USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1274 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 97 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 134 THR OG1 : rot 73:sc= 0.546 USER MOD Set 2.1: A 90 TYR OH : rot 130:sc= 0 USER MOD Set 2.2: A 96 GLN : amide:sc= 0.858 K(o=0.86,f=-3.9!) USER MOD Set 3.1: A 77 HIS : no HD1:sc= -5.26! C(o=-10!,f=-14!) USER MOD Set 3.2: A 104 SER OG : rot -30:sc= -4.94! USER MOD Set 4.1: A 74 THR OG1 : rot 170:sc= -0.187 USER MOD Set 4.2: A 75 HIS : no HD1:sc= -1.27 K(o=-1.5,f=-0.66) USER MOD Single : A 4 SER OG : rot -38:sc= 0.0808 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 11 GLN : amide:sc= -2.6! K(o=-2.6!,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 GLN : amide:sc= -1.24! K(o=-1.2!,f=0) USER MOD Single : A 15 LYS NZ :NH3+ -172:sc= 0.98 (180deg=0.911) USER MOD Single : A 18 HIS : no HD1:sc= -0.084 K(o=-0.084,f=-1.6!) USER MOD Single : A 19 MET CE :methyl -144:sc= -0.327 (180deg=-1.39!) USER MOD Single : A 20 TYR OH : rot 30:sc= -0.432 USER MOD Single : A 23 ASN : amide:sc= -0.11! C(o=-0.11!,f=-8.2!) USER MOD Single : A 26 GLN : amide:sc= -3.4! C(o=-3.4!,f=-3.2!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 79:sc= 0.921 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 154:sc= -0.0819 (180deg=-1.19) USER MOD Single : A 41 HIS : no HD1:sc= -2.02 X(o=-2,f=-2) USER MOD Single : A 44 ASN : amide:sc= -1.74! X(o=-1.7!,f=-2) USER MOD Single : A 46 MET CE :methyl -143:sc= -0.214 (180deg=-1.84!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -0.97 K(o=-0.97,f=-0.28) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.459 USER MOD Single : A 68 GLN : amide:sc= -0.0721 K(o=-0.072,f=-0.78) USER MOD Single : A 71 GLN : amide:sc= -0.609 X(o=-0.61,f=-0.39) USER MOD Single : A 83 SER OG : rot 15:sc= 0.242 USER MOD Single : A 86 ASN : amide:sc= -3.09! K(o=-3.1!,f=0.53) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -159:sc= -0.0777 (180deg=-0.768) USER MOD Single : A 103 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.123) USER MOD Single : A 106 ASN : amide:sc= -1.81! C(o=-1.8!,f=-0.52!) USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -3.55! C(o=-3.6!,f=-3.3!) USER MOD Single : A 118 ASN : amide:sc= -1.06 X(o=-1.1,f=-0.71) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot -60:sc= -2.39! USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 MET CE :methyl 169:sc= -0.397 (180deg=-0.767) USER MOD Single : A 135 TYR OH : rot 159:sc= -0.46 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= -0.343 USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot -72:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 61 N SER A 4 29.453 -1.380 10.889 1.00 2.40 N ATOM 62 CA SER A 4 29.666 -0.025 10.307 1.00 2.30 C ATOM 63 C SER A 4 28.401 0.417 9.570 1.00 2.02 C ATOM 64 O SER A 4 27.339 -0.145 9.748 1.00 1.96 O ATOM 65 CB SER A 4 30.837 -0.071 9.325 1.00 2.43 C ATOM 66 OG SER A 4 30.523 -0.961 8.262 1.00 3.00 O ATOM 0 HA SER A 4 29.888 0.683 11.105 1.00 2.30 H new ATOM 0 HB2 SER A 4 31.037 0.926 8.933 1.00 2.43 H new ATOM 0 HB3 SER A 4 31.742 -0.400 9.835 1.00 2.43 H new ATOM 0 HG SER A 4 30.037 -1.735 8.616 1.00 3.00 H new ATOM 72 N GLU A 5 28.506 1.421 8.743 1.00 1.94 N ATOM 73 CA GLU A 5 27.308 1.897 7.995 1.00 1.75 C ATOM 74 C GLU A 5 26.648 0.715 7.284 1.00 1.75 C ATOM 75 O GLU A 5 25.449 0.686 7.088 1.00 1.68 O ATOM 76 CB GLU A 5 27.733 2.942 6.961 1.00 1.75 C ATOM 77 CG GLU A 5 26.490 3.520 6.280 1.00 1.64 C ATOM 78 CD GLU A 5 26.888 4.734 5.440 1.00 2.19 C ATOM 79 OE1 GLU A 5 27.724 4.577 4.565 1.00 2.85 O ATOM 80 OE2 GLU A 5 26.350 5.801 5.685 1.00 2.57 O ATOM 0 H GLU A 5 29.368 1.932 8.553 1.00 1.94 H new ATOM 0 HA GLU A 5 26.599 2.344 8.692 1.00 1.75 H new ATOM 0 HB2 GLU A 5 28.299 3.738 7.444 1.00 1.75 H new ATOM 0 HB3 GLU A 5 28.390 2.489 6.219 1.00 1.75 H new ATOM 0 HG2 GLU A 5 26.024 2.764 5.648 1.00 1.64 H new ATOM 0 HG3 GLU A 5 25.753 3.808 7.029 1.00 1.64 H new ATOM 87 N TYR A 6 27.422 -0.261 6.894 1.00 1.86 N ATOM 88 CA TYR A 6 26.841 -1.441 6.194 1.00 1.91 C ATOM 89 C TYR A 6 25.634 -1.962 6.978 1.00 1.85 C ATOM 90 O TYR A 6 24.657 -2.408 6.409 1.00 1.88 O ATOM 91 CB TYR A 6 27.894 -2.547 6.094 1.00 2.08 C ATOM 92 CG TYR A 6 27.297 -3.744 5.390 1.00 2.35 C ATOM 93 CD1 TYR A 6 27.118 -3.719 4.001 1.00 3.27 C ATOM 94 CD2 TYR A 6 26.922 -4.876 6.123 1.00 2.28 C ATOM 95 CE1 TYR A 6 26.564 -4.825 3.347 1.00 3.69 C ATOM 96 CE2 TYR A 6 26.368 -5.983 5.469 1.00 2.77 C ATOM 97 CZ TYR A 6 26.189 -5.957 4.081 1.00 3.31 C ATOM 98 OH TYR A 6 25.642 -7.048 3.436 1.00 3.89 O ATOM 0 H TYR A 6 28.432 -0.292 7.030 1.00 1.86 H new ATOM 0 HA TYR A 6 26.525 -1.145 5.194 1.00 1.91 H new ATOM 0 HB2 TYR A 6 28.765 -2.187 5.547 1.00 2.08 H new ATOM 0 HB3 TYR A 6 28.237 -2.830 7.089 1.00 2.08 H new ATOM 0 HD1 TYR A 6 27.408 -2.846 3.435 1.00 3.27 H new ATOM 0 HD2 TYR A 6 27.060 -4.895 7.194 1.00 2.28 H new ATOM 0 HE1 TYR A 6 26.426 -4.806 2.276 1.00 3.69 H new ATOM 0 HE2 TYR A 6 26.079 -6.856 6.035 1.00 2.77 H new ATOM 0 HH TYR A 6 25.439 -7.748 4.092 1.00 3.89 H new ATOM 108 N GLY A 7 25.696 -1.913 8.280 1.00 1.81 N ATOM 109 CA GLY A 7 24.555 -2.411 9.101 1.00 1.78 C ATOM 110 C GLY A 7 23.389 -1.424 9.022 1.00 1.60 C ATOM 111 O GLY A 7 22.243 -1.813 8.908 1.00 1.57 O ATOM 0 H GLY A 7 26.487 -1.550 8.812 1.00 1.81 H new ATOM 0 HA2 GLY A 7 24.239 -3.391 8.744 1.00 1.78 H new ATOM 0 HA3 GLY A 7 24.868 -2.536 10.138 1.00 1.78 H new ATOM 115 N LEU A 8 23.667 -0.151 9.087 1.00 1.51 N ATOM 116 CA LEU A 8 22.568 0.854 9.022 1.00 1.36 C ATOM 117 C LEU A 8 21.778 0.674 7.725 1.00 1.25 C ATOM 118 O LEU A 8 20.619 1.031 7.642 1.00 1.18 O ATOM 119 CB LEU A 8 23.160 2.264 9.072 1.00 1.36 C ATOM 120 CG LEU A 8 24.094 2.393 10.280 1.00 1.50 C ATOM 121 CD1 LEU A 8 24.637 3.823 10.346 1.00 1.58 C ATOM 122 CD2 LEU A 8 23.327 2.073 11.574 1.00 1.55 C ATOM 0 H LEU A 8 24.606 0.236 9.182 1.00 1.51 H new ATOM 0 HA LEU A 8 21.900 0.711 9.871 1.00 1.36 H new ATOM 0 HB2 LEU A 8 23.709 2.471 8.153 1.00 1.36 H new ATOM 0 HB3 LEU A 8 22.360 3.002 9.139 1.00 1.36 H new ATOM 0 HG LEU A 8 24.920 1.690 10.175 1.00 1.50 H new ATOM 0 HD11 LEU A 8 25.302 3.920 11.204 1.00 1.58 H new ATOM 0 HD12 LEU A 8 25.188 4.045 9.432 1.00 1.58 H new ATOM 0 HD13 LEU A 8 23.808 4.523 10.449 1.00 1.58 H new ATOM 0 HD21 LEU A 8 23.998 2.167 12.428 1.00 1.55 H new ATOM 0 HD22 LEU A 8 22.497 2.770 11.687 1.00 1.55 H new ATOM 0 HD23 LEU A 8 22.942 1.055 11.526 1.00 1.55 H new ATOM 134 N GLN A 9 22.384 0.120 6.711 1.00 1.30 N ATOM 135 CA GLN A 9 21.646 -0.079 5.432 1.00 1.24 C ATOM 136 C GLN A 9 20.638 -1.214 5.610 1.00 1.25 C ATOM 137 O GLN A 9 19.441 -1.010 5.550 1.00 1.17 O ATOM 138 CB GLN A 9 22.628 -0.447 4.311 1.00 1.39 C ATOM 139 CG GLN A 9 23.832 0.520 4.310 1.00 1.39 C ATOM 140 CD GLN A 9 24.402 0.647 2.892 1.00 1.56 C ATOM 141 OE1 GLN A 9 24.264 -0.252 2.086 1.00 1.97 O ATOM 142 NE2 GLN A 9 25.041 1.734 2.554 1.00 1.91 N ATOM 0 H GLN A 9 23.352 -0.202 6.712 1.00 1.30 H new ATOM 0 HA GLN A 9 21.129 0.843 5.166 1.00 1.24 H new ATOM 0 HB2 GLN A 9 22.976 -1.471 4.446 1.00 1.39 H new ATOM 0 HB3 GLN A 9 22.121 -0.407 3.347 1.00 1.39 H new ATOM 0 HG2 GLN A 9 23.523 1.499 4.675 1.00 1.39 H new ATOM 0 HG3 GLN A 9 24.603 0.155 4.989 1.00 1.39 H new ATOM 0 HE21 GLN A 9 25.157 2.489 3.230 1.00 1.91 H new ATOM 0 HE22 GLN A 9 25.424 1.829 1.614 1.00 1.91 H new ATOM 151 N LEU A 10 21.111 -2.410 5.831 1.00 1.40 N ATOM 152 CA LEU A 10 20.177 -3.554 6.016 1.00 1.46 C ATOM 153 C LEU A 10 19.160 -3.197 7.102 1.00 1.38 C ATOM 154 O LEU A 10 18.129 -3.824 7.235 1.00 1.34 O ATOM 155 CB LEU A 10 20.971 -4.794 6.431 1.00 1.70 C ATOM 156 CG LEU A 10 20.021 -5.962 6.727 1.00 1.74 C ATOM 157 CD1 LEU A 10 19.069 -6.200 5.542 1.00 1.94 C ATOM 158 CD2 LEU A 10 20.857 -7.216 6.962 1.00 2.17 C ATOM 0 H LEU A 10 22.102 -2.643 5.891 1.00 1.40 H new ATOM 0 HA LEU A 10 19.653 -3.762 5.083 1.00 1.46 H new ATOM 0 HB2 LEU A 10 21.664 -5.073 5.637 1.00 1.70 H new ATOM 0 HB3 LEU A 10 21.570 -4.571 7.314 1.00 1.70 H new ATOM 0 HG LEU A 10 19.424 -5.727 7.608 1.00 1.74 H new ATOM 0 HD11 LEU A 10 18.403 -7.032 5.771 1.00 1.94 H new ATOM 0 HD12 LEU A 10 18.478 -5.301 5.364 1.00 1.94 H new ATOM 0 HD13 LEU A 10 19.650 -6.435 4.650 1.00 1.94 H new ATOM 0 HD21 LEU A 10 20.198 -8.058 7.174 1.00 2.17 H new ATOM 0 HD22 LEU A 10 21.447 -7.432 6.071 1.00 2.17 H new ATOM 0 HD23 LEU A 10 21.524 -7.055 7.809 1.00 2.17 H new ATOM 170 N GLN A 11 19.444 -2.185 7.877 1.00 1.41 N ATOM 171 CA GLN A 11 18.496 -1.776 8.950 1.00 1.38 C ATOM 172 C GLN A 11 17.304 -1.054 8.319 1.00 1.21 C ATOM 173 O GLN A 11 16.164 -1.296 8.665 1.00 1.20 O ATOM 174 CB GLN A 11 19.206 -0.836 9.927 1.00 1.41 C ATOM 175 CG GLN A 11 18.313 -0.590 11.145 1.00 1.67 C ATOM 176 CD GLN A 11 19.013 0.375 12.104 1.00 1.75 C ATOM 177 OE1 GLN A 11 18.621 0.506 13.246 1.00 1.90 O ATOM 178 NE2 GLN A 11 20.041 1.061 11.684 1.00 1.75 N ATOM 0 H GLN A 11 20.293 -1.624 7.812 1.00 1.41 H new ATOM 0 HA GLN A 11 18.147 -2.658 9.487 1.00 1.38 H new ATOM 0 HB2 GLN A 11 20.155 -1.271 10.241 1.00 1.41 H new ATOM 0 HB3 GLN A 11 19.436 0.109 9.435 1.00 1.41 H new ATOM 0 HG2 GLN A 11 17.356 -0.175 10.830 1.00 1.67 H new ATOM 0 HG3 GLN A 11 18.101 -1.532 11.650 1.00 1.67 H new ATOM 0 HE21 GLN A 11 20.370 0.951 10.725 1.00 1.75 H new ATOM 0 HE22 GLN A 11 20.515 1.707 12.315 1.00 1.75 H new ATOM 187 N GLU A 12 17.559 -0.170 7.391 1.00 1.09 N ATOM 188 CA GLU A 12 16.440 0.562 6.736 1.00 0.94 C ATOM 189 C GLU A 12 15.500 -0.448 6.078 1.00 0.93 C ATOM 190 O GLU A 12 14.294 -0.339 6.172 1.00 0.91 O ATOM 191 CB GLU A 12 16.999 1.520 5.680 1.00 0.83 C ATOM 192 CG GLU A 12 17.572 2.762 6.369 1.00 1.14 C ATOM 193 CD GLU A 12 16.428 3.617 6.918 1.00 1.75 C ATOM 194 OE1 GLU A 12 15.462 3.811 6.197 1.00 2.26 O ATOM 195 OE2 GLU A 12 16.536 4.062 8.048 1.00 2.47 O ATOM 0 H GLU A 12 18.492 0.075 7.060 1.00 1.09 H new ATOM 0 HA GLU A 12 15.891 1.139 7.480 1.00 0.94 H new ATOM 0 HB2 GLU A 12 17.775 1.023 5.098 1.00 0.83 H new ATOM 0 HB3 GLU A 12 16.213 1.808 4.982 1.00 0.83 H new ATOM 0 HG2 GLU A 12 18.239 2.466 7.178 1.00 1.14 H new ATOM 0 HG3 GLU A 12 18.166 3.341 5.662 1.00 1.14 H new ATOM 202 N LYS A 13 16.037 -1.441 5.426 1.00 1.00 N ATOM 203 CA LYS A 13 15.158 -2.457 4.788 1.00 1.04 C ATOM 204 C LYS A 13 14.232 -3.032 5.862 1.00 1.07 C ATOM 205 O LYS A 13 13.076 -3.317 5.620 1.00 1.01 O ATOM 206 CB LYS A 13 16.016 -3.579 4.196 1.00 1.19 C ATOM 207 CG LYS A 13 15.163 -4.424 3.243 1.00 1.40 C ATOM 208 CD LYS A 13 15.948 -5.669 2.789 1.00 1.50 C ATOM 209 CE LYS A 13 15.808 -6.795 3.823 1.00 1.81 C ATOM 210 NZ LYS A 13 16.442 -8.034 3.292 1.00 2.31 N ATOM 0 H LYS A 13 17.039 -1.592 5.308 1.00 1.00 H new ATOM 0 HA LYS A 13 14.572 -2.001 3.990 1.00 1.04 H new ATOM 0 HB2 LYS A 13 16.868 -3.157 3.662 1.00 1.19 H new ATOM 0 HB3 LYS A 13 16.417 -4.204 4.994 1.00 1.19 H new ATOM 0 HG2 LYS A 13 14.242 -4.727 3.740 1.00 1.40 H new ATOM 0 HG3 LYS A 13 14.876 -3.829 2.376 1.00 1.40 H new ATOM 0 HD2 LYS A 13 15.578 -6.007 1.821 1.00 1.50 H new ATOM 0 HD3 LYS A 13 17.000 -5.416 2.658 1.00 1.50 H new ATOM 0 HE2 LYS A 13 16.281 -6.504 4.761 1.00 1.81 H new ATOM 0 HE3 LYS A 13 14.755 -6.976 4.040 1.00 1.81 H new ATOM 0 HZ1 LYS A 13 16.349 -8.799 3.991 1.00 2.31 H new ATOM 0 HZ2 LYS A 13 15.971 -8.313 2.408 1.00 2.31 H new ATOM 0 HZ3 LYS A 13 17.450 -7.856 3.106 1.00 2.31 H new ATOM 224 N GLN A 14 14.746 -3.206 7.049 1.00 1.23 N ATOM 225 CA GLN A 14 13.922 -3.768 8.157 1.00 1.31 C ATOM 226 C GLN A 14 12.745 -2.839 8.465 1.00 1.24 C ATOM 227 O GLN A 14 11.606 -3.150 8.180 1.00 1.26 O ATOM 228 CB GLN A 14 14.789 -3.919 9.409 1.00 1.48 C ATOM 229 CG GLN A 14 14.076 -4.819 10.421 1.00 1.51 C ATOM 230 CD GLN A 14 14.940 -4.964 11.675 1.00 1.81 C ATOM 231 OE1 GLN A 14 14.648 -5.767 12.539 1.00 2.53 O ATOM 232 NE2 GLN A 14 15.999 -4.214 11.813 1.00 1.95 N ATOM 0 H GLN A 14 15.709 -2.981 7.300 1.00 1.23 H new ATOM 0 HA GLN A 14 13.537 -4.741 7.853 1.00 1.31 H new ATOM 0 HB2 GLN A 14 15.756 -4.347 9.145 1.00 1.48 H new ATOM 0 HB3 GLN A 14 14.983 -2.941 9.850 1.00 1.48 H new ATOM 0 HG2 GLN A 14 13.107 -4.394 10.682 1.00 1.51 H new ATOM 0 HG3 GLN A 14 13.887 -5.799 9.982 1.00 1.51 H new ATOM 0 HE21 GLN A 14 16.244 -3.540 11.088 1.00 1.95 H new ATOM 0 HE22 GLN A 14 16.581 -4.302 12.646 1.00 1.95 H new ATOM 241 N LYS A 15 13.007 -1.709 9.061 1.00 1.20 N ATOM 242 CA LYS A 15 11.894 -0.775 9.402 1.00 1.17 C ATOM 243 C LYS A 15 10.998 -0.565 8.176 1.00 1.08 C ATOM 244 O LYS A 15 9.788 -0.531 8.286 1.00 1.14 O ATOM 245 CB LYS A 15 12.459 0.572 9.882 1.00 1.11 C ATOM 246 CG LYS A 15 13.724 0.924 9.092 1.00 1.30 C ATOM 247 CD LYS A 15 14.171 2.362 9.427 1.00 1.41 C ATOM 248 CE LYS A 15 13.445 3.367 8.524 1.00 1.30 C ATOM 249 NZ LYS A 15 13.968 4.738 8.787 1.00 1.94 N ATOM 0 H LYS A 15 13.939 -1.391 9.326 1.00 1.20 H new ATOM 0 HA LYS A 15 11.300 -1.210 10.206 1.00 1.17 H new ATOM 0 HB2 LYS A 15 11.711 1.355 9.754 1.00 1.11 H new ATOM 0 HB3 LYS A 15 12.688 0.521 10.946 1.00 1.11 H new ATOM 0 HG2 LYS A 15 14.521 0.221 9.333 1.00 1.30 H new ATOM 0 HG3 LYS A 15 13.532 0.834 8.023 1.00 1.30 H new ATOM 0 HD2 LYS A 15 13.958 2.582 10.473 1.00 1.41 H new ATOM 0 HD3 LYS A 15 15.249 2.456 9.294 1.00 1.41 H new ATOM 0 HE2 LYS A 15 13.593 3.104 7.477 1.00 1.30 H new ATOM 0 HE3 LYS A 15 12.372 3.333 8.713 1.00 1.30 H new ATOM 0 HZ1 LYS A 15 13.387 5.435 8.278 1.00 1.94 H new ATOM 0 HZ2 LYS A 15 13.929 4.934 9.808 1.00 1.94 H new ATOM 0 HZ3 LYS A 15 14.953 4.803 8.459 1.00 1.94 H new ATOM 263 N LEU A 16 11.569 -0.425 7.011 1.00 0.97 N ATOM 264 CA LEU A 16 10.722 -0.221 5.801 1.00 0.93 C ATOM 265 C LEU A 16 9.972 -1.518 5.490 1.00 1.02 C ATOM 266 O LEU A 16 8.889 -1.503 4.939 1.00 1.14 O ATOM 267 CB LEU A 16 11.598 0.170 4.606 1.00 0.81 C ATOM 268 CG LEU A 16 10.714 0.515 3.395 1.00 0.78 C ATOM 269 CD1 LEU A 16 9.855 1.760 3.692 1.00 0.81 C ATOM 270 CD2 LEU A 16 11.610 0.782 2.180 1.00 0.72 C ATOM 0 H LEU A 16 12.575 -0.443 6.845 1.00 0.97 H new ATOM 0 HA LEU A 16 10.008 0.581 5.990 1.00 0.93 H new ATOM 0 HB2 LEU A 16 12.222 1.025 4.866 1.00 0.81 H new ATOM 0 HB3 LEU A 16 12.270 -0.650 4.354 1.00 0.81 H new ATOM 0 HG LEU A 16 10.048 -0.323 3.188 1.00 0.78 H new ATOM 0 HD11 LEU A 16 9.236 1.990 2.825 1.00 0.81 H new ATOM 0 HD12 LEU A 16 9.216 1.564 4.553 1.00 0.81 H new ATOM 0 HD13 LEU A 16 10.505 2.608 3.909 1.00 0.81 H new ATOM 0 HD21 LEU A 16 10.990 1.027 1.318 1.00 0.72 H new ATOM 0 HD22 LEU A 16 12.277 1.616 2.396 1.00 0.72 H new ATOM 0 HD23 LEU A 16 12.201 -0.108 1.961 1.00 0.72 H new ATOM 282 N ARG A 17 10.536 -2.640 5.845 1.00 1.06 N ATOM 283 CA ARG A 17 9.852 -3.936 5.576 1.00 1.19 C ATOM 284 C ARG A 17 8.726 -4.127 6.594 1.00 1.35 C ATOM 285 O ARG A 17 7.608 -4.453 6.245 1.00 1.71 O ATOM 286 CB ARG A 17 10.860 -5.082 5.704 1.00 1.29 C ATOM 287 CG ARG A 17 10.135 -6.425 5.586 1.00 1.36 C ATOM 288 CD ARG A 17 11.163 -7.548 5.439 1.00 1.41 C ATOM 289 NE ARG A 17 12.015 -7.602 6.660 1.00 2.00 N ATOM 290 CZ ARG A 17 12.754 -8.652 6.896 1.00 2.65 C ATOM 291 NH1 ARG A 17 12.747 -9.655 6.061 1.00 3.02 N ATOM 292 NH2 ARG A 17 13.500 -8.698 7.966 1.00 3.41 N ATOM 0 H ARG A 17 11.441 -2.715 6.310 1.00 1.06 H new ATOM 0 HA ARG A 17 9.438 -3.932 4.568 1.00 1.19 H new ATOM 0 HB2 ARG A 17 11.620 -4.999 4.927 1.00 1.29 H new ATOM 0 HB3 ARG A 17 11.376 -5.020 6.662 1.00 1.29 H new ATOM 0 HG2 ARG A 17 9.518 -6.596 6.468 1.00 1.36 H new ATOM 0 HG3 ARG A 17 9.466 -6.415 4.726 1.00 1.36 H new ATOM 0 HD2 ARG A 17 10.657 -8.502 5.293 1.00 1.41 H new ATOM 0 HD3 ARG A 17 11.781 -7.377 4.558 1.00 1.41 H new ATOM 0 HE ARG A 17 12.021 -6.818 7.312 1.00 2.00 H new ATOM 0 HH11 ARG A 17 12.164 -9.618 5.225 1.00 3.02 H new ATOM 0 HH12 ARG A 17 13.324 -10.476 6.245 1.00 3.02 H new ATOM 0 HH21 ARG A 17 13.506 -7.914 8.618 1.00 3.41 H new ATOM 0 HH22 ARG A 17 14.077 -9.518 8.150 1.00 3.41 H new ATOM 306 N HIS A 18 9.011 -3.924 7.851 1.00 1.32 N ATOM 307 CA HIS A 18 7.959 -4.091 8.891 1.00 1.46 C ATOM 308 C HIS A 18 6.999 -2.901 8.835 1.00 1.41 C ATOM 309 O HIS A 18 5.947 -2.910 9.442 1.00 1.58 O ATOM 310 CB HIS A 18 8.612 -4.155 10.273 1.00 1.56 C ATOM 311 CG HIS A 18 9.354 -5.456 10.417 1.00 1.74 C ATOM 312 ND1 HIS A 18 10.739 -5.514 10.483 1.00 1.79 N ATOM 313 CD2 HIS A 18 8.919 -6.756 10.509 1.00 1.97 C ATOM 314 CE1 HIS A 18 11.085 -6.809 10.608 1.00 2.01 C ATOM 315 NE2 HIS A 18 10.014 -7.603 10.629 1.00 2.12 N ATOM 0 H HIS A 18 9.928 -3.649 8.202 1.00 1.32 H new ATOM 0 HA HIS A 18 7.408 -5.014 8.708 1.00 1.46 H new ATOM 0 HB2 HIS A 18 9.297 -3.317 10.403 1.00 1.56 H new ATOM 0 HB3 HIS A 18 7.853 -4.069 11.050 1.00 1.56 H new ATOM 0 HD2 HIS A 18 7.886 -7.071 10.491 1.00 1.97 H new ATOM 0 HE1 HIS A 18 12.103 -7.161 10.682 1.00 2.01 H new ATOM 0 HE2 HIS A 18 10.001 -8.619 10.715 1.00 2.12 H new ATOM 324 N MET A 19 7.353 -1.877 8.106 1.00 1.30 N ATOM 325 CA MET A 19 6.462 -0.686 8.007 1.00 1.30 C ATOM 326 C MET A 19 5.036 -1.143 7.690 1.00 1.38 C ATOM 327 O MET A 19 4.238 -1.378 8.575 1.00 1.62 O ATOM 328 CB MET A 19 6.965 0.234 6.890 1.00 1.25 C ATOM 329 CG MET A 19 6.033 1.455 6.743 1.00 1.97 C ATOM 330 SD MET A 19 7.006 2.911 6.274 1.00 2.14 S ATOM 331 CE MET A 19 7.965 3.071 7.805 1.00 1.24 C ATOM 0 H MET A 19 8.221 -1.814 7.575 1.00 1.30 H new ATOM 0 HA MET A 19 6.468 -0.145 8.953 1.00 1.30 H new ATOM 0 HB2 MET A 19 7.979 0.566 7.112 1.00 1.25 H new ATOM 0 HB3 MET A 19 7.008 -0.315 5.949 1.00 1.25 H new ATOM 0 HG2 MET A 19 5.272 1.255 5.989 1.00 1.97 H new ATOM 0 HG3 MET A 19 5.510 1.641 7.681 1.00 1.97 H new ATOM 0 HE1 MET A 19 8.120 4.126 8.029 1.00 1.24 H new ATOM 0 HE2 MET A 19 7.422 2.602 8.625 1.00 1.24 H new ATOM 0 HE3 MET A 19 8.931 2.581 7.682 1.00 1.24 H new ATOM 341 N TYR A 20 4.712 -1.275 6.432 1.00 1.33 N ATOM 342 CA TYR A 20 3.341 -1.722 6.055 1.00 1.40 C ATOM 343 C TYR A 20 3.276 -3.250 6.108 1.00 1.44 C ATOM 344 O TYR A 20 2.249 -3.847 5.855 1.00 1.61 O ATOM 345 CB TYR A 20 3.023 -1.245 4.637 1.00 1.38 C ATOM 346 CG TYR A 20 3.421 0.207 4.494 1.00 1.33 C ATOM 347 CD1 TYR A 20 2.774 1.185 5.260 1.00 1.58 C ATOM 348 CD2 TYR A 20 4.435 0.577 3.600 1.00 1.96 C ATOM 349 CE1 TYR A 20 3.139 2.530 5.132 1.00 1.66 C ATOM 350 CE2 TYR A 20 4.800 1.923 3.473 1.00 1.92 C ATOM 351 CZ TYR A 20 4.152 2.899 4.239 1.00 1.36 C ATOM 352 OH TYR A 20 4.512 4.225 4.114 1.00 1.43 O ATOM 0 H TYR A 20 5.339 -1.092 5.648 1.00 1.33 H new ATOM 0 HA TYR A 20 2.614 -1.302 6.750 1.00 1.40 H new ATOM 0 HB2 TYR A 20 3.558 -1.854 3.908 1.00 1.38 H new ATOM 0 HB3 TYR A 20 1.959 -1.364 4.432 1.00 1.38 H new ATOM 0 HD1 TYR A 20 1.993 0.901 5.950 1.00 1.58 H new ATOM 0 HD2 TYR A 20 4.935 -0.176 3.009 1.00 1.96 H new ATOM 0 HE1 TYR A 20 2.639 3.284 5.722 1.00 1.66 H new ATOM 0 HE2 TYR A 20 5.581 2.208 2.784 1.00 1.92 H new ATOM 0 HH TYR A 20 4.363 4.686 4.966 1.00 1.43 H new ATOM 362 N GLY A 21 4.368 -3.887 6.437 1.00 1.41 N ATOM 363 CA GLY A 21 4.372 -5.375 6.508 1.00 1.50 C ATOM 364 C GLY A 21 4.501 -5.956 5.099 1.00 1.35 C ATOM 365 O GLY A 21 3.647 -6.687 4.638 1.00 1.43 O ATOM 0 H GLY A 21 5.257 -3.440 6.660 1.00 1.41 H new ATOM 0 HA2 GLY A 21 5.199 -5.717 7.130 1.00 1.50 H new ATOM 0 HA3 GLY A 21 3.453 -5.729 6.976 1.00 1.50 H new ATOM 369 N VAL A 22 5.566 -5.637 4.408 1.00 1.18 N ATOM 370 CA VAL A 22 5.756 -6.170 3.023 1.00 1.08 C ATOM 371 C VAL A 22 6.592 -7.454 3.100 1.00 1.11 C ATOM 372 O VAL A 22 7.755 -7.426 3.450 1.00 1.19 O ATOM 373 CB VAL A 22 6.482 -5.121 2.134 1.00 0.93 C ATOM 374 CG1 VAL A 22 5.953 -5.199 0.688 1.00 0.96 C ATOM 375 CG2 VAL A 22 6.257 -3.707 2.695 1.00 0.94 C ATOM 0 H VAL A 22 6.314 -5.030 4.743 1.00 1.18 H new ATOM 0 HA VAL A 22 4.784 -6.383 2.579 1.00 1.08 H new ATOM 0 HB VAL A 22 7.550 -5.338 2.136 1.00 0.93 H new ATOM 0 HG11 VAL A 22 6.467 -4.461 0.072 1.00 0.96 H new ATOM 0 HG12 VAL A 22 6.135 -6.196 0.287 1.00 0.96 H new ATOM 0 HG13 VAL A 22 4.882 -4.995 0.681 1.00 0.96 H new ATOM 0 HG21 VAL A 22 6.770 -2.980 2.065 1.00 0.94 H new ATOM 0 HG22 VAL A 22 5.190 -3.487 2.709 1.00 0.94 H new ATOM 0 HG23 VAL A 22 6.652 -3.651 3.709 1.00 0.94 H new ATOM 385 N ASN A 23 6.011 -8.576 2.777 1.00 1.30 N ATOM 386 CA ASN A 23 6.781 -9.850 2.837 1.00 1.35 C ATOM 387 C ASN A 23 8.001 -9.749 1.921 1.00 1.29 C ATOM 388 O ASN A 23 8.054 -8.923 1.031 1.00 1.26 O ATOM 389 CB ASN A 23 5.891 -11.008 2.380 1.00 1.49 C ATOM 390 CG ASN A 23 6.555 -12.337 2.746 1.00 1.73 C ATOM 391 OD1 ASN A 23 7.630 -12.357 3.312 1.00 2.34 O ATOM 392 ND2 ASN A 23 5.955 -13.457 2.446 1.00 2.26 N ATOM 0 H ASN A 23 5.041 -8.666 2.475 1.00 1.30 H new ATOM 0 HA ASN A 23 7.109 -10.030 3.861 1.00 1.35 H new ATOM 0 HB2 ASN A 23 4.911 -10.936 2.853 1.00 1.49 H new ATOM 0 HB3 ASN A 23 5.730 -10.954 1.303 1.00 1.49 H new ATOM 0 HD21 ASN A 23 6.389 -14.348 2.687 1.00 2.26 H new ATOM 0 HD22 ASN A 23 5.053 -13.441 1.971 1.00 2.26 H new ATOM 399 N GLU A 24 8.984 -10.583 2.128 1.00 1.33 N ATOM 400 CA GLU A 24 10.198 -10.532 1.267 1.00 1.30 C ATOM 401 C GLU A 24 9.791 -10.725 -0.195 1.00 1.30 C ATOM 402 O GLU A 24 10.239 -10.015 -1.073 1.00 1.37 O ATOM 403 CB GLU A 24 11.164 -11.645 1.678 1.00 1.39 C ATOM 404 CG GLU A 24 11.794 -11.302 3.030 1.00 1.51 C ATOM 405 CD GLU A 24 12.774 -10.141 2.856 1.00 1.57 C ATOM 406 OE1 GLU A 24 12.342 -9.005 2.963 1.00 2.15 O ATOM 407 OE2 GLU A 24 13.941 -10.407 2.618 1.00 1.69 O ATOM 0 H GLU A 24 8.998 -11.297 2.856 1.00 1.33 H new ATOM 0 HA GLU A 24 10.688 -9.565 1.386 1.00 1.30 H new ATOM 0 HB2 GLU A 24 10.634 -12.595 1.743 1.00 1.39 H new ATOM 0 HB3 GLU A 24 11.941 -11.764 0.923 1.00 1.39 H new ATOM 0 HG2 GLU A 24 11.018 -11.033 3.747 1.00 1.51 H new ATOM 0 HG3 GLU A 24 12.312 -12.172 3.433 1.00 1.51 H new ATOM 414 N ARG A 25 8.944 -11.680 -0.462 1.00 1.26 N ATOM 415 CA ARG A 25 8.507 -11.918 -1.866 1.00 1.27 C ATOM 416 C ARG A 25 7.970 -10.612 -2.453 1.00 1.11 C ATOM 417 O ARG A 25 8.396 -10.168 -3.499 1.00 1.14 O ATOM 418 CB ARG A 25 7.401 -12.981 -1.883 1.00 1.39 C ATOM 419 CG ARG A 25 7.172 -13.490 -3.320 1.00 1.55 C ATOM 420 CD ARG A 25 8.141 -14.636 -3.639 1.00 1.73 C ATOM 421 NE ARG A 25 7.950 -15.737 -2.654 1.00 2.26 N ATOM 422 CZ ARG A 25 8.443 -16.921 -2.895 1.00 2.83 C ATOM 423 NH1 ARG A 25 9.105 -17.140 -3.998 1.00 3.11 N ATOM 424 NH2 ARG A 25 8.274 -17.886 -2.032 1.00 3.67 N ATOM 0 H ARG A 25 8.535 -12.306 0.232 1.00 1.26 H new ATOM 0 HA ARG A 25 9.352 -12.266 -2.460 1.00 1.27 H new ATOM 0 HB2 ARG A 25 7.676 -13.813 -1.235 1.00 1.39 H new ATOM 0 HB3 ARG A 25 6.477 -12.561 -1.487 1.00 1.39 H new ATOM 0 HG2 ARG A 25 6.143 -13.832 -3.432 1.00 1.55 H new ATOM 0 HG3 ARG A 25 7.316 -12.675 -4.029 1.00 1.55 H new ATOM 0 HD2 ARG A 25 7.966 -15.004 -4.650 1.00 1.73 H new ATOM 0 HD3 ARG A 25 9.170 -14.277 -3.604 1.00 1.73 H new ATOM 0 HE ARG A 25 7.434 -15.565 -1.791 1.00 2.26 H new ATOM 0 HH11 ARG A 25 9.237 -16.386 -4.672 1.00 3.11 H new ATOM 0 HH12 ARG A 25 9.490 -18.065 -4.186 1.00 3.11 H new ATOM 0 HH21 ARG A 25 7.757 -17.714 -1.170 1.00 3.67 H new ATOM 0 HH22 ARG A 25 8.659 -18.812 -2.220 1.00 3.67 H new ATOM 438 N GLN A 26 7.038 -9.993 -1.783 1.00 1.01 N ATOM 439 CA GLN A 26 6.472 -8.715 -2.299 1.00 0.88 C ATOM 440 C GLN A 26 7.560 -7.639 -2.307 1.00 0.79 C ATOM 441 O GLN A 26 7.532 -6.723 -3.101 1.00 0.74 O ATOM 442 CB GLN A 26 5.326 -8.261 -1.388 1.00 0.92 C ATOM 443 CG GLN A 26 4.066 -9.072 -1.686 1.00 1.58 C ATOM 444 CD GLN A 26 4.387 -10.567 -1.627 1.00 2.06 C ATOM 445 OE1 GLN A 26 4.323 -11.173 -0.576 1.00 2.40 O ATOM 446 NE2 GLN A 26 4.732 -11.192 -2.719 1.00 2.90 N ATOM 0 H GLN A 26 6.644 -10.317 -0.900 1.00 1.01 H new ATOM 0 HA GLN A 26 6.100 -8.868 -3.312 1.00 0.88 H new ATOM 0 HB2 GLN A 26 5.610 -8.387 -0.343 1.00 0.92 H new ATOM 0 HB3 GLN A 26 5.129 -7.200 -1.540 1.00 0.92 H new ATOM 0 HG2 GLN A 26 3.287 -8.829 -0.964 1.00 1.58 H new ATOM 0 HG3 GLN A 26 3.680 -8.812 -2.671 1.00 1.58 H new ATOM 0 HE21 GLN A 26 4.786 -10.684 -3.602 1.00 2.90 H new ATOM 0 HE22 GLN A 26 4.948 -12.189 -2.690 1.00 2.90 H new ATOM 455 N PHE A 27 8.511 -7.735 -1.422 1.00 0.82 N ATOM 456 CA PHE A 27 9.589 -6.708 -1.375 1.00 0.74 C ATOM 457 C PHE A 27 10.519 -6.879 -2.583 1.00 0.75 C ATOM 458 O PHE A 27 10.565 -6.048 -3.468 1.00 0.74 O ATOM 459 CB PHE A 27 10.390 -6.879 -0.071 1.00 0.78 C ATOM 460 CG PHE A 27 11.077 -5.578 0.297 1.00 0.75 C ATOM 461 CD1 PHE A 27 12.123 -5.087 -0.494 1.00 1.44 C ATOM 462 CD2 PHE A 27 10.666 -4.864 1.432 1.00 1.15 C ATOM 463 CE1 PHE A 27 12.756 -3.886 -0.151 1.00 1.44 C ATOM 464 CE2 PHE A 27 11.299 -3.664 1.773 1.00 1.15 C ATOM 465 CZ PHE A 27 12.344 -3.174 0.981 1.00 0.74 C ATOM 0 H PHE A 27 8.589 -8.479 -0.729 1.00 0.82 H new ATOM 0 HA PHE A 27 9.149 -5.711 -1.405 1.00 0.74 H new ATOM 0 HB2 PHE A 27 9.725 -7.188 0.735 1.00 0.78 H new ATOM 0 HB3 PHE A 27 11.132 -7.669 -0.192 1.00 0.78 H new ATOM 0 HD1 PHE A 27 12.442 -5.635 -1.369 1.00 1.44 H new ATOM 0 HD2 PHE A 27 9.860 -5.241 2.044 1.00 1.15 H new ATOM 0 HE1 PHE A 27 13.563 -3.509 -0.761 1.00 1.44 H new ATOM 0 HE2 PHE A 27 10.981 -3.116 2.647 1.00 1.15 H new ATOM 0 HZ PHE A 27 12.832 -2.247 1.243 1.00 0.74 H new ATOM 475 N ARG A 28 11.269 -7.948 -2.617 1.00 0.84 N ATOM 476 CA ARG A 28 12.208 -8.173 -3.754 1.00 0.90 C ATOM 477 C ARG A 28 11.445 -8.157 -5.081 1.00 0.89 C ATOM 478 O ARG A 28 11.893 -7.587 -6.057 1.00 0.89 O ATOM 479 CB ARG A 28 12.898 -9.527 -3.585 1.00 1.04 C ATOM 480 CG ARG A 28 13.956 -9.702 -4.680 1.00 1.73 C ATOM 481 CD ARG A 28 14.913 -10.832 -4.298 1.00 1.87 C ATOM 482 NE ARG A 28 14.180 -12.129 -4.302 1.00 2.53 N ATOM 483 CZ ARG A 28 14.843 -13.253 -4.307 1.00 3.19 C ATOM 484 NH1 ARG A 28 16.148 -13.240 -4.311 1.00 3.45 N ATOM 485 NH2 ARG A 28 14.202 -14.390 -4.310 1.00 4.07 N ATOM 0 H ARG A 28 11.272 -8.677 -1.904 1.00 0.84 H new ATOM 0 HA ARG A 28 12.952 -7.377 -3.760 1.00 0.90 H new ATOM 0 HB2 ARG A 28 13.364 -9.590 -2.601 1.00 1.04 H new ATOM 0 HB3 ARG A 28 12.164 -10.331 -3.642 1.00 1.04 H new ATOM 0 HG2 ARG A 28 13.474 -9.927 -5.632 1.00 1.73 H new ATOM 0 HG3 ARG A 28 14.510 -8.773 -4.815 1.00 1.73 H new ATOM 0 HD2 ARG A 28 15.745 -10.871 -5.001 1.00 1.87 H new ATOM 0 HD3 ARG A 28 15.337 -10.645 -3.311 1.00 1.87 H new ATOM 0 HE ARG A 28 13.160 -12.138 -4.301 1.00 2.53 H new ATOM 0 HH11 ARG A 28 16.649 -12.352 -4.310 1.00 3.45 H new ATOM 0 HH12 ARG A 28 16.667 -14.118 -4.315 1.00 3.45 H new ATOM 0 HH21 ARG A 28 13.182 -14.400 -4.308 1.00 4.07 H new ATOM 0 HH22 ARG A 28 14.721 -15.268 -4.314 1.00 4.07 H new ATOM 499 N LYS A 29 10.301 -8.780 -5.133 1.00 0.91 N ATOM 500 CA LYS A 29 9.526 -8.794 -6.405 1.00 0.93 C ATOM 501 C LYS A 29 9.124 -7.364 -6.765 1.00 0.80 C ATOM 502 O LYS A 29 9.536 -6.830 -7.774 1.00 0.85 O ATOM 503 CB LYS A 29 8.270 -9.656 -6.232 1.00 1.00 C ATOM 504 CG LYS A 29 7.586 -9.882 -7.596 1.00 1.05 C ATOM 505 CD LYS A 29 8.216 -11.088 -8.323 1.00 1.22 C ATOM 506 CE LYS A 29 7.575 -12.396 -7.840 1.00 1.62 C ATOM 507 NZ LYS A 29 6.309 -12.634 -8.589 1.00 2.20 N ATOM 0 H LYS A 29 9.871 -9.278 -4.354 1.00 0.91 H new ATOM 0 HA LYS A 29 10.139 -9.212 -7.203 1.00 0.93 H new ATOM 0 HB2 LYS A 29 8.537 -10.615 -5.788 1.00 1.00 H new ATOM 0 HB3 LYS A 29 7.577 -9.168 -5.546 1.00 1.00 H new ATOM 0 HG2 LYS A 29 6.520 -10.054 -7.451 1.00 1.05 H new ATOM 0 HG3 LYS A 29 7.684 -8.987 -8.211 1.00 1.05 H new ATOM 0 HD2 LYS A 29 8.080 -10.984 -9.399 1.00 1.22 H new ATOM 0 HD3 LYS A 29 9.290 -11.112 -8.139 1.00 1.22 H new ATOM 0 HE2 LYS A 29 8.262 -13.228 -7.992 1.00 1.62 H new ATOM 0 HE3 LYS A 29 7.373 -12.341 -6.770 1.00 1.62 H new ATOM 0 HZ1 LYS A 29 5.874 -13.520 -8.262 1.00 2.20 H new ATOM 0 HZ2 LYS A 29 5.653 -11.844 -8.422 1.00 2.20 H new ATOM 0 HZ3 LYS A 29 6.515 -12.704 -9.606 1.00 2.20 H new ATOM 521 N THR A 30 8.326 -6.741 -5.943 1.00 0.70 N ATOM 522 CA THR A 30 7.897 -5.342 -6.232 1.00 0.61 C ATOM 523 C THR A 30 9.123 -4.481 -6.550 1.00 0.61 C ATOM 524 O THR A 30 9.011 -3.412 -7.115 1.00 0.63 O ATOM 525 CB THR A 30 7.180 -4.769 -5.008 1.00 0.58 C ATOM 526 OG1 THR A 30 6.113 -5.631 -4.639 1.00 0.74 O ATOM 527 CG2 THR A 30 6.624 -3.386 -5.345 1.00 0.63 C ATOM 0 H THR A 30 7.951 -7.140 -5.082 1.00 0.70 H new ATOM 0 HA THR A 30 7.222 -5.341 -7.088 1.00 0.61 H new ATOM 0 HB THR A 30 7.884 -4.686 -4.180 1.00 0.58 H new ATOM 0 HG1 THR A 30 6.469 -6.398 -4.144 1.00 0.74 H new ATOM 0 HG21 THR A 30 6.113 -2.977 -4.473 1.00 0.63 H new ATOM 0 HG22 THR A 30 7.442 -2.724 -5.630 1.00 0.63 H new ATOM 0 HG23 THR A 30 5.920 -3.469 -6.173 1.00 0.63 H new ATOM 535 N PHE A 31 10.294 -4.933 -6.186 1.00 0.68 N ATOM 536 CA PHE A 31 11.522 -4.132 -6.462 1.00 0.77 C ATOM 537 C PHE A 31 11.907 -4.265 -7.939 1.00 0.90 C ATOM 538 O PHE A 31 11.691 -3.367 -8.728 1.00 0.92 O ATOM 539 CB PHE A 31 12.671 -4.636 -5.581 1.00 0.87 C ATOM 540 CG PHE A 31 13.770 -3.600 -5.531 1.00 0.81 C ATOM 541 CD1 PHE A 31 13.730 -2.583 -4.568 1.00 1.21 C ATOM 542 CD2 PHE A 31 14.828 -3.656 -6.446 1.00 1.66 C ATOM 543 CE1 PHE A 31 14.748 -1.623 -4.521 1.00 1.25 C ATOM 544 CE2 PHE A 31 15.846 -2.696 -6.398 1.00 1.69 C ATOM 545 CZ PHE A 31 15.806 -1.680 -5.436 1.00 0.92 C ATOM 0 H PHE A 31 10.453 -5.821 -5.710 1.00 0.68 H new ATOM 0 HA PHE A 31 11.326 -3.084 -6.237 1.00 0.77 H new ATOM 0 HB2 PHE A 31 12.306 -4.842 -4.575 1.00 0.87 H new ATOM 0 HB3 PHE A 31 13.061 -5.574 -5.977 1.00 0.87 H new ATOM 0 HD1 PHE A 31 12.914 -2.540 -3.862 1.00 1.21 H new ATOM 0 HD2 PHE A 31 14.859 -4.439 -7.189 1.00 1.66 H new ATOM 0 HE1 PHE A 31 14.717 -0.839 -3.779 1.00 1.25 H new ATOM 0 HE2 PHE A 31 16.663 -2.739 -7.104 1.00 1.69 H new ATOM 0 HZ PHE A 31 16.592 -0.940 -5.400 1.00 0.92 H new ATOM 555 N GLU A 32 12.478 -5.376 -8.320 1.00 1.04 N ATOM 556 CA GLU A 32 12.876 -5.557 -9.747 1.00 1.22 C ATOM 557 C GLU A 32 11.680 -5.252 -10.651 1.00 1.22 C ATOM 558 O GLU A 32 11.804 -5.156 -11.855 1.00 1.40 O ATOM 559 CB GLU A 32 13.330 -7.001 -9.972 1.00 1.30 C ATOM 560 CG GLU A 32 14.639 -7.248 -9.220 1.00 1.43 C ATOM 561 CD GLU A 32 15.150 -8.656 -9.533 1.00 1.98 C ATOM 562 OE1 GLU A 32 14.587 -9.600 -9.004 1.00 2.24 O ATOM 563 OE2 GLU A 32 16.095 -8.766 -10.297 1.00 2.70 O ATOM 0 H GLU A 32 12.686 -6.164 -7.707 1.00 1.04 H new ATOM 0 HA GLU A 32 13.695 -4.878 -9.985 1.00 1.22 H new ATOM 0 HB2 GLU A 32 12.563 -7.693 -9.625 1.00 1.30 H new ATOM 0 HB3 GLU A 32 13.469 -7.188 -11.037 1.00 1.30 H new ATOM 0 HG2 GLU A 32 15.383 -6.507 -9.511 1.00 1.43 H new ATOM 0 HG3 GLU A 32 14.481 -7.137 -8.147 1.00 1.43 H new ATOM 570 N GLU A 33 10.520 -5.101 -10.073 1.00 1.08 N ATOM 571 CA GLU A 33 9.300 -4.804 -10.880 1.00 1.14 C ATOM 572 C GLU A 33 9.151 -3.285 -11.031 1.00 1.18 C ATOM 573 O GLU A 33 8.712 -2.793 -12.051 1.00 1.53 O ATOM 574 CB GLU A 33 8.078 -5.384 -10.147 1.00 1.08 C ATOM 575 CG GLU A 33 7.828 -6.829 -10.594 1.00 1.16 C ATOM 576 CD GLU A 33 7.182 -6.832 -11.980 1.00 1.63 C ATOM 577 OE1 GLU A 33 6.127 -6.237 -12.121 1.00 2.19 O ATOM 578 OE2 GLU A 33 7.754 -7.428 -12.878 1.00 2.26 O ATOM 0 H GLU A 33 10.363 -5.171 -9.068 1.00 1.08 H new ATOM 0 HA GLU A 33 9.380 -5.251 -11.871 1.00 1.14 H new ATOM 0 HB2 GLU A 33 8.242 -5.352 -9.070 1.00 1.08 H new ATOM 0 HB3 GLU A 33 7.198 -4.775 -10.353 1.00 1.08 H new ATOM 0 HG2 GLU A 33 8.768 -7.381 -10.618 1.00 1.16 H new ATOM 0 HG3 GLU A 33 7.180 -7.335 -9.878 1.00 1.16 H new ATOM 585 N ALA A 34 9.508 -2.540 -10.021 1.00 0.91 N ATOM 586 CA ALA A 34 9.379 -1.058 -10.107 1.00 0.95 C ATOM 587 C ALA A 34 10.525 -0.499 -10.963 1.00 1.55 C ATOM 588 O ALA A 34 10.451 0.604 -11.468 1.00 1.70 O ATOM 589 CB ALA A 34 9.417 -0.464 -8.680 1.00 0.83 C ATOM 0 H ALA A 34 9.883 -2.893 -9.141 1.00 0.91 H new ATOM 0 HA ALA A 34 8.433 -0.786 -10.574 1.00 0.95 H new ATOM 0 HB1 ALA A 34 9.323 0.621 -8.735 1.00 0.83 H new ATOM 0 HB2 ALA A 34 8.592 -0.871 -8.095 1.00 0.83 H new ATOM 0 HB3 ALA A 34 10.362 -0.723 -8.203 1.00 0.83 H new ATOM 595 N GLY A 35 11.579 -1.249 -11.131 1.00 2.02 N ATOM 596 CA GLY A 35 12.718 -0.755 -11.955 1.00 2.71 C ATOM 597 C GLY A 35 12.258 -0.564 -13.401 1.00 1.89 C ATOM 598 O GLY A 35 12.931 0.055 -14.201 1.00 2.20 O ATOM 0 H GLY A 35 11.701 -2.181 -10.734 1.00 2.02 H new ATOM 0 HA2 GLY A 35 13.089 0.188 -11.553 1.00 2.71 H new ATOM 0 HA3 GLY A 35 13.544 -1.465 -11.916 1.00 2.71 H new ATOM 602 N LYS A 36 11.114 -1.092 -13.743 1.00 1.22 N ATOM 603 CA LYS A 36 10.609 -0.942 -15.137 1.00 1.47 C ATOM 604 C LYS A 36 9.931 0.421 -15.289 1.00 1.60 C ATOM 605 O LYS A 36 9.801 0.941 -16.379 1.00 2.06 O ATOM 606 CB LYS A 36 9.592 -2.048 -15.436 1.00 1.84 C ATOM 607 CG LYS A 36 10.146 -3.403 -14.986 1.00 1.78 C ATOM 608 CD LYS A 36 11.423 -3.727 -15.768 1.00 1.27 C ATOM 609 CE LYS A 36 11.739 -5.220 -15.644 1.00 1.57 C ATOM 610 NZ LYS A 36 13.061 -5.502 -16.271 1.00 2.06 N ATOM 0 H LYS A 36 10.507 -1.621 -13.117 1.00 1.22 H new ATOM 0 HA LYS A 36 11.444 -1.016 -15.834 1.00 1.47 H new ATOM 0 HB2 LYS A 36 8.654 -1.840 -14.921 1.00 1.84 H new ATOM 0 HB3 LYS A 36 9.371 -2.072 -16.503 1.00 1.84 H new ATOM 0 HG2 LYS A 36 10.358 -3.382 -13.917 1.00 1.78 H new ATOM 0 HG3 LYS A 36 9.402 -4.183 -15.148 1.00 1.78 H new ATOM 0 HD2 LYS A 36 11.297 -3.458 -16.817 1.00 1.27 H new ATOM 0 HD3 LYS A 36 12.255 -3.136 -15.385 1.00 1.27 H new ATOM 0 HE2 LYS A 36 11.752 -5.514 -14.594 1.00 1.57 H new ATOM 0 HE3 LYS A 36 10.961 -5.809 -16.130 1.00 1.57 H new ATOM 0 HZ1 LYS A 36 13.276 -6.516 -16.187 1.00 2.06 H new ATOM 0 HZ2 LYS A 36 13.032 -5.236 -17.276 1.00 2.06 H new ATOM 0 HZ3 LYS A 36 13.799 -4.951 -15.788 1.00 2.06 H new ATOM 624 N MET A 37 9.491 1.002 -14.205 1.00 1.32 N ATOM 625 CA MET A 37 8.815 2.329 -14.290 1.00 1.49 C ATOM 626 C MET A 37 9.879 3.443 -14.292 1.00 1.68 C ATOM 627 O MET A 37 10.810 3.407 -13.512 1.00 1.71 O ATOM 628 CB MET A 37 7.902 2.515 -13.074 1.00 1.44 C ATOM 629 CG MET A 37 6.890 1.354 -12.973 1.00 1.33 C ATOM 630 SD MET A 37 6.536 1.005 -11.231 1.00 1.63 S ATOM 631 CE MET A 37 6.156 2.699 -10.724 1.00 0.92 C ATOM 0 H MET A 37 9.570 0.615 -13.265 1.00 1.32 H new ATOM 0 HA MET A 37 8.225 2.378 -15.205 1.00 1.49 H new ATOM 0 HB2 MET A 37 8.502 2.562 -12.165 1.00 1.44 H new ATOM 0 HB3 MET A 37 7.370 3.463 -13.153 1.00 1.44 H new ATOM 0 HG2 MET A 37 5.970 1.614 -13.496 1.00 1.33 H new ATOM 0 HG3 MET A 37 7.292 0.465 -13.458 1.00 1.33 H new ATOM 0 HE1 MET A 37 5.489 2.680 -9.862 1.00 0.92 H new ATOM 0 HE2 MET A 37 7.079 3.215 -10.458 1.00 0.92 H new ATOM 0 HE3 MET A 37 5.671 3.225 -11.546 1.00 0.92 H new ATOM 684 N HIS A 41 14.426 4.684 -9.632 1.00 1.36 N ATOM 685 CA HIS A 41 14.049 3.297 -9.232 1.00 1.22 C ATOM 686 C HIS A 41 13.605 3.290 -7.767 1.00 0.94 C ATOM 687 O HIS A 41 12.609 2.691 -7.411 1.00 0.92 O ATOM 688 CB HIS A 41 15.260 2.375 -9.400 1.00 1.34 C ATOM 689 CG HIS A 41 14.836 0.940 -9.231 1.00 1.20 C ATOM 690 ND1 HIS A 41 15.747 -0.108 -9.283 1.00 1.57 N ATOM 691 CD2 HIS A 41 13.610 0.359 -9.010 1.00 1.61 C ATOM 692 CE1 HIS A 41 15.061 -1.251 -9.098 1.00 2.39 C ATOM 693 NE2 HIS A 41 13.759 -1.021 -8.927 1.00 2.46 N ATOM 0 HA HIS A 41 13.231 2.946 -9.861 1.00 1.22 H new ATOM 0 HB2 HIS A 41 15.704 2.519 -10.385 1.00 1.34 H new ATOM 0 HB3 HIS A 41 16.025 2.627 -8.665 1.00 1.34 H new ATOM 0 HD2 HIS A 41 12.675 0.892 -8.915 1.00 1.61 H new ATOM 0 HE1 HIS A 41 15.510 -2.233 -9.089 1.00 2.39 H new ATOM 0 HE2 HIS A 41 13.026 -1.712 -8.769 1.00 2.46 H new ATOM 702 N GLY A 42 14.338 3.951 -6.914 1.00 0.85 N ATOM 703 CA GLY A 42 13.959 3.978 -5.474 1.00 0.78 C ATOM 704 C GLY A 42 12.525 4.491 -5.325 1.00 0.77 C ATOM 705 O GLY A 42 11.669 3.817 -4.788 1.00 0.75 O ATOM 0 H GLY A 42 15.182 4.473 -7.152 1.00 0.85 H new ATOM 0 HA2 GLY A 42 14.044 2.978 -5.047 1.00 0.78 H new ATOM 0 HA3 GLY A 42 14.644 4.620 -4.920 1.00 0.78 H new ATOM 709 N GLU A 43 12.255 5.679 -5.793 1.00 0.89 N ATOM 710 CA GLU A 43 10.875 6.231 -5.673 1.00 0.93 C ATOM 711 C GLU A 43 9.863 5.184 -6.148 1.00 0.85 C ATOM 712 O GLU A 43 8.907 4.877 -5.466 1.00 0.82 O ATOM 713 CB GLU A 43 10.753 7.492 -6.534 1.00 1.08 C ATOM 714 CG GLU A 43 9.509 8.281 -6.117 1.00 1.36 C ATOM 715 CD GLU A 43 9.359 9.511 -7.013 1.00 1.59 C ATOM 716 OE1 GLU A 43 10.339 10.217 -7.186 1.00 2.17 O ATOM 717 OE2 GLU A 43 8.267 9.726 -7.513 1.00 1.81 O ATOM 0 H GLU A 43 12.929 6.291 -6.253 1.00 0.89 H new ATOM 0 HA GLU A 43 10.673 6.483 -4.632 1.00 0.93 H new ATOM 0 HB2 GLU A 43 11.643 8.110 -6.419 1.00 1.08 H new ATOM 0 HB3 GLU A 43 10.687 7.220 -7.588 1.00 1.08 H new ATOM 0 HG2 GLU A 43 8.623 7.651 -6.195 1.00 1.36 H new ATOM 0 HG3 GLU A 43 9.592 8.586 -5.074 1.00 1.36 H new ATOM 724 N ASN A 44 10.071 4.633 -7.313 1.00 0.84 N ATOM 725 CA ASN A 44 9.126 3.603 -7.831 1.00 0.79 C ATOM 726 C ASN A 44 8.869 2.552 -6.746 1.00 0.64 C ATOM 727 O ASN A 44 7.742 2.229 -6.438 1.00 0.65 O ATOM 728 CB ASN A 44 9.736 2.931 -9.062 1.00 0.83 C ATOM 729 CG ASN A 44 9.952 3.974 -10.160 1.00 1.13 C ATOM 730 OD1 ASN A 44 9.242 4.958 -10.228 1.00 1.81 O ATOM 731 ND2 ASN A 44 10.910 3.800 -11.029 1.00 1.62 N ATOM 0 H ASN A 44 10.854 4.852 -7.928 1.00 0.84 H new ATOM 0 HA ASN A 44 8.183 4.076 -8.104 1.00 0.79 H new ATOM 0 HB2 ASN A 44 10.684 2.461 -8.800 1.00 0.83 H new ATOM 0 HB3 ASN A 44 9.077 2.140 -9.421 1.00 0.83 H new ATOM 0 HD21 ASN A 44 11.063 4.490 -11.765 1.00 1.62 H new ATOM 0 HD22 ASN A 44 11.506 2.974 -10.972 1.00 1.62 H new ATOM 738 N PHE A 45 9.905 2.014 -6.162 1.00 0.60 N ATOM 739 CA PHE A 45 9.702 0.986 -5.101 1.00 0.52 C ATOM 740 C PHE A 45 8.873 1.584 -3.961 1.00 0.51 C ATOM 741 O PHE A 45 7.975 0.954 -3.438 1.00 0.51 O ATOM 742 CB PHE A 45 11.061 0.527 -4.563 1.00 0.65 C ATOM 743 CG PHE A 45 10.853 -0.496 -3.466 1.00 0.39 C ATOM 744 CD1 PHE A 45 10.239 -1.722 -3.757 1.00 1.33 C ATOM 745 CD2 PHE A 45 11.273 -0.220 -2.156 1.00 1.25 C ATOM 746 CE1 PHE A 45 10.045 -2.667 -2.743 1.00 1.58 C ATOM 747 CE2 PHE A 45 11.079 -1.167 -1.144 1.00 1.49 C ATOM 748 CZ PHE A 45 10.465 -2.390 -1.438 1.00 1.23 C ATOM 0 H PHE A 45 10.877 2.240 -6.372 1.00 0.60 H new ATOM 0 HA PHE A 45 9.174 0.131 -5.522 1.00 0.52 H new ATOM 0 HB2 PHE A 45 11.656 0.096 -5.368 1.00 0.65 H new ATOM 0 HB3 PHE A 45 11.618 1.381 -4.177 1.00 0.65 H new ATOM 0 HD1 PHE A 45 9.915 -1.938 -4.765 1.00 1.33 H new ATOM 0 HD2 PHE A 45 11.746 0.724 -1.929 1.00 1.25 H new ATOM 0 HE1 PHE A 45 9.571 -3.611 -2.968 1.00 1.58 H new ATOM 0 HE2 PHE A 45 11.403 -0.954 -0.136 1.00 1.49 H new ATOM 0 HZ PHE A 45 10.315 -3.120 -0.657 1.00 1.23 H new ATOM 758 N MET A 46 9.163 2.797 -3.573 1.00 0.59 N ATOM 759 CA MET A 46 8.387 3.434 -2.469 1.00 0.67 C ATOM 760 C MET A 46 6.979 3.773 -2.967 1.00 0.72 C ATOM 761 O MET A 46 6.085 4.048 -2.192 1.00 0.89 O ATOM 762 CB MET A 46 9.092 4.719 -2.025 1.00 0.83 C ATOM 763 CG MET A 46 10.354 4.379 -1.220 1.00 0.98 C ATOM 764 SD MET A 46 9.910 3.547 0.330 1.00 1.57 S ATOM 765 CE MET A 46 8.958 4.896 1.070 1.00 0.82 C ATOM 0 H MET A 46 9.903 3.374 -3.972 1.00 0.59 H new ATOM 0 HA MET A 46 8.321 2.745 -1.627 1.00 0.67 H new ATOM 0 HB2 MET A 46 9.358 5.317 -2.897 1.00 0.83 H new ATOM 0 HB3 MET A 46 8.416 5.322 -1.419 1.00 0.83 H new ATOM 0 HG2 MET A 46 11.008 3.737 -1.810 1.00 0.98 H new ATOM 0 HG3 MET A 46 10.912 5.290 -1.004 1.00 0.98 H new ATOM 0 HE1 MET A 46 9.138 4.921 2.145 1.00 0.82 H new ATOM 0 HE2 MET A 46 9.266 5.844 0.628 1.00 0.82 H new ATOM 0 HE3 MET A 46 7.896 4.737 0.884 1.00 0.82 H new ATOM 775 N ILE A 47 6.777 3.756 -4.258 1.00 0.70 N ATOM 776 CA ILE A 47 5.431 4.079 -4.816 1.00 0.81 C ATOM 777 C ILE A 47 4.571 2.806 -4.849 1.00 0.73 C ATOM 778 O ILE A 47 3.435 2.804 -4.417 1.00 0.86 O ATOM 779 CB ILE A 47 5.607 4.648 -6.236 1.00 0.87 C ATOM 780 CG1 ILE A 47 6.087 6.104 -6.143 1.00 1.07 C ATOM 781 CG2 ILE A 47 4.285 4.596 -7.006 1.00 0.95 C ATOM 782 CD1 ILE A 47 6.513 6.614 -7.526 1.00 1.11 C ATOM 0 H ILE A 47 7.489 3.531 -4.953 1.00 0.70 H new ATOM 0 HA ILE A 47 4.931 4.819 -4.192 1.00 0.81 H new ATOM 0 HB ILE A 47 6.344 4.045 -6.767 1.00 0.87 H new ATOM 0 HG12 ILE A 47 5.290 6.732 -5.746 1.00 1.07 H new ATOM 0 HG13 ILE A 47 6.924 6.174 -5.448 1.00 1.07 H new ATOM 0 HG21 ILE A 47 4.431 5.003 -8.007 1.00 0.95 H new ATOM 0 HG22 ILE A 47 3.947 3.562 -7.080 1.00 0.95 H new ATOM 0 HG23 ILE A 47 3.534 5.186 -6.480 1.00 0.95 H new ATOM 0 HD11 ILE A 47 6.851 7.647 -7.445 1.00 1.11 H new ATOM 0 HD12 ILE A 47 7.325 5.996 -7.907 1.00 1.11 H new ATOM 0 HD13 ILE A 47 5.666 6.562 -8.210 1.00 1.11 H new ATOM 794 N LEU A 48 5.098 1.726 -5.361 1.00 0.61 N ATOM 795 CA LEU A 48 4.299 0.466 -5.420 1.00 0.65 C ATOM 796 C LEU A 48 3.922 0.020 -4.004 1.00 0.73 C ATOM 797 O LEU A 48 2.800 -0.371 -3.750 1.00 0.99 O ATOM 798 CB LEU A 48 5.119 -0.640 -6.092 1.00 0.59 C ATOM 799 CG LEU A 48 5.614 -0.186 -7.471 1.00 0.56 C ATOM 800 CD1 LEU A 48 6.314 -1.359 -8.161 1.00 0.75 C ATOM 801 CD2 LEU A 48 4.431 0.282 -8.334 1.00 0.68 C ATOM 0 H LEU A 48 6.043 1.661 -5.740 1.00 0.61 H new ATOM 0 HA LEU A 48 3.393 0.652 -5.997 1.00 0.65 H new ATOM 0 HB2 LEU A 48 5.970 -0.902 -5.463 1.00 0.59 H new ATOM 0 HB3 LEU A 48 4.511 -1.538 -6.196 1.00 0.59 H new ATOM 0 HG LEU A 48 6.309 0.644 -7.347 1.00 0.56 H new ATOM 0 HD11 LEU A 48 6.669 -1.045 -9.142 1.00 0.75 H new ATOM 0 HD12 LEU A 48 7.160 -1.684 -7.556 1.00 0.75 H new ATOM 0 HD13 LEU A 48 5.612 -2.185 -8.277 1.00 0.75 H new ATOM 0 HD21 LEU A 48 4.797 0.601 -9.310 1.00 0.68 H new ATOM 0 HD22 LEU A 48 3.726 -0.540 -8.462 1.00 0.68 H new ATOM 0 HD23 LEU A 48 3.930 1.117 -7.843 1.00 0.68 H new ATOM 813 N LEU A 49 4.847 0.065 -3.082 1.00 0.60 N ATOM 814 CA LEU A 49 4.532 -0.367 -1.686 1.00 0.72 C ATOM 815 C LEU A 49 3.203 0.252 -1.241 1.00 0.87 C ATOM 816 O LEU A 49 2.503 -0.291 -0.410 1.00 1.08 O ATOM 817 CB LEU A 49 5.640 0.099 -0.735 1.00 0.73 C ATOM 818 CG LEU A 49 6.908 -0.753 -0.918 1.00 0.62 C ATOM 819 CD1 LEU A 49 8.027 -0.171 -0.041 1.00 0.65 C ATOM 820 CD2 LEU A 49 6.637 -2.224 -0.519 1.00 0.69 C ATOM 0 H LEU A 49 5.805 0.381 -3.233 1.00 0.60 H new ATOM 0 HA LEU A 49 4.460 -1.454 -1.661 1.00 0.72 H new ATOM 0 HB2 LEU A 49 5.870 1.148 -0.923 1.00 0.73 H new ATOM 0 HB3 LEU A 49 5.294 0.029 0.296 1.00 0.73 H new ATOM 0 HG LEU A 49 7.207 -0.734 -1.966 1.00 0.62 H new ATOM 0 HD11 LEU A 49 8.932 -0.767 -0.162 1.00 0.65 H new ATOM 0 HD12 LEU A 49 8.227 0.857 -0.341 1.00 0.65 H new ATOM 0 HD13 LEU A 49 7.717 -0.190 1.004 1.00 0.65 H new ATOM 0 HD21 LEU A 49 7.545 -2.811 -0.655 1.00 0.69 H new ATOM 0 HD22 LEU A 49 6.330 -2.267 0.526 1.00 0.69 H new ATOM 0 HD23 LEU A 49 5.844 -2.631 -1.147 1.00 0.69 H new ATOM 832 N GLU A 50 2.854 1.389 -1.781 1.00 0.88 N ATOM 833 CA GLU A 50 1.574 2.048 -1.384 1.00 1.04 C ATOM 834 C GLU A 50 0.445 1.576 -2.303 1.00 1.01 C ATOM 835 O GLU A 50 -0.692 1.452 -1.892 1.00 1.10 O ATOM 836 CB GLU A 50 1.729 3.566 -1.508 1.00 1.11 C ATOM 837 CG GLU A 50 0.561 4.263 -0.805 1.00 1.59 C ATOM 838 CD GLU A 50 0.819 5.769 -0.763 1.00 1.70 C ATOM 839 OE1 GLU A 50 0.960 6.356 -1.823 1.00 1.97 O ATOM 840 OE2 GLU A 50 0.872 6.311 0.329 1.00 2.27 O ATOM 0 H GLU A 50 3.400 1.891 -2.481 1.00 0.88 H new ATOM 0 HA GLU A 50 1.334 1.785 -0.354 1.00 1.04 H new ATOM 0 HB2 GLU A 50 2.673 3.882 -1.065 1.00 1.11 H new ATOM 0 HB3 GLU A 50 1.757 3.854 -2.559 1.00 1.11 H new ATOM 0 HG2 GLU A 50 -0.370 4.057 -1.333 1.00 1.59 H new ATOM 0 HG3 GLU A 50 0.447 3.874 0.207 1.00 1.59 H new ATOM 847 N SER A 51 0.747 1.313 -3.545 1.00 0.98 N ATOM 848 CA SER A 51 -0.311 0.852 -4.488 1.00 0.99 C ATOM 849 C SER A 51 -0.925 -0.455 -3.978 1.00 0.99 C ATOM 850 O SER A 51 -1.974 -0.873 -4.427 1.00 1.08 O ATOM 851 CB SER A 51 0.303 0.620 -5.869 1.00 1.10 C ATOM 852 OG SER A 51 1.056 1.765 -6.246 1.00 1.82 O ATOM 0 H SER A 51 1.680 1.397 -3.947 1.00 0.98 H new ATOM 0 HA SER A 51 -1.088 1.613 -4.556 1.00 0.99 H new ATOM 0 HB2 SER A 51 0.944 -0.261 -5.851 1.00 1.10 H new ATOM 0 HB3 SER A 51 -0.482 0.429 -6.601 1.00 1.10 H new ATOM 0 HG SER A 51 1.453 1.619 -7.130 1.00 1.82 H new ATOM 858 N ARG A 52 -0.272 -1.108 -3.052 1.00 1.00 N ATOM 859 CA ARG A 52 -0.808 -2.396 -2.517 1.00 1.02 C ATOM 860 C ARG A 52 -2.313 -2.279 -2.257 1.00 0.88 C ATOM 861 O ARG A 52 -2.763 -1.439 -1.503 1.00 0.82 O ATOM 862 CB ARG A 52 -0.093 -2.742 -1.208 1.00 1.09 C ATOM 863 CG ARG A 52 1.376 -3.069 -1.492 1.00 1.25 C ATOM 864 CD ARG A 52 1.996 -3.736 -0.261 1.00 1.73 C ATOM 865 NE ARG A 52 1.425 -3.130 0.974 1.00 2.33 N ATOM 866 CZ ARG A 52 1.567 -3.733 2.122 1.00 2.94 C ATOM 867 NH1 ARG A 52 2.210 -4.867 2.188 1.00 3.14 N ATOM 868 NH2 ARG A 52 1.067 -3.204 3.204 1.00 3.81 N ATOM 0 H ARG A 52 0.611 -0.804 -2.642 1.00 1.00 H new ATOM 0 HA ARG A 52 -0.635 -3.182 -3.252 1.00 1.02 H new ATOM 0 HB2 ARG A 52 -0.161 -1.905 -0.513 1.00 1.09 H new ATOM 0 HB3 ARG A 52 -0.579 -3.593 -0.731 1.00 1.09 H new ATOM 0 HG2 ARG A 52 1.452 -3.731 -2.355 1.00 1.25 H new ATOM 0 HG3 ARG A 52 1.921 -2.158 -1.739 1.00 1.25 H new ATOM 0 HD2 ARG A 52 1.799 -4.808 -0.277 1.00 1.73 H new ATOM 0 HD3 ARG A 52 3.079 -3.611 -0.273 1.00 1.73 H new ATOM 0 HE ARG A 52 0.923 -2.244 0.922 1.00 2.33 H new ATOM 0 HH11 ARG A 52 2.601 -5.281 1.342 1.00 3.14 H new ATOM 0 HH12 ARG A 52 2.321 -5.339 3.086 1.00 3.14 H new ATOM 0 HH21 ARG A 52 0.564 -2.318 3.153 1.00 3.81 H new ATOM 0 HH22 ARG A 52 1.179 -3.676 4.101 1.00 3.81 H new ATOM 882 N LEU A 53 -3.090 -3.122 -2.883 1.00 0.89 N ATOM 883 CA LEU A 53 -4.571 -3.081 -2.694 1.00 0.78 C ATOM 884 C LEU A 53 -4.908 -2.913 -1.207 1.00 0.73 C ATOM 885 O LEU A 53 -5.730 -2.104 -0.840 1.00 0.66 O ATOM 886 CB LEU A 53 -5.188 -4.401 -3.189 1.00 0.84 C ATOM 887 CG LEU A 53 -5.318 -4.412 -4.720 1.00 0.83 C ATOM 888 CD1 LEU A 53 -6.356 -3.377 -5.192 1.00 0.81 C ATOM 889 CD2 LEU A 53 -3.957 -4.115 -5.353 1.00 0.90 C ATOM 0 H LEU A 53 -2.760 -3.844 -3.523 1.00 0.89 H new ATOM 0 HA LEU A 53 -4.973 -2.240 -3.259 1.00 0.78 H new ATOM 0 HB2 LEU A 53 -4.569 -5.238 -2.868 1.00 0.84 H new ATOM 0 HB3 LEU A 53 -6.170 -4.539 -2.737 1.00 0.84 H new ATOM 0 HG LEU A 53 -5.657 -5.400 -5.032 1.00 0.83 H new ATOM 0 HD11 LEU A 53 -6.429 -3.405 -6.279 1.00 0.81 H new ATOM 0 HD12 LEU A 53 -7.327 -3.612 -4.757 1.00 0.81 H new ATOM 0 HD13 LEU A 53 -6.047 -2.381 -4.874 1.00 0.81 H new ATOM 0 HD21 LEU A 53 -4.051 -4.123 -6.439 1.00 0.90 H new ATOM 0 HD22 LEU A 53 -3.610 -3.135 -5.026 1.00 0.90 H new ATOM 0 HD23 LEU A 53 -3.239 -4.875 -5.045 1.00 0.90 H new ATOM 901 N ASP A 54 -4.289 -3.678 -0.353 1.00 0.81 N ATOM 902 CA ASP A 54 -4.595 -3.568 1.103 1.00 0.81 C ATOM 903 C ASP A 54 -4.297 -2.153 1.600 1.00 0.76 C ATOM 904 O ASP A 54 -5.155 -1.487 2.146 1.00 0.76 O ATOM 905 CB ASP A 54 -3.744 -4.574 1.881 1.00 0.96 C ATOM 906 CG ASP A 54 -2.271 -4.391 1.511 1.00 1.54 C ATOM 907 OD1 ASP A 54 -1.636 -3.528 2.095 1.00 1.90 O ATOM 908 OD2 ASP A 54 -1.802 -5.117 0.650 1.00 2.40 O ATOM 0 H ASP A 54 -3.585 -4.374 -0.598 1.00 0.81 H new ATOM 0 HA ASP A 54 -5.652 -3.783 1.261 1.00 0.81 H new ATOM 0 HB2 ASP A 54 -3.881 -4.430 2.953 1.00 0.96 H new ATOM 0 HB3 ASP A 54 -4.064 -5.591 1.652 1.00 0.96 H new ATOM 913 N ASN A 55 -3.089 -1.688 1.424 1.00 0.77 N ATOM 914 CA ASN A 55 -2.738 -0.315 1.894 1.00 0.73 C ATOM 915 C ASN A 55 -3.841 0.667 1.485 1.00 0.61 C ATOM 916 O ASN A 55 -4.459 1.301 2.314 1.00 0.59 O ATOM 917 CB ASN A 55 -1.412 0.117 1.265 1.00 0.78 C ATOM 918 CG ASN A 55 -0.921 1.399 1.939 1.00 0.88 C ATOM 919 OD1 ASN A 55 -0.306 1.352 2.985 1.00 1.56 O ATOM 920 ND2 ASN A 55 -1.170 2.552 1.379 1.00 1.10 N ATOM 0 H ASN A 55 -2.329 -2.199 0.975 1.00 0.77 H new ATOM 0 HA ASN A 55 -2.642 -0.319 2.980 1.00 0.73 H new ATOM 0 HB2 ASN A 55 -0.669 -0.673 1.378 1.00 0.78 H new ATOM 0 HB3 ASN A 55 -1.542 0.283 0.195 1.00 0.78 H new ATOM 0 HD21 ASN A 55 -0.848 3.413 1.820 1.00 1.10 H new ATOM 0 HD22 ASN A 55 -1.687 2.591 0.500 1.00 1.10 H new ATOM 927 N LEU A 56 -4.087 0.792 0.211 1.00 0.59 N ATOM 928 CA LEU A 56 -5.142 1.724 -0.271 1.00 0.50 C ATOM 929 C LEU A 56 -6.410 1.577 0.585 1.00 0.45 C ATOM 930 O LEU A 56 -6.900 2.535 1.143 1.00 0.43 O ATOM 931 CB LEU A 56 -5.441 1.385 -1.755 1.00 0.50 C ATOM 932 CG LEU A 56 -5.356 2.641 -2.642 1.00 0.51 C ATOM 933 CD1 LEU A 56 -5.213 2.225 -4.111 1.00 0.59 C ATOM 934 CD2 LEU A 56 -6.633 3.471 -2.476 1.00 0.46 C ATOM 0 H LEU A 56 -3.596 0.282 -0.524 1.00 0.59 H new ATOM 0 HA LEU A 56 -4.803 2.757 -0.188 1.00 0.50 H new ATOM 0 HB2 LEU A 56 -4.732 0.637 -2.110 1.00 0.50 H new ATOM 0 HB3 LEU A 56 -6.435 0.945 -1.837 1.00 0.50 H new ATOM 0 HG LEU A 56 -4.491 3.234 -2.344 1.00 0.51 H new ATOM 0 HD11 LEU A 56 -5.153 3.115 -4.737 1.00 0.59 H new ATOM 0 HD12 LEU A 56 -4.306 1.633 -4.235 1.00 0.59 H new ATOM 0 HD13 LEU A 56 -6.078 1.631 -4.407 1.00 0.59 H new ATOM 0 HD21 LEU A 56 -6.573 4.360 -3.104 1.00 0.46 H new ATOM 0 HD22 LEU A 56 -7.496 2.875 -2.773 1.00 0.46 H new ATOM 0 HD23 LEU A 56 -6.740 3.770 -1.433 1.00 0.46 H new ATOM 946 N VAL A 57 -6.948 0.394 0.695 1.00 0.47 N ATOM 947 CA VAL A 57 -8.182 0.216 1.513 1.00 0.45 C ATOM 948 C VAL A 57 -7.968 0.834 2.898 1.00 0.50 C ATOM 949 O VAL A 57 -8.628 1.784 3.271 1.00 0.56 O ATOM 950 CB VAL A 57 -8.486 -1.283 1.642 1.00 0.50 C ATOM 951 CG1 VAL A 57 -9.775 -1.497 2.443 1.00 0.50 C ATOM 952 CG2 VAL A 57 -8.664 -1.888 0.245 1.00 0.50 C ATOM 0 H VAL A 57 -6.589 -0.454 0.256 1.00 0.47 H new ATOM 0 HA VAL A 57 -9.024 0.713 1.031 1.00 0.45 H new ATOM 0 HB VAL A 57 -7.657 -1.766 2.159 1.00 0.50 H new ATOM 0 HG11 VAL A 57 -9.978 -2.565 2.527 1.00 0.50 H new ATOM 0 HG12 VAL A 57 -9.659 -1.071 3.439 1.00 0.50 H new ATOM 0 HG13 VAL A 57 -10.605 -1.008 1.933 1.00 0.50 H new ATOM 0 HG21 VAL A 57 -8.880 -2.953 0.334 1.00 0.50 H new ATOM 0 HG22 VAL A 57 -9.490 -1.392 -0.264 1.00 0.50 H new ATOM 0 HG23 VAL A 57 -7.748 -1.751 -0.330 1.00 0.50 H new ATOM 962 N TYR A 58 -7.053 0.306 3.666 1.00 0.57 N ATOM 963 CA TYR A 58 -6.807 0.872 5.023 1.00 0.65 C ATOM 964 C TYR A 58 -6.522 2.372 4.901 1.00 0.64 C ATOM 965 O TYR A 58 -7.005 3.170 5.679 1.00 0.68 O ATOM 966 CB TYR A 58 -5.606 0.158 5.666 1.00 0.78 C ATOM 967 CG TYR A 58 -5.111 0.939 6.869 1.00 0.87 C ATOM 968 CD1 TYR A 58 -5.994 1.260 7.909 1.00 1.48 C ATOM 969 CD2 TYR A 58 -3.771 1.345 6.942 1.00 1.45 C ATOM 970 CE1 TYR A 58 -5.539 1.986 9.016 1.00 1.54 C ATOM 971 CE2 TYR A 58 -3.317 2.069 8.050 1.00 1.53 C ATOM 972 CZ TYR A 58 -4.201 2.390 9.087 1.00 1.08 C ATOM 973 OH TYR A 58 -3.753 3.105 10.179 1.00 1.20 O ATOM 0 H TYR A 58 -6.467 -0.490 3.413 1.00 0.57 H new ATOM 0 HA TYR A 58 -7.686 0.724 5.650 1.00 0.65 H new ATOM 0 HB2 TYR A 58 -5.893 -0.849 5.970 1.00 0.78 H new ATOM 0 HB3 TYR A 58 -4.803 0.054 4.936 1.00 0.78 H new ATOM 0 HD1 TYR A 58 -7.026 0.947 7.856 1.00 1.48 H new ATOM 0 HD2 TYR A 58 -3.088 1.099 6.142 1.00 1.45 H new ATOM 0 HE1 TYR A 58 -6.221 2.234 9.816 1.00 1.54 H new ATOM 0 HE2 TYR A 58 -2.284 2.380 8.105 1.00 1.53 H new ATOM 0 HH TYR A 58 -2.800 3.305 10.070 1.00 1.20 H new ATOM 983 N ARG A 59 -5.737 2.762 3.934 1.00 0.66 N ATOM 984 CA ARG A 59 -5.418 4.208 3.770 1.00 0.69 C ATOM 985 C ARG A 59 -6.707 5.027 3.843 1.00 0.62 C ATOM 986 O ARG A 59 -6.853 5.898 4.678 1.00 0.72 O ATOM 987 CB ARG A 59 -4.748 4.435 2.411 1.00 0.75 C ATOM 988 CG ARG A 59 -4.119 5.848 2.355 1.00 0.74 C ATOM 989 CD ARG A 59 -2.664 5.821 2.853 1.00 1.15 C ATOM 990 NE ARG A 59 -2.627 5.620 4.342 1.00 1.12 N ATOM 991 CZ ARG A 59 -3.167 6.478 5.166 1.00 1.63 C ATOM 992 NH1 ARG A 59 -3.635 7.612 4.727 1.00 2.19 N ATOM 993 NH2 ARG A 59 -3.199 6.215 6.444 1.00 2.38 N ATOM 0 H ARG A 59 -5.303 2.142 3.251 1.00 0.66 H new ATOM 0 HA ARG A 59 -4.742 4.521 4.566 1.00 0.69 H new ATOM 0 HB2 ARG A 59 -3.979 3.680 2.246 1.00 0.75 H new ATOM 0 HB3 ARG A 59 -5.482 4.324 1.612 1.00 0.75 H new ATOM 0 HG2 ARG A 59 -4.151 6.224 1.333 1.00 0.74 H new ATOM 0 HG3 ARG A 59 -4.704 6.535 2.966 1.00 0.74 H new ATOM 0 HD2 ARG A 59 -2.117 5.019 2.357 1.00 1.15 H new ATOM 0 HD3 ARG A 59 -2.166 6.755 2.593 1.00 1.15 H new ATOM 0 HE ARG A 59 -2.168 4.791 4.719 1.00 1.12 H new ATOM 0 HH11 ARG A 59 -3.581 7.835 3.733 1.00 2.19 H new ATOM 0 HH12 ARG A 59 -4.055 8.276 5.377 1.00 2.19 H new ATOM 0 HH21 ARG A 59 -2.804 5.343 6.795 1.00 2.38 H new ATOM 0 HH22 ARG A 59 -3.619 6.882 7.091 1.00 2.38 H new ATOM 1007 N LEU A 60 -7.645 4.754 2.978 1.00 0.52 N ATOM 1008 CA LEU A 60 -8.921 5.518 3.008 1.00 0.54 C ATOM 1009 C LEU A 60 -9.536 5.394 4.413 1.00 0.63 C ATOM 1010 O LEU A 60 -9.122 6.071 5.333 1.00 0.81 O ATOM 1011 CB LEU A 60 -9.886 4.961 1.949 1.00 0.52 C ATOM 1012 CG LEU A 60 -9.188 4.882 0.581 1.00 0.42 C ATOM 1013 CD1 LEU A 60 -10.056 4.071 -0.383 1.00 0.39 C ATOM 1014 CD2 LEU A 60 -8.976 6.289 0.006 1.00 0.74 C ATOM 0 H LEU A 60 -7.582 4.037 2.255 1.00 0.52 H new ATOM 0 HA LEU A 60 -8.735 6.568 2.784 1.00 0.54 H new ATOM 0 HB2 LEU A 60 -10.231 3.971 2.247 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -10.767 5.598 1.879 1.00 0.52 H new ATOM 0 HG LEU A 60 -8.218 4.401 0.708 1.00 0.42 H new ATOM 0 HD11 LEU A 60 -9.564 4.013 -1.354 1.00 0.39 H new ATOM 0 HD12 LEU A 60 -10.197 3.065 0.013 1.00 0.39 H new ATOM 0 HD13 LEU A 60 -11.026 4.556 -0.496 1.00 0.39 H new ATOM 0 HD21 LEU A 60 -8.481 6.216 -0.962 1.00 0.74 H new ATOM 0 HD22 LEU A 60 -9.941 6.781 -0.116 1.00 0.74 H new ATOM 0 HD23 LEU A 60 -8.355 6.871 0.688 1.00 0.74 H new ATOM 1026 N GLY A 61 -10.511 4.539 4.597 1.00 0.61 N ATOM 1027 CA GLY A 61 -11.123 4.391 5.952 1.00 0.74 C ATOM 1028 C GLY A 61 -12.134 3.239 5.942 1.00 0.72 C ATOM 1029 O GLY A 61 -13.136 3.274 6.628 1.00 0.82 O ATOM 0 H GLY A 61 -10.907 3.941 3.872 1.00 0.61 H new ATOM 0 HA2 GLY A 61 -10.347 4.199 6.693 1.00 0.74 H new ATOM 0 HA3 GLY A 61 -11.617 5.318 6.241 1.00 0.74 H new ATOM 1033 N LEU A 62 -11.878 2.219 5.167 1.00 0.62 N ATOM 1034 CA LEU A 62 -12.817 1.058 5.101 1.00 0.63 C ATOM 1035 C LEU A 62 -12.404 -0.006 6.121 1.00 0.72 C ATOM 1036 O LEU A 62 -13.124 -0.946 6.371 1.00 0.80 O ATOM 1037 CB LEU A 62 -12.782 0.454 3.696 1.00 0.50 C ATOM 1038 CG LEU A 62 -13.038 1.546 2.650 1.00 0.44 C ATOM 1039 CD1 LEU A 62 -12.817 0.966 1.251 1.00 0.34 C ATOM 1040 CD2 LEU A 62 -14.481 2.062 2.771 1.00 0.53 C ATOM 0 H LEU A 62 -11.053 2.139 4.572 1.00 0.62 H new ATOM 0 HA LEU A 62 -13.826 1.401 5.329 1.00 0.63 H new ATOM 0 HB2 LEU A 62 -11.814 -0.014 3.516 1.00 0.50 H new ATOM 0 HB3 LEU A 62 -13.535 -0.329 3.609 1.00 0.50 H new ATOM 0 HG LEU A 62 -12.350 2.374 2.818 1.00 0.44 H new ATOM 0 HD11 LEU A 62 -12.998 1.739 0.504 1.00 0.34 H new ATOM 0 HD12 LEU A 62 -11.791 0.609 1.163 1.00 0.34 H new ATOM 0 HD13 LEU A 62 -13.505 0.136 1.088 1.00 0.34 H new ATOM 0 HD21 LEU A 62 -14.654 2.837 2.024 1.00 0.53 H new ATOM 0 HD22 LEU A 62 -15.177 1.239 2.607 1.00 0.53 H new ATOM 0 HD23 LEU A 62 -14.637 2.476 3.767 1.00 0.53 H new ATOM 1052 N ALA A 63 -11.254 0.133 6.722 1.00 0.75 N ATOM 1053 CA ALA A 63 -10.816 -0.878 7.735 1.00 0.86 C ATOM 1054 C ALA A 63 -9.991 -0.173 8.814 1.00 0.99 C ATOM 1055 O ALA A 63 -9.406 0.868 8.587 1.00 1.02 O ATOM 1056 CB ALA A 63 -9.996 -1.994 7.051 1.00 0.82 C ATOM 0 H ALA A 63 -10.599 0.898 6.559 1.00 0.75 H new ATOM 0 HA ALA A 63 -11.687 -1.341 8.199 1.00 0.86 H new ATOM 0 HB1 ALA A 63 -9.682 -2.724 7.797 1.00 0.82 H new ATOM 0 HB2 ALA A 63 -10.610 -2.486 6.297 1.00 0.82 H new ATOM 0 HB3 ALA A 63 -9.116 -1.560 6.576 1.00 0.82 H new ATOM 1062 N ARG A 64 -9.969 -0.720 9.994 1.00 1.14 N ATOM 1063 CA ARG A 64 -9.217 -0.076 11.104 1.00 1.28 C ATOM 1064 C ARG A 64 -7.716 -0.338 10.973 1.00 1.28 C ATOM 1065 O ARG A 64 -6.910 0.521 11.270 1.00 1.37 O ATOM 1066 CB ARG A 64 -9.720 -0.643 12.444 1.00 1.47 C ATOM 1067 CG ARG A 64 -11.000 0.087 12.880 1.00 1.43 C ATOM 1068 CD ARG A 64 -10.690 1.555 13.227 1.00 1.55 C ATOM 1069 NE ARG A 64 -11.541 1.981 14.374 1.00 1.79 N ATOM 1070 CZ ARG A 64 -11.234 3.054 15.051 1.00 2.25 C ATOM 1071 NH1 ARG A 64 -10.175 3.746 14.732 1.00 2.85 N ATOM 1072 NH2 ARG A 64 -11.985 3.433 16.049 1.00 2.50 N ATOM 0 H ARG A 64 -10.442 -1.590 10.239 1.00 1.14 H new ATOM 0 HA ARG A 64 -9.382 1.001 11.061 1.00 1.28 H new ATOM 0 HB2 ARG A 64 -9.917 -1.710 12.345 1.00 1.47 H new ATOM 0 HB3 ARG A 64 -8.950 -0.530 13.207 1.00 1.47 H new ATOM 0 HG2 ARG A 64 -11.740 0.044 12.081 1.00 1.43 H new ATOM 0 HG3 ARG A 64 -11.435 -0.414 13.745 1.00 1.43 H new ATOM 0 HD2 ARG A 64 -9.636 1.666 13.481 1.00 1.55 H new ATOM 0 HD3 ARG A 64 -10.879 2.192 12.363 1.00 1.55 H new ATOM 0 HE ARG A 64 -12.363 1.434 14.630 1.00 1.79 H new ATOM 0 HH11 ARG A 64 -9.587 3.449 13.954 1.00 2.85 H new ATOM 0 HH12 ARG A 64 -9.935 4.584 15.261 1.00 2.85 H new ATOM 0 HH21 ARG A 64 -12.812 2.891 16.300 1.00 2.50 H new ATOM 0 HH22 ARG A 64 -11.745 4.271 16.578 1.00 2.50 H new ATOM 1086 N THR A 65 -7.324 -1.516 10.565 1.00 1.23 N ATOM 1087 CA THR A 65 -5.863 -1.818 10.466 1.00 1.28 C ATOM 1088 C THR A 65 -5.588 -2.742 9.278 1.00 1.20 C ATOM 1089 O THR A 65 -6.490 -3.299 8.684 1.00 1.10 O ATOM 1090 CB THR A 65 -5.422 -2.498 11.766 1.00 1.43 C ATOM 1091 OG1 THR A 65 -5.731 -3.883 11.701 1.00 1.41 O ATOM 1092 CG2 THR A 65 -6.160 -1.861 12.954 1.00 1.51 C ATOM 0 H THR A 65 -7.946 -2.279 10.297 1.00 1.23 H new ATOM 0 HA THR A 65 -5.306 -0.893 10.315 1.00 1.28 H new ATOM 0 HB THR A 65 -4.348 -2.371 11.898 1.00 1.43 H new ATOM 0 HG1 THR A 65 -5.448 -4.321 12.531 1.00 1.41 H new ATOM 0 HG21 THR A 65 -5.846 -2.345 13.879 1.00 1.51 H new ATOM 0 HG22 THR A 65 -5.923 -0.798 13.002 1.00 1.51 H new ATOM 0 HG23 THR A 65 -7.235 -1.988 12.825 1.00 1.51 H new ATOM 1100 N ARG A 66 -4.339 -2.902 8.924 1.00 1.26 N ATOM 1101 CA ARG A 66 -3.990 -3.780 7.771 1.00 1.22 C ATOM 1102 C ARG A 66 -4.661 -5.145 7.937 1.00 1.18 C ATOM 1103 O ARG A 66 -5.213 -5.690 7.003 1.00 1.13 O ATOM 1104 CB ARG A 66 -2.469 -3.956 7.693 1.00 1.35 C ATOM 1105 CG ARG A 66 -1.900 -4.254 9.083 1.00 1.94 C ATOM 1106 CD ARG A 66 -0.376 -4.356 8.996 1.00 2.15 C ATOM 1107 NE ARG A 66 0.203 -4.331 10.369 1.00 2.90 N ATOM 1108 CZ ARG A 66 1.442 -4.693 10.560 1.00 3.42 C ATOM 1109 NH1 ARG A 66 2.175 -5.073 9.550 1.00 3.55 N ATOM 1110 NH2 ARG A 66 1.949 -4.674 11.763 1.00 4.25 N ATOM 0 H ARG A 66 -3.544 -2.460 9.386 1.00 1.26 H new ATOM 0 HA ARG A 66 -4.344 -3.317 6.850 1.00 1.22 H new ATOM 0 HB2 ARG A 66 -2.224 -4.769 7.010 1.00 1.35 H new ATOM 0 HB3 ARG A 66 -2.011 -3.052 7.290 1.00 1.35 H new ATOM 0 HG2 ARG A 66 -2.184 -3.466 9.781 1.00 1.94 H new ATOM 0 HG3 ARG A 66 -2.317 -5.185 9.467 1.00 1.94 H new ATOM 0 HD2 ARG A 66 -0.091 -5.276 8.486 1.00 2.15 H new ATOM 0 HD3 ARG A 66 0.021 -3.529 8.407 1.00 2.15 H new ATOM 0 HE ARG A 66 -0.369 -4.031 11.159 1.00 2.90 H new ATOM 0 HH11 ARG A 66 1.780 -5.087 8.610 1.00 3.55 H new ATOM 0 HH12 ARG A 66 3.143 -5.356 9.700 1.00 3.55 H new ATOM 0 HH21 ARG A 66 1.377 -4.376 12.553 1.00 4.25 H new ATOM 0 HH22 ARG A 66 2.917 -4.957 11.913 1.00 4.25 H new ATOM 1124 N ARG A 67 -4.626 -5.702 9.117 1.00 1.25 N ATOM 1125 CA ARG A 67 -5.274 -7.028 9.324 1.00 1.24 C ATOM 1126 C ARG A 67 -6.743 -6.928 8.912 1.00 1.15 C ATOM 1127 O ARG A 67 -7.381 -7.910 8.589 1.00 1.16 O ATOM 1128 CB ARG A 67 -5.183 -7.421 10.801 1.00 1.31 C ATOM 1129 CG ARG A 67 -3.738 -7.267 11.289 1.00 1.66 C ATOM 1130 CD ARG A 67 -2.805 -8.136 10.440 1.00 1.60 C ATOM 1131 NE ARG A 67 -1.539 -8.380 11.188 1.00 2.18 N ATOM 1132 CZ ARG A 67 -0.725 -9.323 10.803 1.00 2.73 C ATOM 1133 NH1 ARG A 67 -1.017 -10.053 9.761 1.00 2.99 N ATOM 1134 NH2 ARG A 67 0.382 -9.538 11.460 1.00 3.46 N ATOM 0 H ARG A 67 -4.180 -5.300 9.941 1.00 1.25 H new ATOM 0 HA ARG A 67 -4.769 -7.784 8.722 1.00 1.24 H new ATOM 0 HB2 ARG A 67 -5.847 -6.793 11.396 1.00 1.31 H new ATOM 0 HB3 ARG A 67 -5.514 -8.451 10.934 1.00 1.31 H new ATOM 0 HG2 ARG A 67 -3.433 -6.222 11.226 1.00 1.66 H new ATOM 0 HG3 ARG A 67 -3.666 -7.558 12.337 1.00 1.66 H new ATOM 0 HD2 ARG A 67 -3.289 -9.084 10.203 1.00 1.60 H new ATOM 0 HD3 ARG A 67 -2.591 -7.641 9.493 1.00 1.60 H new ATOM 0 HE ARG A 67 -1.309 -7.809 12.001 1.00 2.18 H new ATOM 0 HH11 ARG A 67 -1.882 -9.886 9.247 1.00 2.99 H new ATOM 0 HH12 ARG A 67 -0.380 -10.791 9.460 1.00 2.99 H new ATOM 0 HH21 ARG A 67 0.610 -8.968 12.275 1.00 3.46 H new ATOM 0 HH22 ARG A 67 1.019 -10.276 11.159 1.00 3.46 H new ATOM 1148 N GLN A 68 -7.279 -5.738 8.923 1.00 1.08 N ATOM 1149 CA GLN A 68 -8.705 -5.540 8.536 1.00 1.00 C ATOM 1150 C GLN A 68 -8.798 -5.275 7.032 1.00 0.90 C ATOM 1151 O GLN A 68 -9.664 -5.794 6.355 1.00 0.84 O ATOM 1152 CB GLN A 68 -9.268 -4.363 9.331 1.00 1.00 C ATOM 1153 CG GLN A 68 -8.941 -4.545 10.809 1.00 1.35 C ATOM 1154 CD GLN A 68 -9.495 -5.883 11.301 1.00 1.61 C ATOM 1155 OE1 GLN A 68 -8.763 -6.844 11.436 1.00 2.28 O ATOM 1156 NE2 GLN A 68 -10.766 -5.988 11.577 1.00 2.12 N ATOM 0 H GLN A 68 -6.784 -4.886 9.186 1.00 1.08 H new ATOM 0 HA GLN A 68 -9.287 -6.434 8.760 1.00 1.00 H new ATOM 0 HB2 GLN A 68 -8.844 -3.428 8.966 1.00 1.00 H new ATOM 0 HB3 GLN A 68 -10.347 -4.299 9.192 1.00 1.00 H new ATOM 0 HG2 GLN A 68 -7.862 -4.510 10.959 1.00 1.35 H new ATOM 0 HG3 GLN A 68 -9.370 -3.728 11.389 1.00 1.35 H new ATOM 0 HE21 GLN A 68 -11.381 -5.182 11.464 1.00 2.12 H new ATOM 0 HE22 GLN A 68 -11.145 -6.876 11.906 1.00 2.12 H new ATOM 1165 N ALA A 69 -7.907 -4.488 6.498 1.00 0.89 N ATOM 1166 CA ALA A 69 -7.944 -4.205 5.035 1.00 0.80 C ATOM 1167 C ALA A 69 -7.518 -5.457 4.257 1.00 0.84 C ATOM 1168 O ALA A 69 -8.069 -5.771 3.221 1.00 0.82 O ATOM 1169 CB ALA A 69 -6.990 -3.045 4.725 1.00 0.81 C ATOM 0 H ALA A 69 -7.154 -4.028 7.010 1.00 0.89 H new ATOM 0 HA ALA A 69 -8.956 -3.932 4.737 1.00 0.80 H new ATOM 0 HB1 ALA A 69 -7.011 -2.832 3.656 1.00 0.81 H new ATOM 0 HB2 ALA A 69 -7.303 -2.159 5.278 1.00 0.81 H new ATOM 0 HB3 ALA A 69 -5.977 -3.318 5.020 1.00 0.81 H new ATOM 1175 N ARG A 70 -6.540 -6.169 4.744 1.00 0.97 N ATOM 1176 CA ARG A 70 -6.080 -7.391 4.025 1.00 1.05 C ATOM 1177 C ARG A 70 -7.209 -8.425 3.984 1.00 1.03 C ATOM 1178 O ARG A 70 -7.559 -8.936 2.937 1.00 1.06 O ATOM 1179 CB ARG A 70 -4.873 -7.985 4.755 1.00 1.22 C ATOM 1180 CG ARG A 70 -4.336 -9.181 3.967 1.00 1.67 C ATOM 1181 CD ARG A 70 -3.071 -9.713 4.644 1.00 1.84 C ATOM 1182 NE ARG A 70 -1.937 -8.783 4.380 1.00 1.97 N ATOM 1183 CZ ARG A 70 -0.846 -8.866 5.091 1.00 2.40 C ATOM 1184 NH1 ARG A 70 -0.747 -9.763 6.033 1.00 2.74 N ATOM 1185 NH2 ARG A 70 0.147 -8.051 4.860 1.00 3.09 N ATOM 0 H ARG A 70 -6.040 -5.958 5.608 1.00 0.97 H new ATOM 0 HA ARG A 70 -5.799 -7.125 3.006 1.00 1.05 H new ATOM 0 HB2 ARG A 70 -4.094 -7.230 4.866 1.00 1.22 H new ATOM 0 HB3 ARG A 70 -5.160 -8.297 5.759 1.00 1.22 H new ATOM 0 HG2 ARG A 70 -5.091 -9.965 3.916 1.00 1.67 H new ATOM 0 HG3 ARG A 70 -4.115 -8.885 2.942 1.00 1.67 H new ATOM 0 HD2 ARG A 70 -3.234 -9.810 5.717 1.00 1.84 H new ATOM 0 HD3 ARG A 70 -2.835 -10.708 4.267 1.00 1.84 H new ATOM 0 HE ARG A 70 -2.014 -8.082 3.643 1.00 1.97 H new ATOM 0 HH11 ARG A 70 -1.523 -10.400 6.214 1.00 2.74 H new ATOM 0 HH12 ARG A 70 0.106 -9.827 6.588 1.00 2.74 H new ATOM 0 HH21 ARG A 70 0.070 -7.349 4.124 1.00 3.09 H new ATOM 0 HH22 ARG A 70 1.000 -8.116 5.416 1.00 3.09 H new ATOM 1199 N GLN A 71 -7.776 -8.744 5.115 1.00 1.02 N ATOM 1200 CA GLN A 71 -8.874 -9.752 5.143 1.00 1.04 C ATOM 1201 C GLN A 71 -10.032 -9.293 4.252 1.00 0.92 C ATOM 1202 O GLN A 71 -10.715 -10.098 3.651 1.00 0.96 O ATOM 1203 CB GLN A 71 -9.373 -9.921 6.580 1.00 1.10 C ATOM 1204 CG GLN A 71 -8.297 -10.617 7.416 1.00 1.17 C ATOM 1205 CD GLN A 71 -8.730 -10.646 8.883 1.00 1.48 C ATOM 1206 OE1 GLN A 71 -8.067 -10.089 9.735 1.00 2.27 O ATOM 1207 NE2 GLN A 71 -9.823 -11.277 9.216 1.00 1.72 N ATOM 0 H GLN A 71 -7.526 -8.350 6.022 1.00 1.02 H new ATOM 0 HA GLN A 71 -8.494 -10.703 4.771 1.00 1.04 H new ATOM 0 HB2 GLN A 71 -9.610 -8.948 7.011 1.00 1.10 H new ATOM 0 HB3 GLN A 71 -10.292 -10.507 6.590 1.00 1.10 H new ATOM 0 HG2 GLN A 71 -8.139 -11.632 7.052 1.00 1.17 H new ATOM 0 HG3 GLN A 71 -7.347 -10.091 7.316 1.00 1.17 H new ATOM 0 HE21 GLN A 71 -10.380 -11.745 8.501 1.00 1.72 H new ATOM 0 HE22 GLN A 71 -10.120 -11.302 10.191 1.00 1.72 H new ATOM 1216 N LEU A 72 -10.262 -8.011 4.155 1.00 0.80 N ATOM 1217 CA LEU A 72 -11.380 -7.532 3.292 1.00 0.69 C ATOM 1218 C LEU A 72 -11.077 -7.898 1.837 1.00 0.67 C ATOM 1219 O LEU A 72 -11.920 -8.411 1.128 1.00 0.72 O ATOM 1220 CB LEU A 72 -11.534 -6.011 3.427 1.00 0.60 C ATOM 1221 CG LEU A 72 -12.338 -5.671 4.698 1.00 0.67 C ATOM 1222 CD1 LEU A 72 -12.073 -4.218 5.087 1.00 0.63 C ATOM 1223 CD2 LEU A 72 -13.848 -5.853 4.455 1.00 0.73 C ATOM 0 H LEU A 72 -9.731 -7.282 4.630 1.00 0.80 H new ATOM 0 HA LEU A 72 -12.311 -8.005 3.604 1.00 0.69 H new ATOM 0 HB2 LEU A 72 -10.552 -5.541 3.472 1.00 0.60 H new ATOM 0 HB3 LEU A 72 -12.040 -5.609 2.549 1.00 0.60 H new ATOM 0 HG LEU A 72 -12.025 -6.344 5.496 1.00 0.67 H new ATOM 0 HD11 LEU A 72 -12.639 -3.973 5.985 1.00 0.63 H new ATOM 0 HD12 LEU A 72 -11.009 -4.081 5.280 1.00 0.63 H new ATOM 0 HD13 LEU A 72 -12.381 -3.561 4.273 1.00 0.63 H new ATOM 0 HD21 LEU A 72 -14.395 -5.608 5.365 1.00 0.73 H new ATOM 0 HD22 LEU A 72 -14.169 -5.193 3.649 1.00 0.73 H new ATOM 0 HD23 LEU A 72 -14.050 -6.888 4.178 1.00 0.73 H new ATOM 1235 N VAL A 73 -9.878 -7.645 1.388 1.00 0.68 N ATOM 1236 CA VAL A 73 -9.524 -7.988 -0.018 1.00 0.68 C ATOM 1237 C VAL A 73 -9.776 -9.480 -0.250 1.00 0.76 C ATOM 1238 O VAL A 73 -10.627 -9.866 -1.024 1.00 0.76 O ATOM 1239 CB VAL A 73 -8.040 -7.679 -0.264 1.00 0.74 C ATOM 1240 CG1 VAL A 73 -7.600 -8.274 -1.606 1.00 0.81 C ATOM 1241 CG2 VAL A 73 -7.827 -6.164 -0.297 1.00 0.65 C ATOM 0 H VAL A 73 -9.130 -7.216 1.933 1.00 0.68 H new ATOM 0 HA VAL A 73 -10.135 -7.400 -0.702 1.00 0.68 H new ATOM 0 HB VAL A 73 -7.450 -8.117 0.541 1.00 0.74 H new ATOM 0 HG11 VAL A 73 -6.546 -8.051 -1.775 1.00 0.81 H new ATOM 0 HG12 VAL A 73 -7.745 -9.354 -1.590 1.00 0.81 H new ATOM 0 HG13 VAL A 73 -8.196 -7.840 -2.409 1.00 0.81 H new ATOM 0 HG21 VAL A 73 -6.773 -5.948 -0.472 1.00 0.65 H new ATOM 0 HG22 VAL A 73 -8.424 -5.730 -1.099 1.00 0.65 H new ATOM 0 HG23 VAL A 73 -8.132 -5.733 0.656 1.00 0.65 H new ATOM 1251 N THR A 74 -9.024 -10.316 0.413 1.00 0.87 N ATOM 1252 CA THR A 74 -9.181 -11.786 0.244 1.00 0.96 C ATOM 1253 C THR A 74 -10.662 -12.174 0.196 1.00 0.92 C ATOM 1254 O THR A 74 -11.057 -13.041 -0.558 1.00 0.99 O ATOM 1255 CB THR A 74 -8.511 -12.484 1.426 1.00 1.06 C ATOM 1256 OG1 THR A 74 -8.906 -11.848 2.633 1.00 1.06 O ATOM 1257 CG2 THR A 74 -6.992 -12.400 1.276 1.00 1.15 C ATOM 0 H THR A 74 -8.298 -10.037 1.073 1.00 0.87 H new ATOM 0 HA THR A 74 -8.718 -12.090 -0.694 1.00 0.96 H new ATOM 0 HB THR A 74 -8.813 -13.531 1.450 1.00 1.06 H new ATOM 0 HG1 THR A 74 -8.612 -12.386 3.398 1.00 1.06 H new ATOM 0 HG21 THR A 74 -6.515 -12.898 2.120 1.00 1.15 H new ATOM 0 HG22 THR A 74 -6.690 -12.888 0.349 1.00 1.15 H new ATOM 0 HG23 THR A 74 -6.686 -11.354 1.252 1.00 1.15 H new ATOM 1265 N HIS A 75 -11.483 -11.549 0.990 1.00 0.86 N ATOM 1266 CA HIS A 75 -12.931 -11.899 0.979 1.00 0.85 C ATOM 1267 C HIS A 75 -13.526 -11.587 -0.397 1.00 0.78 C ATOM 1268 O HIS A 75 -14.568 -12.093 -0.762 1.00 0.83 O ATOM 1269 CB HIS A 75 -13.662 -11.087 2.049 1.00 0.84 C ATOM 1270 CG HIS A 75 -13.241 -11.561 3.412 1.00 0.95 C ATOM 1271 ND1 HIS A 75 -13.858 -11.116 4.574 1.00 1.18 N ATOM 1272 CD2 HIS A 75 -12.268 -12.441 3.818 1.00 1.03 C ATOM 1273 CE1 HIS A 75 -13.255 -11.724 5.612 1.00 1.31 C ATOM 1274 NE2 HIS A 75 -12.282 -12.540 5.205 1.00 1.20 N ATOM 0 H HIS A 75 -11.217 -10.813 1.644 1.00 0.86 H new ATOM 0 HA HIS A 75 -13.047 -12.962 1.189 1.00 0.85 H new ATOM 0 HB2 HIS A 75 -13.435 -10.027 1.935 1.00 0.84 H new ATOM 0 HB3 HIS A 75 -14.740 -11.197 1.931 1.00 0.84 H new ATOM 0 HD2 HIS A 75 -11.596 -12.974 3.162 1.00 1.03 H new ATOM 0 HE1 HIS A 75 -13.525 -11.570 6.646 1.00 1.31 H new ATOM 0 HE2 HIS A 75 -11.675 -13.116 5.789 1.00 1.20 H new ATOM 1283 N GLY A 76 -12.871 -10.759 -1.165 1.00 0.77 N ATOM 1284 CA GLY A 76 -13.399 -10.418 -2.517 1.00 0.74 C ATOM 1285 C GLY A 76 -14.569 -9.442 -2.381 1.00 0.67 C ATOM 1286 O GLY A 76 -15.662 -9.704 -2.844 1.00 0.75 O ATOM 0 H GLY A 76 -11.993 -10.304 -0.915 1.00 0.77 H new ATOM 0 HA2 GLY A 76 -12.611 -9.974 -3.125 1.00 0.74 H new ATOM 0 HA3 GLY A 76 -13.725 -11.323 -3.030 1.00 0.74 H new ATOM 1290 N HIS A 77 -14.345 -8.317 -1.746 1.00 0.60 N ATOM 1291 CA HIS A 77 -15.434 -7.303 -1.563 1.00 0.58 C ATOM 1292 C HIS A 77 -15.049 -6.006 -2.279 1.00 0.50 C ATOM 1293 O HIS A 77 -15.891 -5.271 -2.751 1.00 0.51 O ATOM 1294 CB HIS A 77 -15.607 -7.019 -0.070 1.00 0.62 C ATOM 1295 CG HIS A 77 -16.158 -8.239 0.614 1.00 0.65 C ATOM 1296 ND1 HIS A 77 -17.030 -9.113 -0.020 1.00 0.69 N ATOM 1297 CD2 HIS A 77 -15.977 -8.741 1.880 1.00 0.73 C ATOM 1298 CE1 HIS A 77 -17.341 -10.084 0.859 1.00 0.76 C ATOM 1299 NE2 HIS A 77 -16.727 -9.903 2.029 1.00 0.77 N ATOM 0 H HIS A 77 -13.446 -8.054 -1.342 1.00 0.60 H new ATOM 0 HA HIS A 77 -16.365 -7.687 -1.979 1.00 0.58 H new ATOM 0 HB2 HIS A 77 -14.649 -6.743 0.372 1.00 0.62 H new ATOM 0 HB3 HIS A 77 -16.280 -6.174 0.074 1.00 0.62 H new ATOM 0 HD2 HIS A 77 -15.350 -8.302 2.641 1.00 0.73 H new ATOM 0 HE1 HIS A 77 -18.005 -10.908 0.643 1.00 0.76 H new ATOM 0 HE2 HIS A 77 -16.793 -10.493 2.859 1.00 0.77 H new ATOM 1308 N ILE A 78 -13.782 -5.715 -2.360 1.00 0.49 N ATOM 1309 CA ILE A 78 -13.347 -4.463 -3.040 1.00 0.45 C ATOM 1310 C ILE A 78 -13.542 -4.619 -4.557 1.00 0.51 C ATOM 1311 O ILE A 78 -13.011 -5.519 -5.177 1.00 0.57 O ATOM 1312 CB ILE A 78 -11.865 -4.195 -2.694 1.00 0.45 C ATOM 1313 CG1 ILE A 78 -11.759 -3.459 -1.345 1.00 0.91 C ATOM 1314 CG2 ILE A 78 -11.208 -3.327 -3.777 1.00 0.60 C ATOM 1315 CD1 ILE A 78 -12.634 -4.135 -0.282 1.00 0.37 C ATOM 0 H ILE A 78 -13.028 -6.290 -1.985 1.00 0.49 H new ATOM 0 HA ILE A 78 -13.943 -3.615 -2.702 1.00 0.45 H new ATOM 0 HB ILE A 78 -11.354 -5.156 -2.635 1.00 0.45 H new ATOM 0 HG12 ILE A 78 -10.721 -3.447 -1.013 1.00 0.91 H new ATOM 0 HG13 ILE A 78 -12.066 -2.420 -1.468 1.00 0.91 H new ATOM 0 HG21 ILE A 78 -10.165 -3.148 -3.517 1.00 0.60 H new ATOM 0 HG22 ILE A 78 -11.260 -3.841 -4.737 1.00 0.60 H new ATOM 0 HG23 ILE A 78 -11.733 -2.374 -3.847 1.00 0.60 H new ATOM 0 HD11 ILE A 78 -12.542 -3.597 0.661 1.00 0.37 H new ATOM 0 HD12 ILE A 78 -13.675 -4.123 -0.606 1.00 0.37 H new ATOM 0 HD13 ILE A 78 -12.308 -5.166 -0.145 1.00 0.37 H new ATOM 1327 N LEU A 79 -14.300 -3.731 -5.150 1.00 0.52 N ATOM 1328 CA LEU A 79 -14.545 -3.790 -6.622 1.00 0.61 C ATOM 1329 C LEU A 79 -13.648 -2.781 -7.329 1.00 0.63 C ATOM 1330 O LEU A 79 -13.964 -1.610 -7.400 1.00 0.69 O ATOM 1331 CB LEU A 79 -15.992 -3.405 -6.934 1.00 0.68 C ATOM 1332 CG LEU A 79 -16.981 -4.311 -6.196 1.00 0.68 C ATOM 1333 CD1 LEU A 79 -18.382 -3.697 -6.304 1.00 0.76 C ATOM 1334 CD2 LEU A 79 -16.983 -5.711 -6.825 1.00 0.76 C ATOM 0 H LEU A 79 -14.764 -2.960 -4.671 1.00 0.52 H new ATOM 0 HA LEU A 79 -14.339 -4.805 -6.960 1.00 0.61 H new ATOM 0 HB2 LEU A 79 -16.164 -2.367 -6.649 1.00 0.68 H new ATOM 0 HB3 LEU A 79 -16.165 -3.473 -8.008 1.00 0.68 H new ATOM 0 HG LEU A 79 -16.689 -4.398 -5.150 1.00 0.68 H new ATOM 0 HD11 LEU A 79 -19.099 -4.332 -5.783 1.00 0.76 H new ATOM 0 HD12 LEU A 79 -18.380 -2.705 -5.853 1.00 0.76 H new ATOM 0 HD13 LEU A 79 -18.664 -3.617 -7.354 1.00 0.76 H new ATOM 0 HD21 LEU A 79 -17.690 -6.348 -6.293 1.00 0.76 H new ATOM 0 HD22 LEU A 79 -17.277 -5.639 -7.872 1.00 0.76 H new ATOM 0 HD23 LEU A 79 -15.984 -6.142 -6.757 1.00 0.76 H new ATOM 1346 N VAL A 80 -12.546 -3.208 -7.876 1.00 0.64 N ATOM 1347 CA VAL A 80 -11.677 -2.239 -8.595 1.00 0.69 C ATOM 1348 C VAL A 80 -12.266 -2.013 -9.984 1.00 0.82 C ATOM 1349 O VAL A 80 -12.707 -2.939 -10.634 1.00 0.92 O ATOM 1350 CB VAL A 80 -10.253 -2.783 -8.697 1.00 0.76 C ATOM 1351 CG1 VAL A 80 -9.424 -1.876 -9.612 1.00 0.91 C ATOM 1352 CG2 VAL A 80 -9.623 -2.816 -7.297 1.00 0.70 C ATOM 0 H VAL A 80 -12.213 -4.172 -7.857 1.00 0.64 H new ATOM 0 HA VAL A 80 -11.635 -1.295 -8.053 1.00 0.69 H new ATOM 0 HB VAL A 80 -10.274 -3.791 -9.112 1.00 0.76 H new ATOM 0 HG11 VAL A 80 -8.408 -2.264 -9.685 1.00 0.91 H new ATOM 0 HG12 VAL A 80 -9.875 -1.850 -10.604 1.00 0.91 H new ATOM 0 HG13 VAL A 80 -9.399 -0.868 -9.199 1.00 0.91 H new ATOM 0 HG21 VAL A 80 -8.606 -3.204 -7.364 1.00 0.70 H new ATOM 0 HG22 VAL A 80 -9.600 -1.807 -6.884 1.00 0.70 H new ATOM 0 HG23 VAL A 80 -10.215 -3.461 -6.647 1.00 0.70 H new ATOM 1362 N ASP A 81 -12.285 -0.787 -10.441 1.00 0.85 N ATOM 1363 CA ASP A 81 -12.864 -0.495 -11.788 1.00 1.00 C ATOM 1364 C ASP A 81 -14.184 -1.263 -11.946 1.00 1.01 C ATOM 1365 O ASP A 81 -14.662 -1.487 -13.041 1.00 1.14 O ATOM 1366 CB ASP A 81 -11.881 -0.939 -12.873 1.00 1.10 C ATOM 1367 CG ASP A 81 -12.484 -0.668 -14.253 1.00 1.43 C ATOM 1368 OD1 ASP A 81 -13.383 0.152 -14.333 1.00 1.82 O ATOM 1369 OD2 ASP A 81 -12.036 -1.286 -15.205 1.00 1.98 O ATOM 0 H ASP A 81 -11.925 0.025 -9.940 1.00 0.85 H new ATOM 0 HA ASP A 81 -13.049 0.575 -11.885 1.00 1.00 H new ATOM 0 HB2 ASP A 81 -10.938 -0.403 -12.765 1.00 1.10 H new ATOM 0 HB3 ASP A 81 -11.658 -2.000 -12.764 1.00 1.10 H new ATOM 1374 N GLY A 82 -14.762 -1.683 -10.849 1.00 0.95 N ATOM 1375 CA GLY A 82 -16.036 -2.455 -10.912 1.00 0.98 C ATOM 1376 C GLY A 82 -15.710 -3.942 -11.074 1.00 0.96 C ATOM 1377 O GLY A 82 -16.363 -4.653 -11.812 1.00 1.03 O ATOM 0 H GLY A 82 -14.402 -1.522 -9.908 1.00 0.95 H new ATOM 0 HA2 GLY A 82 -16.619 -2.294 -10.005 1.00 0.98 H new ATOM 0 HA3 GLY A 82 -16.645 -2.110 -11.748 1.00 0.98 H new ATOM 1381 N SER A 83 -14.695 -4.416 -10.394 1.00 0.90 N ATOM 1382 CA SER A 83 -14.314 -5.858 -10.512 1.00 0.91 C ATOM 1383 C SER A 83 -13.756 -6.357 -9.176 1.00 0.82 C ATOM 1384 O SER A 83 -12.901 -5.736 -8.577 1.00 0.74 O ATOM 1385 CB SER A 83 -13.240 -6.008 -11.595 1.00 0.98 C ATOM 1386 OG SER A 83 -13.857 -5.972 -12.875 1.00 1.10 O ATOM 0 H SER A 83 -14.113 -3.866 -9.762 1.00 0.90 H new ATOM 0 HA SER A 83 -15.194 -6.444 -10.778 1.00 0.91 H new ATOM 0 HB2 SER A 83 -12.506 -5.207 -11.509 1.00 0.98 H new ATOM 0 HB3 SER A 83 -12.703 -6.947 -11.463 1.00 0.98 H new ATOM 0 HG SER A 83 -14.768 -5.622 -12.789 1.00 1.10 H new ATOM 1392 N ARG A 84 -14.225 -7.485 -8.714 1.00 0.84 N ATOM 1393 CA ARG A 84 -13.715 -8.032 -7.427 1.00 0.78 C ATOM 1394 C ARG A 84 -12.229 -8.370 -7.578 1.00 0.79 C ATOM 1395 O ARG A 84 -11.840 -9.094 -8.472 1.00 0.89 O ATOM 1396 CB ARG A 84 -14.489 -9.305 -7.070 1.00 0.85 C ATOM 1397 CG ARG A 84 -15.982 -8.986 -6.938 1.00 1.27 C ATOM 1398 CD ARG A 84 -16.794 -10.282 -7.020 1.00 1.34 C ATOM 1399 NE ARG A 84 -18.248 -9.962 -6.978 1.00 1.97 N ATOM 1400 CZ ARG A 84 -19.125 -10.862 -7.330 1.00 2.29 C ATOM 1401 NH1 ARG A 84 -18.727 -12.043 -7.717 1.00 2.36 N ATOM 1402 NH2 ARG A 84 -20.399 -10.582 -7.293 1.00 3.07 N ATOM 0 H ARG A 84 -14.939 -8.050 -9.173 1.00 0.84 H new ATOM 0 HA ARG A 84 -13.847 -7.292 -6.637 1.00 0.78 H new ATOM 0 HB2 ARG A 84 -14.336 -10.062 -7.839 1.00 0.85 H new ATOM 0 HB3 ARG A 84 -14.113 -9.720 -6.135 1.00 0.85 H new ATOM 0 HG2 ARG A 84 -16.174 -8.484 -5.990 1.00 1.27 H new ATOM 0 HG3 ARG A 84 -16.289 -8.302 -7.729 1.00 1.27 H new ATOM 0 HD2 ARG A 84 -16.555 -10.816 -7.940 1.00 1.34 H new ATOM 0 HD3 ARG A 84 -16.532 -10.941 -6.192 1.00 1.34 H new ATOM 0 HE ARG A 84 -18.558 -9.039 -6.674 1.00 1.97 H new ATOM 0 HH11 ARG A 84 -17.731 -12.262 -7.744 1.00 2.36 H new ATOM 0 HH12 ARG A 84 -19.412 -12.747 -7.992 1.00 2.36 H new ATOM 0 HH21 ARG A 84 -20.710 -9.659 -6.989 1.00 3.07 H new ATOM 0 HH22 ARG A 84 -21.084 -11.286 -7.568 1.00 3.07 H new ATOM 1416 N VAL A 85 -11.399 -7.851 -6.705 1.00 0.72 N ATOM 1417 CA VAL A 85 -9.929 -8.133 -6.776 1.00 0.78 C ATOM 1418 C VAL A 85 -9.488 -8.782 -5.463 1.00 0.79 C ATOM 1419 O VAL A 85 -8.844 -8.172 -4.637 1.00 0.79 O ATOM 1420 CB VAL A 85 -9.176 -6.808 -7.005 1.00 0.72 C ATOM 1421 CG1 VAL A 85 -7.655 -6.983 -6.767 1.00 0.85 C ATOM 1422 CG2 VAL A 85 -9.429 -6.345 -8.449 1.00 0.77 C ATOM 0 H VAL A 85 -11.679 -7.238 -5.939 1.00 0.72 H new ATOM 0 HA VAL A 85 -9.707 -8.811 -7.600 1.00 0.78 H new ATOM 0 HB VAL A 85 -9.541 -6.063 -6.298 1.00 0.72 H new ATOM 0 HG11 VAL A 85 -7.149 -6.033 -6.936 1.00 0.85 H new ATOM 0 HG12 VAL A 85 -7.482 -7.309 -5.741 1.00 0.85 H new ATOM 0 HG13 VAL A 85 -7.262 -7.731 -7.456 1.00 0.85 H new ATOM 0 HG21 VAL A 85 -8.903 -5.407 -8.628 1.00 0.77 H new ATOM 0 HG22 VAL A 85 -9.066 -7.103 -9.143 1.00 0.77 H new ATOM 0 HG23 VAL A 85 -10.498 -6.196 -8.601 1.00 0.77 H new ATOM 1432 N ASN A 86 -9.838 -10.026 -5.267 1.00 0.83 N ATOM 1433 CA ASN A 86 -9.442 -10.724 -4.013 1.00 0.87 C ATOM 1434 C ASN A 86 -7.932 -10.944 -4.026 1.00 0.99 C ATOM 1435 O ASN A 86 -7.376 -11.593 -3.163 1.00 1.33 O ATOM 1436 CB ASN A 86 -10.156 -12.075 -3.930 1.00 0.94 C ATOM 1437 CG ASN A 86 -9.938 -12.849 -5.231 1.00 1.45 C ATOM 1438 OD1 ASN A 86 -9.178 -13.797 -5.267 1.00 1.99 O ATOM 1439 ND2 ASN A 86 -10.577 -12.484 -6.309 1.00 2.18 N ATOM 0 H ASN A 86 -10.381 -10.587 -5.923 1.00 0.83 H new ATOM 0 HA ASN A 86 -9.720 -10.119 -3.150 1.00 0.87 H new ATOM 0 HB2 ASN A 86 -9.775 -12.648 -3.085 1.00 0.94 H new ATOM 0 HB3 ASN A 86 -11.222 -11.925 -3.758 1.00 0.94 H new ATOM 0 HD21 ASN A 86 -10.439 -12.994 -7.181 1.00 2.18 H new ATOM 0 HD22 ASN A 86 -11.215 -11.689 -6.279 1.00 2.18 H new ATOM 1446 N ILE A 87 -7.264 -10.399 -5.006 1.00 0.92 N ATOM 1447 CA ILE A 87 -5.786 -10.556 -5.098 1.00 1.02 C ATOM 1448 C ILE A 87 -5.125 -9.331 -4.434 1.00 1.02 C ATOM 1449 O ILE A 87 -5.280 -8.224 -4.912 1.00 1.03 O ATOM 1450 CB ILE A 87 -5.381 -10.611 -6.579 1.00 1.09 C ATOM 1451 CG1 ILE A 87 -5.971 -11.874 -7.253 1.00 1.12 C ATOM 1452 CG2 ILE A 87 -3.854 -10.648 -6.676 1.00 1.22 C ATOM 1453 CD1 ILE A 87 -7.401 -11.609 -7.749 1.00 1.08 C ATOM 0 H ILE A 87 -7.684 -9.847 -5.754 1.00 0.92 H new ATOM 0 HA ILE A 87 -5.468 -11.471 -4.598 1.00 1.02 H new ATOM 0 HB ILE A 87 -5.768 -9.729 -7.089 1.00 1.09 H new ATOM 0 HG12 ILE A 87 -5.340 -12.173 -8.090 1.00 1.12 H new ATOM 0 HG13 ILE A 87 -5.974 -12.702 -6.544 1.00 1.12 H new ATOM 0 HG21 ILE A 87 -3.557 -10.687 -7.724 1.00 1.22 H new ATOM 0 HG22 ILE A 87 -3.438 -9.752 -6.214 1.00 1.22 H new ATOM 0 HG23 ILE A 87 -3.478 -11.531 -6.159 1.00 1.22 H new ATOM 0 HD11 ILE A 87 -7.796 -12.510 -8.219 1.00 1.08 H new ATOM 0 HD12 ILE A 87 -8.033 -11.333 -6.905 1.00 1.08 H new ATOM 0 HD13 ILE A 87 -7.389 -10.796 -8.475 1.00 1.08 H new ATOM 1465 N PRO A 88 -4.410 -9.497 -3.338 1.00 1.07 N ATOM 1466 CA PRO A 88 -3.764 -8.347 -2.639 1.00 1.11 C ATOM 1467 C PRO A 88 -2.462 -7.903 -3.316 1.00 1.24 C ATOM 1468 O PRO A 88 -2.060 -6.760 -3.218 1.00 1.34 O ATOM 1469 CB PRO A 88 -3.495 -8.897 -1.234 1.00 1.16 C ATOM 1470 CG PRO A 88 -3.270 -10.362 -1.436 1.00 1.27 C ATOM 1471 CD PRO A 88 -4.132 -10.771 -2.642 1.00 1.14 C ATOM 0 HA PRO A 88 -4.392 -7.456 -2.646 1.00 1.11 H new ATOM 0 HB2 PRO A 88 -2.624 -8.421 -0.783 1.00 1.16 H new ATOM 0 HB3 PRO A 88 -4.339 -8.714 -0.569 1.00 1.16 H new ATOM 0 HG2 PRO A 88 -2.217 -10.571 -1.623 1.00 1.27 H new ATOM 0 HG3 PRO A 88 -3.554 -10.925 -0.547 1.00 1.27 H new ATOM 0 HD2 PRO A 88 -3.604 -11.471 -3.289 1.00 1.14 H new ATOM 0 HD3 PRO A 88 -5.053 -11.261 -2.325 1.00 1.14 H new ATOM 1479 N SER A 89 -1.798 -8.796 -3.990 1.00 1.34 N ATOM 1480 CA SER A 89 -0.522 -8.426 -4.661 1.00 1.50 C ATOM 1481 C SER A 89 -0.809 -7.601 -5.922 1.00 1.40 C ATOM 1482 O SER A 89 0.061 -6.935 -6.448 1.00 1.48 O ATOM 1483 CB SER A 89 0.223 -9.705 -5.041 1.00 1.71 C ATOM 1484 OG SER A 89 0.863 -10.234 -3.887 1.00 1.84 O ATOM 0 H SER A 89 -2.083 -9.768 -4.106 1.00 1.34 H new ATOM 0 HA SER A 89 0.087 -7.827 -3.983 1.00 1.50 H new ATOM 0 HB2 SER A 89 -0.472 -10.436 -5.453 1.00 1.71 H new ATOM 0 HB3 SER A 89 0.960 -9.494 -5.816 1.00 1.71 H new ATOM 0 HG SER A 89 1.341 -11.056 -4.126 1.00 1.84 H new ATOM 1490 N TYR A 90 -2.016 -7.643 -6.416 1.00 1.28 N ATOM 1491 CA TYR A 90 -2.339 -6.863 -7.645 1.00 1.23 C ATOM 1492 C TYR A 90 -1.882 -5.416 -7.447 1.00 1.25 C ATOM 1493 O TYR A 90 -1.412 -5.050 -6.388 1.00 1.65 O ATOM 1494 CB TYR A 90 -3.852 -6.913 -7.911 1.00 1.12 C ATOM 1495 CG TYR A 90 -4.197 -6.089 -9.139 1.00 1.12 C ATOM 1496 CD1 TYR A 90 -3.639 -6.413 -10.385 1.00 1.67 C ATOM 1497 CD2 TYR A 90 -5.077 -5.000 -9.035 1.00 1.46 C ATOM 1498 CE1 TYR A 90 -3.958 -5.651 -11.516 1.00 1.75 C ATOM 1499 CE2 TYR A 90 -5.394 -4.241 -10.168 1.00 1.44 C ATOM 1500 CZ TYR A 90 -4.834 -4.566 -11.407 1.00 1.22 C ATOM 1501 OH TYR A 90 -5.147 -3.817 -12.523 1.00 1.31 O ATOM 0 H TYR A 90 -2.789 -8.181 -6.024 1.00 1.28 H new ATOM 0 HA TYR A 90 -1.823 -7.292 -8.504 1.00 1.23 H new ATOM 0 HB2 TYR A 90 -4.169 -7.946 -8.056 1.00 1.12 H new ATOM 0 HB3 TYR A 90 -4.393 -6.532 -7.045 1.00 1.12 H new ATOM 0 HD1 TYR A 90 -2.963 -7.251 -10.472 1.00 1.67 H new ATOM 0 HD2 TYR A 90 -5.510 -4.747 -8.079 1.00 1.46 H new ATOM 0 HE1 TYR A 90 -3.527 -5.902 -12.474 1.00 1.75 H new ATOM 0 HE2 TYR A 90 -6.071 -3.404 -10.085 1.00 1.44 H new ATOM 0 HH TYR A 90 -6.120 -3.723 -12.591 1.00 1.31 H new ATOM 1511 N ARG A 91 -1.999 -4.591 -8.454 1.00 1.24 N ATOM 1512 CA ARG A 91 -1.555 -3.169 -8.316 1.00 1.22 C ATOM 1513 C ARG A 91 -2.504 -2.258 -9.093 1.00 1.16 C ATOM 1514 O ARG A 91 -2.922 -2.568 -10.191 1.00 1.28 O ATOM 1515 CB ARG A 91 -0.137 -3.024 -8.874 1.00 1.33 C ATOM 1516 CG ARG A 91 0.864 -3.623 -7.883 1.00 1.41 C ATOM 1517 CD ARG A 91 2.271 -3.568 -8.482 1.00 1.57 C ATOM 1518 NE ARG A 91 2.347 -4.489 -9.652 1.00 1.61 N ATOM 1519 CZ ARG A 91 3.339 -4.392 -10.495 1.00 2.20 C ATOM 1520 NH1 ARG A 91 4.264 -3.490 -10.313 1.00 2.99 N ATOM 1521 NH2 ARG A 91 3.405 -5.198 -11.519 1.00 2.49 N ATOM 0 H ARG A 91 -2.382 -4.838 -9.366 1.00 1.24 H new ATOM 0 HA ARG A 91 -1.564 -2.886 -7.263 1.00 1.22 H new ATOM 0 HB2 ARG A 91 -0.060 -3.530 -9.836 1.00 1.33 H new ATOM 0 HB3 ARG A 91 0.091 -1.972 -9.048 1.00 1.33 H new ATOM 0 HG2 ARG A 91 0.836 -3.072 -6.943 1.00 1.41 H new ATOM 0 HG3 ARG A 91 0.594 -4.654 -7.656 1.00 1.41 H new ATOM 0 HD2 ARG A 91 2.507 -2.550 -8.791 1.00 1.57 H new ATOM 0 HD3 ARG A 91 3.009 -3.853 -7.732 1.00 1.57 H new ATOM 0 HE ARG A 91 1.624 -5.195 -9.794 1.00 1.61 H new ATOM 0 HH11 ARG A 91 4.212 -2.861 -9.512 1.00 2.99 H new ATOM 0 HH12 ARG A 91 5.039 -3.414 -10.972 1.00 2.99 H new ATOM 0 HH21 ARG A 91 2.682 -5.903 -11.660 1.00 2.49 H new ATOM 0 HH22 ARG A 91 4.180 -5.123 -12.178 1.00 2.49 H new ATOM 1535 N VAL A 92 -2.852 -1.133 -8.524 1.00 1.01 N ATOM 1536 CA VAL A 92 -3.781 -0.188 -9.215 1.00 0.98 C ATOM 1537 C VAL A 92 -2.985 0.937 -9.880 1.00 1.05 C ATOM 1538 O VAL A 92 -1.863 1.224 -9.510 1.00 1.10 O ATOM 1539 CB VAL A 92 -4.735 0.424 -8.188 1.00 0.88 C ATOM 1540 CG1 VAL A 92 -5.709 1.363 -8.900 1.00 0.87 C ATOM 1541 CG2 VAL A 92 -5.516 -0.691 -7.484 1.00 0.84 C ATOM 0 H VAL A 92 -2.531 -0.826 -7.606 1.00 1.01 H new ATOM 0 HA VAL A 92 -4.343 -0.733 -9.973 1.00 0.98 H new ATOM 0 HB VAL A 92 -4.164 0.985 -7.448 1.00 0.88 H new ATOM 0 HG11 VAL A 92 -6.391 1.801 -8.171 1.00 0.87 H new ATOM 0 HG12 VAL A 92 -5.151 2.156 -9.398 1.00 0.87 H new ATOM 0 HG13 VAL A 92 -6.280 0.802 -9.640 1.00 0.87 H new ATOM 0 HG21 VAL A 92 -6.195 -0.253 -6.752 1.00 0.84 H new ATOM 0 HG22 VAL A 92 -6.089 -1.254 -8.220 1.00 0.84 H new ATOM 0 HG23 VAL A 92 -4.819 -1.359 -6.978 1.00 0.84 H new ATOM 1551 N LYS A 93 -3.569 1.585 -10.855 1.00 1.10 N ATOM 1552 CA LYS A 93 -2.873 2.708 -11.553 1.00 1.17 C ATOM 1553 C LYS A 93 -3.917 3.777 -11.908 1.00 1.13 C ATOM 1554 O LYS A 93 -5.076 3.463 -12.097 1.00 1.09 O ATOM 1555 CB LYS A 93 -2.224 2.181 -12.836 1.00 1.29 C ATOM 1556 CG LYS A 93 -0.945 1.416 -12.488 1.00 1.55 C ATOM 1557 CD LYS A 93 -0.316 0.863 -13.769 1.00 1.88 C ATOM 1558 CE LYS A 93 0.739 -0.186 -13.411 1.00 2.06 C ATOM 1559 NZ LYS A 93 1.486 0.256 -12.200 1.00 3.01 N ATOM 0 H LYS A 93 -4.507 1.382 -11.201 1.00 1.10 H new ATOM 0 HA LYS A 93 -2.103 3.135 -10.911 1.00 1.17 H new ATOM 0 HB2 LYS A 93 -2.918 1.528 -13.365 1.00 1.29 H new ATOM 0 HB3 LYS A 93 -1.993 3.010 -13.506 1.00 1.29 H new ATOM 0 HG2 LYS A 93 -0.241 2.075 -11.980 1.00 1.55 H new ATOM 0 HG3 LYS A 93 -1.172 0.601 -11.800 1.00 1.55 H new ATOM 0 HD2 LYS A 93 -1.085 0.419 -14.401 1.00 1.88 H new ATOM 0 HD3 LYS A 93 0.140 1.671 -14.341 1.00 1.88 H new ATOM 0 HE2 LYS A 93 0.262 -1.149 -13.226 1.00 2.06 H new ATOM 0 HE3 LYS A 93 1.427 -0.325 -14.245 1.00 2.06 H new ATOM 0 HZ1 LYS A 93 2.401 -0.237 -12.157 1.00 3.01 H new ATOM 0 HZ2 LYS A 93 1.647 1.282 -12.247 1.00 3.01 H new ATOM 0 HZ3 LYS A 93 0.932 0.031 -11.349 1.00 3.01 H new ATOM 1573 N PRO A 94 -3.528 5.029 -12.002 1.00 1.16 N ATOM 1574 CA PRO A 94 -4.470 6.131 -12.342 1.00 1.14 C ATOM 1575 C PRO A 94 -5.517 5.700 -13.376 1.00 1.16 C ATOM 1576 O PRO A 94 -5.213 5.019 -14.336 1.00 1.28 O ATOM 1577 CB PRO A 94 -3.547 7.211 -12.908 1.00 1.23 C ATOM 1578 CG PRO A 94 -2.261 7.038 -12.158 1.00 1.27 C ATOM 1579 CD PRO A 94 -2.158 5.543 -11.797 1.00 1.25 C ATOM 0 HA PRO A 94 -5.053 6.463 -11.483 1.00 1.14 H new ATOM 0 HB2 PRO A 94 -3.401 7.085 -13.981 1.00 1.23 H new ATOM 0 HB3 PRO A 94 -3.963 8.207 -12.758 1.00 1.23 H new ATOM 0 HG2 PRO A 94 -1.412 7.349 -12.768 1.00 1.27 H new ATOM 0 HG3 PRO A 94 -2.251 7.655 -11.259 1.00 1.27 H new ATOM 0 HD2 PRO A 94 -1.439 5.027 -12.434 1.00 1.25 H new ATOM 0 HD3 PRO A 94 -1.829 5.403 -10.767 1.00 1.25 H new ATOM 1587 N GLY A 95 -6.751 6.085 -13.182 1.00 1.09 N ATOM 1588 CA GLY A 95 -7.827 5.694 -14.144 1.00 1.13 C ATOM 1589 C GLY A 95 -8.542 4.447 -13.620 1.00 1.07 C ATOM 1590 O GLY A 95 -9.037 3.637 -14.378 1.00 1.20 O ATOM 0 H GLY A 95 -7.062 6.656 -12.396 1.00 1.09 H new ATOM 0 HA2 GLY A 95 -8.538 6.511 -14.265 1.00 1.13 H new ATOM 0 HA3 GLY A 95 -7.399 5.496 -15.127 1.00 1.13 H new ATOM 1594 N GLN A 96 -8.600 4.289 -12.323 1.00 1.00 N ATOM 1595 CA GLN A 96 -9.281 3.097 -11.733 1.00 0.94 C ATOM 1596 C GLN A 96 -9.924 3.497 -10.404 1.00 0.82 C ATOM 1597 O GLN A 96 -9.407 4.331 -9.685 1.00 0.78 O ATOM 1598 CB GLN A 96 -8.252 1.992 -11.489 1.00 0.96 C ATOM 1599 CG GLN A 96 -7.820 1.390 -12.828 1.00 1.26 C ATOM 1600 CD GLN A 96 -6.867 0.220 -12.578 1.00 1.42 C ATOM 1601 OE1 GLN A 96 -5.727 0.418 -12.205 1.00 2.05 O ATOM 1602 NE2 GLN A 96 -7.287 -1.001 -12.769 1.00 2.03 N ATOM 0 H GLN A 96 -8.203 4.938 -11.643 1.00 1.00 H new ATOM 0 HA GLN A 96 -10.047 2.733 -12.418 1.00 0.94 H new ATOM 0 HB2 GLN A 96 -7.386 2.396 -10.964 1.00 0.96 H new ATOM 0 HB3 GLN A 96 -8.679 1.218 -10.851 1.00 0.96 H new ATOM 0 HG2 GLN A 96 -8.693 1.049 -13.384 1.00 1.26 H new ATOM 0 HG3 GLN A 96 -7.330 2.148 -13.438 1.00 1.26 H new ATOM 0 HE21 GLN A 96 -8.243 -1.168 -13.082 1.00 2.03 H new ATOM 0 HE22 GLN A 96 -6.659 -1.788 -12.605 1.00 2.03 H new ATOM 1611 N THR A 97 -11.055 2.915 -10.076 1.00 0.77 N ATOM 1612 CA THR A 97 -11.755 3.259 -8.796 1.00 0.66 C ATOM 1613 C THR A 97 -11.831 2.032 -7.886 1.00 0.57 C ATOM 1614 O THR A 97 -12.016 0.926 -8.338 1.00 0.61 O ATOM 1615 CB THR A 97 -13.179 3.734 -9.106 1.00 0.70 C ATOM 1616 OG1 THR A 97 -13.137 4.791 -10.053 1.00 0.63 O ATOM 1617 CG2 THR A 97 -13.848 4.219 -7.831 1.00 0.74 C ATOM 0 H THR A 97 -11.526 2.211 -10.645 1.00 0.77 H new ATOM 0 HA THR A 97 -11.196 4.048 -8.292 1.00 0.66 H new ATOM 0 HB THR A 97 -13.751 2.903 -9.519 1.00 0.70 H new ATOM 0 HG1 THR A 97 -14.049 5.090 -10.250 1.00 0.63 H new ATOM 0 HG21 THR A 97 -14.860 4.556 -8.056 1.00 0.74 H new ATOM 0 HG22 THR A 97 -13.889 3.404 -7.109 1.00 0.74 H new ATOM 0 HG23 THR A 97 -13.275 5.046 -7.412 1.00 0.74 H new ATOM 1625 N ILE A 98 -11.732 2.243 -6.599 1.00 0.47 N ATOM 1626 CA ILE A 98 -11.838 1.118 -5.614 1.00 0.39 C ATOM 1627 C ILE A 98 -13.208 1.250 -4.936 1.00 0.36 C ATOM 1628 O ILE A 98 -13.554 2.314 -4.461 1.00 0.42 O ATOM 1629 CB ILE A 98 -10.730 1.248 -4.549 1.00 0.33 C ATOM 1630 CG1 ILE A 98 -9.399 1.667 -5.196 1.00 0.41 C ATOM 1631 CG2 ILE A 98 -10.554 -0.087 -3.822 1.00 0.35 C ATOM 1632 CD1 ILE A 98 -8.888 0.584 -6.144 1.00 0.56 C ATOM 0 H ILE A 98 -11.580 3.160 -6.180 1.00 0.47 H new ATOM 0 HA ILE A 98 -11.729 0.154 -6.111 1.00 0.39 H new ATOM 0 HB ILE A 98 -11.024 2.017 -3.834 1.00 0.33 H new ATOM 0 HG12 ILE A 98 -9.534 2.600 -5.743 1.00 0.41 H new ATOM 0 HG13 ILE A 98 -8.657 1.856 -4.420 1.00 0.41 H new ATOM 0 HG21 ILE A 98 -9.770 0.009 -3.070 1.00 0.35 H new ATOM 0 HG22 ILE A 98 -11.490 -0.363 -3.337 1.00 0.35 H new ATOM 0 HG23 ILE A 98 -10.276 -0.858 -4.540 1.00 0.35 H new ATOM 0 HD11 ILE A 98 -7.946 0.905 -6.589 1.00 0.56 H new ATOM 0 HD12 ILE A 98 -8.731 -0.341 -5.589 1.00 0.56 H new ATOM 0 HD13 ILE A 98 -9.622 0.414 -6.932 1.00 0.56 H new ATOM 1644 N ALA A 99 -14.011 0.211 -4.906 1.00 0.41 N ATOM 1645 CA ALA A 99 -15.368 0.348 -4.274 1.00 0.45 C ATOM 1646 C ALA A 99 -15.763 -0.910 -3.500 1.00 0.42 C ATOM 1647 O ALA A 99 -15.619 -2.017 -3.965 1.00 0.48 O ATOM 1648 CB ALA A 99 -16.394 0.635 -5.375 1.00 0.58 C ATOM 0 H ALA A 99 -13.793 -0.711 -5.284 1.00 0.41 H new ATOM 0 HA ALA A 99 -15.339 1.170 -3.558 1.00 0.45 H new ATOM 0 HB1 ALA A 99 -17.385 0.737 -4.932 1.00 0.58 H new ATOM 0 HB2 ALA A 99 -16.129 1.560 -5.887 1.00 0.58 H new ATOM 0 HB3 ALA A 99 -16.400 -0.187 -6.090 1.00 0.58 H new ATOM 1654 N VAL A 100 -16.270 -0.728 -2.306 1.00 0.40 N ATOM 1655 CA VAL A 100 -16.684 -1.898 -1.477 1.00 0.41 C ATOM 1656 C VAL A 100 -17.851 -2.628 -2.146 1.00 0.49 C ATOM 1657 O VAL A 100 -18.737 -2.019 -2.712 1.00 0.54 O ATOM 1658 CB VAL A 100 -17.125 -1.409 -0.094 1.00 0.46 C ATOM 1659 CG1 VAL A 100 -17.588 -2.601 0.745 1.00 0.55 C ATOM 1660 CG2 VAL A 100 -15.950 -0.721 0.606 1.00 0.43 C ATOM 0 H VAL A 100 -16.415 0.183 -1.870 1.00 0.40 H new ATOM 0 HA VAL A 100 -15.840 -2.581 -1.379 1.00 0.41 H new ATOM 0 HB VAL A 100 -17.946 -0.701 -0.206 1.00 0.46 H new ATOM 0 HG11 VAL A 100 -17.902 -2.253 1.729 1.00 0.55 H new ATOM 0 HG12 VAL A 100 -18.426 -3.091 0.249 1.00 0.55 H new ATOM 0 HG13 VAL A 100 -16.767 -3.309 0.855 1.00 0.55 H new ATOM 0 HG21 VAL A 100 -16.265 -0.374 1.590 1.00 0.43 H new ATOM 0 HG22 VAL A 100 -15.128 -1.428 0.717 1.00 0.43 H new ATOM 0 HG23 VAL A 100 -15.619 0.129 0.010 1.00 0.43 H new ATOM 1670 N ARG A 101 -17.857 -3.933 -2.081 1.00 0.55 N ATOM 1671 CA ARG A 101 -18.966 -4.708 -2.707 1.00 0.64 C ATOM 1672 C ARG A 101 -20.269 -4.418 -1.952 1.00 0.75 C ATOM 1673 O ARG A 101 -20.281 -4.289 -0.745 1.00 0.96 O ATOM 1674 CB ARG A 101 -18.644 -6.206 -2.643 1.00 0.66 C ATOM 1675 CG ARG A 101 -19.876 -7.026 -3.037 1.00 0.76 C ATOM 1676 CD ARG A 101 -19.458 -8.466 -3.343 1.00 1.10 C ATOM 1677 NE ARG A 101 -20.665 -9.338 -3.376 1.00 1.67 N ATOM 1678 CZ ARG A 101 -20.594 -10.530 -3.904 1.00 1.98 C ATOM 1679 NH1 ARG A 101 -19.466 -10.956 -4.403 1.00 2.25 N ATOM 1680 NH2 ARG A 101 -21.651 -11.295 -3.932 1.00 2.74 N ATOM 0 H ARG A 101 -17.141 -4.495 -1.621 1.00 0.55 H new ATOM 0 HA ARG A 101 -19.080 -4.415 -3.751 1.00 0.64 H new ATOM 0 HB2 ARG A 101 -17.815 -6.437 -3.312 1.00 0.66 H new ATOM 0 HB3 ARG A 101 -18.325 -6.475 -1.636 1.00 0.66 H new ATOM 0 HG2 ARG A 101 -20.608 -7.013 -2.229 1.00 0.76 H new ATOM 0 HG3 ARG A 101 -20.356 -6.583 -3.909 1.00 0.76 H new ATOM 0 HD2 ARG A 101 -18.939 -8.509 -4.300 1.00 1.10 H new ATOM 0 HD3 ARG A 101 -18.760 -8.822 -2.585 1.00 1.10 H new ATOM 0 HE ARG A 101 -21.547 -9.004 -2.986 1.00 1.67 H new ATOM 0 HH11 ARG A 101 -18.640 -10.358 -4.380 1.00 2.25 H new ATOM 0 HH12 ARG A 101 -19.410 -11.887 -4.816 1.00 2.25 H new ATOM 0 HH21 ARG A 101 -22.532 -10.962 -3.541 1.00 2.74 H new ATOM 0 HH22 ARG A 101 -21.596 -12.226 -4.344 1.00 2.74 H new ATOM 1694 N GLU A 102 -21.363 -4.308 -2.655 1.00 0.90 N ATOM 1695 CA GLU A 102 -22.663 -4.017 -1.982 1.00 1.00 C ATOM 1696 C GLU A 102 -22.858 -4.947 -0.779 1.00 1.03 C ATOM 1697 O GLU A 102 -22.853 -4.514 0.355 1.00 1.09 O ATOM 1698 CB GLU A 102 -23.809 -4.224 -2.976 1.00 1.13 C ATOM 1699 CG GLU A 102 -23.794 -3.103 -4.018 1.00 1.39 C ATOM 1700 CD GLU A 102 -22.565 -3.256 -4.915 1.00 1.83 C ATOM 1701 OE1 GLU A 102 -22.565 -4.157 -5.738 1.00 2.21 O ATOM 1702 OE2 GLU A 102 -21.644 -2.469 -4.765 1.00 2.46 O ATOM 0 H GLU A 102 -21.414 -4.407 -3.669 1.00 0.90 H new ATOM 0 HA GLU A 102 -22.658 -2.984 -1.634 1.00 1.00 H new ATOM 0 HB2 GLU A 102 -23.708 -5.192 -3.467 1.00 1.13 H new ATOM 0 HB3 GLU A 102 -24.763 -4.232 -2.450 1.00 1.13 H new ATOM 0 HG2 GLU A 102 -24.703 -3.139 -4.619 1.00 1.39 H new ATOM 0 HG3 GLU A 102 -23.777 -2.132 -3.523 1.00 1.39 H new ATOM 1709 N LYS A 103 -23.039 -6.218 -1.014 1.00 1.07 N ATOM 1710 CA LYS A 103 -23.243 -7.166 0.122 1.00 1.13 C ATOM 1711 C LYS A 103 -22.181 -6.920 1.198 1.00 1.00 C ATOM 1712 O LYS A 103 -22.325 -7.329 2.333 1.00 1.14 O ATOM 1713 CB LYS A 103 -23.130 -8.608 -0.390 1.00 1.22 C ATOM 1714 CG LYS A 103 -24.222 -8.887 -1.442 1.00 1.79 C ATOM 1715 CD LYS A 103 -25.515 -9.351 -0.756 1.00 1.93 C ATOM 1716 CE LYS A 103 -26.680 -9.266 -1.745 1.00 2.07 C ATOM 1717 NZ LYS A 103 -26.450 -10.219 -2.867 1.00 2.77 N ATOM 0 H LYS A 103 -23.055 -6.642 -1.942 1.00 1.07 H new ATOM 0 HA LYS A 103 -24.232 -7.008 0.551 1.00 1.13 H new ATOM 0 HB2 LYS A 103 -22.144 -8.770 -0.826 1.00 1.22 H new ATOM 0 HB3 LYS A 103 -23.229 -9.306 0.442 1.00 1.22 H new ATOM 0 HG2 LYS A 103 -24.414 -7.986 -2.025 1.00 1.79 H new ATOM 0 HG3 LYS A 103 -23.878 -9.650 -2.140 1.00 1.79 H new ATOM 0 HD2 LYS A 103 -25.402 -10.375 -0.399 1.00 1.93 H new ATOM 0 HD3 LYS A 103 -25.719 -8.730 0.116 1.00 1.93 H new ATOM 0 HE2 LYS A 103 -27.617 -9.501 -1.240 1.00 2.07 H new ATOM 0 HE3 LYS A 103 -26.771 -8.250 -2.130 1.00 2.07 H new ATOM 0 HZ1 LYS A 103 -27.316 -10.300 -3.437 1.00 2.77 H new ATOM 0 HZ2 LYS A 103 -25.674 -9.870 -3.465 1.00 2.77 H new ATOM 0 HZ3 LYS A 103 -26.199 -11.153 -2.484 1.00 2.77 H new ATOM 1731 N SER A 104 -21.114 -6.253 0.847 1.00 0.88 N ATOM 1732 CA SER A 104 -20.028 -5.970 1.837 1.00 0.79 C ATOM 1733 C SER A 104 -20.165 -4.530 2.341 1.00 0.76 C ATOM 1734 O SER A 104 -19.277 -4.001 2.979 1.00 0.67 O ATOM 1735 CB SER A 104 -18.676 -6.143 1.146 1.00 0.70 C ATOM 1736 OG SER A 104 -18.651 -7.402 0.488 1.00 0.77 O ATOM 0 H SER A 104 -20.945 -5.888 -0.090 1.00 0.88 H new ATOM 0 HA SER A 104 -20.103 -6.656 2.681 1.00 0.79 H new ATOM 0 HB2 SER A 104 -18.515 -5.339 0.427 1.00 0.70 H new ATOM 0 HB3 SER A 104 -17.869 -6.084 1.877 1.00 0.70 H new ATOM 0 HG SER A 104 -19.218 -8.036 0.974 1.00 0.77 H new ATOM 1742 N ARG A 105 -21.280 -3.891 2.073 1.00 0.93 N ATOM 1743 CA ARG A 105 -21.484 -2.487 2.551 1.00 0.97 C ATOM 1744 C ARG A 105 -22.336 -2.528 3.819 1.00 1.06 C ATOM 1745 O ARG A 105 -23.213 -1.715 4.028 1.00 1.20 O ATOM 1746 CB ARG A 105 -22.205 -1.666 1.473 1.00 1.15 C ATOM 1747 CG ARG A 105 -21.216 -1.258 0.373 1.00 1.08 C ATOM 1748 CD ARG A 105 -21.833 -0.151 -0.482 1.00 1.12 C ATOM 1749 NE ARG A 105 -23.194 -0.564 -0.926 1.00 1.66 N ATOM 1750 CZ ARG A 105 -24.019 0.323 -1.410 1.00 2.23 C ATOM 1751 NH1 ARG A 105 -23.651 1.571 -1.507 1.00 2.36 N ATOM 1752 NH2 ARG A 105 -25.212 -0.037 -1.798 1.00 2.99 N ATOM 0 H ARG A 105 -22.058 -4.283 1.543 1.00 0.93 H new ATOM 0 HA ARG A 105 -20.520 -2.022 2.759 1.00 0.97 H new ATOM 0 HB2 ARG A 105 -23.019 -2.250 1.043 1.00 1.15 H new ATOM 0 HB3 ARG A 105 -22.652 -0.778 1.919 1.00 1.15 H new ATOM 0 HG2 ARG A 105 -20.283 -0.911 0.818 1.00 1.08 H new ATOM 0 HG3 ARG A 105 -20.972 -2.119 -0.249 1.00 1.08 H new ATOM 0 HD2 ARG A 105 -21.891 0.775 0.090 1.00 1.12 H new ATOM 0 HD3 ARG A 105 -21.202 0.049 -1.348 1.00 1.12 H new ATOM 0 HE ARG A 105 -23.481 -1.540 -0.852 1.00 1.66 H new ATOM 0 HH11 ARG A 105 -22.719 1.853 -1.204 1.00 2.36 H new ATOM 0 HH12 ARG A 105 -24.296 2.265 -1.885 1.00 2.36 H new ATOM 0 HH21 ARG A 105 -25.500 -1.013 -1.723 1.00 2.99 H new ATOM 0 HH22 ARG A 105 -25.856 0.657 -2.176 1.00 2.99 H new ATOM 1766 N ASN A 106 -22.066 -3.478 4.666 1.00 1.07 N ATOM 1767 CA ASN A 106 -22.824 -3.611 5.934 1.00 1.19 C ATOM 1768 C ASN A 106 -21.913 -4.285 6.969 1.00 1.15 C ATOM 1769 O ASN A 106 -22.352 -4.699 8.023 1.00 1.23 O ATOM 1770 CB ASN A 106 -24.072 -4.478 5.670 1.00 1.31 C ATOM 1771 CG ASN A 106 -25.315 -3.595 5.501 1.00 1.59 C ATOM 1772 OD1 ASN A 106 -25.226 -2.487 5.011 1.00 2.04 O ATOM 1773 ND2 ASN A 106 -26.477 -4.044 5.890 1.00 2.09 N ATOM 0 H ASN A 106 -21.339 -4.180 4.529 1.00 1.07 H new ATOM 0 HA ASN A 106 -23.140 -2.638 6.309 1.00 1.19 H new ATOM 0 HB2 ASN A 106 -23.921 -5.079 4.773 1.00 1.31 H new ATOM 0 HB3 ASN A 106 -24.221 -5.172 6.497 1.00 1.31 H new ATOM 0 HD21 ASN A 106 -27.310 -3.465 5.782 1.00 2.09 H new ATOM 0 HD22 ASN A 106 -26.553 -4.974 6.302 1.00 2.09 H new ATOM 1780 N LEU A 107 -20.650 -4.411 6.662 1.00 1.04 N ATOM 1781 CA LEU A 107 -19.706 -5.068 7.599 1.00 1.03 C ATOM 1782 C LEU A 107 -19.372 -4.134 8.763 1.00 1.13 C ATOM 1783 O LEU A 107 -18.938 -3.016 8.566 1.00 1.17 O ATOM 1784 CB LEU A 107 -18.430 -5.393 6.839 1.00 0.90 C ATOM 1785 CG LEU A 107 -18.711 -6.486 5.793 1.00 0.87 C ATOM 1786 CD1 LEU A 107 -17.683 -6.386 4.682 1.00 0.79 C ATOM 1787 CD2 LEU A 107 -18.604 -7.871 6.429 1.00 0.94 C ATOM 0 H LEU A 107 -20.232 -4.082 5.792 1.00 1.04 H new ATOM 0 HA LEU A 107 -20.161 -5.974 7.999 1.00 1.03 H new ATOM 0 HB2 LEU A 107 -18.049 -4.497 6.349 1.00 0.90 H new ATOM 0 HB3 LEU A 107 -17.659 -5.729 7.532 1.00 0.90 H new ATOM 0 HG LEU A 107 -19.718 -6.345 5.399 1.00 0.87 H new ATOM 0 HD11 LEU A 107 -17.876 -7.158 3.937 1.00 0.79 H new ATOM 0 HD12 LEU A 107 -17.749 -5.404 4.213 1.00 0.79 H new ATOM 0 HD13 LEU A 107 -16.684 -6.524 5.097 1.00 0.79 H new ATOM 0 HD21 LEU A 107 -18.805 -8.633 5.677 1.00 0.94 H new ATOM 0 HD22 LEU A 107 -17.599 -8.011 6.828 1.00 0.94 H new ATOM 0 HD23 LEU A 107 -19.331 -7.958 7.237 1.00 0.94 H new ATOM 1799 N GLN A 108 -19.557 -4.582 9.973 1.00 1.21 N ATOM 1800 CA GLN A 108 -19.233 -3.713 11.138 1.00 1.32 C ATOM 1801 C GLN A 108 -17.786 -3.230 11.012 1.00 1.25 C ATOM 1802 O GLN A 108 -17.496 -2.059 11.157 1.00 1.28 O ATOM 1803 CB GLN A 108 -19.406 -4.508 12.437 1.00 1.46 C ATOM 1804 CG GLN A 108 -18.475 -5.727 12.430 1.00 1.56 C ATOM 1805 CD GLN A 108 -18.957 -6.750 13.463 1.00 1.88 C ATOM 1806 OE1 GLN A 108 -18.402 -6.852 14.539 1.00 2.20 O ATOM 1807 NE2 GLN A 108 -19.973 -7.517 13.177 1.00 2.48 N ATOM 0 H GLN A 108 -19.917 -5.508 10.205 1.00 1.21 H new ATOM 0 HA GLN A 108 -19.904 -2.854 11.157 1.00 1.32 H new ATOM 0 HB2 GLN A 108 -19.182 -3.873 13.295 1.00 1.46 H new ATOM 0 HB3 GLN A 108 -20.442 -4.831 12.541 1.00 1.46 H new ATOM 0 HG2 GLN A 108 -18.458 -6.178 11.438 1.00 1.56 H new ATOM 0 HG3 GLN A 108 -17.455 -5.419 12.658 1.00 1.56 H new ATOM 0 HE21 GLN A 108 -20.439 -7.431 12.274 1.00 2.48 H new ATOM 0 HE22 GLN A 108 -20.302 -8.203 13.857 1.00 2.48 H new ATOM 1816 N VAL A 109 -16.879 -4.127 10.744 1.00 1.19 N ATOM 1817 CA VAL A 109 -15.447 -3.733 10.607 1.00 1.15 C ATOM 1818 C VAL A 109 -15.332 -2.541 9.646 1.00 1.05 C ATOM 1819 O VAL A 109 -14.472 -1.692 9.799 1.00 1.07 O ATOM 1820 CB VAL A 109 -14.638 -4.934 10.079 1.00 1.11 C ATOM 1821 CG1 VAL A 109 -15.422 -5.636 8.973 1.00 1.01 C ATOM 1822 CG2 VAL A 109 -13.290 -4.468 9.515 1.00 1.04 C ATOM 0 H VAL A 109 -17.068 -5.121 10.613 1.00 1.19 H new ATOM 0 HA VAL A 109 -15.048 -3.437 11.577 1.00 1.15 H new ATOM 0 HB VAL A 109 -14.462 -5.622 10.906 1.00 1.11 H new ATOM 0 HG11 VAL A 109 -14.847 -6.485 8.602 1.00 1.01 H new ATOM 0 HG12 VAL A 109 -16.374 -5.988 9.369 1.00 1.01 H new ATOM 0 HG13 VAL A 109 -15.605 -4.937 8.157 1.00 1.01 H new ATOM 0 HG21 VAL A 109 -12.732 -5.329 9.147 1.00 1.04 H new ATOM 0 HG22 VAL A 109 -13.460 -3.769 8.696 1.00 1.04 H new ATOM 0 HG23 VAL A 109 -12.718 -3.974 10.301 1.00 1.04 H new ATOM 1832 N ILE A 110 -16.201 -2.441 8.674 1.00 0.96 N ATOM 1833 CA ILE A 110 -16.132 -1.281 7.740 1.00 0.87 C ATOM 1834 C ILE A 110 -16.929 -0.131 8.342 1.00 0.96 C ATOM 1835 O ILE A 110 -16.399 0.917 8.644 1.00 0.99 O ATOM 1836 CB ILE A 110 -16.733 -1.665 6.385 1.00 0.79 C ATOM 1837 CG1 ILE A 110 -15.804 -2.677 5.704 1.00 0.70 C ATOM 1838 CG2 ILE A 110 -16.868 -0.411 5.505 1.00 0.77 C ATOM 1839 CD1 ILE A 110 -16.415 -3.157 4.391 1.00 0.64 C ATOM 0 H ILE A 110 -16.950 -3.108 8.488 1.00 0.96 H new ATOM 0 HA ILE A 110 -15.093 -0.985 7.592 1.00 0.87 H new ATOM 0 HB ILE A 110 -17.720 -2.105 6.527 1.00 0.79 H new ATOM 0 HG12 ILE A 110 -14.833 -2.220 5.515 1.00 0.70 H new ATOM 0 HG13 ILE A 110 -15.633 -3.526 6.365 1.00 0.70 H new ATOM 0 HG21 ILE A 110 -17.296 -0.687 4.541 1.00 0.77 H new ATOM 0 HG22 ILE A 110 -17.519 0.311 5.998 1.00 0.77 H new ATOM 0 HG23 ILE A 110 -15.885 0.033 5.351 1.00 0.77 H new ATOM 0 HD11 ILE A 110 -15.744 -3.875 3.919 1.00 0.64 H new ATOM 0 HD12 ILE A 110 -17.375 -3.633 4.589 1.00 0.64 H new ATOM 0 HD13 ILE A 110 -16.562 -2.306 3.726 1.00 0.64 H new ATOM 1851 N LYS A 111 -18.200 -0.346 8.547 1.00 1.02 N ATOM 1852 CA LYS A 111 -19.056 0.712 9.152 1.00 1.13 C ATOM 1853 C LYS A 111 -18.339 1.276 10.375 1.00 1.19 C ATOM 1854 O LYS A 111 -18.592 2.380 10.814 1.00 1.26 O ATOM 1855 CB LYS A 111 -20.393 0.095 9.568 1.00 1.23 C ATOM 1856 CG LYS A 111 -21.113 -0.451 8.320 1.00 1.17 C ATOM 1857 CD LYS A 111 -21.934 0.672 7.638 1.00 1.35 C ATOM 1858 CE LYS A 111 -21.955 0.469 6.117 1.00 1.23 C ATOM 1859 NZ LYS A 111 -23.150 1.148 5.542 1.00 1.58 N ATOM 0 H LYS A 111 -18.684 -1.214 8.320 1.00 1.02 H new ATOM 0 HA LYS A 111 -19.240 1.512 8.435 1.00 1.13 H new ATOM 0 HB2 LYS A 111 -20.228 -0.708 10.287 1.00 1.23 H new ATOM 0 HB3 LYS A 111 -21.014 0.843 10.062 1.00 1.23 H new ATOM 0 HG2 LYS A 111 -20.383 -0.855 7.618 1.00 1.17 H new ATOM 0 HG3 LYS A 111 -21.772 -1.272 8.602 1.00 1.17 H new ATOM 0 HD2 LYS A 111 -22.953 0.673 8.025 1.00 1.35 H new ATOM 0 HD3 LYS A 111 -21.501 1.644 7.876 1.00 1.35 H new ATOM 0 HE2 LYS A 111 -21.045 0.873 5.673 1.00 1.23 H new ATOM 0 HE3 LYS A 111 -21.980 -0.595 5.882 1.00 1.23 H new ATOM 0 HZ1 LYS A 111 -23.165 1.011 4.511 1.00 1.58 H new ATOM 0 HZ2 LYS A 111 -24.013 0.743 5.958 1.00 1.58 H new ATOM 0 HZ3 LYS A 111 -23.108 2.165 5.755 1.00 1.58 H new ATOM 1873 N GLU A 112 -17.428 0.513 10.914 1.00 1.18 N ATOM 1874 CA GLU A 112 -16.659 0.976 12.102 1.00 1.26 C ATOM 1875 C GLU A 112 -15.439 1.772 11.630 1.00 1.19 C ATOM 1876 O GLU A 112 -15.039 2.736 12.252 1.00 1.28 O ATOM 1877 CB GLU A 112 -16.194 -0.237 12.911 1.00 1.29 C ATOM 1878 CG GLU A 112 -15.442 0.236 14.157 1.00 1.47 C ATOM 1879 CD GLU A 112 -15.170 -0.959 15.073 1.00 1.84 C ATOM 1880 OE1 GLU A 112 -14.520 -1.889 14.624 1.00 1.95 O ATOM 1881 OE2 GLU A 112 -15.615 -0.923 16.208 1.00 2.56 O ATOM 0 H GLU A 112 -17.182 -0.419 10.579 1.00 1.18 H new ATOM 0 HA GLU A 112 -17.291 1.607 12.727 1.00 1.26 H new ATOM 0 HB2 GLU A 112 -17.051 -0.845 13.200 1.00 1.29 H new ATOM 0 HB3 GLU A 112 -15.547 -0.868 12.301 1.00 1.29 H new ATOM 0 HG2 GLU A 112 -14.503 0.709 13.870 1.00 1.47 H new ATOM 0 HG3 GLU A 112 -16.029 0.987 14.686 1.00 1.47 H new ATOM 1888 N ALA A 113 -14.841 1.380 10.533 1.00 1.06 N ATOM 1889 CA ALA A 113 -13.649 2.127 10.035 1.00 1.01 C ATOM 1890 C ALA A 113 -14.093 3.430 9.354 1.00 0.97 C ATOM 1891 O ALA A 113 -13.337 4.378 9.276 1.00 0.96 O ATOM 1892 CB ALA A 113 -12.866 1.260 9.043 1.00 0.93 C ATOM 0 H ALA A 113 -15.125 0.581 9.966 1.00 1.06 H new ATOM 0 HA ALA A 113 -13.005 2.370 10.880 1.00 1.01 H new ATOM 0 HB1 ALA A 113 -11.997 1.812 8.684 1.00 0.93 H new ATOM 0 HB2 ALA A 113 -12.536 0.347 9.539 1.00 0.93 H new ATOM 0 HB3 ALA A 113 -13.507 1.003 8.199 1.00 0.93 H new ATOM 1898 N LEU A 114 -15.309 3.501 8.870 1.00 0.98 N ATOM 1899 CA LEU A 114 -15.766 4.760 8.217 1.00 0.97 C ATOM 1900 C LEU A 114 -15.657 5.909 9.221 1.00 1.06 C ATOM 1901 O LEU A 114 -15.337 7.026 8.868 1.00 1.09 O ATOM 1902 CB LEU A 114 -17.226 4.635 7.775 1.00 1.02 C ATOM 1903 CG LEU A 114 -17.431 3.446 6.823 1.00 0.93 C ATOM 1904 CD1 LEU A 114 -18.800 3.579 6.159 1.00 1.02 C ATOM 1905 CD2 LEU A 114 -16.349 3.415 5.734 1.00 0.89 C ATOM 0 H LEU A 114 -15.996 2.748 8.900 1.00 0.98 H new ATOM 0 HA LEU A 114 -15.142 4.950 7.344 1.00 0.97 H new ATOM 0 HB2 LEU A 114 -17.863 4.514 8.651 1.00 1.02 H new ATOM 0 HB3 LEU A 114 -17.537 5.555 7.280 1.00 1.02 H new ATOM 0 HG LEU A 114 -17.367 2.523 7.399 1.00 0.93 H new ATOM 0 HD11 LEU A 114 -18.958 2.741 5.480 1.00 1.02 H new ATOM 0 HD12 LEU A 114 -19.577 3.578 6.924 1.00 1.02 H new ATOM 0 HD13 LEU A 114 -18.843 4.513 5.599 1.00 1.02 H new ATOM 0 HD21 LEU A 114 -16.520 2.563 5.076 1.00 0.89 H new ATOM 0 HD22 LEU A 114 -16.391 4.337 5.153 1.00 0.89 H new ATOM 0 HD23 LEU A 114 -15.367 3.323 6.199 1.00 0.89 H new ATOM 1917 N GLU A 115 -15.917 5.641 10.471 1.00 1.19 N ATOM 1918 CA GLU A 115 -15.824 6.716 11.497 1.00 1.30 C ATOM 1919 C GLU A 115 -14.353 7.005 11.781 1.00 1.29 C ATOM 1920 O GLU A 115 -13.953 8.138 11.964 1.00 1.36 O ATOM 1921 CB GLU A 115 -16.512 6.258 12.784 1.00 1.42 C ATOM 1922 CG GLU A 115 -17.988 5.969 12.500 1.00 1.48 C ATOM 1923 CD GLU A 115 -18.734 7.287 12.284 1.00 2.00 C ATOM 1924 OE1 GLU A 115 -19.050 7.934 13.269 1.00 2.73 O ATOM 1925 OE2 GLU A 115 -18.978 7.626 11.138 1.00 2.38 O ATOM 0 H GLU A 115 -16.190 4.724 10.826 1.00 1.19 H new ATOM 0 HA GLU A 115 -16.314 7.618 11.130 1.00 1.30 H new ATOM 0 HB2 GLU A 115 -16.024 5.364 13.171 1.00 1.42 H new ATOM 0 HB3 GLU A 115 -16.422 7.028 13.550 1.00 1.42 H new ATOM 0 HG2 GLU A 115 -18.082 5.337 11.617 1.00 1.48 H new ATOM 0 HG3 GLU A 115 -18.429 5.421 13.333 1.00 1.48 H new ATOM 1932 N ALA A 116 -13.544 5.985 11.814 1.00 1.25 N ATOM 1933 CA ALA A 116 -12.095 6.189 12.080 1.00 1.27 C ATOM 1934 C ALA A 116 -11.473 6.961 10.915 1.00 1.22 C ATOM 1935 O ALA A 116 -10.285 7.210 10.885 1.00 1.45 O ATOM 1936 CB ALA A 116 -11.411 4.827 12.217 1.00 1.25 C ATOM 0 H ALA A 116 -13.825 5.015 11.668 1.00 1.25 H new ATOM 0 HA ALA A 116 -11.964 6.755 13.002 1.00 1.27 H new ATOM 0 HB1 ALA A 116 -10.348 4.971 12.412 1.00 1.25 H new ATOM 0 HB2 ALA A 116 -11.860 4.276 13.043 1.00 1.25 H new ATOM 0 HB3 ALA A 116 -11.537 4.262 11.293 1.00 1.25 H new ATOM 1942 N ASN A 117 -12.271 7.339 9.954 1.00 1.16 N ATOM 1943 CA ASN A 117 -11.731 8.092 8.788 1.00 1.10 C ATOM 1944 C ASN A 117 -11.544 9.562 9.168 1.00 1.52 C ATOM 1945 O ASN A 117 -12.497 10.302 9.315 1.00 2.05 O ATOM 1946 CB ASN A 117 -12.711 7.988 7.617 1.00 1.42 C ATOM 1947 CG ASN A 117 -12.020 8.442 6.331 1.00 1.19 C ATOM 1948 OD1 ASN A 117 -10.831 8.694 6.322 1.00 1.49 O ATOM 1949 ND2 ASN A 117 -12.718 8.558 5.235 1.00 1.68 N ATOM 0 H ASN A 117 -13.275 7.158 9.927 1.00 1.16 H new ATOM 0 HA ASN A 117 -10.769 7.669 8.497 1.00 1.10 H new ATOM 0 HB2 ASN A 117 -13.060 6.961 7.512 1.00 1.42 H new ATOM 0 HB3 ASN A 117 -13.589 8.605 7.808 1.00 1.42 H new ATOM 0 HD21 ASN A 117 -12.266 8.860 4.372 1.00 1.68 H new ATOM 0 HD22 ASN A 117 -13.716 8.347 5.241 1.00 1.68 H new ATOM 1956 N ASN A 118 -10.320 9.992 9.324 1.00 1.67 N ATOM 1957 CA ASN A 118 -10.059 11.417 9.689 1.00 2.33 C ATOM 1958 C ASN A 118 -8.768 11.874 9.012 1.00 1.95 C ATOM 1959 O ASN A 118 -8.072 12.744 9.494 1.00 2.55 O ATOM 1960 CB ASN A 118 -9.913 11.540 11.208 1.00 3.26 C ATOM 1961 CG ASN A 118 -11.156 10.964 11.888 1.00 4.00 C ATOM 1962 OD1 ASN A 118 -11.085 9.945 12.547 1.00 4.45 O ATOM 1963 ND2 ASN A 118 -12.300 11.578 11.757 1.00 4.51 N ATOM 0 H ASN A 118 -9.486 9.416 9.214 1.00 1.67 H new ATOM 0 HA ASN A 118 -10.890 12.040 9.358 1.00 2.33 H new ATOM 0 HB2 ASN A 118 -9.023 11.008 11.543 1.00 3.26 H new ATOM 0 HB3 ASN A 118 -9.784 12.585 11.488 1.00 3.26 H new ATOM 0 HD21 ASN A 118 -13.135 11.203 12.208 1.00 4.51 H new ATOM 0 HD22 ASN A 118 -12.360 12.433 11.204 1.00 4.51 H new ATOM 1970 N TYR A 119 -8.455 11.287 7.893 1.00 1.33 N ATOM 1971 CA TYR A 119 -7.215 11.667 7.158 1.00 1.26 C ATOM 1972 C TYR A 119 -7.169 10.898 5.836 1.00 1.10 C ATOM 1973 O TYR A 119 -7.296 9.690 5.810 1.00 1.08 O ATOM 1974 CB TYR A 119 -5.985 11.309 8.001 1.00 1.57 C ATOM 1975 CG TYR A 119 -4.730 11.537 7.190 1.00 1.68 C ATOM 1976 CD1 TYR A 119 -4.204 12.828 7.062 1.00 2.46 C ATOM 1977 CD2 TYR A 119 -4.094 10.457 6.565 1.00 1.82 C ATOM 1978 CE1 TYR A 119 -3.042 13.039 6.309 1.00 2.65 C ATOM 1979 CE2 TYR A 119 -2.932 10.669 5.813 1.00 2.23 C ATOM 1980 CZ TYR A 119 -2.407 11.960 5.685 1.00 2.33 C ATOM 1981 OH TYR A 119 -1.262 12.168 4.943 1.00 2.77 O ATOM 0 H TYR A 119 -9.009 10.554 7.451 1.00 1.33 H new ATOM 0 HA TYR A 119 -7.215 12.740 6.964 1.00 1.26 H new ATOM 0 HB2 TYR A 119 -5.961 11.918 8.905 1.00 1.57 H new ATOM 0 HB3 TYR A 119 -6.040 10.268 8.319 1.00 1.57 H new ATOM 0 HD1 TYR A 119 -4.694 13.661 7.544 1.00 2.46 H new ATOM 0 HD2 TYR A 119 -4.500 9.461 6.663 1.00 1.82 H new ATOM 0 HE1 TYR A 119 -2.636 14.035 6.210 1.00 2.65 H new ATOM 0 HE2 TYR A 119 -2.441 9.836 5.332 1.00 2.23 H new ATOM 0 HH TYR A 119 -0.948 11.314 4.579 1.00 2.77 H new ATOM 1991 N ILE A 120 -6.968 11.585 4.740 1.00 1.11 N ATOM 1992 CA ILE A 120 -6.897 10.895 3.415 1.00 0.98 C ATOM 1993 C ILE A 120 -5.884 11.629 2.517 1.00 1.00 C ATOM 1994 O ILE A 120 -5.986 12.827 2.347 1.00 1.09 O ATOM 1995 CB ILE A 120 -8.264 10.933 2.736 1.00 0.93 C ATOM 1996 CG1 ILE A 120 -9.340 10.493 3.741 1.00 0.94 C ATOM 1997 CG2 ILE A 120 -8.248 9.981 1.534 1.00 0.96 C ATOM 1998 CD1 ILE A 120 -10.661 10.187 3.030 1.00 0.89 C ATOM 0 H ILE A 120 -6.850 12.598 4.705 1.00 1.11 H new ATOM 0 HA ILE A 120 -6.591 9.860 3.568 1.00 0.98 H new ATOM 0 HB ILE A 120 -8.487 11.944 2.395 1.00 0.93 H new ATOM 0 HG12 ILE A 120 -9.000 9.609 4.280 1.00 0.94 H new ATOM 0 HG13 ILE A 120 -9.494 11.278 4.481 1.00 0.94 H new ATOM 0 HG21 ILE A 120 -9.220 10.000 1.042 1.00 0.96 H new ATOM 0 HG22 ILE A 120 -7.478 10.297 0.830 1.00 0.96 H new ATOM 0 HG23 ILE A 120 -8.034 8.968 1.875 1.00 0.96 H new ATOM 0 HD11 ILE A 120 -11.406 9.878 3.763 1.00 0.89 H new ATOM 0 HD12 ILE A 120 -11.011 11.080 2.512 1.00 0.89 H new ATOM 0 HD13 ILE A 120 -10.508 9.385 2.308 1.00 0.89 H new ATOM 2010 N PRO A 121 -4.919 10.943 1.933 1.00 0.98 N ATOM 2011 CA PRO A 121 -3.920 11.600 1.040 1.00 1.05 C ATOM 2012 C PRO A 121 -4.575 12.581 0.056 1.00 1.02 C ATOM 2013 O PRO A 121 -5.780 12.729 0.018 1.00 0.97 O ATOM 2014 CB PRO A 121 -3.275 10.430 0.292 1.00 1.09 C ATOM 2015 CG PRO A 121 -3.389 9.265 1.222 1.00 1.01 C ATOM 2016 CD PRO A 121 -4.659 9.493 2.055 1.00 0.94 C ATOM 0 HA PRO A 121 -3.205 12.200 1.603 1.00 1.05 H new ATOM 0 HB2 PRO A 121 -3.787 10.234 -0.650 1.00 1.09 H new ATOM 0 HB3 PRO A 121 -2.233 10.642 0.051 1.00 1.09 H new ATOM 0 HG2 PRO A 121 -3.453 8.330 0.666 1.00 1.01 H new ATOM 0 HG3 PRO A 121 -2.511 9.194 1.865 1.00 1.01 H new ATOM 0 HD2 PRO A 121 -5.495 8.905 1.675 1.00 0.94 H new ATOM 0 HD3 PRO A 121 -4.511 9.201 3.095 1.00 0.94 H new ATOM 2024 N ASP A 122 -3.788 13.257 -0.738 1.00 1.10 N ATOM 2025 CA ASP A 122 -4.360 14.236 -1.711 1.00 1.13 C ATOM 2026 C ASP A 122 -4.667 13.550 -3.047 1.00 1.08 C ATOM 2027 O ASP A 122 -5.522 13.989 -3.790 1.00 1.24 O ATOM 2028 CB ASP A 122 -3.350 15.360 -1.946 1.00 1.28 C ATOM 2029 CG ASP A 122 -3.935 16.375 -2.930 1.00 1.31 C ATOM 2030 OD1 ASP A 122 -4.770 17.161 -2.514 1.00 1.68 O ATOM 2031 OD2 ASP A 122 -3.538 16.349 -4.084 1.00 1.75 O ATOM 0 H ASP A 122 -2.772 13.174 -0.756 1.00 1.10 H new ATOM 0 HA ASP A 122 -5.285 14.640 -1.300 1.00 1.13 H new ATOM 0 HB2 ASP A 122 -3.109 15.850 -1.002 1.00 1.28 H new ATOM 0 HB3 ASP A 122 -2.420 14.951 -2.340 1.00 1.28 H new ATOM 2036 N TYR A 123 -3.974 12.490 -3.376 1.00 0.92 N ATOM 2037 CA TYR A 123 -4.237 11.809 -4.682 1.00 0.88 C ATOM 2038 C TYR A 123 -5.375 10.792 -4.540 1.00 0.80 C ATOM 2039 O TYR A 123 -5.744 10.135 -5.495 1.00 0.84 O ATOM 2040 CB TYR A 123 -2.968 11.099 -5.166 1.00 0.90 C ATOM 2041 CG TYR A 123 -2.410 10.217 -4.076 1.00 1.00 C ATOM 2042 CD1 TYR A 123 -1.569 10.758 -3.098 1.00 1.72 C ATOM 2043 CD2 TYR A 123 -2.727 8.854 -4.051 1.00 1.45 C ATOM 2044 CE1 TYR A 123 -1.048 9.936 -2.092 1.00 1.77 C ATOM 2045 CE2 TYR A 123 -2.206 8.032 -3.045 1.00 1.56 C ATOM 2046 CZ TYR A 123 -1.366 8.573 -2.065 1.00 1.21 C ATOM 2047 OH TYR A 123 -0.852 7.764 -1.073 1.00 1.33 O ATOM 0 H TYR A 123 -3.243 12.068 -2.803 1.00 0.92 H new ATOM 0 HA TYR A 123 -4.531 12.563 -5.412 1.00 0.88 H new ATOM 0 HB2 TYR A 123 -3.193 10.499 -6.048 1.00 0.90 H new ATOM 0 HB3 TYR A 123 -2.222 11.836 -5.463 1.00 0.90 H new ATOM 0 HD1 TYR A 123 -1.322 11.809 -3.119 1.00 1.72 H new ATOM 0 HD2 TYR A 123 -3.374 8.436 -4.808 1.00 1.45 H new ATOM 0 HE1 TYR A 123 -0.400 10.354 -1.336 1.00 1.77 H new ATOM 0 HE2 TYR A 123 -2.452 6.981 -3.025 1.00 1.56 H new ATOM 0 HH TYR A 123 0.127 7.781 -1.112 1.00 1.33 H new ATOM 2057 N LEU A 124 -5.942 10.659 -3.362 1.00 0.73 N ATOM 2058 CA LEU A 124 -7.069 9.687 -3.162 1.00 0.66 C ATOM 2059 C LEU A 124 -8.364 10.444 -2.875 1.00 0.68 C ATOM 2060 O LEU A 124 -8.453 11.225 -1.949 1.00 0.77 O ATOM 2061 CB LEU A 124 -6.770 8.765 -1.968 1.00 0.61 C ATOM 2062 CG LEU A 124 -5.571 7.848 -2.261 1.00 0.62 C ATOM 2063 CD1 LEU A 124 -5.368 6.887 -1.082 1.00 0.58 C ATOM 2064 CD2 LEU A 124 -5.818 7.027 -3.536 1.00 0.67 C ATOM 0 H LEU A 124 -5.673 11.182 -2.529 1.00 0.73 H new ATOM 0 HA LEU A 124 -7.175 9.093 -4.070 1.00 0.66 H new ATOM 0 HB2 LEU A 124 -6.563 9.367 -1.083 1.00 0.61 H new ATOM 0 HB3 LEU A 124 -7.648 8.160 -1.744 1.00 0.61 H new ATOM 0 HG LEU A 124 -4.685 8.467 -2.402 1.00 0.62 H new ATOM 0 HD11 LEU A 124 -4.519 6.235 -1.286 1.00 0.58 H new ATOM 0 HD12 LEU A 124 -5.176 7.460 -0.175 1.00 0.58 H new ATOM 0 HD13 LEU A 124 -6.265 6.283 -0.947 1.00 0.58 H new ATOM 0 HD21 LEU A 124 -4.959 6.384 -3.727 1.00 0.67 H new ATOM 0 HD22 LEU A 124 -6.709 6.413 -3.406 1.00 0.67 H new ATOM 0 HD23 LEU A 124 -5.962 7.701 -4.381 1.00 0.67 H new ATOM 2076 N SER A 125 -9.383 10.178 -3.650 1.00 0.67 N ATOM 2077 CA SER A 125 -10.707 10.831 -3.428 1.00 0.73 C ATOM 2078 C SER A 125 -11.601 9.802 -2.733 1.00 0.68 C ATOM 2079 O SER A 125 -11.847 8.740 -3.266 1.00 0.71 O ATOM 2080 CB SER A 125 -11.314 11.231 -4.782 1.00 0.81 C ATOM 2081 OG SER A 125 -12.707 10.941 -4.786 1.00 1.35 O ATOM 0 H SER A 125 -9.354 9.529 -4.436 1.00 0.67 H new ATOM 0 HA SER A 125 -10.609 11.730 -2.819 1.00 0.73 H new ATOM 0 HB2 SER A 125 -11.153 12.294 -4.964 1.00 0.81 H new ATOM 0 HB3 SER A 125 -10.818 10.691 -5.588 1.00 0.81 H new ATOM 0 HG SER A 125 -13.092 11.198 -5.650 1.00 1.35 H new ATOM 2087 N PHE A 126 -12.073 10.087 -1.543 1.00 0.64 N ATOM 2088 CA PHE A 126 -12.930 9.096 -0.812 1.00 0.62 C ATOM 2089 C PHE A 126 -14.405 9.494 -0.877 1.00 0.74 C ATOM 2090 O PHE A 126 -14.786 10.580 -0.489 1.00 0.87 O ATOM 2091 CB PHE A 126 -12.493 9.045 0.648 1.00 0.63 C ATOM 2092 CG PHE A 126 -13.244 7.943 1.362 1.00 0.69 C ATOM 2093 CD1 PHE A 126 -13.013 6.606 1.017 1.00 1.42 C ATOM 2094 CD2 PHE A 126 -14.171 8.256 2.366 1.00 1.36 C ATOM 2095 CE1 PHE A 126 -13.706 5.583 1.675 1.00 1.49 C ATOM 2096 CE2 PHE A 126 -14.863 7.232 3.023 1.00 1.39 C ATOM 2097 CZ PHE A 126 -14.631 5.896 2.678 1.00 0.87 C ATOM 0 H PHE A 126 -11.903 10.961 -1.046 1.00 0.64 H new ATOM 0 HA PHE A 126 -12.813 8.120 -1.283 1.00 0.62 H new ATOM 0 HB2 PHE A 126 -11.419 8.868 0.711 1.00 0.63 H new ATOM 0 HB3 PHE A 126 -12.687 10.003 1.130 1.00 0.63 H new ATOM 0 HD1 PHE A 126 -12.300 6.364 0.243 1.00 1.42 H new ATOM 0 HD2 PHE A 126 -14.351 9.287 2.632 1.00 1.36 H new ATOM 0 HE1 PHE A 126 -13.527 4.552 1.409 1.00 1.49 H new ATOM 0 HE2 PHE A 126 -15.577 7.473 3.797 1.00 1.39 H new ATOM 0 HZ PHE A 126 -15.165 5.106 3.185 1.00 0.87 H new ATOM 2107 N ASP A 127 -15.238 8.599 -1.346 1.00 0.80 N ATOM 2108 CA ASP A 127 -16.705 8.879 -1.427 1.00 0.94 C ATOM 2109 C ASP A 127 -17.412 8.062 -0.328 1.00 0.96 C ATOM 2110 O ASP A 127 -17.423 6.848 -0.384 1.00 0.93 O ATOM 2111 CB ASP A 127 -17.225 8.433 -2.796 1.00 1.00 C ATOM 2112 CG ASP A 127 -18.670 8.904 -2.971 1.00 1.49 C ATOM 2113 OD1 ASP A 127 -19.302 9.198 -1.970 1.00 2.18 O ATOM 2114 OD2 ASP A 127 -19.121 8.962 -4.103 1.00 1.92 O ATOM 0 H ASP A 127 -14.961 7.676 -1.680 1.00 0.80 H new ATOM 0 HA ASP A 127 -16.897 9.943 -1.293 1.00 0.94 H new ATOM 0 HB2 ASP A 127 -16.599 8.846 -3.587 1.00 1.00 H new ATOM 0 HB3 ASP A 127 -17.172 7.348 -2.881 1.00 1.00 H new ATOM 2119 N PRO A 128 -17.984 8.695 0.675 1.00 1.05 N ATOM 2120 CA PRO A 128 -18.667 7.965 1.782 1.00 1.10 C ATOM 2121 C PRO A 128 -20.077 7.497 1.398 1.00 1.19 C ATOM 2122 O PRO A 128 -20.498 6.414 1.752 1.00 1.23 O ATOM 2123 CB PRO A 128 -18.719 9.007 2.905 1.00 1.23 C ATOM 2124 CG PRO A 128 -18.813 10.321 2.197 1.00 1.40 C ATOM 2125 CD PRO A 128 -18.053 10.158 0.875 1.00 1.18 C ATOM 0 HA PRO A 128 -18.143 7.050 2.057 1.00 1.10 H new ATOM 0 HB2 PRO A 128 -19.578 8.845 3.556 1.00 1.23 H new ATOM 0 HB3 PRO A 128 -17.829 8.958 3.533 1.00 1.23 H new ATOM 0 HG2 PRO A 128 -19.853 10.591 2.016 1.00 1.40 H new ATOM 0 HG3 PRO A 128 -18.377 11.118 2.799 1.00 1.40 H new ATOM 0 HD2 PRO A 128 -18.574 10.648 0.053 1.00 1.18 H new ATOM 0 HD3 PRO A 128 -17.058 10.600 0.930 1.00 1.18 H new ATOM 2133 N GLU A 129 -20.809 8.304 0.682 1.00 1.25 N ATOM 2134 CA GLU A 129 -22.187 7.902 0.286 1.00 1.36 C ATOM 2135 C GLU A 129 -22.142 6.575 -0.477 1.00 1.21 C ATOM 2136 O GLU A 129 -22.846 5.639 -0.154 1.00 1.26 O ATOM 2137 CB GLU A 129 -22.794 8.983 -0.611 1.00 1.48 C ATOM 2138 CG GLU A 129 -23.014 10.259 0.203 1.00 1.70 C ATOM 2139 CD GLU A 129 -23.827 11.258 -0.623 1.00 2.08 C ATOM 2140 OE1 GLU A 129 -23.716 11.221 -1.837 1.00 2.49 O ATOM 2141 OE2 GLU A 129 -24.546 12.042 -0.027 1.00 2.70 O ATOM 0 H GLU A 129 -20.513 9.223 0.354 1.00 1.25 H new ATOM 0 HA GLU A 129 -22.797 7.782 1.181 1.00 1.36 H new ATOM 0 HB2 GLU A 129 -22.132 9.186 -1.453 1.00 1.48 H new ATOM 0 HB3 GLU A 129 -23.740 8.636 -1.026 1.00 1.48 H new ATOM 0 HG2 GLU A 129 -23.538 10.026 1.130 1.00 1.70 H new ATOM 0 HG3 GLU A 129 -22.055 10.696 0.480 1.00 1.70 H new ATOM 2148 N LYS A 130 -21.326 6.489 -1.495 1.00 1.07 N ATOM 2149 CA LYS A 130 -21.239 5.231 -2.293 1.00 0.96 C ATOM 2150 C LYS A 130 -20.078 4.367 -1.786 1.00 0.80 C ATOM 2151 O LYS A 130 -19.792 3.320 -2.333 1.00 0.73 O ATOM 2152 CB LYS A 130 -20.999 5.600 -3.764 1.00 1.01 C ATOM 2153 CG LYS A 130 -22.319 6.040 -4.426 1.00 1.15 C ATOM 2154 CD LYS A 130 -23.083 4.814 -4.957 1.00 1.29 C ATOM 2155 CE LYS A 130 -22.604 4.464 -6.371 1.00 1.69 C ATOM 2156 NZ LYS A 130 -23.011 3.069 -6.702 1.00 1.92 N ATOM 0 H LYS A 130 -20.713 7.241 -1.809 1.00 1.07 H new ATOM 0 HA LYS A 130 -22.166 4.667 -2.193 1.00 0.96 H new ATOM 0 HB2 LYS A 130 -20.266 6.404 -3.830 1.00 1.01 H new ATOM 0 HB3 LYS A 130 -20.584 4.745 -4.298 1.00 1.01 H new ATOM 0 HG2 LYS A 130 -22.935 6.577 -3.704 1.00 1.15 H new ATOM 0 HG3 LYS A 130 -22.112 6.730 -5.244 1.00 1.15 H new ATOM 0 HD2 LYS A 130 -22.929 3.964 -4.292 1.00 1.29 H new ATOM 0 HD3 LYS A 130 -24.153 5.020 -4.968 1.00 1.29 H new ATOM 0 HE2 LYS A 130 -23.030 5.160 -7.094 1.00 1.69 H new ATOM 0 HE3 LYS A 130 -21.520 4.563 -6.434 1.00 1.69 H new ATOM 0 HZ1 LYS A 130 -22.686 2.831 -7.661 1.00 1.92 H new ATOM 0 HZ2 LYS A 130 -22.584 2.411 -6.019 1.00 1.92 H new ATOM 0 HZ3 LYS A 130 -24.047 2.990 -6.658 1.00 1.92 H new ATOM 2170 N MET A 131 -19.401 4.791 -0.752 1.00 0.78 N ATOM 2171 CA MET A 131 -18.259 3.981 -0.232 1.00 0.65 C ATOM 2172 C MET A 131 -17.346 3.602 -1.404 1.00 0.57 C ATOM 2173 O MET A 131 -17.156 2.435 -1.713 1.00 0.50 O ATOM 2174 CB MET A 131 -18.803 2.711 0.456 1.00 0.62 C ATOM 2175 CG MET A 131 -19.073 2.987 1.944 1.00 0.77 C ATOM 2176 SD MET A 131 -20.385 1.883 2.534 1.00 1.58 S ATOM 2177 CE MET A 131 -19.331 0.629 3.306 1.00 0.86 C ATOM 0 H MET A 131 -19.587 5.658 -0.247 1.00 0.78 H new ATOM 0 HA MET A 131 -17.689 4.558 0.497 1.00 0.65 H new ATOM 0 HB2 MET A 131 -19.722 2.388 -0.034 1.00 0.62 H new ATOM 0 HB3 MET A 131 -18.085 1.897 0.354 1.00 0.62 H new ATOM 0 HG2 MET A 131 -18.164 2.832 2.525 1.00 0.77 H new ATOM 0 HG3 MET A 131 -19.367 4.027 2.085 1.00 0.77 H new ATOM 0 HE1 MET A 131 -19.945 -0.046 3.901 1.00 0.86 H new ATOM 0 HE2 MET A 131 -18.814 0.062 2.532 1.00 0.86 H new ATOM 0 HE3 MET A 131 -18.598 1.116 3.950 1.00 0.86 H new ATOM 2187 N GLU A 132 -16.782 4.585 -2.063 1.00 0.62 N ATOM 2188 CA GLU A 132 -15.886 4.303 -3.222 1.00 0.59 C ATOM 2189 C GLU A 132 -14.682 5.254 -3.186 1.00 0.57 C ATOM 2190 O GLU A 132 -14.816 6.457 -3.092 1.00 0.69 O ATOM 2191 CB GLU A 132 -16.715 4.434 -4.538 1.00 0.74 C ATOM 2192 CG GLU A 132 -15.966 5.199 -5.641 1.00 0.84 C ATOM 2193 CD GLU A 132 -16.039 6.705 -5.374 1.00 1.28 C ATOM 2194 OE1 GLU A 132 -17.142 7.211 -5.248 1.00 1.94 O ATOM 2195 OE2 GLU A 132 -14.992 7.326 -5.302 1.00 1.79 O ATOM 0 H GLU A 132 -16.906 5.574 -1.845 1.00 0.62 H new ATOM 0 HA GLU A 132 -15.491 3.288 -3.173 1.00 0.59 H new ATOM 0 HB2 GLU A 132 -16.970 3.439 -4.902 1.00 0.74 H new ATOM 0 HB3 GLU A 132 -17.653 4.944 -4.321 1.00 0.74 H new ATOM 0 HG2 GLU A 132 -14.925 4.877 -5.676 1.00 0.84 H new ATOM 0 HG3 GLU A 132 -16.403 4.972 -6.614 1.00 0.84 H new ATOM 2202 N GLY A 133 -13.500 4.697 -3.284 1.00 0.47 N ATOM 2203 CA GLY A 133 -12.254 5.521 -3.289 1.00 0.51 C ATOM 2204 C GLY A 133 -11.752 5.590 -4.730 1.00 0.54 C ATOM 2205 O GLY A 133 -11.732 4.593 -5.424 1.00 0.55 O ATOM 0 H GLY A 133 -13.345 3.692 -3.362 1.00 0.47 H new ATOM 0 HA2 GLY A 133 -12.455 6.521 -2.905 1.00 0.51 H new ATOM 0 HA3 GLY A 133 -11.498 5.077 -2.641 1.00 0.51 H new ATOM 2209 N THR A 134 -11.368 6.754 -5.198 1.00 0.60 N ATOM 2210 CA THR A 134 -10.894 6.884 -6.617 1.00 0.67 C ATOM 2211 C THR A 134 -9.415 7.266 -6.672 1.00 0.67 C ATOM 2212 O THR A 134 -8.985 8.232 -6.072 1.00 0.68 O ATOM 2213 CB THR A 134 -11.720 7.962 -7.323 1.00 0.76 C ATOM 2214 OG1 THR A 134 -13.066 7.524 -7.437 1.00 0.78 O ATOM 2215 CG2 THR A 134 -11.148 8.229 -8.719 1.00 0.84 C ATOM 0 H THR A 134 -11.362 7.621 -4.660 1.00 0.60 H new ATOM 0 HA THR A 134 -11.019 5.922 -7.114 1.00 0.67 H new ATOM 0 HB THR A 134 -11.682 8.883 -6.741 1.00 0.76 H new ATOM 0 HG1 THR A 134 -13.495 7.554 -6.557 1.00 0.78 H new ATOM 0 HG21 THR A 134 -11.742 8.997 -9.215 1.00 0.84 H new ATOM 0 HG22 THR A 134 -10.116 8.569 -8.631 1.00 0.84 H new ATOM 0 HG23 THR A 134 -11.179 7.311 -9.306 1.00 0.84 H new ATOM 2223 N TYR A 135 -8.642 6.530 -7.428 1.00 0.70 N ATOM 2224 CA TYR A 135 -7.199 6.867 -7.570 1.00 0.75 C ATOM 2225 C TYR A 135 -7.114 8.030 -8.564 1.00 0.83 C ATOM 2226 O TYR A 135 -7.055 7.833 -9.761 1.00 0.94 O ATOM 2227 CB TYR A 135 -6.440 5.631 -8.102 1.00 0.81 C ATOM 2228 CG TYR A 135 -5.052 5.562 -7.501 1.00 0.81 C ATOM 2229 CD1 TYR A 135 -4.900 5.276 -6.142 1.00 1.40 C ATOM 2230 CD2 TYR A 135 -3.923 5.772 -8.303 1.00 1.37 C ATOM 2231 CE1 TYR A 135 -3.619 5.199 -5.580 1.00 1.44 C ATOM 2232 CE2 TYR A 135 -2.643 5.697 -7.741 1.00 1.38 C ATOM 2233 CZ TYR A 135 -2.491 5.410 -6.380 1.00 0.88 C ATOM 2234 OH TYR A 135 -1.230 5.333 -5.827 1.00 0.95 O ATOM 0 H TYR A 135 -8.950 5.711 -7.952 1.00 0.70 H new ATOM 0 HA TYR A 135 -6.751 7.151 -6.618 1.00 0.75 H new ATOM 0 HB2 TYR A 135 -6.994 4.724 -7.858 1.00 0.81 H new ATOM 0 HB3 TYR A 135 -6.370 5.680 -9.189 1.00 0.81 H new ATOM 0 HD1 TYR A 135 -5.771 5.114 -5.524 1.00 1.40 H new ATOM 0 HD2 TYR A 135 -4.040 5.992 -9.354 1.00 1.37 H new ATOM 0 HE1 TYR A 135 -3.502 4.977 -4.530 1.00 1.44 H new ATOM 0 HE2 TYR A 135 -1.772 5.861 -8.358 1.00 1.38 H new ATOM 0 HH TYR A 135 -0.572 5.168 -6.534 1.00 0.95 H new ATOM 2244 N THR A 136 -7.169 9.242 -8.082 1.00 0.82 N ATOM 2245 CA THR A 136 -7.158 10.413 -9.009 1.00 0.91 C ATOM 2246 C THR A 136 -5.722 10.804 -9.395 1.00 0.96 C ATOM 2247 O THR A 136 -5.523 11.601 -10.290 1.00 1.03 O ATOM 2248 CB THR A 136 -7.881 11.614 -8.343 1.00 0.90 C ATOM 2249 OG1 THR A 136 -6.946 12.651 -8.075 1.00 0.96 O ATOM 2250 CG2 THR A 136 -8.547 11.185 -7.026 1.00 0.82 C ATOM 0 H THR A 136 -7.221 9.473 -7.090 1.00 0.82 H new ATOM 0 HA THR A 136 -7.685 10.134 -9.922 1.00 0.91 H new ATOM 0 HB THR A 136 -8.648 11.974 -9.028 1.00 0.90 H new ATOM 0 HG1 THR A 136 -7.407 13.407 -7.656 1.00 0.96 H new ATOM 0 HG21 THR A 136 -9.048 12.042 -6.576 1.00 0.82 H new ATOM 0 HG22 THR A 136 -9.278 10.401 -7.226 1.00 0.82 H new ATOM 0 HG23 THR A 136 -7.788 10.807 -6.341 1.00 0.82 H new ATOM 2258 N ARG A 137 -4.720 10.264 -8.749 1.00 0.96 N ATOM 2259 CA ARG A 137 -3.324 10.647 -9.129 1.00 1.04 C ATOM 2260 C ARG A 137 -2.302 9.724 -8.447 1.00 1.01 C ATOM 2261 O ARG A 137 -2.643 8.891 -7.631 1.00 1.00 O ATOM 2262 CB ARG A 137 -3.071 12.103 -8.706 1.00 1.06 C ATOM 2263 CG ARG A 137 -1.687 12.564 -9.191 1.00 1.38 C ATOM 2264 CD ARG A 137 -1.655 14.094 -9.292 1.00 1.68 C ATOM 2265 NE ARG A 137 -0.241 14.559 -9.365 1.00 2.38 N ATOM 2266 CZ ARG A 137 0.026 15.776 -9.753 1.00 2.78 C ATOM 2267 NH1 ARG A 137 -0.946 16.585 -10.078 1.00 2.77 N ATOM 2268 NH2 ARG A 137 1.263 16.185 -9.815 1.00 3.73 N ATOM 0 H ARG A 137 -4.803 9.588 -7.990 1.00 0.96 H new ATOM 0 HA ARG A 137 -3.210 10.546 -10.208 1.00 1.04 H new ATOM 0 HB2 ARG A 137 -3.844 12.750 -9.121 1.00 1.06 H new ATOM 0 HB3 ARG A 137 -3.132 12.190 -7.621 1.00 1.06 H new ATOM 0 HG2 ARG A 137 -0.917 12.220 -8.501 1.00 1.38 H new ATOM 0 HG3 ARG A 137 -1.466 12.122 -10.162 1.00 1.38 H new ATOM 0 HD2 ARG A 137 -2.203 14.422 -10.175 1.00 1.68 H new ATOM 0 HD3 ARG A 137 -2.150 14.536 -8.428 1.00 1.68 H new ATOM 0 HE ARG A 137 0.518 13.926 -9.112 1.00 2.38 H new ATOM 0 HH11 ARG A 137 -1.913 16.266 -10.029 1.00 2.77 H new ATOM 0 HH12 ARG A 137 -0.738 17.536 -10.381 1.00 2.77 H new ATOM 0 HH21 ARG A 137 2.022 15.553 -9.560 1.00 3.73 H new ATOM 0 HH22 ARG A 137 1.471 17.136 -10.118 1.00 3.73 H new ATOM 2282 N LEU A 138 -1.045 9.877 -8.787 1.00 1.04 N ATOM 2283 CA LEU A 138 0.025 9.029 -8.176 1.00 1.06 C ATOM 2284 C LEU A 138 0.557 9.730 -6.912 1.00 1.13 C ATOM 2285 O LEU A 138 0.440 10.932 -6.778 1.00 1.18 O ATOM 2286 CB LEU A 138 1.167 8.857 -9.197 1.00 1.11 C ATOM 2287 CG LEU A 138 0.907 7.625 -10.089 1.00 1.10 C ATOM 2288 CD1 LEU A 138 1.660 7.779 -11.407 1.00 1.08 C ATOM 2289 CD2 LEU A 138 1.390 6.345 -9.391 1.00 1.17 C ATOM 0 H LEU A 138 -0.712 10.560 -9.468 1.00 1.04 H new ATOM 0 HA LEU A 138 -0.374 8.051 -7.907 1.00 1.06 H new ATOM 0 HB2 LEU A 138 1.249 9.751 -9.815 1.00 1.11 H new ATOM 0 HB3 LEU A 138 2.117 8.742 -8.675 1.00 1.11 H new ATOM 0 HG LEU A 138 -0.165 7.553 -10.274 1.00 1.10 H new ATOM 0 HD11 LEU A 138 1.475 6.908 -12.036 1.00 1.08 H new ATOM 0 HD12 LEU A 138 1.315 8.677 -11.920 1.00 1.08 H new ATOM 0 HD13 LEU A 138 2.728 7.863 -11.208 1.00 1.08 H new ATOM 0 HD21 LEU A 138 1.199 5.486 -10.034 1.00 1.17 H new ATOM 0 HD22 LEU A 138 2.459 6.420 -9.193 1.00 1.17 H new ATOM 0 HD23 LEU A 138 0.855 6.220 -8.450 1.00 1.17 H new ATOM 2301 N PRO A 139 1.147 8.995 -5.996 1.00 1.18 N ATOM 2302 CA PRO A 139 1.709 9.578 -4.740 1.00 1.30 C ATOM 2303 C PRO A 139 3.093 10.205 -4.960 1.00 1.23 C ATOM 2304 O PRO A 139 3.740 9.964 -5.961 1.00 1.30 O ATOM 2305 CB PRO A 139 1.815 8.363 -3.815 1.00 1.39 C ATOM 2306 CG PRO A 139 2.094 7.220 -4.736 1.00 1.25 C ATOM 2307 CD PRO A 139 1.346 7.531 -6.041 1.00 1.16 C ATOM 0 HA PRO A 139 1.091 10.384 -4.345 1.00 1.30 H new ATOM 0 HB2 PRO A 139 2.613 8.488 -3.084 1.00 1.39 H new ATOM 0 HB3 PRO A 139 0.892 8.207 -3.256 1.00 1.39 H new ATOM 0 HG2 PRO A 139 3.164 7.117 -4.916 1.00 1.25 H new ATOM 0 HG3 PRO A 139 1.751 6.280 -4.305 1.00 1.25 H new ATOM 0 HD2 PRO A 139 1.926 7.233 -6.915 1.00 1.16 H new ATOM 0 HD3 PRO A 139 0.396 7.000 -6.093 1.00 1.16 H new ATOM 2315 N GLU A 140 3.550 10.998 -4.021 1.00 1.23 N ATOM 2316 CA GLU A 140 4.898 11.643 -4.145 1.00 1.28 C ATOM 2317 C GLU A 140 5.687 11.397 -2.856 1.00 1.27 C ATOM 2318 O GLU A 140 5.183 10.830 -1.908 1.00 1.14 O ATOM 2319 CB GLU A 140 4.732 13.155 -4.376 1.00 1.44 C ATOM 2320 CG GLU A 140 3.436 13.416 -5.147 1.00 1.52 C ATOM 2321 CD GLU A 140 3.423 14.861 -5.651 1.00 2.22 C ATOM 2322 OE1 GLU A 140 3.015 15.727 -4.895 1.00 2.75 O ATOM 2323 OE2 GLU A 140 3.822 15.076 -6.783 1.00 2.80 O ATOM 0 H GLU A 140 3.043 11.229 -3.166 1.00 1.23 H new ATOM 0 HA GLU A 140 5.435 11.215 -4.991 1.00 1.28 H new ATOM 0 HB2 GLU A 140 4.711 13.679 -3.421 1.00 1.44 H new ATOM 0 HB3 GLU A 140 5.584 13.544 -4.934 1.00 1.44 H new ATOM 0 HG2 GLU A 140 3.355 12.726 -5.987 1.00 1.52 H new ATOM 0 HG3 GLU A 140 2.575 13.237 -4.503 1.00 1.52 H new ATOM 2330 N ARG A 141 6.920 11.811 -2.817 1.00 1.50 N ATOM 2331 CA ARG A 141 7.744 11.592 -1.593 1.00 1.62 C ATOM 2332 C ARG A 141 7.180 12.420 -0.433 1.00 1.82 C ATOM 2333 O ARG A 141 7.351 12.084 0.722 1.00 1.88 O ATOM 2334 CB ARG A 141 9.194 12.017 -1.878 1.00 1.91 C ATOM 2335 CG ARG A 141 10.154 11.312 -0.902 1.00 2.24 C ATOM 2336 CD ARG A 141 10.448 9.870 -1.378 1.00 2.57 C ATOM 2337 NE ARG A 141 10.378 8.921 -0.221 1.00 3.39 N ATOM 2338 CZ ARG A 141 10.970 9.186 0.915 1.00 4.11 C ATOM 2339 NH1 ARG A 141 11.726 10.241 1.039 1.00 4.27 N ATOM 2340 NH2 ARG A 141 10.829 8.369 1.923 1.00 5.03 N ATOM 0 H ARG A 141 7.396 12.293 -3.580 1.00 1.50 H new ATOM 0 HA ARG A 141 7.719 10.537 -1.320 1.00 1.62 H new ATOM 0 HB2 ARG A 141 9.459 11.767 -2.905 1.00 1.91 H new ATOM 0 HB3 ARG A 141 9.291 13.098 -1.778 1.00 1.91 H new ATOM 0 HG2 ARG A 141 11.085 11.874 -0.829 1.00 2.24 H new ATOM 0 HG3 ARG A 141 9.716 11.290 0.096 1.00 2.24 H new ATOM 0 HD2 ARG A 141 9.728 9.577 -2.142 1.00 2.57 H new ATOM 0 HD3 ARG A 141 11.436 9.824 -1.836 1.00 2.57 H new ATOM 0 HE ARG A 141 9.858 8.050 -0.321 1.00 3.39 H new ATOM 0 HH11 ARG A 141 11.860 10.868 0.246 1.00 4.27 H new ATOM 0 HH12 ARG A 141 12.183 10.439 1.929 1.00 4.27 H new ATOM 0 HH21 ARG A 141 10.259 7.529 1.823 1.00 5.03 H new ATOM 0 HH22 ARG A 141 11.288 8.571 2.811 1.00 5.03 H new ATOM 2354 N SER A 142 6.516 13.502 -0.732 1.00 2.02 N ATOM 2355 CA SER A 142 5.949 14.354 0.352 1.00 2.34 C ATOM 2356 C SER A 142 5.021 13.520 1.240 1.00 2.30 C ATOM 2357 O SER A 142 5.084 13.587 2.452 1.00 2.62 O ATOM 2358 CB SER A 142 5.158 15.506 -0.268 1.00 2.60 C ATOM 2359 OG SER A 142 3.948 15.002 -0.818 1.00 2.51 O ATOM 0 H SER A 142 6.341 13.834 -1.681 1.00 2.02 H new ATOM 0 HA SER A 142 6.763 14.751 0.958 1.00 2.34 H new ATOM 0 HB2 SER A 142 4.941 16.261 0.487 1.00 2.60 H new ATOM 0 HB3 SER A 142 5.749 15.992 -1.044 1.00 2.60 H new ATOM 0 HG SER A 142 3.437 15.738 -1.215 1.00 2.51 H new ATOM 2365 N GLU A 143 4.157 12.740 0.651 1.00 2.07 N ATOM 2366 CA GLU A 143 3.224 11.912 1.469 1.00 2.17 C ATOM 2367 C GLU A 143 3.960 10.679 2.001 1.00 1.96 C ATOM 2368 O GLU A 143 3.994 10.431 3.190 1.00 2.39 O ATOM 2369 CB GLU A 143 2.044 11.469 0.602 1.00 2.18 C ATOM 2370 CG GLU A 143 1.416 12.692 -0.070 1.00 2.76 C ATOM 2371 CD GLU A 143 0.856 13.631 0.999 1.00 3.26 C ATOM 2372 OE1 GLU A 143 -0.247 13.383 1.459 1.00 3.48 O ATOM 2373 OE2 GLU A 143 1.538 14.584 1.339 1.00 3.88 O ATOM 0 H GLU A 143 4.056 12.640 -0.359 1.00 2.07 H new ATOM 0 HA GLU A 143 2.858 12.502 2.309 1.00 2.17 H new ATOM 0 HB2 GLU A 143 2.381 10.759 -0.153 1.00 2.18 H new ATOM 0 HB3 GLU A 143 1.302 10.956 1.214 1.00 2.18 H new ATOM 0 HG2 GLU A 143 2.161 13.212 -0.672 1.00 2.76 H new ATOM 0 HG3 GLU A 143 0.621 12.380 -0.747 1.00 2.76 H new ATOM 2380 N LEU A 144 4.547 9.903 1.131 1.00 1.52 N ATOM 2381 CA LEU A 144 5.279 8.685 1.588 1.00 1.32 C ATOM 2382 C LEU A 144 6.207 9.058 2.757 1.00 1.46 C ATOM 2383 O LEU A 144 6.681 10.174 2.833 1.00 1.70 O ATOM 2384 CB LEU A 144 6.110 8.137 0.424 1.00 1.25 C ATOM 2385 CG LEU A 144 5.195 7.824 -0.768 1.00 1.20 C ATOM 2386 CD1 LEU A 144 6.050 7.368 -1.954 1.00 1.27 C ATOM 2387 CD2 LEU A 144 4.198 6.712 -0.392 1.00 1.01 C ATOM 0 H LEU A 144 4.552 10.059 0.123 1.00 1.52 H new ATOM 0 HA LEU A 144 4.570 7.927 1.920 1.00 1.32 H new ATOM 0 HB2 LEU A 144 6.867 8.865 0.132 1.00 1.25 H new ATOM 0 HB3 LEU A 144 6.638 7.236 0.735 1.00 1.25 H new ATOM 0 HG LEU A 144 4.638 8.721 -1.039 1.00 1.20 H new ATOM 0 HD11 LEU A 144 5.404 7.144 -2.803 1.00 1.27 H new ATOM 0 HD12 LEU A 144 6.747 8.161 -2.226 1.00 1.27 H new ATOM 0 HD13 LEU A 144 6.608 6.474 -1.677 1.00 1.27 H new ATOM 0 HD21 LEU A 144 3.554 6.498 -1.245 1.00 1.01 H new ATOM 0 HD22 LEU A 144 4.745 5.811 -0.115 1.00 1.01 H new ATOM 0 HD23 LEU A 144 3.588 7.039 0.450 1.00 1.01 H new ATOM 2399 N PRO A 145 6.466 8.141 3.665 1.00 1.41 N ATOM 2400 CA PRO A 145 7.348 8.396 4.837 1.00 1.65 C ATOM 2401 C PRO A 145 8.504 9.354 4.523 1.00 1.82 C ATOM 2402 O PRO A 145 9.244 9.164 3.579 1.00 1.74 O ATOM 2403 CB PRO A 145 7.868 7.002 5.174 1.00 1.57 C ATOM 2404 CG PRO A 145 6.727 6.088 4.844 1.00 1.38 C ATOM 2405 CD PRO A 145 5.954 6.754 3.688 1.00 1.21 C ATOM 0 HA PRO A 145 6.816 8.884 5.654 1.00 1.65 H new ATOM 0 HB2 PRO A 145 8.755 6.757 4.590 1.00 1.57 H new ATOM 0 HB3 PRO A 145 8.147 6.925 6.225 1.00 1.57 H new ATOM 0 HG2 PRO A 145 7.091 5.103 4.551 1.00 1.38 H new ATOM 0 HG3 PRO A 145 6.082 5.944 5.711 1.00 1.38 H new ATOM 0 HD2 PRO A 145 6.137 6.246 2.741 1.00 1.21 H new ATOM 0 HD3 PRO A 145 4.878 6.729 3.861 1.00 1.21 H new ATOM 2413 N ALA A 146 8.664 10.381 5.316 1.00 2.33 N ATOM 2414 CA ALA A 146 9.772 11.349 5.073 1.00 2.58 C ATOM 2415 C ALA A 146 11.111 10.652 5.313 1.00 1.89 C ATOM 2416 O ALA A 146 12.109 10.971 4.697 1.00 2.36 O ATOM 2417 CB ALA A 146 9.634 12.535 6.030 1.00 3.11 C ATOM 0 H ALA A 146 8.075 10.591 6.122 1.00 2.33 H new ATOM 0 HA ALA A 146 9.725 11.708 4.045 1.00 2.58 H new ATOM 0 HB1 ALA A 146 10.444 13.242 5.852 1.00 3.11 H new ATOM 0 HB2 ALA A 146 8.677 13.029 5.861 1.00 3.11 H new ATOM 0 HB3 ALA A 146 9.682 12.180 7.059 1.00 3.11 H new ATOM 2423 N GLU A 147 11.137 9.692 6.196 1.00 1.23 N ATOM 2424 CA GLU A 147 12.409 8.963 6.465 1.00 1.16 C ATOM 2425 C GLU A 147 12.711 8.080 5.249 1.00 1.09 C ATOM 2426 O GLU A 147 12.381 8.426 4.134 1.00 1.83 O ATOM 2427 CB GLU A 147 12.266 8.099 7.746 1.00 1.57 C ATOM 2428 CG GLU A 147 11.100 8.610 8.598 1.00 1.77 C ATOM 2429 CD GLU A 147 11.234 8.085 10.030 1.00 2.24 C ATOM 2430 OE1 GLU A 147 11.479 6.900 10.185 1.00 2.50 O ATOM 2431 OE2 GLU A 147 11.089 8.878 10.946 1.00 2.89 O ATOM 0 H GLU A 147 10.334 9.381 6.742 1.00 1.23 H new ATOM 0 HA GLU A 147 13.226 9.666 6.627 1.00 1.16 H new ATOM 0 HB2 GLU A 147 12.099 7.057 7.474 1.00 1.57 H new ATOM 0 HB3 GLU A 147 13.190 8.134 8.323 1.00 1.57 H new ATOM 0 HG2 GLU A 147 11.090 9.700 8.600 1.00 1.77 H new ATOM 0 HG3 GLU A 147 10.153 8.283 8.168 1.00 1.77 H new ATOM 2438 N ILE A 148 13.283 6.925 5.462 1.00 0.98 N ATOM 2439 CA ILE A 148 13.563 5.986 4.337 1.00 0.80 C ATOM 2440 C ILE A 148 14.380 6.664 3.225 1.00 0.83 C ATOM 2441 O ILE A 148 14.012 7.696 2.703 1.00 1.07 O ATOM 2442 CB ILE A 148 12.229 5.480 3.760 1.00 0.79 C ATOM 2443 CG1 ILE A 148 11.215 5.260 4.895 1.00 0.84 C ATOM 2444 CG2 ILE A 148 12.453 4.159 3.020 1.00 0.79 C ATOM 2445 CD1 ILE A 148 11.829 4.390 5.998 1.00 0.83 C ATOM 0 H ILE A 148 13.572 6.588 6.380 1.00 0.98 H new ATOM 0 HA ILE A 148 14.150 5.153 4.723 1.00 0.80 H new ATOM 0 HB ILE A 148 11.840 6.226 3.067 1.00 0.79 H new ATOM 0 HG12 ILE A 148 10.909 6.221 5.309 1.00 0.84 H new ATOM 0 HG13 ILE A 148 10.318 4.781 4.502 1.00 0.84 H new ATOM 0 HG21 ILE A 148 11.506 3.805 2.613 1.00 0.79 H new ATOM 0 HG22 ILE A 148 13.162 4.313 2.207 1.00 0.79 H new ATOM 0 HG23 ILE A 148 12.851 3.417 3.712 1.00 0.79 H new ATOM 0 HD11 ILE A 148 11.099 4.243 6.794 1.00 0.83 H new ATOM 0 HD12 ILE A 148 12.113 3.423 5.583 1.00 0.83 H new ATOM 0 HD13 ILE A 148 12.712 4.885 6.402 1.00 0.83 H new ATOM 2457 N ASN A 149 15.473 6.054 2.832 1.00 0.79 N ATOM 2458 CA ASN A 149 16.314 6.613 1.723 1.00 0.92 C ATOM 2459 C ASN A 149 16.191 5.660 0.529 1.00 1.09 C ATOM 2460 O ASN A 149 16.290 6.056 -0.615 1.00 2.09 O ATOM 2461 CB ASN A 149 17.788 6.718 2.184 1.00 0.94 C ATOM 2462 CG ASN A 149 18.441 7.974 1.591 1.00 1.09 C ATOM 2463 OD1 ASN A 149 19.058 7.916 0.546 1.00 1.70 O ATOM 2464 ND2 ASN A 149 18.330 9.111 2.221 1.00 1.26 N ATOM 0 H ASN A 149 15.822 5.185 3.235 1.00 0.79 H new ATOM 0 HA ASN A 149 15.978 7.612 1.445 1.00 0.92 H new ATOM 0 HB2 ASN A 149 17.834 6.755 3.272 1.00 0.94 H new ATOM 0 HB3 ASN A 149 18.339 5.831 1.871 1.00 0.94 H new ATOM 0 HD21 ASN A 149 18.761 9.951 1.836 1.00 1.26 H new ATOM 0 HD22 ASN A 149 17.812 9.159 3.098 1.00 1.26 H new ATOM 2471 N GLU A 150 15.952 4.403 0.802 1.00 0.74 N ATOM 2472 CA GLU A 150 15.793 3.406 -0.294 1.00 0.77 C ATOM 2473 C GLU A 150 17.148 3.137 -0.962 1.00 0.80 C ATOM 2474 O GLU A 150 17.372 2.085 -1.524 1.00 0.83 O ATOM 2475 CB GLU A 150 14.790 3.957 -1.329 1.00 1.05 C ATOM 2476 CG GLU A 150 13.993 2.814 -1.973 1.00 1.14 C ATOM 2477 CD GLU A 150 14.942 1.706 -2.431 1.00 1.90 C ATOM 2478 OE1 GLU A 150 15.259 0.855 -1.619 1.00 2.37 O ATOM 2479 OE2 GLU A 150 15.332 1.726 -3.586 1.00 2.60 O ATOM 0 H GLU A 150 15.860 4.024 1.744 1.00 0.74 H new ATOM 0 HA GLU A 150 15.418 2.468 0.115 1.00 0.77 H new ATOM 0 HB2 GLU A 150 14.107 4.656 -0.845 1.00 1.05 H new ATOM 0 HB3 GLU A 150 15.323 4.514 -2.099 1.00 1.05 H new ATOM 0 HG2 GLU A 150 13.273 2.415 -1.259 1.00 1.14 H new ATOM 0 HG3 GLU A 150 13.424 3.191 -2.823 1.00 1.14 H new ATOM 2486 N ALA A 151 18.047 4.078 -0.909 1.00 0.86 N ATOM 2487 CA ALA A 151 19.375 3.881 -1.549 1.00 0.96 C ATOM 2488 C ALA A 151 20.160 2.788 -0.823 1.00 0.97 C ATOM 2489 O ALA A 151 20.651 1.858 -1.430 1.00 1.09 O ATOM 2490 CB ALA A 151 20.164 5.184 -1.487 1.00 1.03 C ATOM 0 H ALA A 151 17.918 4.979 -0.448 1.00 0.86 H new ATOM 0 HA ALA A 151 19.224 3.582 -2.586 1.00 0.96 H new ATOM 0 HB1 ALA A 151 21.138 5.042 -1.955 1.00 1.03 H new ATOM 0 HB2 ALA A 151 19.618 5.966 -2.015 1.00 1.03 H new ATOM 0 HB3 ALA A 151 20.301 5.477 -0.446 1.00 1.03 H new ATOM 2496 N LEU A 152 20.300 2.899 0.471 1.00 0.91 N ATOM 2497 CA LEU A 152 21.074 1.868 1.226 1.00 0.96 C ATOM 2498 C LEU A 152 20.604 0.475 0.786 1.00 1.00 C ATOM 2499 O LEU A 152 21.332 -0.494 0.868 1.00 1.27 O ATOM 2500 CB LEU A 152 20.867 2.034 2.752 1.00 0.93 C ATOM 2501 CG LEU A 152 20.326 3.441 3.097 1.00 1.02 C ATOM 2502 CD1 LEU A 152 18.791 3.457 3.015 1.00 1.03 C ATOM 2503 CD2 LEU A 152 20.749 3.824 4.522 1.00 1.05 C ATOM 0 H LEU A 152 19.914 3.655 1.037 1.00 0.91 H new ATOM 0 HA LEU A 152 22.136 1.990 1.012 1.00 0.96 H new ATOM 0 HB2 LEU A 152 20.170 1.276 3.111 1.00 0.93 H new ATOM 0 HB3 LEU A 152 21.812 1.869 3.269 1.00 0.93 H new ATOM 0 HG LEU A 152 20.735 4.154 2.382 1.00 1.02 H new ATOM 0 HD11 LEU A 152 18.424 4.454 3.260 1.00 1.03 H new ATOM 0 HD12 LEU A 152 18.478 3.193 2.005 1.00 1.03 H new ATOM 0 HD13 LEU A 152 18.381 2.735 3.722 1.00 1.03 H new ATOM 0 HD21 LEU A 152 20.366 4.816 4.761 1.00 1.05 H new ATOM 0 HD22 LEU A 152 20.345 3.099 5.229 1.00 1.05 H new ATOM 0 HD23 LEU A 152 21.837 3.829 4.590 1.00 1.05 H new ATOM 2515 N ILE A 153 19.387 0.375 0.316 1.00 0.81 N ATOM 2516 CA ILE A 153 18.861 -0.947 -0.135 1.00 0.85 C ATOM 2517 C ILE A 153 19.192 -1.130 -1.622 1.00 0.89 C ATOM 2518 O ILE A 153 19.425 -2.227 -2.087 1.00 1.04 O ATOM 2519 CB ILE A 153 17.332 -1.009 0.082 1.00 0.78 C ATOM 2520 CG1 ILE A 153 16.935 -0.103 1.254 1.00 0.77 C ATOM 2521 CG2 ILE A 153 16.912 -2.450 0.399 1.00 0.87 C ATOM 2522 CD1 ILE A 153 15.429 -0.217 1.499 1.00 0.72 C ATOM 0 H ILE A 153 18.734 1.154 0.225 1.00 0.81 H new ATOM 0 HA ILE A 153 19.324 -1.746 0.444 1.00 0.85 H new ATOM 0 HB ILE A 153 16.833 -0.672 -0.826 1.00 0.78 H new ATOM 0 HG12 ILE A 153 17.483 -0.390 2.151 1.00 0.77 H new ATOM 0 HG13 ILE A 153 17.201 0.931 1.035 1.00 0.77 H new ATOM 0 HG21 ILE A 153 15.833 -2.489 0.551 1.00 0.87 H new ATOM 0 HG22 ILE A 153 17.185 -3.100 -0.432 1.00 0.87 H new ATOM 0 HG23 ILE A 153 17.419 -2.786 1.304 1.00 0.87 H new ATOM 0 HD11 ILE A 153 15.146 0.427 2.332 1.00 0.72 H new ATOM 0 HD12 ILE A 153 14.890 0.091 0.603 1.00 0.72 H new ATOM 0 HD13 ILE A 153 15.176 -1.250 1.737 1.00 0.72 H new ATOM 2534 N VAL A 154 19.220 -0.060 -2.368 1.00 0.84 N ATOM 2535 CA VAL A 154 19.546 -0.174 -3.816 1.00 0.92 C ATOM 2536 C VAL A 154 20.863 -0.945 -3.960 1.00 1.06 C ATOM 2537 O VAL A 154 20.925 -1.984 -4.587 1.00 1.12 O ATOM 2538 CB VAL A 154 19.681 1.239 -4.417 1.00 0.91 C ATOM 2539 CG1 VAL A 154 20.412 1.177 -5.765 1.00 1.03 C ATOM 2540 CG2 VAL A 154 18.285 1.838 -4.628 1.00 0.80 C ATOM 0 H VAL A 154 19.031 0.886 -2.037 1.00 0.84 H new ATOM 0 HA VAL A 154 18.756 -0.706 -4.346 1.00 0.92 H new ATOM 0 HB VAL A 154 20.254 1.861 -3.729 1.00 0.91 H new ATOM 0 HG11 VAL A 154 20.500 2.182 -6.178 1.00 1.03 H new ATOM 0 HG12 VAL A 154 21.407 0.756 -5.620 1.00 1.03 H new ATOM 0 HG13 VAL A 154 19.849 0.549 -6.456 1.00 1.03 H new ATOM 0 HG21 VAL A 154 18.378 2.837 -5.053 1.00 0.80 H new ATOM 0 HG22 VAL A 154 17.717 1.205 -5.310 1.00 0.80 H new ATOM 0 HG23 VAL A 154 17.766 1.898 -3.671 1.00 0.80 H new ATOM 2550 N GLU A 155 21.916 -0.434 -3.387 1.00 1.14 N ATOM 2551 CA GLU A 155 23.237 -1.120 -3.489 1.00 1.29 C ATOM 2552 C GLU A 155 23.191 -2.479 -2.779 1.00 1.34 C ATOM 2553 O GLU A 155 23.882 -3.404 -3.157 1.00 1.55 O ATOM 2554 CB GLU A 155 24.311 -0.246 -2.840 1.00 1.36 C ATOM 2555 CG GLU A 155 24.557 0.990 -3.707 1.00 1.32 C ATOM 2556 CD GLU A 155 25.694 1.818 -3.107 1.00 1.64 C ATOM 2557 OE1 GLU A 155 26.603 1.225 -2.550 1.00 2.26 O ATOM 2558 OE2 GLU A 155 25.638 3.032 -3.215 1.00 1.90 O ATOM 0 H GLU A 155 21.920 0.433 -2.850 1.00 1.14 H new ATOM 0 HA GLU A 155 23.472 -1.280 -4.541 1.00 1.29 H new ATOM 0 HB2 GLU A 155 23.995 0.055 -1.841 1.00 1.36 H new ATOM 0 HB3 GLU A 155 25.235 -0.812 -2.725 1.00 1.36 H new ATOM 0 HG2 GLU A 155 24.810 0.689 -4.724 1.00 1.32 H new ATOM 0 HG3 GLU A 155 23.649 1.590 -3.768 1.00 1.32 H new ATOM 2565 N PHE A 156 22.396 -2.612 -1.750 1.00 1.24 N ATOM 2566 CA PHE A 156 22.332 -3.918 -1.025 1.00 1.32 C ATOM 2567 C PHE A 156 22.186 -5.064 -2.028 1.00 1.47 C ATOM 2568 O PHE A 156 22.826 -6.090 -1.910 1.00 1.55 O ATOM 2569 CB PHE A 156 21.133 -3.932 -0.073 1.00 1.25 C ATOM 2570 CG PHE A 156 21.151 -5.210 0.735 1.00 1.36 C ATOM 2571 CD1 PHE A 156 22.134 -5.402 1.713 1.00 1.94 C ATOM 2572 CD2 PHE A 156 20.188 -6.202 0.507 1.00 1.80 C ATOM 2573 CE1 PHE A 156 22.154 -6.584 2.463 1.00 2.06 C ATOM 2574 CE2 PHE A 156 20.208 -7.384 1.257 1.00 1.90 C ATOM 2575 CZ PHE A 156 21.191 -7.575 2.235 1.00 1.65 C ATOM 0 H PHE A 156 21.791 -1.878 -1.381 1.00 1.24 H new ATOM 0 HA PHE A 156 23.252 -4.045 -0.454 1.00 1.32 H new ATOM 0 HB2 PHE A 156 21.171 -3.068 0.591 1.00 1.25 H new ATOM 0 HB3 PHE A 156 20.204 -3.859 -0.639 1.00 1.25 H new ATOM 0 HD1 PHE A 156 22.877 -4.638 1.889 1.00 1.94 H new ATOM 0 HD2 PHE A 156 19.430 -6.055 -0.248 1.00 1.80 H new ATOM 0 HE1 PHE A 156 22.912 -6.732 3.218 1.00 2.06 H new ATOM 0 HE2 PHE A 156 19.465 -8.148 1.081 1.00 1.90 H new ATOM 0 HZ PHE A 156 21.207 -8.487 2.814 1.00 1.65 H new ATOM 2585 N TYR A 157 21.345 -4.902 -3.014 1.00 1.56 N ATOM 2586 CA TYR A 157 21.152 -5.981 -4.022 1.00 1.74 C ATOM 2587 C TYR A 157 22.156 -5.798 -5.163 1.00 1.83 C ATOM 2588 O TYR A 157 22.028 -6.390 -6.216 1.00 2.02 O ATOM 2589 CB TYR A 157 19.727 -5.894 -4.573 1.00 1.77 C ATOM 2590 CG TYR A 157 18.755 -6.455 -3.561 1.00 1.65 C ATOM 2591 CD1 TYR A 157 18.564 -7.839 -3.468 1.00 2.02 C ATOM 2592 CD2 TYR A 157 18.048 -5.593 -2.715 1.00 2.08 C ATOM 2593 CE1 TYR A 157 17.665 -8.360 -2.530 1.00 2.08 C ATOM 2594 CE2 TYR A 157 17.149 -6.114 -1.776 1.00 2.23 C ATOM 2595 CZ TYR A 157 16.958 -7.498 -1.684 1.00 1.92 C ATOM 2596 OH TYR A 157 16.072 -8.011 -0.758 1.00 2.22 O ATOM 0 H TYR A 157 20.782 -4.065 -3.164 1.00 1.56 H new ATOM 0 HA TYR A 157 21.310 -6.955 -3.559 1.00 1.74 H new ATOM 0 HB2 TYR A 157 19.476 -4.857 -4.797 1.00 1.77 H new ATOM 0 HB3 TYR A 157 19.654 -6.449 -5.508 1.00 1.77 H new ATOM 0 HD1 TYR A 157 19.110 -8.505 -4.120 1.00 2.02 H new ATOM 0 HD2 TYR A 157 18.196 -4.526 -2.786 1.00 2.08 H new ATOM 0 HE1 TYR A 157 17.517 -9.427 -2.459 1.00 2.08 H new ATOM 0 HE2 TYR A 157 16.603 -5.449 -1.123 1.00 2.23 H new ATOM 0 HH TYR A 157 15.667 -7.277 -0.251 1.00 2.22 H new ATOM 2606 N SER A 158 23.156 -4.984 -4.962 1.00 1.75 N ATOM 2607 CA SER A 158 24.166 -4.765 -6.036 1.00 1.87 C ATOM 2608 C SER A 158 25.417 -4.121 -5.437 1.00 2.00 C ATOM 2609 O SER A 158 25.762 -3.000 -5.754 1.00 2.12 O ATOM 2610 CB SER A 158 23.581 -3.843 -7.106 1.00 1.89 C ATOM 2611 OG SER A 158 24.639 -3.282 -7.872 1.00 2.42 O ATOM 0 H SER A 158 23.317 -4.461 -4.101 1.00 1.75 H new ATOM 0 HA SER A 158 24.430 -5.722 -6.486 1.00 1.87 H new ATOM 0 HB2 SER A 158 22.904 -4.401 -7.753 1.00 1.89 H new ATOM 0 HB3 SER A 158 22.995 -3.051 -6.639 1.00 1.89 H new ATOM 0 HG SER A 158 25.114 -2.614 -7.334 1.00 2.42 H new ATOM 2617 N ARG A 159 26.099 -4.820 -4.571 1.00 2.16 N ATOM 2618 CA ARG A 159 27.327 -4.246 -3.953 1.00 2.40 C ATOM 2619 C ARG A 159 28.257 -3.730 -5.054 1.00 3.28 C ATOM 2620 O ARG A 159 28.661 -2.582 -4.971 1.00 4.21 O ATOM 2621 CB ARG A 159 28.046 -5.332 -3.141 1.00 2.32 C ATOM 2622 CG ARG A 159 27.295 -5.600 -1.825 1.00 2.10 C ATOM 2623 CD ARG A 159 27.765 -4.624 -0.739 1.00 2.05 C ATOM 2624 NE ARG A 159 29.003 -5.153 -0.101 1.00 2.89 N ATOM 2625 CZ ARG A 159 29.745 -4.369 0.633 1.00 3.39 C ATOM 2626 NH1 ARG A 159 29.402 -3.122 0.807 1.00 3.38 N ATOM 2627 NH2 ARG A 159 30.830 -4.831 1.191 1.00 4.37 N ATOM 2628 OXT ARG A 159 28.550 -4.493 -5.960 1.00 3.31 O ATOM 0 H ARG A 159 25.859 -5.763 -4.265 1.00 2.16 H new ATOM 0 HA ARG A 159 27.053 -3.422 -3.294 1.00 2.40 H new ATOM 0 HB2 ARG A 159 28.109 -6.250 -3.725 1.00 2.32 H new ATOM 0 HB3 ARG A 159 29.068 -5.019 -2.927 1.00 2.32 H new ATOM 0 HG2 ARG A 159 26.222 -5.492 -1.982 1.00 2.10 H new ATOM 0 HG3 ARG A 159 27.468 -6.626 -1.501 1.00 2.10 H new ATOM 0 HD2 ARG A 159 27.957 -3.643 -1.174 1.00 2.05 H new ATOM 0 HD3 ARG A 159 26.984 -4.493 0.010 1.00 2.05 H new ATOM 0 HE ARG A 159 29.271 -6.128 -0.238 1.00 2.89 H new ATOM 0 HH11 ARG A 159 28.554 -2.760 0.370 1.00 3.38 H new ATOM 0 HH12 ARG A 159 29.981 -2.509 1.380 1.00 3.38 H new ATOM 0 HH21 ARG A 159 31.099 -5.805 1.054 1.00 4.37 H new ATOM 0 HH22 ARG A 159 31.409 -4.218 1.764 1.00 4.37 H new