6.598 7.674 0.544 1.00 0.00 C ATOM 1031 CG2 ILE A 69 -8.438 6.202 1.425 1.00 0.00 C ATOM 1032 CD1 ILE A 69 -7.582 8.304 -0.423 1.00 0.00 C ATOM 0 H ILE A 69 -5.824 7.738 2.719 1.00 0.00 H new ATOM 0 HA ILE A 69 -6.651 5.096 2.754 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.877 5.610 0.120 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.509 8.310 1.425 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.614 7.638 0.076 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -9.077 6.572 0.623 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -8.706 5.171 1.656 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -8.575 6.820 2.312 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.238 9.303 -0.693 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.653 7.690 -1.321 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -8.562 8.373 0.049 1.00 0.00 H new ATOM 1044 N ALA A 70 -3.999 5.871 0.947 1.00 0.00 N ATOM 1045 CA ALA A 70 -2.816 5.382 0.281 1.00 0.00 C ATOM 1046 C ALA A 70 -2.164 4.274 1.103 1.00 0.00 C ATOM 1047 O ALA A 70 -1.510 3.383 0.563 1.00 0.00 O ATOM 1048 CB ALA A 70 -1.859 6.532 0.040 1.00 0.00 C ATOM 0 H ALA A 70 -4.059 6.887 1.007 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.090 4.956 -0.684 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.965 6.162 -0.463 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -2.343 7.283 -0.585 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.580 6.979 0.994 1.00 0.00 H new ATOM 1054 N ARG A 71 -2.377 4.330 2.419 1.00 0.00 N ATOM 1055 CA ARG A 71 -1.844 3.328 3.325 1.00 0.00 C ATOM 1056 C ARG A 71 -2.743 2.095 3.327 1.00 0.00 C ATOM 1057 O ARG A 71 -2.315 1.010 2.932 1.00 0.00 O ATOM 1058 CB ARG A 71 -1.723 3.897 4.742 1.00 0.00 C ATOM 1059 CG ARG A 71 -0.288 4.022 5.226 1.00 0.00 C ATOM 1060 CD ARG A 71 0.544 4.881 4.287 1.00 0.00 C ATOM 1061 NE ARG A 71 1.543 5.668 5.006 1.00 0.00 N ATOM 1062 CZ ARG A 71 2.347 6.555 4.425 1.00 0.00 C ATOM 1063 NH1 ARG A 71 2.274 6.770 3.116 1.00 0.00 N ATOM 1064 NH2 ARG A 71 3.228 7.229 5.152 1.00 0.00 N ATOM 0 H ARG A 71 -2.918 5.064 2.876 1.00 0.00 H new ATOM 0 HA ARG A 71 -0.850 3.041 2.982 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -2.195 4.879 4.772 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -2.275 3.257 5.430 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -0.277 4.457 6.225 1.00 0.00 H new ATOM 0 HG3 ARG A 71 0.158 3.031 5.305 1.00 0.00 H new ATOM 0 HD2 ARG A 71 1.042 4.243 3.557 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -0.112 5.550 3.730 1.00 0.00 H new ATOM 0 HE ARG A 71 1.629 5.529 6.013 1.00 0.00 H new ATOM 0 HH11 ARG A 71 1.599 6.254 2.551 1.00 0.00 H new ATOM 0 HH12 ARG A 71 2.893 7.451 2.676 1.00 0.00 H new ATOM 0 HH21 ARG A 71 3.290 7.068 6.157 1.00 0.00 H new ATOM 0 HH22 ARG A 71 3.844 7.909 4.706 1.00 0.00 H new ATOM 1078 N PHE A 72 -3.996 2.259 3.767 1.00 0.00 N ATOM 1079 CA PHE A 72 -4.932 1.147 3.802 1.00 0.00 C ATOM 1080 C PHE A 72 -4.972 0.402 2.470 1.00 0.00 C ATOM 1081 O PHE A 72 -4.947 -0.828 2.439 1.00 0.00 O ATOM 1082 CB PHE A 72 -6.331 1.645 4.149 1.00 0.00 C ATOM 1083 CG PHE A 72 -7.152 0.629 4.889 1.00 0.00 C ATOM 1084 CD1 PHE A 72 -6.888 -0.725 4.765 1.00 0.00 C ATOM 1085 CD2 PHE A 72 -8.186 1.030 5.706 1.00 0.00 C ATOM 1086 CE1 PHE A 72 -7.641 -1.654 5.443 1.00 0.00 C ATOM 1087 CE2 PHE A 72 -8.948 0.102 6.389 1.00 0.00 C ATOM 1088 CZ PHE A 72 -8.675 -1.241 6.257 1.00 0.00 C ATOM 0 H PHE A 72 -4.376 3.145 4.099 1.00 0.00 H new ATOM 0 HA PHE A 72 -4.588 0.454 4.570 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -6.249 2.548 4.755 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -6.849 1.923 3.231 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -6.081 -1.055 4.128 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.404 2.082 5.814 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -7.423 -2.707 5.338 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -9.757 0.429 7.026 1.00 0.00 H new ATOM 0 HZ PHE A 72 -9.269 -1.969 6.789 1.00 0.00 H new ATOM 1098 N ASN A 73 -5.040 1.151 1.371 1.00 0.00 N ATOM 1099 CA ASN A 73 -5.093 0.553 0.037 1.00 0.00 C ATOM 1100 C ASN A 73 -4.143 -0.637 -0.070 1.00 0.00 C ATOM 1101 O ASN A 73 -4.506 -1.692 -0.589 1.00 0.00 O ATOM 1102 CB ASN A 73 -4.754 1.598 -1.027 1.00 0.00 C ATOM 1103 CG ASN A 73 -5.931 2.503 -1.340 1.00 0.00 C ATOM 1104 OD1 ASN A 73 -7.001 2.037 -1.730 1.00 0.00 O ATOM 1105 ND2 ASN A 73 -5.738 3.807 -1.168 1.00 0.00 N ATOM 0 H ASN A 73 -5.060 2.171 1.377 1.00 0.00 H new ATOM 0 HA ASN A 73 -6.108 0.193 -0.131 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -3.914 2.203 -0.685 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -4.433 1.094 -1.939 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -6.494 4.464 -1.361 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -4.834 4.150 -0.843 1.00 0.00 H new ATOM 1112 N SER A 74 -2.929 -0.459 0.435 1.00 0.00 N ATOM 1113 CA SER A 74 -1.926 -1.516 0.412 1.00 0.00 C ATOM 1114 C SER A 74 -1.690 -2.077 1.814 1.00 0.00 C ATOM 1115 O SER A 74 -0.547 -2.280 2.224 1.00 0.00 O ATOM 1116 CB SER A 74 -0.614 -0.987 -0.167 1.00 0.00 C ATOM 1117 OG SER A 74 -0.795 -0.507 -1.488 1.00 0.00 O ATOM 0 H SER A 74 -2.614 0.410 0.867 1.00 0.00 H new ATOM 0 HA SER A 74 -2.297 -2.321 -0.222 1.00 0.00 H new ATOM 0 HB2 SER A 74 -0.231 -0.186 0.465 1.00 0.00 H new ATOM 0 HB3 SER A 74 0.134 -1.780 -0.164 1.00 0.00 H new ATOM 0 HG SER A 74 0.059 -0.173 -1.834 1.00 0.00 H new ATOM 1123 N LEU A 75 -2.772 -2.313 2.554 1.00 0.00 N ATOM 1124 CA LEU A 75 -2.658 -2.835 3.914 1.00 0.00 C ATOM 1125 C LEU A 75 -3.303 -4.212 4.053 1.00 0.00 C ATOM 1126 O LEU A 75 -2.829 -5.050 4.820 1.00 0.00 O ATOM 1127 CB LEU A 75 -3.291 -1.859 4.906 1.00 0.00 C ATOM 1128 CG LEU A 75 -2.333 -1.305 5.964 1.00 0.00 C ATOM 1129 CD1 LEU A 75 -1.965 0.137 5.654 1.00 0.00 C ATOM 1130 CD2 LEU A 75 -2.947 -1.414 7.351 1.00 0.00 C ATOM 0 H LEU A 75 -3.729 -2.153 2.239 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.596 -2.944 4.136 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.718 -1.024 4.350 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -4.116 -2.361 5.411 1.00 0.00 H new ATOM 0 HG LEU A 75 -1.421 -1.902 5.944 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.284 0.511 6.418 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -1.480 0.187 4.679 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.867 0.748 5.642 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.251 -1.015 8.089 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.876 -0.845 7.383 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.154 -2.460 7.576 1.00 0.00 H new ATOM 1142 N LEU A 76 -4.369 -4.449 3.299 1.00 0.00 N ATOM 1143 CA LEU A 76 -5.068 -5.732 3.331 1.00 0.00 C ATOM 1144 C LEU A 76 -4.264 -6.781 2.582 1.00 0.00 C ATOM 1145 O LEU A 76 -4.787 -7.478 1.712 1.00 0.00 O ATOM 1146 CB LEU A 76 -6.459 -5.601 2.698 1.00 0.00 C ATOM 1147 CG LEU A 76 -6.547 -4.722 1.439 1.00 0.00 C ATOM 1148 CD1 LEU A 76 -6.782 -3.266 1.821 1.00 0.00 C ATOM 1149 CD2 LEU A 76 -5.295 -4.863 0.567 1.00 0.00 C ATOM 0 H LEU A 76 -4.771 -3.768 2.655 1.00 0.00 H new ATOM 0 HA LEU A 76 -5.181 -6.038 4.371 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -6.817 -6.599 2.446 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -7.141 -5.198 3.447 1.00 0.00 H new ATOM 0 HG LEU A 76 -7.396 -5.067 0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -6.842 -2.658 0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -7.715 -3.182 2.377 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.957 -2.915 2.441 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -5.392 -4.228 -0.314 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -4.418 -4.560 1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -5.184 -5.902 0.255 1.00 0.00 H new ATOM 1161 N ILE A 77 -2.979 -6.858 2.896 1.00 0.00 N ATOM 1162 CA ILE A 77 -2.094 -7.788 2.217 1.00 0.00 C ATOM 1163 C ILE A 77 -2.224 -7.571 0.735 1.00 0.00 C ATOM 1164 O ILE A 77 -2.592 -8.478 -0.010 1.00 0.00 O ATOM 1165 CB ILE A 77 -2.406 -9.255 2.569 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -2.699 -9.392 4.065 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -1.248 -10.155 2.161 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -1.636 -8.782 4.954 1.00 0.00 C ATOM 0 H ILE A 77 -2.529 -6.290 3.614 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.073 -7.598 2.546 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.292 -9.567 2.017 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.657 -8.919 4.283 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -2.802 -10.449 4.310 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.483 -11.188 2.416 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -1.086 -10.074 1.086 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.345 -9.848 2.688 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -1.914 -8.918 5.999 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -0.680 -9.271 4.766 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.548 -7.717 4.738 1.00 0.00 H new ATOM 1180 N GLU A 78 -1.937 -6.329 0.334 1.00 0.00 N ATOM 1181 CA GLU A 78 -2.026 -5.911 -1.055 1.00 0.00 C ATOM 1182 C GLU A 78 -2.190 -7.102 -1.973 1.00 0.00 C ATOM 1183 O GLU A 78 -1.365 -8.015 -1.990 1.00 0.00 O ATOM 1184 CB GLU A 78 -0.805 -5.086 -1.455 1.00 0.00 C ATOM 1185 CG GLU A 78 -1.171 -3.735 -2.045 1.00 0.00 C ATOM 1186 CD GLU A 78 -1.048 -3.706 -3.557 1.00 0.00 C ATOM 1187 OE1 GLU A 78 -0.172 -4.416 -4.094 1.00 0.00 O ATOM 1188 OE2 GLU A 78 -1.827 -2.974 -4.202 1.00 0.00 O ATOM 0 H GLU A 78 -1.637 -5.590 0.969 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.911 -5.282 -1.157 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -0.172 -4.935 -0.580 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.216 -5.646 -2.181 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -2.193 -3.484 -1.762 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.525 -2.969 -1.617 1.00 0.00 H new ATOM 1195 N GLU A 79 -3.279 -7.081 -2.715 1.00 0.00 N ATOM 1196 CA GLU A 79 -3.625 -8.148 -3.643 1.00 0.00 C ATOM 1197 C GLU A 79 -2.392 -8.740 -4.336 1.00 0.00 C ATOM 1198 O GLU A 79 -2.420 -9.887 -4.781 1.00 0.00 O ATOM 1199 CB GLU A 79 -4.630 -7.613 -4.662 1.00 0.00 C ATOM 1200 CG GLU A 79 -5.710 -6.740 -4.028 1.00 0.00 C ATOM 1201 CD GLU A 79 -7.092 -7.021 -4.586 1.00 0.00 C ATOM 1202 OE1 GLU A 79 -7.481 -8.207 -4.637 1.00 0.00 O ATOM 1203 OE2 GLU A 79 -7.785 -6.056 -4.971 1.00 0.00 O ATOM 0 H GLU A 79 -3.956 -6.319 -2.693 1.00 0.00 H new ATOM 0 HA GLU A 79 -4.075 -8.965 -3.079 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -4.100 -7.035 -5.419 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.102 -8.451 -5.174 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.718 -6.904 -2.950 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -5.464 -5.690 -4.189 1.00 0.00 H new ATOM 1210 N SER A 80 -1.306 -7.969 -4.411 1.00 0.00 N ATOM 1211 CA SER A 80 -0.081 -8.451 -5.035 1.00 0.00 C ATOM 1212 C SER A 80 1.177 -7.988 -4.285 1.00 0.00 C ATOM 1213 O SER A 80 2.192 -7.691 -4.915 1.00 0.00 O ATOM 1214 CB SER A 80 -0.015 -7.984 -6.490 1.00 0.00 C ATOM 1215 OG SER A 80 0.463 -6.653 -6.578 1.00 0.00 O ATOM 0 H SER A 80 -1.253 -7.017 -4.050 1.00 0.00 H new ATOM 0 HA SER A 80 -0.106 -9.540 -4.995 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.638 -8.646 -7.058 1.00 0.00 H new ATOM 0 HB3 SER A 80 -1.005 -8.049 -6.941 1.00 0.00 H new ATOM 0 HG SER A 80 1.371 -6.607 -6.213 1.00 0.00 H new ATOM 1221 N THR A 81 1.133 -7.934 -2.945 1.00 0.00 N ATOM 1222 CA THR A 81 2.309 -7.512 -2.180 1.00 0.00 C ATOM 1223 C THR A 81 3.241 -8.686 -1.892 1.00 0.00 C ATOM 1224 O THR A 81 4.290 -8.513 -1.270 1.00 0.00 O ATOM 1225 CB THR A 81 1.896 -6.851 -0.869 1.00 0.00 C ATOM 1226 OG1 THR A 81 3.027 -6.609 -0.052 1.00 0.00 O ATOM 1227 CG2 THR A 81 0.919 -7.680 -0.070 1.00 0.00 C ATOM 0 H THR A 81 0.316 -8.171 -2.383 1.00 0.00 H new ATOM 0 HA THR A 81 2.847 -6.787 -2.791 1.00 0.00 H new ATOM 0 HB THR A 81 1.410 -5.917 -1.153 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.825 -6.984 -0.479 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.665 -7.155 0.851 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.015 -7.843 -0.657 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.371 -8.641 0.173 1.00 0.00 H new ATOM 1235 N GLY A 82 2.866 -9.878 -2.350 1.00 0.00 N ATOM 1236 CA GLY A 82 3.701 -11.043 -2.129 1.00 0.00 C ATOM 1237 C GLY A 82 5.104 -10.853 -2.671 1.00 0.00 C ATOM 1238 O GLY A 82 6.042 -11.518 -2.234 1.00 0.00 O ATOM 0 H GLY A 82 2.005 -10.056 -2.867 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.751 -11.254 -1.061 1.00 0.00 H new ATOM 0 HA3 GLY A 82 3.244 -11.911 -2.604 1.00 0.00 H new ATOM 1242 N ASP A 83 5.246 -9.936 -3.625 1.00 0.00 N ATOM 1243 CA ASP A 83 6.543 -9.653 -4.230 1.00 0.00 C ATOM 1244 C ASP A 83 7.344 -8.679 -3.373 1.00 0.00 C ATOM 1245 O ASP A 83 7.427 -7.488 -3.677 1.00 0.00 O ATOM 1246 CB ASP A 83 6.359 -9.080 -5.637 1.00 0.00 C ATOM 1247 CG ASP A 83 6.345 -10.159 -6.703 1.00 0.00 C ATOM 1248 OD1 ASP A 83 7.117 -11.132 -6.573 1.00 0.00 O ATOM 1249 OD2 ASP A 83 5.562 -10.030 -7.667 1.00 0.00 O ATOM 0 H ASP A 83 4.478 -9.376 -3.995 1.00 0.00 H new ATOM 0 HA ASP A 83 7.096 -10.590 -4.296 1.00 0.00 H new ATOM 0 HB2 ASP A 83 5.425 -8.519 -5.679 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.163 -8.375 -5.848 1.00 0.00 H new ATOM 1254 N PHE A 84 7.929 -9.193 -2.298 1.00 0.00 N ATOM 1255 CA PHE A 84 8.722 -8.375 -1.388 1.00 0.00 C ATOM 1256 C PHE A 84 10.019 -7.914 -2.043 1.00 0.00 C ATOM 1257 O PHE A 84 10.291 -6.716 -2.127 1.00 0.00 O ATOM 1258 CB PHE A 84 9.033 -9.160 -0.113 1.00 0.00 C ATOM 1259 CG PHE A 84 7.901 -9.189 0.886 1.00 0.00 C ATOM 1260 CD1 PHE A 84 6.710 -8.514 0.643 1.00 0.00 C ATOM 1261 CD2 PHE A 84 8.032 -9.895 2.069 1.00 0.00 C ATOM 1262 CE1 PHE A 84 5.680 -8.546 1.562 1.00 0.00 C ATOM 1263 CE2 PHE A 84 7.003 -9.928 2.991 1.00 0.00 C ATOM 1264 CZ PHE A 84 5.827 -9.253 2.737 1.00 0.00 C ATOM 0 H PHE A 84 7.869 -10.176 -2.034 1.00 0.00 H new ATOM 0 HA PHE A 84 8.137 -7.490 -1.136 1.00 0.00 H new ATOM 0 HB2 PHE A 84 9.291 -10.184 -0.384 1.00 0.00 H new ATOM 0 HB3 PHE A 84 9.912 -8.725 0.363 1.00 0.00 H new ATOM 0 HD1 PHE A 84 6.589 -7.958 -0.275 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.949 -10.427 2.274 1.00 0.00 H new ATOM 0 HE1 PHE A 84 4.760 -8.018 1.361 1.00 0.00 H new ATOM 0 HE2 PHE A 84 7.120 -10.482 3.911 1.00 0.00 H new ATOM 0 HZ PHE A 84 5.023 -9.278 3.457 1.00 0.00 H new ATOM 1274 N ASN A 85 10.816 -8.869 -2.507 1.00 0.00 N ATOM 1275 CA ASN A 85 12.084 -8.551 -3.154 1.00 0.00 C ATOM 1276 C ASN A 85 11.862 -7.723 -4.413 1.00 0.00 C ATOM 1277 O ASN A 85 12.788 -7.089 -4.919 1.00 0.00 O ATOM 1278 CB ASN A 85 12.834 -9.837 -3.509 1.00 0.00 C ATOM 1279 CG ASN A 85 13.459 -10.497 -2.296 1.00 0.00 C ATOM 1280 OD1 ASN A 85 14.559 -10.138 -1.877 1.00 0.00 O ATOM 1281 ND2 ASN A 85 12.758 -11.470 -1.727 1.00 0.00 N ATOM 0 H ASN A 85 10.608 -9.866 -2.448 1.00 0.00 H new ATOM 0 HA ASN A 85 12.681 -7.966 -2.455 1.00 0.00 H new ATOM 0 HB2 ASN A 85 12.146 -10.536 -3.985 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.613 -9.611 -4.237 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.127 -11.953 -0.908 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.850 -11.735 -2.109 1.00 0.00 H new ATOM 1288 N GLY A 86 10.634 -7.741 -4.924 1.00 0.00 N ATOM 1289 CA GLY A 86 10.327 -6.996 -6.128 1.00 0.00 C ATOM 1290 C GLY A 86 10.911 -7.647 -7.366 1.00 0.00 C ATOM 1291 O GLY A 86 10.812 -7.105 -8.467 1.00 0.00 O ATOM 0 H GLY A 86 9.850 -8.257 -4.526 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.246 -6.915 -6.238 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.715 -5.982 -6.035 1.00 0.00 H new ATOM 1295 N ASN A 87 11.524 -8.816 -7.186 1.00 0.00 N ATOM 1296 CA ASN A 87 12.129 -9.542 -8.298 1.00 0.00 C ATOM 1297 C ASN A 87 11.082 -10.351 -9.061 1.00 0.00 C ATOM 1298 O ASN A 87 11.259 -10.652 -10.241 1.00 0.00 O ATOM 1299 CB ASN A 87 13.235 -10.469 -7.788 1.00 0.00 C ATOM 1300 CG ASN A 87 12.782 -11.325 -6.622 1.00 0.00 C ATOM 1301 OD1 ASN A 87 11.585 -11.502 -6.395 1.00 0.00 O ATOM 1302 ND2 ASN A 87 13.740 -11.861 -5.875 1.00 0.00 N ATOM 0 H ASN A 87 11.614 -9.279 -6.282 1.00 0.00 H new ATOM 0 HA ASN A 87 12.562 -8.811 -8.981 1.00 0.00 H new ATOM 0 HB2 ASN A 87 13.567 -11.114 -8.601 1.00 0.00 H new ATOM 0 HB3 ASN A 87 14.094 -9.871 -7.484 1.00 0.00 H new ATOM 0 HD21 ASN A 87 13.496 -12.446 -5.076 1.00 0.00 H new ATOM 0 HD22 ASN A 87 14.720 -11.687 -6.100 1.00 0.00 H new ATOM 1309 N GLY A 88 9.992 -10.697 -8.383 1.00 0.00 N ATOM 1310 CA GLY A 88 8.937 -11.464 -9.020 1.00 0.00 C ATOM 1311 C GLY A 88 8.980 -12.936 -8.657 1.00 0.00 C ATOM 1312 O GLY A 88 8.811 -13.799 -9.518 1.00 0.00 O ATOM 0 H GLY A 88 9.821 -10.460 -7.406 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.970 -11.052 -8.733 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.020 -11.359 -10.102 1.00 0.00 H new ATOM 1316 N LYS A 89 9.202 -13.225 -7.378 1.00 0.00 N ATOM 1317 CA LYS A 89 9.262 -14.602 -6.906 1.00 0.00 C ATOM 1318 C LYS A 89 9.004 -14.667 -5.406 1.00 0.00 C ATOM 1319 O LYS A 89 9.779 -14.136 -4.610 1.00 0.00 O ATOM 1320 CB LYS A 89 10.622 -15.221 -7.231 1.00 0.00 C ATOM 1321 CG LYS A 89 11.800 -14.350 -6.828 1.00 0.00 C ATOM 1322 CD LYS A 89 13.120 -15.086 -6.995 1.00 0.00 C ATOM 1323 CE LYS A 89 14.084 -14.766 -5.862 1.00 0.00 C ATOM 1324 NZ LYS A 89 14.911 -15.946 -5.489 1.00 0.00 N ATOM 0 H LYS A 89 9.343 -12.523 -6.651 1.00 0.00 H new ATOM 0 HA LYS A 89 8.486 -15.171 -7.418 1.00 0.00 H new ATOM 0 HB2 LYS A 89 10.703 -16.184 -6.726 1.00 0.00 H new ATOM 0 HB3 LYS A 89 10.676 -15.417 -8.302 1.00 0.00 H new ATOM 0 HG2 LYS A 89 11.808 -13.444 -7.434 1.00 0.00 H new ATOM 0 HG3 LYS A 89 11.685 -14.038 -5.790 1.00 0.00 H new ATOM 0 HD2 LYS A 89 12.937 -16.160 -7.026 1.00 0.00 H new ATOM 0 HD3 LYS A 89 13.573 -14.812 -7.948 1.00 0.00 H new ATOM 0 HE2 LYS A 89 14.736 -13.945 -6.161 1.00 0.00 H new ATOM 0 HE3 LYS A 89 13.522 -14.426 -4.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 15.612 -15.666 -4.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 14.298 -16.691 -5.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 15.402 -16.307 -6.332 1.00 0.00 H new ATOM 1338 N ILE A 90 7.909 -15.314 -5.025 1.00 0.00 N ATOM 1339 CA ILE A 90 7.550 -15.441 -3.617 1.00 0.00 C ATOM 1340 C ILE A 90 7.911 -16.818 -3.082 1.00 0.00 C ATOM 1341 O ILE A 90 7.341 -17.827 -3.497 1.00 0.00 O ATOM 1342 CB ILE A 90 6.044 -15.193 -3.384 1.00 0.00 C ATOM 1343 CG1 ILE A 90 5.500 -14.151 -4.369 1.00 0.00 C ATOM 1344 CG2 ILE A 90 5.803 -14.748 -1.950 1.00 0.00 C ATOM 1345 CD1 ILE A 90 6.415 -12.961 -4.570 1.00 0.00 C ATOM 0 H ILE A 90 7.255 -15.758 -5.670 1.00 0.00 H new ATOM 0 HA ILE A 90 8.119 -14.680 -3.082 1.00 0.00 H new ATOM 0 HB ILE A 90 5.511 -16.128 -3.557 1.00 0.00 H new ATOM 0 HG12 ILE A 90 5.327 -14.631 -5.332 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.533 -13.797 -4.011 1.00 0.00 H new ATOM 0 HG21 ILE A 90 4.738 -14.576 -1.797 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.148 -15.523 -1.266 1.00 0.00 H new ATOM 0 HG23 ILE A 90 6.351 -13.825 -1.758 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.961 -12.269 -5.280 1.00 0.00 H new ATOM 0 HD12 ILE A 90 6.568 -12.455 -3.617 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.375 -13.302 -4.958 1.00 0.00 H new ATOM 1357 N ASP A 91 8.864 -16.854 -2.156 1.00 0.00 N ATOM 1358 CA ASP A 91 9.303 -18.113 -1.561 1.00 0.00 C ATOM 1359 C ASP A 91 10.497 -17.889 -0.641 1.00 0.00 C ATOM 1360 O ASP A 91 10.380 -17.985 0.581 1.00 0.00 O ATOM 1361 CB ASP A 91 9.668 -19.124 -2.652 1.00 0.00 C ATOM 1362 CG ASP A 91 8.881 -20.414 -2.531 1.00 0.00 C ATOM 1363 OD1 ASP A 91 7.753 -20.473 -3.062 1.00 0.00 O ATOM 1364 OD2 ASP A 91 9.395 -21.367 -1.906 1.00 0.00 O ATOM 0 H ASP A 91 9.347 -16.028 -1.802 1.00 0.00 H new ATOM 0 HA ASP A 91 8.478 -18.512 -0.971 1.00 0.00 H new ATOM 0 HB2 ASP A 91 9.485 -18.680 -3.631 1.00 0.00 H new ATOM 0 HB3 ASP A 91 10.734 -19.345 -2.597 1.00 0.00 H new ATOM 1369 N ILE A 92 11.645 -17.588 -1.235 1.00 0.00 N ATOM 1370 CA ILE A 92 12.860 -17.349 -0.466 1.00 0.00 C ATOM 1371 C ILE A 92 12.801 -16.000 0.237 1.00 0.00 C ATOM 1372 O ILE A 92 13.451 -15.796 1.263 1.00 0.00 O ATOM 1373 CB ILE A 92 14.115 -17.402 -1.355 1.00 0.00 C ATOM 1374 CG1 ILE A 92 15.378 -17.244 -0.496 1.00 0.00 C ATOM 1375 CG2 ILE A 92 14.047 -16.341 -2.447 1.00 0.00 C ATOM 1376 CD1 ILE A 92 15.758 -15.808 -0.193 1.00 0.00 C ATOM 0 H ILE A 92 11.760 -17.504 -2.245 1.00 0.00 H new ATOM 0 HA ILE A 92 12.926 -18.143 0.277 1.00 0.00 H new ATOM 0 HB ILE A 92 14.159 -18.374 -1.846 1.00 0.00 H new ATOM 0 HG12 ILE A 92 15.230 -17.774 0.445 1.00 0.00 H new ATOM 0 HG13 ILE A 92 16.211 -17.727 -1.006 1.00 0.00 H new ATOM 0 HG21 ILE A 92 14.944 -16.396 -3.064 1.00 0.00 H new ATOM 0 HG22 ILE A 92 13.168 -16.514 -3.068 1.00 0.00 H new ATOM 0 HG23 ILE A 92 13.980 -15.353 -1.991 1.00 0.00 H new ATOM 0 HD11 ILE A 92 16.661 -15.792 0.418 1.00 0.00 H new ATOM 0 HD12 ILE A 92 15.942 -15.276 -1.126 1.00 0.00 H new ATOM 0 HD13 ILE A 92 14.945 -15.323 0.348 1.00 0.00 H new ATOM 1388 N GLY A 93 12.010 -15.086 -0.312 1.00 0.00 N ATOM 1389 CA GLY A 93 11.874 -13.775 0.287 1.00 0.00 C ATOM 1390 C GLY A 93 11.041 -13.801 1.557 1.00 0.00 C ATOM 1391 O GLY A 93 10.671 -12.753 2.086 1.00 0.00 O ATOM 0 H GLY A 93 11.462 -15.230 -1.160 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.863 -13.378 0.513 1.00 0.00 H new ATOM 0 HA3 GLY A 93 11.415 -13.096 -0.432 1.00 0.00 H new ATOM 1395 N ASP A 94 10.742 -15.003 2.046 1.00 0.00 N ATOM 1396 CA ASP A 94 9.948 -15.165 3.256 1.00 0.00 C ATOM 1397 C ASP A 94 10.850 -15.366 4.470 1.00 0.00 C ATOM 1398 O ASP A 94 10.685 -14.708 5.497 1.00 0.00 O ATOM 1399 CB ASP A 94 8.992 -16.357 3.093 1.00 0.00 C ATOM 1400 CG ASP A 94 8.522 -16.939 4.416 1.00 0.00 C ATOM 1401 OD1 ASP A 94 8.478 -16.191 5.416 1.00 0.00 O ATOM 1402 OD2 ASP A 94 8.197 -18.145 4.449 1.00 0.00 O ATOM 0 H ASP A 94 11.040 -15.880 1.619 1.00 0.00 H new ATOM 0 HA ASP A 94 9.363 -14.259 3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 94 8.124 -16.041 2.515 1.00 0.00 H new ATOM 0 HB3 ASP A 94 9.491 -17.137 2.518 1.00 0.00 H new ATOM 1407 N LEU A 95 11.796 -16.290 4.347 1.00 0.00 N ATOM 1408 CA LEU A 95 12.716 -16.590 5.438 1.00 0.00 C ATOM 1409 C LEU A 95 14.063 -15.902 5.237 1.00 0.00 C ATOM 1410 O LEU A 95 15.097 -16.408 5.674 1.00 0.00 O ATOM 1411 CB LEU A 95 12.917 -18.101 5.559 1.00 0.00 C ATOM 1412 CG LEU A 95 11.912 -18.818 6.462 1.00 0.00 C ATOM 1413 CD1 LEU A 95 12.070 -18.362 7.903 1.00 0.00 C ATOM 1414 CD2 LEU A 95 10.492 -18.574 5.976 1.00 0.00 C ATOM 0 H LEU A 95 11.946 -16.844 3.504 1.00 0.00 H new ATOM 0 HA LEU A 95 12.275 -16.209 6.359 1.00 0.00 H new ATOM 0 HB2 LEU A 95 12.865 -18.540 4.563 1.00 0.00 H new ATOM 0 HB3 LEU A 95 13.922 -18.289 5.938 1.00 0.00 H new ATOM 0 HG LEU A 95 12.111 -19.889 6.418 1.00 0.00 H new ATOM 0 HD11 LEU A 95 11.347 -18.883 8.531 1.00 0.00 H new ATOM 0 HD12 LEU A 95 13.079 -18.588 8.248 1.00 0.00 H new ATOM 0 HD13 LEU A 95 11.898 -17.288 7.966 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.790 -19.091 6.630 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.281 -17.505 5.991 1.00 0.00 H new ATOM 0 HD23 LEU A 95 10.386 -18.951 4.959 1.00 0.00 H new ATOM 1426 N ALA A 96 14.054 -14.752 4.568 1.00 0.00 N ATOM 1427 CA ALA A 96 15.292 -14.022 4.317 1.00 0.00 C ATOM 1428 C ALA A 96 15.054 -12.540 4.020 1.00 0.00 C ATOM 1429 O ALA A 96 15.918 -11.705 4.289 1.00 0.00 O ATOM 1430 CB ALA A 96 16.049 -14.666 3.166 1.00 0.00 C ATOM 0 H ALA A 96 13.214 -14.310 4.194 1.00 0.00 H new ATOM 0 HA ALA A 96 15.885 -14.074 5.230 1.00 0.00 H new ATOM 0 HB1 ALA A 96 16.972 -14.116 2.984 1.00 0.00 H new ATOM 0 HB2 ALA A 96 16.286 -15.699 3.420 1.00 0.00 H new ATOM 0 HB3 ALA A 96 15.432 -14.646 2.268 1.00 0.00 H new ATOM 1436 N MET A 97 13.901 -12.213 3.444 1.00 0.00 N ATOM 1437 CA MET A 97 13.595 -10.828 3.098 1.00 0.00 C ATOM 1438 C MET A 97 12.888 -10.083 4.229 1.00 0.00 C ATOM 1439 O MET A 97 13.477 -9.226 4.887 1.00 0.00 O ATOM 1440 CB MET A 97 12.728 -10.779 1.836 1.00 0.00 C ATOM 1441 CG MET A 97 13.331 -9.969 0.700 1.00 0.00 C ATOM 1442 SD MET A 97 13.910 -8.344 1.225 1.00 0.00 S ATOM 1443 CE MET A 97 13.709 -7.413 -0.289 1.00 0.00 C ATOM 0 H MET A 97 13.168 -12.882 3.208 1.00 0.00 H new ATOM 0 HA MET A 97 14.548 -10.329 2.920 1.00 0.00 H new ATOM 0 HB2 MET A 97 12.553 -11.797 1.489 1.00 0.00 H new ATOM 0 HB3 MET A 97 11.756 -10.358 2.092 1.00 0.00 H new ATOM 0 HG2 MET A 97 14.164 -10.523 0.268 1.00 0.00 H new ATOM 0 HG3 MET A 97 12.587 -9.847 -0.087 1.00 0.00 H new ATOM 0 HE1 MET A 97 13.713 -6.347 -0.064 1.00 0.00 H new ATOM 0 HE2 MET A 97 14.529 -7.643 -0.969 1.00 0.00 H new ATOM 0 HE3 MET A 97 12.762 -7.681 -0.758 1.00 0.00 H new ATOM 1453 N VAL A 98 11.607 -10.383 4.415 1.00 0.00 N ATOM 1454 CA VAL A 98 10.794 -9.714 5.426 1.00 0.00 C ATOM 1455 C VAL A 98 11.295 -9.946 6.854 1.00 0.00 C ATOM 1456 O VAL A 98 11.741 -9.008 7.514 1.00 0.00 O ATOM 1457 CB VAL A 98 9.303 -10.118 5.304 1.00 0.00 C ATOM 1458 CG1 VAL A 98 9.144 -11.625 5.191 1.00 0.00 C ATOM 1459 CG2 VAL A 98 8.473 -9.578 6.463 1.00 0.00 C ATOM 0 H VAL A 98 11.106 -11.089 3.876 1.00 0.00 H new ATOM 0 HA VAL A 98 10.890 -8.646 5.228 1.00 0.00 H new ATOM 0 HB VAL A 98 8.927 -9.666 4.386 1.00 0.00 H new ATOM 0 HG11 VAL A 98 8.086 -11.874 5.107 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.672 -11.981 4.306 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.560 -12.102 6.078 1.00 0.00 H new ATOM 0 HG21 VAL A 98 7.434 -9.883 6.340 1.00 0.00 H new ATOM 0 HG22 VAL A 98 8.859 -9.974 7.402 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.532 -8.490 6.477 1.00 0.00 H new ATOM 1469 N SER A 99 11.200 -11.175 7.347 1.00 0.00 N ATOM 1470 CA SER A 99 11.620 -11.470 8.713 1.00 0.00 C ATOM 1471 C SER A 99 13.035 -10.978 9.021 1.00 0.00 C ATOM 1472 O SER A 99 13.426 -10.915 10.187 1.00 0.00 O ATOM 1473 CB SER A 99 11.521 -12.959 9.013 1.00 0.00 C ATOM 1474 OG SER A 99 12.532 -13.690 8.341 1.00 0.00 O ATOM 0 H SER A 99 10.840 -11.976 6.829 1.00 0.00 H new ATOM 0 HA SER A 99 10.932 -10.924 9.359 1.00 0.00 H new ATOM 0 HB2 SER A 99 11.605 -13.122 10.087 1.00 0.00 H new ATOM 0 HB3 SER A 99 10.541 -13.328 8.711 1.00 0.00 H new ATOM 0 HG SER A 99 12.444 -14.642 8.554 1.00 0.00 H new ATOM 1480 N LYS A 100 13.811 -10.649 7.992 1.00 0.00 N ATOM 1481 CA LYS A 100 15.178 -10.191 8.209 1.00 0.00 C ATOM 1482 C LYS A 100 15.232 -8.751 8.707 1.00 0.00 C ATOM 1483 O LYS A 100 15.941 -8.455 9.670 1.00 0.00 O ATOM 1484 CB LYS A 100 16.024 -10.380 6.939 1.00 0.00 C ATOM 1485 CG LYS A 100 16.157 -9.141 6.063 1.00 0.00 C ATOM 1486 CD LYS A 100 17.261 -8.220 6.560 1.00 0.00 C ATOM 1487 CE LYS A 100 17.267 -6.899 5.810 1.00 0.00 C ATOM 1488 NZ LYS A 100 18.559 -6.664 5.108 1.00 0.00 N ATOM 0 H LYS A 100 13.522 -10.690 7.015 1.00 0.00 H new ATOM 0 HA LYS A 100 15.607 -10.809 8.998 1.00 0.00 H new ATOM 0 HB2 LYS A 100 17.021 -10.709 7.231 1.00 0.00 H new ATOM 0 HB3 LYS A 100 15.585 -11.181 6.344 1.00 0.00 H new ATOM 0 HG2 LYS A 100 16.367 -9.441 5.037 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.210 -8.601 6.049 1.00 0.00 H new ATOM 0 HD2 LYS A 100 17.128 -8.033 7.626 1.00 0.00 H new ATOM 0 HD3 LYS A 100 18.227 -8.711 6.441 1.00 0.00 H new ATOM 0 HE2 LYS A 100 16.453 -6.890 5.085 1.00 0.00 H new ATOM 0 HE3 LYS A 100 17.080 -6.084 6.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.522 -5.752 4.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 19.333 -6.647 5.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 18.725 -7.428 4.422 1.00 0.00 H new ATOM 1502 N ASN A 101 14.480 -7.858 8.078 1.00 0.00 N ATOM 1503 CA ASN A 101 14.463 -6.471 8.506 1.00 0.00 C ATOM 1504 C ASN A 101 13.648 -6.369 9.777 1.00 0.00 C ATOM 1505 O ASN A 101 14.129 -5.916 10.815 1.00 0.00 O ATOM 1506 CB ASN A 101 13.848 -5.573 7.428 1.00 0.00 C ATOM 1507 CG ASN A 101 14.548 -5.689 6.090 1.00 0.00 C ATOM 1508 OD1 ASN A 101 15.426 -4.891 5.764 1.00 0.00 O ATOM 1509 ND2 ASN A 101 14.154 -6.683 5.300 1.00 0.00 N ATOM 0 H ASN A 101 13.881 -8.068 7.279 1.00 0.00 H new ATOM 0 HA ASN A 101 15.486 -6.138 8.681 1.00 0.00 H new ATOM 0 HB2 ASN A 101 12.796 -5.831 7.305 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.885 -4.536 7.762 1.00 0.00 H new ATOM 0 HD21 ASN A 101 14.584 -6.807 4.383 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.422 -7.322 5.611 1.00 0.00 H new ATOM 1516 N ILE A 102 12.402 -6.802 9.659 1.00 0.00 N ATOM 1517 CA ILE A 102 11.444 -6.791 10.749 1.00 0.00 C ATOM 1518 C ILE A 102 11.591 -5.549 11.604 1.00 0.00 C ATOM 1519 O ILE A 102 12.456 -5.454 12.474 1.00 0.00 O ATOM 1520 CB ILE A 102 11.529 -8.066 11.613 1.00 0.00 C ATOM 1521 CG1 ILE A 102 11.087 -9.277 10.788 1.00 0.00 C ATOM 1522 CG2 ILE A 102 10.678 -7.940 12.873 1.00 0.00 C ATOM 1523 CD1 ILE A 102 9.576 -9.437 10.655 1.00 0.00 C ATOM 0 H ILE A 102 12.024 -7.176 8.789 1.00 0.00 H new ATOM 0 HA ILE A 102 10.454 -6.774 10.294 1.00 0.00 H new ATOM 0 HB ILE A 102 12.564 -8.201 11.927 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.520 -9.198 9.791 1.00 0.00 H new ATOM 0 HG13 ILE A 102 11.496 -10.179 11.243 1.00 0.00 H new ATOM 0 HG21 ILE A 102 10.759 -8.855 13.460 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.029 -7.096 13.466 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.637 -7.779 12.594 1.00 0.00 H new ATOM 0 HD11 ILE A 102 9.355 -10.320 10.055 1.00 0.00 H new ATOM 0 HD12 ILE A 102 9.134 -9.551 11.645 1.00 0.00 H new ATOM 0 HD13 ILE A 102 9.158 -8.555 10.170 1.00 0.00 H new ATOM 1535 N GLY A 103 10.717 -4.606 11.326 1.00 0.00 N ATOM 1536 CA GLY A 103 10.712 -3.346 12.044 1.00 0.00 C ATOM 1537 C GLY A 103 11.372 -2.229 11.257 1.00 0.00 C ATOM 1538 O GLY A 103 11.568 -1.129 11.774 1.00 0.00 O ATOM 0 H GLY A 103 9.998 -4.687 10.607 1.00 0.00 H new ATOM 0 HA2 GLY A 103 9.684 -3.066 12.274 1.00 0.00 H new ATOM 0 HA3 GLY A 103 11.229 -3.471 12.995 1.00 0.00 H new ATOM 1542 N SER A 104 11.716 -2.510 10.002 1.00 0.00 N ATOM 1543 CA SER A 104 12.356 -1.520 9.145 1.00 0.00 C ATOM 1544 C SER A 104 11.336 -0.523 8.609 1.00 0.00 C ATOM 1545 O SER A 104 10.377 -0.899 7.935 1.00 0.00 O ATOM 1546 CB SER A 104 13.074 -2.207 7.983 1.00 0.00 C ATOM 1547 OG SER A 104 13.377 -1.284 6.951 1.00 0.00 O ATOM 0 H SER A 104 11.562 -3.415 9.558 1.00 0.00 H new ATOM 0 HA SER A 104 13.087 -0.977 9.744 1.00 0.00 H new ATOM 0 HB2 SER A 104 13.993 -2.670 8.342 1.00 0.00 H new ATOM 0 HB3 SER A 104 12.448 -3.007 7.587 1.00 0.00 H new ATOM 0 HG SER A 104 13.162 -1.683 6.082 1.00 0.00 H new ATOM 1553 N THR A 105 11.550 0.750 8.917 1.00 0.00 N ATOM 1554 CA THR A 105 10.652 1.810 8.473 1.00 0.00 C ATOM 1555 C THR A 105 11.158 2.452 7.182 1.00 0.00 C ATOM 1556 O THR A 105 10.838 3.604 6.886 1.00 0.00 O ATOM 1557 CB THR A 105 10.504 2.874 9.566 1.00 0.00 C ATOM 1558 OG1 THR A 105 11.528 3.848 9.462 1.00 0.00 O ATOM 1559 CG2 THR A 105 10.556 2.306 10.970 1.00 0.00 C ATOM 0 H THR A 105 12.340 1.075 9.474 1.00 0.00 H new ATOM 0 HA THR A 105 9.677 1.365 8.275 1.00 0.00 H new ATOM 0 HB THR A 105 9.520 3.314 9.405 1.00 0.00 H new ATOM 0 HG1 THR A 105 11.400 4.371 8.643 1.00 0.00 H new ATOM 0 HG21 THR A 105 10.445 3.114 11.694 1.00 0.00 H new ATOM 0 HG22 THR A 105 9.747 1.587 11.102 1.00 0.00 H new ATOM 0 HG23 THR A 105 11.513 1.808 11.126 1.00 0.00 H new ATOM 1567 N THR A 106 11.946 1.702 6.416 1.00 0.00 N ATOM 1568 CA THR A 106 12.491 2.202 5.159 1.00 0.00 C ATOM 1569 C THR A 106 11.710 1.648 3.972 1.00 0.00 C ATOM 1570 O THR A 106 10.862 2.333 3.400 1.00 0.00 O ATOM 1571 CB THR A 106 13.969 1.830 5.035 1.00 0.00 C ATOM 1572 OG1 THR A 106 14.138 0.424 5.088 1.00 0.00 O ATOM 1573 CG2 THR A 106 14.833 2.437 6.119 1.00 0.00 C ATOM 0 H THR A 106 12.221 0.747 6.644 1.00 0.00 H new ATOM 0 HA THR A 106 12.399 3.288 5.156 1.00 0.00 H new ATOM 0 HB THR A 106 14.288 2.231 4.073 1.00 0.00 H new ATOM 0 HG1 THR A 106 13.983 0.110 6.003 1.00 0.00 H new ATOM 0 HG21 THR A 106 15.869 2.133 5.971 1.00 0.00 H new ATOM 0 HG22 THR A 106 14.764 3.524 6.073 1.00 0.00 H new ATOM 0 HG23 THR A 106 14.489 2.092 7.094 1.00 0.00 H new ATOM 1581 N ASN A 107 11.997 0.401 3.608 1.00 0.00 N ATOM 1582 CA ASN A 107 11.315 -0.243 2.492 1.00 0.00 C ATOM 1583 C ASN A 107 9.953 -0.773 2.929 1.00 0.00 C ATOM 1584 O ASN A 107 9.861 -1.623 3.815 1.00 0.00 O ATOM 1585 CB ASN A 107 12.170 -1.379 1.927 1.00 0.00 C ATOM 1586 CG ASN A 107 12.342 -2.521 2.908 1.00 0.00 C ATOM 1587 OD1 ASN A 107 12.869 -2.341 4.006 1.00 0.00 O ATOM 1588 ND2 ASN A 107 11.896 -3.708 2.514 1.00 0.00 N ATOM 0 H ASN A 107 12.696 -0.182 4.069 1.00 0.00 H new ATOM 0 HA ASN A 107 11.162 0.500 1.709 1.00 0.00 H new ATOM 0 HB2 ASN A 107 11.710 -1.756 1.013 1.00 0.00 H new ATOM 0 HB3 ASN A 107 13.150 -0.989 1.653 1.00 0.00 H new ATOM 0 HD21 ASN A 107 11.984 -4.516 3.130 1.00 0.00 H new ATOM 0 HD22 ASN A 107 11.466 -3.812 1.595 1.00 0.00 H new ATOM 1595 N THR A 108 8.898 -0.257 2.310 1.00 0.00 N ATOM 1596 CA THR A 108 7.537 -0.667 2.641 1.00 0.00 C ATOM 1597 C THR A 108 7.073 -1.833 1.773 1.00 0.00 C ATOM 1598 O THR A 108 6.185 -2.589 2.162 1.00 0.00 O ATOM 1599 CB THR A 108 6.580 0.507 2.461 1.00 0.00 C ATOM 1600 OG1 THR A 108 5.329 0.227 3.065 1.00 0.00 O ATOM 1601 CG2 THR A 108 6.326 0.839 1.008 1.00 0.00 C ATOM 0 H THR A 108 8.958 0.447 1.575 1.00 0.00 H new ATOM 0 HA THR A 108 7.536 -0.993 3.681 1.00 0.00 H new ATOM 0 HB THR A 108 7.063 1.360 2.937 1.00 0.00 H new ATOM 0 HG1 THR A 108 5.216 0.789 3.860 1.00 0.00 H new ATOM 0 HG21 THR A 108 5.638 1.682 0.942 1.00 0.00 H new ATOM 0 HG22 THR A 108 7.267 1.100 0.525 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.889 -0.026 0.508 1.00 0.00 H new ATOM 1609 N SER A 109 7.665 -1.966 0.590 1.00 0.00 N ATOM 1610 CA SER A 109 7.301 -3.035 -0.335 1.00 0.00 C ATOM 1611 C SER A 109 7.270 -4.393 0.365 1.00 0.00 C ATOM 1612 O SER A 109 6.613 -5.326 -0.096 1.00 0.00 O ATOM 1613 CB SER A 109 8.287 -3.079 -1.503 1.00 0.00 C ATOM 1614 OG SER A 109 7.816 -3.924 -2.538 1.00 0.00 O ATOM 0 H SER A 109 8.400 -1.346 0.249 1.00 0.00 H new ATOM 0 HA SER A 109 6.300 -2.823 -0.711 1.00 0.00 H new ATOM 0 HB2 SER A 109 8.439 -2.072 -1.892 1.00 0.00 H new ATOM 0 HB3 SER A 109 9.256 -3.435 -1.152 1.00 0.00 H new ATOM 0 HG SER A 109 8.464 -3.933 -3.273 1.00 0.00 H new ATOM 1620 N LEU A 110 7.996 -4.497 1.472 1.00 0.00 N ATOM 1621 CA LEU A 110 8.068 -5.739 2.229 1.00 0.00 C ATOM 1622 C LEU A 110 6.993 -5.824 3.307 1.00 0.00 C ATOM 1623 O LEU A 110 6.852 -6.855 3.961 1.00 0.00 O ATOM 1624 CB LEU A 110 9.437 -5.860 2.882 1.00 0.00 C ATOM 1625 CG LEU A 110 10.362 -6.877 2.239 1.00 0.00 C ATOM 1626 CD1 LEU A 110 10.976 -6.302 0.969 1.00 0.00 C ATOM 1627 CD2 LEU A 110 11.430 -7.301 3.235 1.00 0.00 C ATOM 0 H LEU A 110 8.545 -3.733 1.866 1.00 0.00 H new ATOM 0 HA LEU A 110 7.903 -6.556 1.527 1.00 0.00 H new ATOM 0 HB2 LEU A 110 9.922 -4.884 2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 110 9.302 -6.125 3.931 1.00 0.00 H new ATOM 0 HG LEU A 110 9.791 -7.762 1.957 1.00 0.00 H new ATOM 0 HD11 LEU A 110 11.637 -7.041 0.518 1.00 0.00 H new ATOM 0 HD12 LEU A 110 10.184 -6.046 0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 110 11.547 -5.406 1.214 1.00 0.00 H new ATOM 0 HD21 LEU A 110 12.092 -8.031 2.770 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.009 -6.429 3.541 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.956 -7.747 4.109 1.00 0.00 H new ATOM 1639 N ASP A 111 6.244 -4.746 3.501 1.00 0.00 N ATOM 1640 CA ASP A 111 5.212 -4.720 4.502 1.00 0.00 C ATOM 1641 C ASP A 111 3.849 -4.783 3.848 1.00 0.00 C ATOM 1642 O ASP A 111 3.346 -3.781 3.340 1.00 0.00 O ATOM 1643 CB ASP A 111 5.325 -3.452 5.351 1.00 0.00 C ATOM 1644 CG ASP A 111 6.751 -3.155 5.773 1.00 0.00 C ATOM 1645 OD1 ASP A 111 7.580 -2.850 4.890 1.00 0.00 O ATOM 1646 OD2 ASP A 111 7.038 -3.227 6.986 1.00 0.00 O ATOM 0 H ASP A 111 6.341 -3.880 2.971 1.00 0.00 H new ATOM 0 HA ASP A 111 5.335 -5.588 5.149 1.00 0.00 H new ATOM 0 HB2 ASP A 111 4.934 -2.606 4.786 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.702 -3.558 6.239 1.00 0.00 H new ATOM 1651 N LEU A 112 3.239 -5.959 3.886 1.00 0.00 N ATOM 1652 CA LEU A 112 1.910 -6.139 3.318 1.00 0.00 C ATOM 1653 C LEU A 112 0.962 -5.074 3.878 1.00 0.00 C ATOM 1654 O LEU A 112 -0.113 -4.823 3.333 1.00 0.00 O ATOM 1655 CB LEU A 112 1.380 -7.540 3.641 1.00 0.00 C ATOM 1656 CG LEU A 112 2.396 -8.681 3.522 1.00 0.00 C ATOM 1657 CD1 LEU A 112 1.938 -9.900 4.319 1.00 0.00 C ATOM 1658 CD2 LEU A 112 2.616 -9.042 2.063 1.00 0.00 C ATOM 0 H LEU A 112 3.640 -6.799 4.302 1.00 0.00 H new ATOM 0 HA LEU A 112 1.969 -6.032 2.235 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.987 -7.534 4.657 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.543 -7.753 2.976 1.00 0.00 H new ATOM 0 HG LEU A 112 3.344 -8.343 3.940 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.675 -10.697 4.220 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.835 -9.630 5.370 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.977 -10.244 3.937 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.340 -9.854 1.994 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.672 -9.359 1.620 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.994 -8.172 1.526 1.00 0.00 H new ATOM 1670 N ASN A 113 1.389 -4.462 4.982 1.00 0.00 N ATOM 1671 CA ASN A 113 0.634 -3.429 5.663 1.00 0.00 C ATOM 1672 C ASN A 113 1.168 -2.043 5.315 1.00 0.00 C ATOM 1673 O ASN A 113 0.407 -1.095 5.135 1.00 0.00 O ATOM 1674 CB ASN A 113 0.769 -3.670 7.162 1.00 0.00 C ATOM 1675 CG ASN A 113 0.135 -2.594 8.024 1.00 0.00 C ATOM 1676 OD1 ASN A 113 -0.026 -1.449 7.602 1.00 0.00 O ATOM 1677 ND2 ASN A 113 -0.224 -2.965 9.248 1.00 0.00 N ATOM 0 H ASN A 113 2.281 -4.677 5.428 1.00 0.00 H new ATOM 0 HA ASN A 113 -0.410 -3.470 5.352 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.315 -4.630 7.407 1.00 0.00 H new ATOM 0 HB3 ASN A 113 1.827 -3.744 7.413 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.652 -2.289 9.881 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -0.071 -3.926 9.555 1.00 0.00 H new ATOM 1684 N LYS A 114 2.490 -1.934 5.252 1.00 0.00 N ATOM 1685 CA LYS A 114 3.149 -0.664 4.961 1.00 0.00 C ATOM 1686 C LYS A 114 3.124 0.222 6.196 1.00 0.00 C ATOM 1687 O LYS A 114 3.065 1.448 6.096 1.00 0.00 O ATOM 1688 CB LYS A 114 2.477 0.067 3.797 1.00 0.00 C ATOM 1689 CG LYS A 114 1.974 -0.851 2.693 1.00 0.00 C ATOM 1690 CD LYS A 114 2.720 -0.620 1.390 1.00 0.00 C ATOM 1691 CE LYS A 114 2.842 -1.904 0.591 1.00 0.00 C ATOM 1692 NZ LYS A 114 4.162 -2.013 -0.090 1.00 0.00 N ATOM 0 H LYS A 114 3.131 -2.714 5.399 1.00 0.00 H new ATOM 0 HA LYS A 114 4.179 -0.881 4.676 1.00 0.00 H new ATOM 0 HB2 LYS A 114 1.639 0.647 4.182 1.00 0.00 H new ATOM 0 HB3 LYS A 114 3.186 0.776 3.370 1.00 0.00 H new ATOM 0 HG2 LYS A 114 2.092 -1.890 3.001 1.00 0.00 H new ATOM 0 HG3 LYS A 114 0.908 -0.684 2.537 1.00 0.00 H new ATOM 0 HD2 LYS A 114 2.198 0.132 0.798 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.714 -0.225 1.602 1.00 0.00 H new ATOM 0 HE2 LYS A 114 2.704 -2.758 1.254 1.00 0.00 H new ATOM 0 HE3 LYS A 114 2.046 -1.946 -0.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 4.113 -2.745 -0.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 4.405 -1.100 -0.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.891 -2.270 0.605 1.00 0.00 H new ATOM 1706 N ASP A 115 3.163 -0.410 7.364 1.00 0.00 N ATOM 1707 CA ASP A 115 3.137 0.319 8.622 1.00 0.00 C ATOM 1708 C ASP A 115 4.501 0.939 8.929 1.00 0.00 C ATOM 1709 O ASP A 115 4.656 1.649 9.924 1.00 0.00 O ATOM 1710 CB ASP A 115 2.700 -0.610 9.761 1.00 0.00 C ATOM 1711 CG ASP A 115 2.666 0.093 11.104 1.00 0.00 C ATOM 1712 OD1 ASP A 115 1.745 0.907 11.324 1.00 0.00 O ATOM 1713 OD2 ASP A 115 3.559 -0.171 11.935 1.00 0.00 O ATOM 0 H ASP A 115 3.213 -1.424 7.463 1.00 0.00 H new ATOM 0 HA ASP A 115 2.415 1.130 8.531 1.00 0.00 H new ATOM 0 HB2 ASP A 115 1.711 -1.011 9.539 1.00 0.00 H new ATOM 0 HB3 ASP A 115 3.383 -1.458 9.816 1.00 0.00 H new ATOM 1718 N GLY A 116 5.491 0.671 8.075 1.00 0.00 N ATOM 1719 CA GLY A 116 6.818 1.222 8.291 1.00 0.00 C ATOM 1720 C GLY A 116 7.623 0.392 9.268 1.00 0.00 C ATOM 1721 O GLY A 116 8.385 0.922 10.073 1.00 0.00 O ATOM 0 H GLY A 116 5.397 0.087 7.244 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.347 1.277 7.340 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.731 2.241 8.667 1.00 0.00 H new ATOM 1725 N SER A 117 7.437 -0.916 9.193 1.00 0.00 N ATOM 1726 CA SER A 117 8.129 -1.857 10.068 1.00 0.00 C ATOM 1727 C SER A 117 7.744 -3.265 9.707 1.00 0.00 C ATOM 1728 O SER A 117 6.589 -3.664 9.858 1.00 0.00 O ATOM 1729 CB SER A 117 7.779 -1.596 11.536 1.00 0.00 C ATOM 1730 OG SER A 117 8.861 -0.995 12.223 1.00 0.00 O ATOM 0 H SER A 117 6.804 -1.358 8.526 1.00 0.00 H new ATOM 0 HA SER A 117 9.202 -1.721 9.935 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.904 -0.949 11.594 1.00 0.00 H new ATOM 0 HB3 SER A 117 7.514 -2.535 12.021 1.00 0.00 H new ATOM 0 HG SER A 117 8.609 -0.838 13.157 1.00 0.00 H new ATOM 1736 N ILE A 118 8.713 -4.024 9.247 1.00 0.00 N ATOM 1737 CA ILE A 118 8.465 -5.391 8.890 1.00 0.00 C ATOM 1738 C ILE A 118 8.101 -6.177 10.134 1.00 0.00 C ATOM 1739 O ILE A 118 8.931 -6.463 10.987 1.00 0.00 O ATOM 1740 CB ILE A 118 9.676 -5.995 8.152 1.00 0.00 C ATOM 1741 CG1 ILE A 118 9.722 -5.452 6.725 1.00 0.00 C ATOM 1742 CG2 ILE A 118 9.615 -7.510 8.135 1.00 0.00 C ATOM 1743 CD1 ILE A 118 8.409 -5.604 5.983 1.00 0.00 C ATOM 0 H ILE A 118 9.675 -3.714 9.114 1.00 0.00 H new ATOM 0 HA ILE A 118 7.624 -5.441 8.198 1.00 0.00 H new ATOM 0 HB ILE A 118 10.583 -5.708 8.684 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.995 -4.397 6.754 1.00 0.00 H new ATOM 0 HG13 ILE A 118 10.506 -5.969 6.172 1.00 0.00 H new ATOM 0 HG21 ILE A 118 10.484 -7.903 7.607 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.612 -7.886 9.158 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.706 -7.832 7.627 1.00 0.00 H new ATOM 0 HD11 ILE A 118 8.511 -5.198 4.976 1.00 0.00 H new ATOM 0 HD12 ILE A 118 8.145 -6.660 5.924 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.626 -5.063 6.515 1.00 0.00 H new ATOM 1755 N ASP A 119 6.828 -6.471 10.248 1.00 0.00 N ATOM 1756 CA ASP A 119 6.321 -7.185 11.410 1.00 0.00 C ATOM 1757 C ASP A 119 5.367 -8.303 10.997 1.00 0.00 C ATOM 1758 O ASP A 119 5.543 -8.922 9.951 1.00 0.00 O ATOM 1759 CB ASP A 119 5.643 -6.201 12.366 1.00 0.00 C ATOM 1760 CG ASP A 119 5.831 -6.584 13.822 1.00 0.00 C ATOM 1761 OD1 ASP A 119 6.957 -6.976 14.192 1.00 0.00 O ATOM 1762 OD2 ASP A 119 4.851 -6.492 14.591 1.00 0.00 O ATOM 0 H ASP A 119 6.120 -6.230 9.555 1.00 0.00 H new ATOM 0 HA ASP A 119 7.159 -7.652 11.927 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.047 -5.202 12.201 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.578 -6.155 12.140 1.00 0.00 H new ATOM 1767 N GLU A 120 4.366 -8.569 11.828 1.00 0.00 N ATOM 1768 CA GLU A 120 3.398 -9.623 11.543 1.00 0.00 C ATOM 1769 C GLU A 120 2.580 -9.295 10.297 1.00 0.00 C ATOM 1770 O GLU A 120 2.291 -10.171 9.482 1.00 0.00 O ATOM 1771 CB GLU A 120 2.469 -9.825 12.741 1.00 0.00 C ATOM 1772 CG GLU A 120 3.198 -10.214 14.016 1.00 0.00 C ATOM 1773 CD GLU A 120 2.574 -9.600 15.254 1.00 0.00 C ATOM 1774 OE1 GLU A 120 2.487 -8.355 15.320 1.00 0.00 O ATOM 1775 OE2 GLU A 120 2.174 -10.362 16.159 1.00 0.00 O ATOM 0 H GLU A 120 4.203 -8.071 12.703 1.00 0.00 H new ATOM 0 HA GLU A 120 3.948 -10.546 11.357 1.00 0.00 H new ATOM 0 HB2 GLU A 120 1.911 -8.905 12.917 1.00 0.00 H new ATOM 0 HB3 GLU A 120 1.740 -10.598 12.499 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.198 -11.300 14.114 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.240 -9.901 13.945 1.00 0.00 H new ATOM 1782 N TYR A 121 2.205 -8.027 10.160 1.00 0.00 N ATOM 1783 CA TYR A 121 1.414 -7.571 9.023 1.00 0.00 C ATOM 1784 C TYR A 121 2.006 -8.045 7.697 1.00 0.00 C ATOM 1785 O TYR A 121 1.282 -8.204 6.715 1.00 0.00 O ATOM 1786 CB TYR A 121 1.300 -6.036 9.006 1.00 0.00 C ATOM 1787 CG TYR A 121 1.905 -5.333 10.205 1.00 0.00 C ATOM 1788 CD1 TYR A 121 1.267 -5.339 11.440 1.00 0.00 C ATOM 1789 CD2 TYR A 121 3.115 -4.660 10.096 1.00 0.00 C ATOM 1790 CE1 TYR A 121 1.819 -4.695 12.531 1.00 0.00 C ATOM 1791 CE2 TYR A 121 3.673 -4.014 11.183 1.00 0.00 C ATOM 1792 CZ TYR A 121 3.021 -4.034 12.398 1.00 0.00 C ATOM 1793 OH TYR A 121 3.574 -3.393 13.482 1.00 0.00 O ATOM 0 H TYR A 121 2.439 -7.292 10.828 1.00 0.00 H new ATOM 0 HA TYR A 121 0.421 -8.005 9.138 1.00 0.00 H new ATOM 0 HB2 TYR A 121 1.782 -5.661 8.103 1.00 0.00 H new ATOM 0 HB3 TYR A 121 0.246 -5.766 8.940 1.00 0.00 H new ATOM 0 HD1 TYR A 121 0.325 -5.855 11.549 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.628 -4.641 9.146 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.311 -4.710 13.484 1.00 0.00 H new ATOM 0 HE2 TYR A 121 4.615 -3.496 11.081 1.00 0.00 H new ATOM 0 HH TYR A 121 4.422 -2.978 13.219 1.00 0.00 H new ATOM 1803 N GLU A 122 3.319 -8.254 7.665 1.00 0.00 N ATOM 1804 CA GLU A 122 3.982 -8.694 6.436 1.00 0.00 C ATOM 1805 C GLU A 122 4.091 -10.217 6.354 1.00 0.00 C ATOM 1806 O GLU A 122 4.374 -10.770 5.292 1.00 0.00 O ATOM 1807 CB GLU A 122 5.371 -8.069 6.280 1.00 0.00 C ATOM 1808 CG GLU A 122 5.790 -7.163 7.421 1.00 0.00 C ATOM 1809 CD GLU A 122 4.995 -5.872 7.462 1.00 0.00 C ATOM 1810 OE1 GLU A 122 3.865 -5.853 6.931 1.00 0.00 O ATOM 1811 OE2 GLU A 122 5.504 -4.879 8.021 1.00 0.00 O ATOM 0 H GLU A 122 3.941 -8.128 8.464 1.00 0.00 H new ATOM 0 HA GLU A 122 3.352 -8.350 5.616 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.105 -8.869 6.181 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.395 -7.497 5.352 1.00 0.00 H new ATOM 0 HG2 GLU A 122 5.665 -7.693 8.365 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.850 -6.930 7.324 1.00 0.00 H new ATOM 1818 N ILE A 123 3.868 -10.884 7.474 1.00 0.00 N ATOM 1819 CA ILE A 123 3.943 -12.344 7.526 1.00 0.00 C ATOM 1820 C ILE A 123 2.570 -12.985 7.336 1.00 0.00 C ATOM 1821 O ILE A 123 2.467 -14.191 7.115 1.00 0.00 O ATOM 1822 CB ILE A 123 4.539 -12.846 8.859 1.00 0.00 C ATOM 1823 CG1 ILE A 123 5.508 -11.817 9.445 1.00 0.00 C ATOM 1824 CG2 ILE A 123 5.240 -14.179 8.655 1.00 0.00 C ATOM 1825 CD1 ILE A 123 6.611 -11.411 8.492 1.00 0.00 C ATOM 0 H ILE A 123 3.633 -10.442 8.363 1.00 0.00 H new ATOM 0 HA ILE A 123 4.600 -12.639 6.707 1.00 0.00 H new ATOM 0 HB ILE A 123 3.722 -12.985 9.567 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.948 -10.929 9.738 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.955 -12.226 10.351 1.00 0.00 H new ATOM 0 HG21 ILE A 123 5.655 -14.521 9.603 1.00 0.00 H new ATOM 0 HG22 ILE A 123 4.524 -14.914 8.287 1.00 0.00 H new ATOM 0 HG23 ILE A 123 6.044 -14.060 7.929 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.259 -10.680 8.976 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.196 -12.289 8.218 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.174 -10.972 7.595 1.00 0.00 H new ATOM 1837 N SER A 124 1.517 -12.176 7.431 1.00 0.00 N ATOM 1838 CA SER A 124 0.147 -12.668 7.280 1.00 0.00 C ATOM 1839 C SER A 124 0.013 -13.602 6.078 1.00 0.00 C ATOM 1840 O SER A 124 -0.451 -14.733 6.211 1.00 0.00 O ATOM 1841 CB SER A 124 -0.824 -11.494 7.138 1.00 0.00 C ATOM 1842 OG SER A 124 -0.188 -10.262 7.436 1.00 0.00 O ATOM 0 H SER A 124 1.585 -11.175 7.612 1.00 0.00 H new ATOM 0 HA SER A 124 -0.100 -13.237 8.177 1.00 0.00 H new ATOM 0 HB2 SER A 124 -1.218 -11.466 6.122 1.00 0.00 H new ATOM 0 HB3 SER A 124 -1.673 -11.639 7.806 1.00 0.00 H new ATOM 0 HG SER A 124 0.140 -9.854 6.607 1.00 0.00 H new ATOM 1848 N PHE A 125 0.417 -13.121 4.908 1.00 0.00 N ATOM 1849 CA PHE A 125 0.336 -13.917 3.687 1.00 0.00 C ATOM 1850 C PHE A 125 1.617 -14.714 3.467 1.00 0.00 C ATOM 1851 O PHE A 125 1.593 -15.799 2.889 1.00 0.00 O ATOM 1852 CB PHE A 125 0.064 -13.013 2.483 1.00 0.00 C ATOM 1853 CG PHE A 125 0.029 -13.745 1.171 1.00 0.00 C ATOM 1854 CD1 PHE A 125 -0.914 -14.733 0.939 1.00 0.00 C ATOM 1855 CD2 PHE A 125 0.937 -13.444 0.170 1.00 0.00 C ATOM 1856 CE1 PHE A 125 -0.951 -15.408 -0.267 1.00 0.00 C ATOM 1857 CE2 PHE A 125 0.907 -14.114 -1.039 1.00 0.00 C ATOM 1858 CZ PHE A 125 -0.039 -15.098 -1.257 1.00 0.00 C ATOM 0 H PHE A 125 0.803 -12.186 4.778 1.00 0.00 H new ATOM 0 HA PHE A 125 -0.489 -14.622 3.796 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -0.889 -12.504 2.630 1.00 0.00 H new ATOM 0 HB3 PHE A 125 0.833 -12.242 2.438 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.629 -14.979 1.710 1.00 0.00 H new ATOM 0 HD2 PHE A 125 1.678 -12.676 0.336 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.691 -16.176 -0.435 1.00 0.00 H new ATOM 0 HE2 PHE A 125 1.621 -13.869 -1.811 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.065 -15.624 -2.200 1.00 0.00 H new ATOM 1868 N ILE A 126 2.734 -14.169 3.935 1.00 0.00 N ATOM 1869 CA ILE A 126 4.026 -14.831 3.793 1.00 0.00 C ATOM 1870 C ILE A 126 4.133 -16.048 4.712 1.00 0.00 C ATOM 1871 O ILE A 126 5.084 -16.823 4.617 1.00 0.00 O ATOM 1872 CB ILE A 126 5.185 -13.865 4.101 1.00 0.00 C ATOM 1873 CG1 ILE A 126 5.019 -12.557 3.318 1.00 0.00 C ATOM 1874 CG2 ILE A 126 6.521 -14.520 3.785 1.00 0.00 C ATOM 1875 CD1 ILE A 126 5.425 -12.654 1.861 1.00 0.00 C ATOM 0 H ILE A 126 2.771 -13.270 4.416 1.00 0.00 H new ATOM 0 HA ILE A 126 4.099 -15.160 2.756 1.00 0.00 H new ATOM 0 HB ILE A 126 5.165 -13.628 5.165 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.977 -12.242 3.374 1.00 0.00 H new ATOM 0 HG13 ILE A 126 5.613 -11.780 3.799 1.00 0.00 H new ATOM 0 HG21 ILE A 126 7.329 -13.824 4.008 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.638 -15.418 4.391 1.00 0.00 H new ATOM 0 HG23 ILE A 126 6.554 -14.788 2.729 1.00 0.00 H new ATOM 0 HD11 ILE A 126 5.278 -11.688 1.377 1.00 0.00 H new ATOM 0 HD12 ILE A 126 6.475 -12.937 1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 126 4.814 -13.406 1.362 1.00 0.00 H new ATOM 1887 N ASN A 127 3.159 -16.213 5.602 1.00 0.00 N ATOM 1888 CA ASN A 127 3.159 -17.338 6.528 1.00 0.00 C ATOM 1889 C ASN A 127 2.547 -18.577 5.881 1.00 0.00 C ATOM 1890 O ASN A 127 3.080 -19.680 6.005 1.00 0.00 O ATOM 1891 CB ASN A 127 2.388 -16.979 7.799 1.00 0.00 C ATOM 1892 CG ASN A 127 3.292 -16.440 8.891 1.00 0.00 C ATOM 1893 OD1 ASN A 127 4.441 -16.860 9.026 1.00 0.00 O ATOM 1894 ND2 ASN A 127 2.775 -15.504 9.678 1.00 0.00 N ATOM 0 H ASN A 127 2.362 -15.584 5.701 1.00 0.00 H new ATOM 0 HA ASN A 127 4.194 -17.561 6.789 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.627 -16.236 7.561 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.866 -17.863 8.166 1.00 0.00 H new ATOM 0 HD21 ASN A 127 3.335 -15.104 10.430 1.00 0.00 H new ATOM 0 HD22 ASN A 127 1.817 -15.185 9.530 1.00 0.00 H new ATOM 1901 N HIS A 128 1.421 -18.390 5.199 1.00 0.00 N ATOM 1902 CA HIS A 128 0.734 -19.497 4.544 1.00 0.00 C ATOM 1903 C HIS A 128 1.165 -19.641 3.086 1.00 0.00 C ATOM 1904 O HIS A 128 1.303 -20.756 2.581 1.00 0.00 O ATOM 1905 CB HIS A 128 -0.782 -19.301 4.626 1.00 0.00 C ATOM 1906 CG HIS A 128 -1.496 -20.436 5.293 1.00 0.00 C ATOM 1907 ND1 HIS A 128 -2.331 -20.266 6.377 1.00 0.00 N ATOM 1908 CD2 HIS A 128 -1.497 -21.763 5.023 1.00 0.00 C ATOM 1909 CE1 HIS A 128 -2.815 -21.439 6.745 1.00 0.00 C ATOM 1910 NE2 HIS A 128 -2.325 -22.363 5.940 1.00 0.00 N ATOM 0 H HIS A 128 0.966 -17.484 5.086 1.00 0.00 H new ATOM 0 HA HIS A 128 1.008 -20.414 5.066 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -0.992 -18.380 5.170 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -1.179 -19.174 3.619 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -0.949 -22.257 4.234 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -3.496 -21.612 7.565 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -2.528 -23.361 5.991 1.00 0.00 H new ATOM 1919 N ARG A 129 1.368 -18.513 2.411 1.00 0.00 N ATOM 1920 CA ARG A 129 1.775 -18.519 1.007 1.00 0.00 C ATOM 1921 C ARG A 129 2.907 -19.515 0.760 1.00 0.00 C ATOM 1922 O ARG A 129 3.005 -20.105 -0.315 1.00 0.00 O ATOM 1923 CB ARG A 129 2.213 -17.117 0.575 1.00 0.00 C ATOM 1924 CG ARG A 129 2.678 -17.039 -0.871 1.00 0.00 C ATOM 1925 CD ARG A 129 1.637 -17.605 -1.825 1.00 0.00 C ATOM 1926 NE ARG A 129 1.656 -16.929 -3.120 1.00 0.00 N ATOM 1927 CZ ARG A 129 0.885 -17.276 -4.149 1.00 0.00 C ATOM 1928 NH1 ARG A 129 0.033 -18.287 -4.037 1.00 0.00 N ATOM 1929 NH2 ARG A 129 0.966 -16.608 -5.291 1.00 0.00 N ATOM 0 H ARG A 129 1.258 -17.582 2.813 1.00 0.00 H new ATOM 0 HA ARG A 129 0.914 -18.827 0.413 1.00 0.00 H new ATOM 0 HB2 ARG A 129 1.382 -16.426 0.718 1.00 0.00 H new ATOM 0 HB3 ARG A 129 3.021 -16.782 1.226 1.00 0.00 H new ATOM 0 HG2 ARG A 129 2.885 -16.001 -1.132 1.00 0.00 H new ATOM 0 HG3 ARG A 129 3.613 -17.589 -0.983 1.00 0.00 H new ATOM 0 HD2 ARG A 129 1.819 -18.670 -1.969 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.647 -17.508 -1.380 1.00 0.00 H new ATOM 0 HE ARG A 129 2.297 -16.145 -3.243 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -0.034 -18.803 -3.160 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -0.555 -18.548 -4.828 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.618 -15.829 -5.381 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.376 -16.873 -6.080 1.00 0.00 H new ATOM 1943 N ILE A 130 3.757 -19.697 1.765 1.00 0.00 N ATOM 1944 CA ILE A 130 4.879 -20.621 1.659 1.00 0.00 C ATOM 1945 C ILE A 130 4.509 -21.998 2.206 1.00 0.00 C ATOM 1946 O ILE A 130 5.007 -23.019 1.731 1.00 0.00 O ATOM 1947 CB ILE A 130 6.118 -20.080 2.407 1.00 0.00 C ATOM 1948 CG1 ILE A 130 6.632 -18.813 1.724 1.00 0.00 C ATOM 1949 CG2 ILE A 130 7.218 -21.132 2.469 1.00 0.00 C ATOM 1950 CD1 ILE A 130 5.924 -17.555 2.175 1.00 0.00 C ATOM 0 H ILE A 130 3.690 -19.216 2.662 1.00 0.00 H new ATOM 0 HA ILE A 130 5.122 -20.716 0.601 1.00 0.00 H new ATOM 0 HB ILE A 130 5.824 -19.837 3.428 1.00 0.00 H new ATOM 0 HG12 ILE A 130 7.699 -18.711 1.922 1.00 0.00 H new ATOM 0 HG13 ILE A 130 6.516 -18.919 0.645 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.079 -20.727 3.000 1.00 0.00 H new ATOM 0 HG22 ILE A 130 6.849 -22.013 2.994 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.514 -21.409 1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 130 6.340 -16.695 1.650 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.860 -17.637 1.953 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.061 -17.425 3.249 1.00 0.00 H new