USER MOD reduce.3.24.130724 H: found=0, std=0, add=1354, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1353 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 142 SER OG : rot 75:sc= 0.613 USER MOD Set 1.2: A 143 ASN : amide:sc= 0.533 K(o=1.1,f=0.028) USER MOD Set 2.1: A 44 TYR OH : rot 30:sc= 0.017 USER MOD Set 2.2: A 93 THR OG1 : rot -59:sc= 1.19 USER MOD Set 2.3: A 115 ASN : amide:sc= -1.86! C(o=-0.66!,f=-1.8!) USER MOD Set 3.1: A 20 ASN :FLIP amide:sc= -0.968 F(o=-3.4!,f=-1.6) USER MOD Set 3.2: A 23 GLN :FLIP amide:sc= 0.573 F(o=-3.4,f=-1.6) USER MOD Set 3.3: A 75 GLN :FLIP amide:sc= -1.24! F(o=-3.4,f=-1.6!) USER MOD Set 4.1: A 35 SER OG : rot 17:sc= 0.652 USER MOD Set 4.2: A 101 TYR OH : rot -39:sc= 0.952 USER MOD Set 5.1: A 30 CYS SG : rot -2:sc= -3.26! USER MOD Set 5.2: A 70 HIS :FLIP no HE2:sc= -0.0655 F(o=-9.6!,f=-3.3) USER MOD Single : A 1 MET CE :methyl 164:sc= -1.79! (180deg=-2.37!) USER MOD Single : A 1 MET N :NH3+ -170:sc= 1.29 (180deg=1.13) USER MOD Single : A 3 LYS NZ :NH3+ 179:sc= 1.34 (180deg=1.3) USER MOD Single : A 5 GLN :FLIP amide:sc= -0.494 F(o=-1.1,f=-0.49) USER MOD Single : A 7 ASN :FLIP amide:sc= -1.3 F(o=-2.7,f=-1.3) USER MOD Single : A 8 ASN :FLIP amide:sc= -1.58 F(o=-11!,f=-1.6) USER MOD Single : A 14 ASN :FLIP amide:sc= -0.886 F(o=-2.8!,f=-0.89) USER MOD Single : A 16 SER OG : rot 69:sc= 1.14 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.0519 USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot -129:sc= -2.03! USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -4.34! C(o=-4.3!,f=-7.1!) USER MOD Single : A 59 SER OG : rot 41:sc= 0.134 USER MOD Single : A 71 MET CE :methyl 167:sc= 0 (180deg=-0.333) USER MOD Single : A 80 ASN : amide:sc= -0.642 X(o=-0.64,f=-0.63) USER MOD Single : A 98 THR OG1 : rot 10:sc= 1.02 USER MOD Single : A 99 CYS SG : rot 129:sc= -12.2! USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.14 USER MOD Single : A 104 GLN : amide:sc= -2.82 X(o=-2.8,f=-3.3!) USER MOD Single : A 111 TYR OH : rot 121:sc= -2.08! USER MOD Single : A 112 TYR OH : rot 180:sc= -0.0145 USER MOD Single : A 114 ASN :FLIP amide:sc= -3.21! C(o=-5.3!,f=-3.2!) USER MOD Single : A 117 TYR OH : rot -115:sc= 0.685 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.0122 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.00171 USER MOD Single : A 125 ASN : amide:sc= 1.12 K(o=1.1,f=-0.11) USER MOD Single : A 129 LYS NZ :NH3+ -154:sc= 1.21 (180deg=1.12) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 GLN :FLIP amide:sc= -1.29 F(o=-2.6!,f=-1.3) USER MOD Single : A 138 ASN : amide:sc= -2.14 K(o=-2.1,f=-5.9!) USER MOD Single : A 147 THR OG1 : rot -0:sc= 0.574 USER MOD Single : A 150 HIS :FLIP no HD1:sc= -0.275 F(o=-1.3,f=-0.27) USER MOD Single : A 152 ASN :FLIP amide:sc= 0 F(o=-2.1,f=0) USER MOD Single : A 156 ASN :FLIP amide:sc= -0.536 F(o=-3.7!,f=-0.54) USER MOD Single : B 120 MET CE :methyl 152:sc= -0.0976 (180deg=-0.743) USER MOD Single : B 122 LYS NZ :NH3+ -164:sc= -7.13! (180deg=-8.49!) USER MOD Single : B 125 GLN :FLIP amide:sc= -4.71! C(o=-5.4!,f=-4.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.206 -1.948 -7.615 1.00 0.00 N ATOM 2 CA MET A 1 -22.580 -3.168 -7.059 1.00 0.00 C ATOM 3 C MET A 1 -21.795 -2.801 -5.815 1.00 0.00 C ATOM 4 O MET A 1 -22.258 -2.990 -4.690 1.00 0.00 O ATOM 5 CB MET A 1 -21.648 -3.807 -8.087 1.00 0.00 C ATOM 6 CG MET A 1 -21.297 -5.253 -7.776 1.00 0.00 C ATOM 7 SD MET A 1 -20.357 -5.473 -6.247 1.00 0.00 S ATOM 8 CE MET A 1 -20.576 -7.231 -5.974 1.00 0.00 C ATOM 0 H1 MET A 1 -23.879 -2.213 -8.363 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.710 -1.441 -6.859 1.00 0.00 H new ATOM 0 H3 MET A 1 -22.470 -1.331 -8.014 1.00 0.00 H new ATOM 0 HA MET A 1 -23.360 -3.886 -6.806 1.00 0.00 H new ATOM 0 HB2 MET A 1 -22.118 -3.759 -9.070 1.00 0.00 H new ATOM 0 HB3 MET A 1 -20.729 -3.223 -8.144 1.00 0.00 H new ATOM 0 HG2 MET A 1 -22.218 -5.833 -7.710 1.00 0.00 H new ATOM 0 HG3 MET A 1 -20.721 -5.662 -8.606 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.842 -7.581 -5.248 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.580 -7.418 -5.593 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.440 -7.765 -6.914 1.00 0.00 H new ATOM 18 N ALA A 2 -20.606 -2.264 -6.028 1.00 0.00 N ATOM 19 CA ALA A 2 -19.806 -1.754 -4.943 1.00 0.00 C ATOM 20 C ALA A 2 -20.316 -0.375 -4.570 1.00 0.00 C ATOM 21 O ALA A 2 -20.871 0.330 -5.410 1.00 0.00 O ATOM 22 CB ALA A 2 -18.337 -1.717 -5.336 1.00 0.00 C ATOM 0 H ALA A 2 -20.177 -2.173 -6.949 1.00 0.00 H new ATOM 0 HA ALA A 2 -19.890 -2.410 -4.077 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -17.748 -1.329 -4.505 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -18.000 -2.724 -5.581 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -18.209 -1.071 -6.204 1.00 0.00 H new ATOM 28 N LYS A 3 -20.163 0.000 -3.315 1.00 0.00 N ATOM 29 CA LYS A 3 -20.698 1.270 -2.846 1.00 0.00 C ATOM 30 C LYS A 3 -19.602 2.317 -2.787 1.00 0.00 C ATOM 31 O LYS A 3 -19.868 3.486 -2.546 1.00 0.00 O ATOM 32 CB LYS A 3 -21.348 1.108 -1.474 1.00 0.00 C ATOM 33 CG LYS A 3 -21.945 -0.260 -1.256 1.00 0.00 C ATOM 34 CD LYS A 3 -23.148 -0.503 -2.092 1.00 0.00 C ATOM 35 CE LYS A 3 -23.556 -1.963 -2.094 1.00 0.00 C ATOM 36 NZ LYS A 3 -24.809 -2.191 -2.861 1.00 0.00 N ATOM 0 H LYS A 3 -19.678 -0.548 -2.605 1.00 0.00 H new ATOM 0 HA LYS A 3 -21.460 1.601 -3.552 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -20.603 1.299 -0.702 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -22.128 1.860 -1.358 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -21.194 -1.019 -1.478 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -22.210 -0.372 -0.205 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -23.975 0.103 -1.722 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -22.949 -0.181 -3.114 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -22.754 -2.563 -2.524 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -23.693 -2.302 -1.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -25.043 -3.204 -2.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -25.585 -1.652 -2.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -24.677 -1.876 -3.843 1.00 0.00 H new ATOM 50 N VAL A 4 -18.365 1.892 -3.004 1.00 0.00 N ATOM 51 CA VAL A 4 -17.232 2.807 -3.018 1.00 0.00 C ATOM 52 C VAL A 4 -16.188 2.349 -4.023 1.00 0.00 C ATOM 53 O VAL A 4 -15.776 1.190 -4.028 1.00 0.00 O ATOM 54 CB VAL A 4 -16.580 2.944 -1.613 1.00 0.00 C ATOM 55 CG1 VAL A 4 -15.115 3.342 -1.711 1.00 0.00 C ATOM 56 CG2 VAL A 4 -17.330 3.953 -0.762 1.00 0.00 C ATOM 0 H VAL A 4 -18.120 0.916 -3.173 1.00 0.00 H new ATOM 0 HA VAL A 4 -17.614 3.785 -3.311 1.00 0.00 H new ATOM 0 HB VAL A 4 -16.638 1.965 -1.137 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -14.694 3.428 -0.709 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -14.568 2.583 -2.271 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -15.032 4.301 -2.223 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -16.854 4.030 0.215 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -17.313 4.927 -1.252 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -18.363 3.628 -0.638 1.00 0.00 H new ATOM 66 N GLN A 5 -15.790 3.267 -4.885 1.00 0.00 N ATOM 67 CA GLN A 5 -14.773 2.997 -5.875 1.00 0.00 C ATOM 68 C GLN A 5 -13.647 4.009 -5.771 1.00 0.00 C ATOM 69 O GLN A 5 -13.806 5.160 -6.169 1.00 0.00 O ATOM 70 CB GLN A 5 -15.382 3.043 -7.271 1.00 0.00 C ATOM 71 CG GLN A 5 -14.403 2.701 -8.362 1.00 0.00 C ATOM 72 CD GLN A 5 -13.905 1.279 -8.247 1.00 0.00 C ATOM 73 OE1 GLN A 5 -12.822 1.097 -7.509 1.00 0.00 O flip ATOM 74 NE2 GLN A 5 -14.483 0.351 -8.810 1.00 0.00 N flip ATOM 0 H GLN A 5 -16.163 4.216 -4.916 1.00 0.00 H new ATOM 0 HA GLN A 5 -14.366 2.002 -5.692 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -16.222 2.349 -7.316 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -15.782 4.041 -7.452 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -14.878 2.842 -9.333 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -13.557 3.387 -8.318 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -15.316 0.534 -9.370 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -14.130 -0.601 -8.717 1.00 0.00 H new ATOM 83 N VAL A 6 -12.523 3.597 -5.201 1.00 0.00 N ATOM 84 CA VAL A 6 -11.339 4.434 -5.226 1.00 0.00 C ATOM 85 C VAL A 6 -10.866 4.576 -6.649 1.00 0.00 C ATOM 86 O VAL A 6 -10.714 3.598 -7.386 1.00 0.00 O ATOM 87 CB VAL A 6 -10.222 3.912 -4.296 1.00 0.00 C ATOM 88 CG1 VAL A 6 -8.817 4.257 -4.754 1.00 0.00 C ATOM 89 CG2 VAL A 6 -10.426 4.458 -2.904 1.00 0.00 C ATOM 0 H VAL A 6 -12.409 2.703 -4.724 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.603 5.417 -4.836 1.00 0.00 H new ATOM 0 HB VAL A 6 -10.301 2.825 -4.318 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -8.094 3.853 -4.045 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -8.639 3.826 -5.739 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -8.707 5.340 -4.807 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.637 4.089 -2.249 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -10.394 5.547 -2.932 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -11.395 4.133 -2.524 1.00 0.00 H new ATOM 99 N ASN A 7 -10.672 5.814 -7.011 1.00 0.00 N ATOM 100 CA ASN A 7 -10.414 6.207 -8.378 1.00 0.00 C ATOM 101 C ASN A 7 -9.061 6.841 -8.425 1.00 0.00 C ATOM 102 O ASN A 7 -8.174 6.460 -9.188 1.00 0.00 O ATOM 103 CB ASN A 7 -11.430 7.262 -8.831 1.00 0.00 C ATOM 104 CG ASN A 7 -12.870 6.802 -8.801 1.00 0.00 C ATOM 105 OD1 ASN A 7 -13.759 7.745 -8.523 1.00 0.00 O flip ATOM 106 ND2 ASN A 7 -13.179 5.635 -9.024 1.00 0.00 N flip ATOM 0 H ASN A 7 -10.688 6.596 -6.356 1.00 0.00 H new ATOM 0 HA ASN A 7 -10.481 5.331 -9.023 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -11.330 8.141 -8.194 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -11.183 7.573 -9.846 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -12.456 4.947 -9.233 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -14.159 5.353 -9.000 1.00 0.00 H new ATOM 113 N ASN A 8 -8.936 7.827 -7.572 1.00 0.00 N ATOM 114 CA ASN A 8 -7.755 8.658 -7.530 1.00 0.00 C ATOM 115 C ASN A 8 -6.926 8.277 -6.331 1.00 0.00 C ATOM 116 O ASN A 8 -7.442 8.186 -5.227 1.00 0.00 O ATOM 117 CB ASN A 8 -8.131 10.145 -7.453 1.00 0.00 C ATOM 118 CG ASN A 8 -6.971 11.081 -7.761 1.00 0.00 C ATOM 119 OD1 ASN A 8 -5.752 10.661 -7.456 1.00 0.00 O flip ATOM 120 ND2 ASN A 8 -7.175 12.190 -8.260 1.00 0.00 N flip ATOM 0 H ASN A 8 -9.649 8.077 -6.887 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.182 8.501 -8.444 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -8.943 10.343 -8.153 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -8.510 10.365 -6.455 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -8.127 12.482 -8.483 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -6.392 12.815 -8.450 1.00 0.00 H new ATOM 127 N VAL A 9 -5.657 8.026 -6.534 1.00 0.00 N ATOM 128 CA VAL A 9 -4.762 7.887 -5.410 1.00 0.00 C ATOM 129 C VAL A 9 -3.558 8.774 -5.615 1.00 0.00 C ATOM 130 O VAL A 9 -2.653 8.426 -6.369 1.00 0.00 O ATOM 131 CB VAL A 9 -4.313 6.437 -5.219 1.00 0.00 C ATOM 132 CG1 VAL A 9 -3.869 6.206 -3.785 1.00 0.00 C ATOM 133 CG2 VAL A 9 -5.446 5.519 -5.597 1.00 0.00 C ATOM 0 H VAL A 9 -5.224 7.915 -7.451 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.299 8.188 -4.510 1.00 0.00 H new ATOM 0 HB VAL A 9 -3.459 6.226 -5.863 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.552 5.170 -3.665 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.037 6.869 -3.551 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.699 6.413 -3.109 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.135 4.483 -5.464 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.308 5.724 -4.961 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.717 5.685 -6.640 1.00 0.00 H new ATOM 143 N VAL A 10 -3.552 9.938 -4.982 1.00 0.00 N ATOM 144 CA VAL A 10 -2.418 10.825 -5.139 1.00 0.00 C ATOM 145 C VAL A 10 -1.453 10.613 -3.999 1.00 0.00 C ATOM 146 O VAL A 10 -1.675 11.054 -2.872 1.00 0.00 O ATOM 147 CB VAL A 10 -2.800 12.319 -5.271 1.00 0.00 C ATOM 148 CG1 VAL A 10 -3.200 12.646 -6.700 1.00 0.00 C ATOM 149 CG2 VAL A 10 -3.912 12.699 -4.322 1.00 0.00 C ATOM 0 H VAL A 10 -4.296 10.280 -4.374 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.944 10.567 -6.086 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.919 12.903 -5.005 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.465 13.701 -6.771 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.365 12.435 -7.369 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -4.057 12.037 -6.986 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -4.151 13.755 -4.446 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.796 12.099 -4.539 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.593 12.517 -3.296 1.00 0.00 H new ATOM 159 N VAL A 11 -0.402 9.881 -4.290 1.00 0.00 N ATOM 160 CA VAL A 11 0.584 9.565 -3.302 1.00 0.00 C ATOM 161 C VAL A 11 1.559 10.702 -3.209 1.00 0.00 C ATOM 162 O VAL A 11 2.265 11.043 -4.158 1.00 0.00 O ATOM 163 CB VAL A 11 1.356 8.280 -3.601 1.00 0.00 C ATOM 164 CG1 VAL A 11 1.986 7.737 -2.329 1.00 0.00 C ATOM 165 CG2 VAL A 11 0.459 7.244 -4.256 1.00 0.00 C ATOM 0 H VAL A 11 -0.214 9.494 -5.215 1.00 0.00 H new ATOM 0 HA VAL A 11 0.053 9.408 -2.363 1.00 0.00 H new ATOM 0 HB VAL A 11 2.154 8.513 -4.306 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.533 6.822 -2.556 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.672 8.477 -1.918 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.205 7.522 -1.599 1.00 0.00 H new ATOM 0 HG21 VAL A 11 1.034 6.340 -4.458 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -0.369 7.006 -3.589 1.00 0.00 H new ATOM 0 HG23 VAL A 11 0.068 7.641 -5.192 1.00 0.00 H new ATOM 175 N LEU A 12 1.577 11.265 -2.049 1.00 0.00 N ATOM 176 CA LEU A 12 2.361 12.423 -1.741 1.00 0.00 C ATOM 177 C LEU A 12 3.721 11.947 -1.341 1.00 0.00 C ATOM 178 O LEU A 12 4.747 12.563 -1.626 1.00 0.00 O ATOM 179 CB LEU A 12 1.684 13.099 -0.587 1.00 0.00 C ATOM 180 CG LEU A 12 0.171 12.930 -0.607 1.00 0.00 C ATOM 181 CD1 LEU A 12 -0.375 13.118 0.773 1.00 0.00 C ATOM 182 CD2 LEU A 12 -0.474 13.861 -1.620 1.00 0.00 C ATOM 0 H LEU A 12 1.029 10.924 -1.259 1.00 0.00 H new ATOM 0 HA LEU A 12 2.452 13.113 -2.580 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.077 12.695 0.346 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.926 14.162 -0.602 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.073 11.917 -0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.458 12.996 0.755 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.063 12.377 1.442 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -0.128 14.118 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.554 13.717 -1.611 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.244 14.895 -1.362 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.087 13.640 -2.615 1.00 0.00 H new ATOM 194 N ASP A 13 3.688 10.819 -0.662 1.00 0.00 N ATOM 195 CA ASP A 13 4.874 10.041 -0.390 1.00 0.00 C ATOM 196 C ASP A 13 5.330 9.321 -1.661 1.00 0.00 C ATOM 197 O ASP A 13 5.360 8.107 -1.764 1.00 0.00 O ATOM 198 CB ASP A 13 4.629 9.073 0.754 1.00 0.00 C ATOM 199 CG ASP A 13 5.800 8.158 1.027 1.00 0.00 C ATOM 200 OD1 ASP A 13 6.919 8.462 0.566 1.00 0.00 O ATOM 201 OD2 ASP A 13 5.602 7.141 1.714 1.00 0.00 O ATOM 0 H ASP A 13 2.832 10.416 -0.282 1.00 0.00 H new ATOM 0 HA ASP A 13 5.677 10.709 -0.079 1.00 0.00 H new ATOM 0 HB2 ASP A 13 4.402 9.639 1.657 1.00 0.00 H new ATOM 0 HB3 ASP A 13 3.751 8.469 0.527 1.00 0.00 H new ATOM 206 N ASN A 14 5.582 10.135 -2.649 1.00 0.00 N ATOM 207 CA ASN A 14 6.401 9.784 -3.794 1.00 0.00 C ATOM 208 C ASN A 14 7.842 9.983 -3.366 1.00 0.00 C ATOM 209 O ASN A 14 8.033 10.508 -2.276 1.00 0.00 O ATOM 210 CB ASN A 14 6.067 10.644 -5.007 1.00 0.00 C ATOM 211 CG ASN A 14 5.605 9.794 -6.165 1.00 0.00 C ATOM 212 OD1 ASN A 14 4.986 8.673 -5.845 1.00 0.00 O flip ATOM 213 ND2 ASN A 14 5.801 10.138 -7.329 1.00 0.00 N flip ATOM 0 H ASN A 14 5.218 11.087 -2.688 1.00 0.00 H new ATOM 0 HA ASN A 14 6.218 8.753 -4.097 1.00 0.00 H new ATOM 0 HB2 ASN A 14 5.289 11.361 -4.745 1.00 0.00 H new ATOM 0 HB3 ASN A 14 6.945 11.219 -5.302 1.00 0.00 H new ATOM 0 HD21 ASN A 14 6.284 11.014 -7.527 1.00 0.00 H new ATOM 0 HD22 ASN A 14 5.480 9.547 -8.096 1.00 0.00 H new ATOM 220 N PRO A 15 8.878 9.639 -4.166 1.00 0.00 N ATOM 221 CA PRO A 15 10.185 9.294 -3.608 1.00 0.00 C ATOM 222 C PRO A 15 10.694 10.317 -2.610 1.00 0.00 C ATOM 223 O PRO A 15 11.153 11.410 -2.947 1.00 0.00 O ATOM 224 CB PRO A 15 11.116 9.257 -4.825 1.00 0.00 C ATOM 225 CG PRO A 15 10.325 9.788 -5.974 1.00 0.00 C ATOM 226 CD PRO A 15 8.883 9.568 -5.631 1.00 0.00 C ATOM 0 HA PRO A 15 10.133 8.354 -3.059 1.00 0.00 H new ATOM 0 HB2 PRO A 15 12.006 9.863 -4.652 1.00 0.00 H new ATOM 0 HB3 PRO A 15 11.456 8.241 -5.024 1.00 0.00 H new ATOM 0 HG2 PRO A 15 10.530 10.847 -6.130 1.00 0.00 H new ATOM 0 HG3 PRO A 15 10.588 9.273 -6.898 1.00 0.00 H new ATOM 0 HD2 PRO A 15 8.242 10.330 -6.074 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.526 8.603 -5.990 1.00 0.00 H new ATOM 234 N SER A 16 10.558 9.912 -1.360 1.00 0.00 N ATOM 235 CA SER A 16 10.973 10.701 -0.211 1.00 0.00 C ATOM 236 C SER A 16 11.620 9.771 0.802 1.00 0.00 C ATOM 237 O SER A 16 11.601 8.554 0.600 1.00 0.00 O ATOM 238 CB SER A 16 9.773 11.414 0.427 1.00 0.00 C ATOM 239 OG SER A 16 9.035 12.143 -0.538 1.00 0.00 O ATOM 0 H SER A 16 10.150 9.011 -1.109 1.00 0.00 H new ATOM 0 HA SER A 16 11.682 11.463 -0.534 1.00 0.00 H new ATOM 0 HB2 SER A 16 9.124 10.681 0.906 1.00 0.00 H new ATOM 0 HB3 SER A 16 10.122 12.090 1.208 1.00 0.00 H new ATOM 0 HG SER A 16 8.591 11.519 -1.150 1.00 0.00 H new ATOM 245 N PRO A 17 12.241 10.312 1.866 1.00 0.00 N ATOM 246 CA PRO A 17 12.797 9.500 2.946 1.00 0.00 C ATOM 247 C PRO A 17 11.882 8.336 3.313 1.00 0.00 C ATOM 248 O PRO A 17 10.672 8.497 3.449 1.00 0.00 O ATOM 249 CB PRO A 17 12.870 10.493 4.100 1.00 0.00 C ATOM 250 CG PRO A 17 13.125 11.806 3.450 1.00 0.00 C ATOM 251 CD PRO A 17 12.437 11.755 2.112 1.00 0.00 C ATOM 0 HA PRO A 17 13.752 9.045 2.681 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.941 10.507 4.670 1.00 0.00 H new ATOM 0 HB3 PRO A 17 13.668 10.234 4.796 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.735 12.623 4.057 1.00 0.00 H new ATOM 0 HG3 PRO A 17 14.194 11.980 3.331 1.00 0.00 H new ATOM 0 HD2 PRO A 17 11.487 12.289 2.131 1.00 0.00 H new ATOM 0 HD3 PRO A 17 13.045 12.214 1.333 1.00 0.00 H new ATOM 259 N PHE A 18 12.468 7.156 3.424 1.00 0.00 N ATOM 260 CA PHE A 18 11.750 5.958 3.800 1.00 0.00 C ATOM 261 C PHE A 18 11.070 6.123 5.155 1.00 0.00 C ATOM 262 O PHE A 18 10.053 5.489 5.421 1.00 0.00 O ATOM 263 CB PHE A 18 12.706 4.762 3.809 1.00 0.00 C ATOM 264 CG PHE A 18 12.174 3.567 4.536 1.00 0.00 C ATOM 265 CD1 PHE A 18 11.174 2.783 3.988 1.00 0.00 C ATOM 266 CD2 PHE A 18 12.668 3.243 5.782 1.00 0.00 C ATOM 267 CE1 PHE A 18 10.678 1.698 4.676 1.00 0.00 C ATOM 268 CE2 PHE A 18 12.178 2.170 6.484 1.00 0.00 C ATOM 269 CZ PHE A 18 11.172 1.388 5.930 1.00 0.00 C ATOM 0 H PHE A 18 13.462 7.005 3.254 1.00 0.00 H new ATOM 0 HA PHE A 18 10.967 5.778 3.064 1.00 0.00 H new ATOM 0 HB2 PHE A 18 12.929 4.480 2.780 1.00 0.00 H new ATOM 0 HB3 PHE A 18 13.647 5.065 4.268 1.00 0.00 H new ATOM 0 HD1 PHE A 18 10.779 3.024 3.012 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.455 3.844 6.213 1.00 0.00 H new ATOM 0 HE1 PHE A 18 9.903 1.089 4.236 1.00 0.00 H new ATOM 0 HE2 PHE A 18 12.572 1.935 7.462 1.00 0.00 H new ATOM 0 HZ PHE A 18 10.778 0.543 6.475 1.00 0.00 H new ATOM 279 N TYR A 19 11.623 6.982 6.006 1.00 0.00 N ATOM 280 CA TYR A 19 11.031 7.222 7.309 1.00 0.00 C ATOM 281 C TYR A 19 9.970 8.314 7.238 1.00 0.00 C ATOM 282 O TYR A 19 9.312 8.618 8.235 1.00 0.00 O ATOM 283 CB TYR A 19 12.101 7.544 8.349 1.00 0.00 C ATOM 284 CG TYR A 19 12.894 6.324 8.767 1.00 0.00 C ATOM 285 CD1 TYR A 19 12.247 5.146 9.131 1.00 0.00 C ATOM 286 CD2 TYR A 19 14.279 6.341 8.785 1.00 0.00 C ATOM 287 CE1 TYR A 19 12.963 4.023 9.500 1.00 0.00 C ATOM 288 CE2 TYR A 19 15.000 5.220 9.152 1.00 0.00 C ATOM 289 CZ TYR A 19 14.338 4.066 9.507 1.00 0.00 C ATOM 290 OH TYR A 19 15.057 2.948 9.865 1.00 0.00 O ATOM 0 H TYR A 19 12.471 7.516 5.816 1.00 0.00 H new ATOM 0 HA TYR A 19 10.534 6.305 7.626 1.00 0.00 H new ATOM 0 HB2 TYR A 19 12.781 8.294 7.945 1.00 0.00 H new ATOM 0 HB3 TYR A 19 11.628 7.983 9.227 1.00 0.00 H new ATOM 0 HD1 TYR A 19 11.168 5.109 9.125 1.00 0.00 H new ATOM 0 HD2 TYR A 19 14.803 7.244 8.508 1.00 0.00 H new ATOM 0 HE1 TYR A 19 12.446 3.117 9.781 1.00 0.00 H new ATOM 0 HE2 TYR A 19 16.080 5.249 9.160 1.00 0.00 H new ATOM 0 HH TYR A 19 16.016 3.146 9.816 1.00 0.00 H new ATOM 300 N ASN A 20 9.806 8.903 6.060 1.00 0.00 N ATOM 301 CA ASN A 20 8.640 9.710 5.775 1.00 0.00 C ATOM 302 C ASN A 20 7.485 8.762 5.527 1.00 0.00 C ATOM 303 O ASN A 20 7.587 7.837 4.726 1.00 0.00 O ATOM 304 CB ASN A 20 8.884 10.638 4.574 1.00 0.00 C ATOM 305 CG ASN A 20 7.751 10.656 3.557 1.00 0.00 C ATOM 306 OD1 ASN A 20 7.797 9.724 2.615 1.00 0.00 O flip ATOM 307 ND2 ASN A 20 6.845 11.489 3.627 1.00 0.00 N flip ATOM 0 H ASN A 20 10.470 8.833 5.289 1.00 0.00 H new ATOM 0 HA ASN A 20 8.412 10.363 6.617 1.00 0.00 H new ATOM 0 HB2 ASN A 20 9.045 11.652 4.940 1.00 0.00 H new ATOM 0 HB3 ASN A 20 9.802 10.331 4.073 1.00 0.00 H new ATOM 0 HD21 ASN A 20 6.851 12.188 4.370 1.00 0.00 H new ATOM 0 HD22 ASN A 20 6.089 11.479 2.942 1.00 0.00 H new ATOM 314 N PRO A 21 6.404 8.949 6.261 1.00 0.00 N ATOM 315 CA PRO A 21 5.265 8.028 6.263 1.00 0.00 C ATOM 316 C PRO A 21 4.581 7.928 4.902 1.00 0.00 C ATOM 317 O PRO A 21 4.604 8.871 4.120 1.00 0.00 O ATOM 318 CB PRO A 21 4.333 8.651 7.313 1.00 0.00 C ATOM 319 CG PRO A 21 5.241 9.486 8.146 1.00 0.00 C ATOM 320 CD PRO A 21 6.197 10.078 7.170 1.00 0.00 C ATOM 0 HA PRO A 21 5.559 7.002 6.485 1.00 0.00 H new ATOM 0 HB2 PRO A 21 3.552 9.252 6.848 1.00 0.00 H new ATOM 0 HB3 PRO A 21 3.834 7.886 7.909 1.00 0.00 H new ATOM 0 HG2 PRO A 21 4.690 10.259 8.682 1.00 0.00 H new ATOM 0 HG3 PRO A 21 5.758 8.886 8.895 1.00 0.00 H new ATOM 0 HD2 PRO A 21 5.781 10.947 6.660 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.124 10.401 7.644 1.00 0.00 H new ATOM 328 N PHE A 22 3.996 6.762 4.633 1.00 0.00 N ATOM 329 CA PHE A 22 3.255 6.520 3.411 1.00 0.00 C ATOM 330 C PHE A 22 2.065 7.443 3.344 1.00 0.00 C ATOM 331 O PHE A 22 1.057 7.239 4.017 1.00 0.00 O ATOM 332 CB PHE A 22 2.799 5.063 3.329 1.00 0.00 C ATOM 333 CG PHE A 22 3.877 4.139 2.857 1.00 0.00 C ATOM 334 CD1 PHE A 22 4.291 4.188 1.537 1.00 0.00 C ATOM 335 CD2 PHE A 22 4.490 3.240 3.719 1.00 0.00 C ATOM 336 CE1 PHE A 22 5.292 3.363 1.078 1.00 0.00 C ATOM 337 CE2 PHE A 22 5.499 2.414 3.262 1.00 0.00 C ATOM 338 CZ PHE A 22 5.898 2.476 1.938 1.00 0.00 C ATOM 0 H PHE A 22 4.027 5.960 5.263 1.00 0.00 H new ATOM 0 HA PHE A 22 3.911 6.718 2.563 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.455 4.740 4.312 1.00 0.00 H new ATOM 0 HB3 PHE A 22 1.946 4.992 2.654 1.00 0.00 H new ATOM 0 HD1 PHE A 22 3.821 4.884 0.858 1.00 0.00 H new ATOM 0 HD2 PHE A 22 4.177 3.186 4.751 1.00 0.00 H new ATOM 0 HE1 PHE A 22 5.602 3.412 0.044 1.00 0.00 H new ATOM 0 HE2 PHE A 22 5.976 1.720 3.938 1.00 0.00 H new ATOM 0 HZ PHE A 22 6.685 1.828 1.580 1.00 0.00 H new ATOM 348 N GLN A 23 2.199 8.458 2.530 1.00 0.00 N ATOM 349 CA GLN A 23 1.211 9.506 2.452 1.00 0.00 C ATOM 350 C GLN A 23 0.423 9.387 1.168 1.00 0.00 C ATOM 351 O GLN A 23 0.908 9.740 0.098 1.00 0.00 O ATOM 352 CB GLN A 23 1.856 10.889 2.497 1.00 0.00 C ATOM 353 CG GLN A 23 2.846 11.109 3.613 1.00 0.00 C ATOM 354 CD GLN A 23 3.250 12.564 3.724 1.00 0.00 C ATOM 355 OE1 GLN A 23 4.334 12.930 3.060 1.00 0.00 O flip ATOM 356 NE2 GLN A 23 2.601 13.350 4.409 1.00 0.00 N flip ATOM 0 H GLN A 23 2.994 8.583 1.903 1.00 0.00 H new ATOM 0 HA GLN A 23 0.552 9.393 3.313 1.00 0.00 H new ATOM 0 HB2 GLN A 23 2.361 11.066 1.547 1.00 0.00 H new ATOM 0 HB3 GLN A 23 1.067 11.636 2.583 1.00 0.00 H new ATOM 0 HG2 GLN A 23 2.410 10.779 4.556 1.00 0.00 H new ATOM 0 HG3 GLN A 23 3.732 10.498 3.440 1.00 0.00 H new ATOM 0 HE21 GLN A 23 1.770 13.028 4.906 1.00 0.00 H new ATOM 0 HE22 GLN A 23 2.893 14.325 4.481 1.00 0.00 H new ATOM 365 N PHE A 24 -0.776 8.879 1.277 1.00 0.00 N ATOM 366 CA PHE A 24 -1.689 8.836 0.159 1.00 0.00 C ATOM 367 C PHE A 24 -2.736 9.902 0.343 1.00 0.00 C ATOM 368 O PHE A 24 -2.981 10.334 1.457 1.00 0.00 O ATOM 369 CB PHE A 24 -2.390 7.488 0.082 1.00 0.00 C ATOM 370 CG PHE A 24 -1.470 6.321 -0.052 1.00 0.00 C ATOM 371 CD1 PHE A 24 -0.963 5.689 1.067 1.00 0.00 C ATOM 372 CD2 PHE A 24 -1.139 5.840 -1.300 1.00 0.00 C ATOM 373 CE1 PHE A 24 -0.138 4.595 0.943 1.00 0.00 C ATOM 374 CE2 PHE A 24 -0.309 4.749 -1.436 1.00 0.00 C ATOM 375 CZ PHE A 24 0.195 4.119 -0.308 1.00 0.00 C ATOM 0 H PHE A 24 -1.149 8.483 2.140 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.121 8.997 -0.757 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.996 7.356 0.978 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.073 7.496 -0.767 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.217 6.058 2.050 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -1.534 6.323 -2.181 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.249 4.108 1.826 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -0.051 4.385 -2.420 1.00 0.00 H new ATOM 0 HZ PHE A 24 0.844 3.261 -0.408 1.00 0.00 H new ATOM 385 N GLU A 25 -3.327 10.344 -0.733 1.00 0.00 N ATOM 386 CA GLU A 25 -4.530 11.136 -0.637 1.00 0.00 C ATOM 387 C GLU A 25 -5.557 10.538 -1.588 1.00 0.00 C ATOM 388 O GLU A 25 -5.653 10.909 -2.757 1.00 0.00 O ATOM 389 CB GLU A 25 -4.219 12.605 -0.945 1.00 0.00 C ATOM 390 CG GLU A 25 -5.333 13.566 -0.569 1.00 0.00 C ATOM 391 CD GLU A 25 -4.821 14.961 -0.257 1.00 0.00 C ATOM 392 OE1 GLU A 25 -4.198 15.590 -1.138 1.00 0.00 O ATOM 393 OE2 GLU A 25 -5.027 15.431 0.885 1.00 0.00 O ATOM 0 H GLU A 25 -3.000 10.172 -1.684 1.00 0.00 H new ATOM 0 HA GLU A 25 -4.939 11.117 0.373 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -3.311 12.892 -0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -4.011 12.706 -2.010 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -6.051 13.621 -1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -5.866 13.177 0.298 1.00 0.00 H new ATOM 400 N ILE A 26 -6.298 9.569 -1.082 1.00 0.00 N ATOM 401 CA ILE A 26 -7.224 8.818 -1.901 1.00 0.00 C ATOM 402 C ILE A 26 -8.515 9.577 -2.179 1.00 0.00 C ATOM 403 O ILE A 26 -9.080 10.225 -1.310 1.00 0.00 O ATOM 404 CB ILE A 26 -7.581 7.477 -1.249 1.00 0.00 C ATOM 405 CG1 ILE A 26 -6.316 6.655 -1.017 1.00 0.00 C ATOM 406 CG2 ILE A 26 -8.533 6.726 -2.156 1.00 0.00 C ATOM 407 CD1 ILE A 26 -6.418 5.679 0.136 1.00 0.00 C ATOM 0 H ILE A 26 -6.274 9.285 -0.103 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.709 8.651 -2.847 1.00 0.00 H new ATOM 0 HB ILE A 26 -8.059 7.654 -0.286 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -6.082 6.103 -1.927 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -5.483 7.333 -0.833 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -8.792 5.771 -1.700 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -9.438 7.316 -2.302 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -8.055 6.550 -3.120 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.479 5.134 0.235 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -6.620 6.225 1.058 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -7.228 4.975 -0.054 1.00 0.00 H new ATOM 419 N THR A 27 -8.968 9.469 -3.407 1.00 0.00 N ATOM 420 CA THR A 27 -10.269 9.963 -3.808 1.00 0.00 C ATOM 421 C THR A 27 -11.105 8.811 -4.314 1.00 0.00 C ATOM 422 O THR A 27 -10.829 8.244 -5.378 1.00 0.00 O ATOM 423 CB THR A 27 -10.160 11.027 -4.913 1.00 0.00 C ATOM 424 OG1 THR A 27 -9.101 11.939 -4.605 1.00 0.00 O ATOM 425 CG2 THR A 27 -11.466 11.791 -5.065 1.00 0.00 C ATOM 0 H THR A 27 -8.441 9.032 -4.163 1.00 0.00 H new ATOM 0 HA THR A 27 -10.735 10.425 -2.937 1.00 0.00 H new ATOM 0 HB THR A 27 -9.946 10.521 -5.855 1.00 0.00 H new ATOM 0 HG1 THR A 27 -9.034 12.614 -5.313 1.00 0.00 H new ATOM 0 HG21 THR A 27 -11.362 12.537 -5.853 1.00 0.00 H new ATOM 0 HG22 THR A 27 -12.265 11.097 -5.326 1.00 0.00 H new ATOM 0 HG23 THR A 27 -11.709 12.287 -4.125 1.00 0.00 H new ATOM 433 N PHE A 28 -12.110 8.453 -3.543 1.00 0.00 N ATOM 434 CA PHE A 28 -13.020 7.416 -3.961 1.00 0.00 C ATOM 435 C PHE A 28 -14.363 7.979 -4.227 1.00 0.00 C ATOM 436 O PHE A 28 -14.852 8.833 -3.503 1.00 0.00 O ATOM 437 CB PHE A 28 -13.156 6.243 -2.987 1.00 0.00 C ATOM 438 CG PHE A 28 -13.343 6.549 -1.521 1.00 0.00 C ATOM 439 CD1 PHE A 28 -12.234 6.658 -0.704 1.00 0.00 C ATOM 440 CD2 PHE A 28 -14.612 6.630 -0.939 1.00 0.00 C ATOM 441 CE1 PHE A 28 -12.372 6.853 0.651 1.00 0.00 C ATOM 442 CE2 PHE A 28 -14.745 6.807 0.422 1.00 0.00 C ATOM 443 CZ PHE A 28 -13.625 6.919 1.213 1.00 0.00 C ATOM 0 H PHE A 28 -12.314 8.863 -2.631 1.00 0.00 H new ATOM 0 HA PHE A 28 -12.576 7.010 -4.870 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -14.003 5.638 -3.311 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -12.265 5.623 -3.086 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -11.246 6.589 -1.135 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -15.493 6.553 -1.559 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -11.495 6.954 1.274 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -15.728 6.858 0.867 1.00 0.00 H new ATOM 0 HZ PHE A 28 -13.730 7.059 2.279 1.00 0.00 H new ATOM 453 N GLU A 29 -14.961 7.470 -5.255 1.00 0.00 N ATOM 454 CA GLU A 29 -16.288 7.864 -5.593 1.00 0.00 C ATOM 455 C GLU A 29 -17.189 6.789 -5.125 1.00 0.00 C ATOM 456 O GLU A 29 -17.114 5.644 -5.574 1.00 0.00 O ATOM 457 CB GLU A 29 -16.463 8.122 -7.081 1.00 0.00 C ATOM 458 CG GLU A 29 -17.833 8.668 -7.451 1.00 0.00 C ATOM 459 CD GLU A 29 -17.909 9.099 -8.898 1.00 0.00 C ATOM 460 OE1 GLU A 29 -17.418 10.200 -9.223 1.00 0.00 O ATOM 461 OE2 GLU A 29 -18.445 8.333 -9.725 1.00 0.00 O ATOM 0 H GLU A 29 -14.548 6.776 -5.878 1.00 0.00 H new ATOM 0 HA GLU A 29 -16.523 8.812 -5.110 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -15.700 8.827 -7.410 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -16.294 7.192 -7.624 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -18.588 7.905 -7.262 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -18.069 9.517 -6.809 1.00 0.00 H new ATOM 468 N CYS A 30 -17.998 7.147 -4.181 1.00 0.00 N ATOM 469 CA CYS A 30 -18.875 6.208 -3.594 1.00 0.00 C ATOM 470 C CYS A 30 -19.930 5.911 -4.593 1.00 0.00 C ATOM 471 O CYS A 30 -20.678 6.771 -5.029 1.00 0.00 O ATOM 472 CB CYS A 30 -19.424 6.778 -2.302 1.00 0.00 C ATOM 473 SG CYS A 30 -18.176 7.716 -1.400 1.00 0.00 S ATOM 0 H CYS A 30 -18.064 8.092 -3.803 1.00 0.00 H new ATOM 0 HA CYS A 30 -18.373 5.277 -3.332 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -20.275 7.423 -2.522 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -19.793 5.967 -1.675 1.00 0.00 H new ATOM 0 HG CYS A 30 -17.046 7.663 -2.041 1.00 0.00 H new ATOM 479 N ILE A 31 -19.890 4.698 -5.030 1.00 0.00 N ATOM 480 CA ILE A 31 -20.726 4.268 -6.090 1.00 0.00 C ATOM 481 C ILE A 31 -22.141 4.121 -5.588 1.00 0.00 C ATOM 482 O ILE A 31 -23.102 4.236 -6.350 1.00 0.00 O ATOM 483 CB ILE A 31 -20.215 2.955 -6.689 1.00 0.00 C ATOM 484 CG1 ILE A 31 -18.810 2.595 -6.185 1.00 0.00 C ATOM 485 CG2 ILE A 31 -20.179 3.116 -8.166 1.00 0.00 C ATOM 486 CD1 ILE A 31 -18.223 1.378 -6.882 1.00 0.00 C ATOM 0 H ILE A 31 -19.273 3.976 -4.658 1.00 0.00 H new ATOM 0 HA ILE A 31 -20.710 5.016 -6.882 1.00 0.00 H new ATOM 0 HB ILE A 31 -20.883 2.148 -6.386 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -18.147 3.447 -6.334 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -18.852 2.407 -5.112 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -19.818 2.195 -8.624 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -21.182 3.335 -8.533 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -19.511 3.937 -8.426 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -17.230 1.174 -6.483 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -18.867 0.515 -6.711 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -18.151 1.571 -7.952 1.00 0.00 H new ATOM 498 N GLU A 32 -22.256 3.906 -4.287 1.00 0.00 N ATOM 499 CA GLU A 32 -23.535 3.746 -3.643 1.00 0.00 C ATOM 500 C GLU A 32 -23.450 4.226 -2.200 1.00 0.00 C ATOM 501 O GLU A 32 -22.358 4.427 -1.674 1.00 0.00 O ATOM 502 CB GLU A 32 -23.978 2.279 -3.711 1.00 0.00 C ATOM 503 CG GLU A 32 -24.198 1.792 -5.124 1.00 0.00 C ATOM 504 CD GLU A 32 -24.861 0.431 -5.181 1.00 0.00 C ATOM 505 OE1 GLU A 32 -26.068 0.348 -4.866 1.00 0.00 O ATOM 506 OE2 GLU A 32 -24.193 -0.558 -5.543 1.00 0.00 O ATOM 0 H GLU A 32 -21.459 3.839 -3.653 1.00 0.00 H new ATOM 0 HA GLU A 32 -24.280 4.349 -4.162 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -23.224 1.655 -3.231 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -24.900 2.157 -3.143 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -24.814 2.514 -5.660 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -23.239 1.746 -5.641 1.00 0.00 H new ATOM 513 N ASP A 33 -24.600 4.432 -1.577 1.00 0.00 N ATOM 514 CA ASP A 33 -24.651 4.890 -0.195 1.00 0.00 C ATOM 515 C ASP A 33 -24.122 3.810 0.736 1.00 0.00 C ATOM 516 O ASP A 33 -24.487 2.638 0.612 1.00 0.00 O ATOM 517 CB ASP A 33 -26.084 5.272 0.184 1.00 0.00 C ATOM 518 CG ASP A 33 -26.212 5.716 1.624 1.00 0.00 C ATOM 519 OD1 ASP A 33 -25.824 6.861 1.931 1.00 0.00 O ATOM 520 OD2 ASP A 33 -26.712 4.926 2.452 1.00 0.00 O ATOM 0 H ASP A 33 -25.514 4.289 -2.007 1.00 0.00 H new ATOM 0 HA ASP A 33 -24.020 5.773 -0.094 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -26.426 6.074 -0.470 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -26.740 4.419 0.012 1.00 0.00 H new ATOM 525 N LEU A 34 -23.264 4.203 1.660 1.00 0.00 N ATOM 526 CA LEU A 34 -22.574 3.254 2.505 1.00 0.00 C ATOM 527 C LEU A 34 -23.317 3.090 3.823 1.00 0.00 C ATOM 528 O LEU A 34 -24.030 3.996 4.247 1.00 0.00 O ATOM 529 CB LEU A 34 -21.173 3.776 2.761 1.00 0.00 C ATOM 530 CG LEU A 34 -20.091 2.745 2.837 1.00 0.00 C ATOM 531 CD1 LEU A 34 -20.022 2.283 4.256 1.00 0.00 C ATOM 532 CD2 LEU A 34 -20.372 1.599 1.879 1.00 0.00 C ATOM 0 H LEU A 34 -23.030 5.179 1.842 1.00 0.00 H new ATOM 0 HA LEU A 34 -22.528 2.282 2.014 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -20.920 4.482 1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -21.181 4.335 3.697 1.00 0.00 H new ATOM 0 HG LEU A 34 -19.130 3.163 2.537 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -19.242 1.528 4.355 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -19.792 3.129 4.903 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -20.981 1.855 4.546 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -19.573 0.861 1.950 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -21.322 1.132 2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -20.423 1.981 0.859 1.00 0.00 H new ATOM 544 N SER A 35 -23.188 1.929 4.456 1.00 0.00 N ATOM 545 CA SER A 35 -23.849 1.706 5.729 1.00 0.00 C ATOM 546 C SER A 35 -22.874 1.497 6.889 1.00 0.00 C ATOM 547 O SER A 35 -23.148 1.889 8.022 1.00 0.00 O ATOM 548 CB SER A 35 -24.822 0.535 5.614 1.00 0.00 C ATOM 549 OG SER A 35 -24.216 -0.576 4.972 1.00 0.00 O ATOM 0 H SER A 35 -22.640 1.141 4.112 1.00 0.00 H new ATOM 0 HA SER A 35 -24.401 2.616 5.964 1.00 0.00 H new ATOM 0 HB2 SER A 35 -25.162 0.243 6.607 1.00 0.00 H new ATOM 0 HB3 SER A 35 -25.704 0.845 5.054 1.00 0.00 H new ATOM 0 HG SER A 35 -23.242 -0.464 4.973 1.00 0.00 H new ATOM 555 N GLU A 36 -21.745 0.890 6.595 1.00 0.00 N ATOM 556 CA GLU A 36 -20.780 0.488 7.620 1.00 0.00 C ATOM 557 C GLU A 36 -19.554 1.401 7.539 1.00 0.00 C ATOM 558 O GLU A 36 -19.653 2.501 7.010 1.00 0.00 O ATOM 559 CB GLU A 36 -20.417 -1.000 7.447 1.00 0.00 C ATOM 560 CG GLU A 36 -19.749 -1.624 8.663 1.00 0.00 C ATOM 561 CD GLU A 36 -19.601 -3.129 8.542 1.00 0.00 C ATOM 562 OE1 GLU A 36 -18.626 -3.588 7.916 1.00 0.00 O ATOM 563 OE2 GLU A 36 -20.458 -3.860 9.089 1.00 0.00 O ATOM 0 H GLU A 36 -21.461 0.657 5.643 1.00 0.00 H new ATOM 0 HA GLU A 36 -21.214 0.596 8.614 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -21.324 -1.559 7.218 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -19.753 -1.103 6.589 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -18.765 -1.176 8.802 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -20.333 -1.391 9.553 1.00 0.00 H new ATOM 570 N ASP A 37 -18.436 1.015 8.130 1.00 0.00 N ATOM 571 CA ASP A 37 -17.209 1.774 7.929 1.00 0.00 C ATOM 572 C ASP A 37 -16.487 1.206 6.714 1.00 0.00 C ATOM 573 O ASP A 37 -16.781 0.097 6.265 1.00 0.00 O ATOM 574 CB ASP A 37 -16.260 1.726 9.145 1.00 0.00 C ATOM 575 CG ASP A 37 -16.950 1.987 10.468 1.00 0.00 C ATOM 576 OD1 ASP A 37 -17.422 3.121 10.692 1.00 0.00 O ATOM 577 OD2 ASP A 37 -17.005 1.057 11.304 1.00 0.00 O ATOM 0 H ASP A 37 -18.349 0.201 8.739 1.00 0.00 H new ATOM 0 HA ASP A 37 -17.487 2.818 7.784 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -15.781 0.748 9.182 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -15.469 2.463 9.006 1.00 0.00 H new ATOM 582 N LEU A 38 -15.560 1.970 6.189 1.00 0.00 N ATOM 583 CA LEU A 38 -14.749 1.556 5.071 1.00 0.00 C ATOM 584 C LEU A 38 -13.318 1.443 5.542 1.00 0.00 C ATOM 585 O LEU A 38 -12.734 2.438 5.979 1.00 0.00 O ATOM 586 CB LEU A 38 -14.824 2.598 3.954 1.00 0.00 C ATOM 587 CG LEU A 38 -14.668 2.059 2.531 1.00 0.00 C ATOM 588 CD1 LEU A 38 -13.411 1.219 2.397 1.00 0.00 C ATOM 589 CD2 LEU A 38 -15.886 1.243 2.132 1.00 0.00 C ATOM 0 H LEU A 38 -15.346 2.907 6.530 1.00 0.00 H new ATOM 0 HA LEU A 38 -15.108 0.600 4.689 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -15.783 3.111 4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -14.049 3.345 4.127 1.00 0.00 H new ATOM 0 HG LEU A 38 -14.581 2.914 1.860 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -13.327 0.850 1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -12.539 1.828 2.635 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -13.463 0.375 3.085 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -15.756 0.868 1.117 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -16.001 0.403 2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -16.775 1.872 2.176 1.00 0.00 H new ATOM 601 N GLU A 39 -12.742 0.261 5.441 1.00 0.00 N ATOM 602 CA GLU A 39 -11.368 0.088 5.877 1.00 0.00 C ATOM 603 C GLU A 39 -10.421 0.332 4.718 1.00 0.00 C ATOM 604 O GLU A 39 -10.598 -0.235 3.655 1.00 0.00 O ATOM 605 CB GLU A 39 -11.126 -1.314 6.450 1.00 0.00 C ATOM 606 CG GLU A 39 -11.653 -1.528 7.863 1.00 0.00 C ATOM 607 CD GLU A 39 -13.169 -1.511 7.966 1.00 0.00 C ATOM 608 OE1 GLU A 39 -13.749 -0.426 8.148 1.00 0.00 O ATOM 609 OE2 GLU A 39 -13.787 -2.595 7.899 1.00 0.00 O ATOM 0 H GLU A 39 -13.190 -0.577 5.070 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.180 0.814 6.668 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -11.591 -2.046 5.790 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -10.054 -1.514 6.443 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -11.284 -2.483 8.237 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -11.246 -0.753 8.513 1.00 0.00 H new ATOM 616 N TRP A 40 -9.455 1.212 4.908 1.00 0.00 N ATOM 617 CA TRP A 40 -8.340 1.337 3.965 1.00 0.00 C ATOM 618 C TRP A 40 -7.071 1.065 4.715 1.00 0.00 C ATOM 619 O TRP A 40 -6.812 1.678 5.741 1.00 0.00 O ATOM 620 CB TRP A 40 -8.252 2.719 3.303 1.00 0.00 C ATOM 621 CG TRP A 40 -9.532 3.146 2.697 1.00 0.00 C ATOM 622 CD1 TRP A 40 -10.506 3.871 3.299 1.00 0.00 C ATOM 623 CD2 TRP A 40 -9.986 2.865 1.378 1.00 0.00 C ATOM 624 NE1 TRP A 40 -11.566 4.027 2.456 1.00 0.00 N ATOM 625 CE2 TRP A 40 -11.272 3.421 1.265 1.00 0.00 C ATOM 626 CE3 TRP A 40 -9.440 2.189 0.281 1.00 0.00 C ATOM 627 CZ2 TRP A 40 -12.023 3.311 0.107 1.00 0.00 C ATOM 628 CZ3 TRP A 40 -10.181 2.091 -0.861 1.00 0.00 C ATOM 629 CH2 TRP A 40 -11.465 2.642 -0.940 1.00 0.00 C ATOM 0 H TRP A 40 -9.413 1.852 5.701 1.00 0.00 H new ATOM 0 HA TRP A 40 -8.502 0.621 3.160 1.00 0.00 H new ATOM 0 HB2 TRP A 40 -7.944 3.454 4.046 1.00 0.00 H new ATOM 0 HB3 TRP A 40 -7.480 2.700 2.534 1.00 0.00 H new ATOM 0 HD1 TRP A 40 -10.450 4.268 4.302 1.00 0.00 H new ATOM 0 HE1 TRP A 40 -12.434 4.515 2.677 1.00 0.00 H new ATOM 0 HE3 TRP A 40 -8.453 1.754 0.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 40 -13.012 3.739 0.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 40 -9.769 1.579 -1.718 1.00 0.00 H new ATOM 0 HH2 TRP A 40 -12.028 2.534 -1.855 1.00 0.00 H new ATOM 640 N LYS A 41 -6.292 0.143 4.229 1.00 0.00 N ATOM 641 CA LYS A 41 -5.121 -0.279 4.953 1.00 0.00 C ATOM 642 C LYS A 41 -3.901 -0.236 4.064 1.00 0.00 C ATOM 643 O LYS A 41 -3.985 -0.554 2.884 1.00 0.00 O ATOM 644 CB LYS A 41 -5.349 -1.689 5.455 1.00 0.00 C ATOM 645 CG LYS A 41 -4.285 -2.193 6.406 1.00 0.00 C ATOM 646 CD LYS A 41 -4.490 -3.667 6.687 1.00 0.00 C ATOM 647 CE LYS A 41 -5.859 -3.923 7.280 1.00 0.00 C ATOM 648 NZ LYS A 41 -6.362 -5.293 6.995 1.00 0.00 N ATOM 0 H LYS A 41 -6.442 -0.331 3.339 1.00 0.00 H new ATOM 0 HA LYS A 41 -4.949 0.395 5.792 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.316 -1.732 5.956 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.403 -2.362 4.599 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -3.297 -2.031 5.976 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -4.323 -1.629 7.338 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -4.378 -4.235 5.764 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -3.721 -4.020 7.374 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -5.817 -3.773 8.359 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -6.564 -3.192 6.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -7.302 -5.414 7.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.430 -5.431 5.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -5.706 -5.994 7.395 1.00 0.00 H new ATOM 662 N ILE A 42 -2.769 0.134 4.632 1.00 0.00 N ATOM 663 CA ILE A 42 -1.531 0.128 3.881 1.00 0.00 C ATOM 664 C ILE A 42 -0.725 -1.076 4.300 1.00 0.00 C ATOM 665 O ILE A 42 -0.190 -1.125 5.412 1.00 0.00 O ATOM 666 CB ILE A 42 -0.663 1.380 4.100 1.00 0.00 C ATOM 667 CG1 ILE A 42 -1.493 2.663 4.086 1.00 0.00 C ATOM 668 CG2 ILE A 42 0.410 1.442 3.021 1.00 0.00 C ATOM 669 CD1 ILE A 42 -0.673 3.901 4.364 1.00 0.00 C ATOM 0 H ILE A 42 -2.682 0.439 5.601 1.00 0.00 H new ATOM 0 HA ILE A 42 -1.804 0.106 2.826 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.202 1.303 5.085 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.977 2.765 3.115 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -2.285 2.584 4.830 1.00 0.00 H new ATOM 0 HG21 ILE A 42 1.027 2.328 3.172 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.034 0.550 3.077 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -0.063 1.493 2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.319 4.778 4.340 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -0.210 3.818 5.347 1.00 0.00 H new ATOM 0 HD13 ILE A 42 0.103 4.001 3.605 1.00 0.00 H new ATOM 681 N ILE A 43 -0.666 -2.054 3.426 1.00 0.00 N ATOM 682 CA ILE A 43 0.032 -3.284 3.718 1.00 0.00 C ATOM 683 C ILE A 43 1.323 -3.345 2.932 1.00 0.00 C ATOM 684 O ILE A 43 1.332 -3.528 1.712 1.00 0.00 O ATOM 685 CB ILE A 43 -0.857 -4.511 3.437 1.00 0.00 C ATOM 686 CG1 ILE A 43 -2.028 -4.487 4.420 1.00 0.00 C ATOM 687 CG2 ILE A 43 -0.056 -5.803 3.573 1.00 0.00 C ATOM 688 CD1 ILE A 43 -3.199 -5.362 4.033 1.00 0.00 C ATOM 0 H ILE A 43 -1.096 -2.021 2.502 1.00 0.00 H new ATOM 0 HA ILE A 43 0.275 -3.302 4.780 1.00 0.00 H new ATOM 0 HB ILE A 43 -1.233 -4.472 2.415 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.668 -4.799 5.400 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.378 -3.460 4.521 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.704 -6.656 3.370 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.769 -5.796 2.860 1.00 0.00 H new ATOM 0 HG23 ILE A 43 0.340 -5.881 4.586 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.980 -5.280 4.789 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.592 -5.039 3.069 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -2.870 -6.399 3.962 1.00 0.00 H new ATOM 700 N TYR A 44 2.406 -3.159 3.651 1.00 0.00 N ATOM 701 CA TYR A 44 3.721 -3.096 3.059 1.00 0.00 C ATOM 702 C TYR A 44 4.328 -4.474 3.020 1.00 0.00 C ATOM 703 O TYR A 44 4.304 -5.194 4.010 1.00 0.00 O ATOM 704 CB TYR A 44 4.617 -2.167 3.877 1.00 0.00 C ATOM 705 CG TYR A 44 5.992 -1.942 3.286 1.00 0.00 C ATOM 706 CD1 TYR A 44 7.054 -2.782 3.595 1.00 0.00 C ATOM 707 CD2 TYR A 44 6.234 -0.876 2.438 1.00 0.00 C ATOM 708 CE1 TYR A 44 8.314 -2.565 3.074 1.00 0.00 C ATOM 709 CE2 TYR A 44 7.489 -0.655 1.913 1.00 0.00 C ATOM 710 CZ TYR A 44 8.525 -1.501 2.232 1.00 0.00 C ATOM 711 OH TYR A 44 9.772 -1.276 1.708 1.00 0.00 O ATOM 0 H TYR A 44 2.399 -3.047 4.665 1.00 0.00 H new ATOM 0 HA TYR A 44 3.634 -2.709 2.044 1.00 0.00 H new ATOM 0 HB2 TYR A 44 4.119 -1.203 3.984 1.00 0.00 H new ATOM 0 HB3 TYR A 44 4.729 -2.580 4.879 1.00 0.00 H new ATOM 0 HD1 TYR A 44 6.891 -3.621 4.255 1.00 0.00 H new ATOM 0 HD2 TYR A 44 5.426 -0.206 2.183 1.00 0.00 H new ATOM 0 HE1 TYR A 44 9.128 -3.228 3.327 1.00 0.00 H new ATOM 0 HE2 TYR A 44 7.659 0.182 1.252 1.00 0.00 H new ATOM 0 HH TYR A 44 10.245 -2.129 1.611 1.00 0.00 H new ATOM 721 N VAL A 45 4.855 -4.851 1.884 1.00 0.00 N ATOM 722 CA VAL A 45 5.576 -6.104 1.797 1.00 0.00 C ATOM 723 C VAL A 45 6.922 -6.003 2.518 1.00 0.00 C ATOM 724 O VAL A 45 7.864 -5.403 2.030 1.00 0.00 O ATOM 725 CB VAL A 45 5.728 -6.558 0.329 1.00 0.00 C ATOM 726 CG1 VAL A 45 6.941 -7.447 0.124 1.00 0.00 C ATOM 727 CG2 VAL A 45 4.468 -7.300 -0.071 1.00 0.00 C ATOM 0 H VAL A 45 4.803 -4.320 1.015 1.00 0.00 H new ATOM 0 HA VAL A 45 4.995 -6.874 2.304 1.00 0.00 H new ATOM 0 HB VAL A 45 5.875 -5.676 -0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 45 7.004 -7.740 -0.924 1.00 0.00 H new ATOM 0 HG12 VAL A 45 7.843 -6.902 0.404 1.00 0.00 H new ATOM 0 HG13 VAL A 45 6.848 -8.338 0.745 1.00 0.00 H new ATOM 0 HG21 VAL A 45 4.553 -7.630 -1.106 1.00 0.00 H new ATOM 0 HG22 VAL A 45 4.335 -8.167 0.577 1.00 0.00 H new ATOM 0 HG23 VAL A 45 3.608 -6.637 0.028 1.00 0.00 H new ATOM 737 N GLY A 46 6.973 -6.554 3.724 1.00 0.00 N ATOM 738 CA GLY A 46 8.191 -6.523 4.502 1.00 0.00 C ATOM 739 C GLY A 46 9.292 -7.299 3.835 1.00 0.00 C ATOM 740 O GLY A 46 10.451 -6.900 3.865 1.00 0.00 O ATOM 0 H GLY A 46 6.188 -7.023 4.176 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.507 -5.489 4.643 1.00 0.00 H new ATOM 0 HA3 GLY A 46 8.002 -6.937 5.493 1.00 0.00 H new ATOM 744 N SER A 47 8.929 -8.436 3.268 1.00 0.00 N ATOM 745 CA SER A 47 9.845 -9.199 2.469 1.00 0.00 C ATOM 746 C SER A 47 9.203 -9.618 1.167 1.00 0.00 C ATOM 747 O SER A 47 8.191 -10.320 1.163 1.00 0.00 O ATOM 748 CB SER A 47 10.253 -10.444 3.220 1.00 0.00 C ATOM 749 OG SER A 47 9.122 -11.262 3.455 1.00 0.00 O ATOM 0 H SER A 47 7.999 -8.845 3.353 1.00 0.00 H new ATOM 0 HA SER A 47 10.713 -8.575 2.258 1.00 0.00 H new ATOM 0 HB2 SER A 47 10.998 -10.996 2.647 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.717 -10.171 4.168 1.00 0.00 H new ATOM 0 HG SER A 47 9.086 -11.506 4.404 1.00 0.00 H new ATOM 755 N ALA A 48 9.771 -9.170 0.076 1.00 0.00 N ATOM 756 CA ALA A 48 9.496 -9.767 -1.213 1.00 0.00 C ATOM 757 C ALA A 48 10.294 -11.061 -1.327 1.00 0.00 C ATOM 758 O ALA A 48 10.177 -11.805 -2.295 1.00 0.00 O ATOM 759 CB ALA A 48 9.851 -8.804 -2.332 1.00 0.00 C ATOM 0 H ALA A 48 10.429 -8.391 0.051 1.00 0.00 H new ATOM 0 HA ALA A 48 8.433 -9.989 -1.302 1.00 0.00 H new ATOM 0 HB1 ALA A 48 9.638 -9.270 -3.294 1.00 0.00 H new ATOM 0 HB2 ALA A 48 9.260 -7.894 -2.230 1.00 0.00 H new ATOM 0 HB3 ALA A 48 10.911 -8.556 -2.276 1.00 0.00 H new ATOM 765 N GLU A 49 11.098 -11.317 -0.299 1.00 0.00 N ATOM 766 CA GLU A 49 11.953 -12.484 -0.253 1.00 0.00 C ATOM 767 C GLU A 49 11.323 -13.583 0.597 1.00 0.00 C ATOM 768 O GLU A 49 11.731 -14.743 0.555 1.00 0.00 O ATOM 769 CB GLU A 49 13.318 -12.090 0.278 1.00 0.00 C ATOM 770 CG GLU A 49 14.266 -11.693 -0.828 1.00 0.00 C ATOM 771 CD GLU A 49 14.599 -10.223 -0.791 1.00 0.00 C ATOM 772 OE1 GLU A 49 13.870 -9.430 -1.419 1.00 0.00 O ATOM 773 OE2 GLU A 49 15.594 -9.857 -0.128 1.00 0.00 O ATOM 0 H GLU A 49 11.170 -10.717 0.523 1.00 0.00 H new ATOM 0 HA GLU A 49 12.072 -12.882 -1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 49 13.209 -11.260 0.976 1.00 0.00 H new ATOM 0 HB3 GLU A 49 13.743 -12.923 0.837 1.00 0.00 H new ATOM 0 HG2 GLU A 49 15.184 -12.274 -0.743 1.00 0.00 H new ATOM 0 HG3 GLU A 49 13.821 -11.939 -1.792 1.00 0.00 H new ATOM 780 N SER A 50 10.353 -13.185 1.395 1.00 0.00 N ATOM 781 CA SER A 50 9.486 -14.091 2.099 1.00 0.00 C ATOM 782 C SER A 50 8.053 -13.625 1.866 1.00 0.00 C ATOM 783 O SER A 50 7.768 -13.060 0.817 1.00 0.00 O ATOM 784 CB SER A 50 9.850 -14.105 3.576 1.00 0.00 C ATOM 785 OG SER A 50 11.190 -14.525 3.764 1.00 0.00 O ATOM 0 H SER A 50 10.146 -12.202 1.572 1.00 0.00 H new ATOM 0 HA SER A 50 9.594 -15.113 1.736 1.00 0.00 H new ATOM 0 HB2 SER A 50 9.715 -13.109 3.997 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.177 -14.773 4.114 1.00 0.00 H new ATOM 0 HG SER A 50 11.402 -14.525 4.721 1.00 0.00 H new ATOM 791 N GLU A 51 7.157 -13.823 2.814 1.00 0.00 N ATOM 792 CA GLU A 51 5.777 -13.386 2.620 1.00 0.00 C ATOM 793 C GLU A 51 5.111 -12.959 3.924 1.00 0.00 C ATOM 794 O GLU A 51 4.305 -12.032 3.936 1.00 0.00 O ATOM 795 CB GLU A 51 4.970 -14.490 1.932 1.00 0.00 C ATOM 796 CG GLU A 51 5.096 -15.848 2.602 1.00 0.00 C ATOM 797 CD GLU A 51 4.400 -16.944 1.829 1.00 0.00 C ATOM 798 OE1 GLU A 51 5.037 -17.556 0.947 1.00 0.00 O ATOM 799 OE2 GLU A 51 3.208 -17.205 2.095 1.00 0.00 O ATOM 0 H GLU A 51 7.348 -14.273 3.709 1.00 0.00 H new ATOM 0 HA GLU A 51 5.800 -12.505 1.979 1.00 0.00 H new ATOM 0 HB2 GLU A 51 3.919 -14.201 1.912 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.297 -14.574 0.896 1.00 0.00 H new ATOM 0 HG2 GLU A 51 6.151 -16.099 2.711 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.676 -15.794 3.606 1.00 0.00 H new ATOM 806 N GLU A 52 5.486 -13.598 5.022 1.00 0.00 N ATOM 807 CA GLU A 52 4.851 -13.352 6.317 1.00 0.00 C ATOM 808 C GLU A 52 5.351 -12.062 6.950 1.00 0.00 C ATOM 809 O GLU A 52 4.956 -11.705 8.059 1.00 0.00 O ATOM 810 CB GLU A 52 5.125 -14.531 7.244 1.00 0.00 C ATOM 811 CG GLU A 52 4.711 -15.852 6.645 1.00 0.00 C ATOM 812 CD GLU A 52 4.911 -17.014 7.590 1.00 0.00 C ATOM 813 OE1 GLU A 52 4.060 -17.223 8.478 1.00 0.00 O ATOM 814 OE2 GLU A 52 5.935 -17.719 7.455 1.00 0.00 O ATOM 0 H GLU A 52 6.230 -14.295 5.046 1.00 0.00 H new ATOM 0 HA GLU A 52 3.778 -13.245 6.159 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.188 -14.562 7.481 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.593 -14.380 8.183 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.661 -15.801 6.356 1.00 0.00 H new ATOM 0 HG3 GLU A 52 5.284 -16.028 5.734 1.00 0.00 H new ATOM 821 N TYR A 53 6.229 -11.374 6.243 1.00 0.00 N ATOM 822 CA TYR A 53 6.810 -10.137 6.747 1.00 0.00 C ATOM 823 C TYR A 53 5.903 -8.940 6.521 1.00 0.00 C ATOM 824 O TYR A 53 6.126 -7.893 7.124 1.00 0.00 O ATOM 825 CB TYR A 53 8.130 -9.846 6.064 1.00 0.00 C ATOM 826 CG TYR A 53 9.266 -10.766 6.415 1.00 0.00 C ATOM 827 CD1 TYR A 53 9.064 -12.039 6.925 1.00 0.00 C ATOM 828 CD2 TYR A 53 10.554 -10.355 6.170 1.00 0.00 C ATOM 829 CE1 TYR A 53 10.136 -12.870 7.190 1.00 0.00 C ATOM 830 CE2 TYR A 53 11.626 -11.170 6.416 1.00 0.00 C ATOM 831 CZ TYR A 53 11.419 -12.431 6.930 1.00 0.00 C ATOM 832 OH TYR A 53 12.492 -13.254 7.177 1.00 0.00 O ATOM 0 H TYR A 53 6.557 -11.649 5.317 1.00 0.00 H new ATOM 0 HA TYR A 53 6.951 -10.285 7.818 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.976 -9.885 4.986 1.00 0.00 H new ATOM 0 HB3 TYR A 53 8.426 -8.825 6.307 1.00 0.00 H new ATOM 0 HD1 TYR A 53 8.059 -12.385 7.117 1.00 0.00 H new ATOM 0 HD2 TYR A 53 10.725 -9.365 5.774 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.971 -13.856 7.598 1.00 0.00 H new ATOM 0 HE2 TYR A 53 12.628 -10.826 6.208 1.00 0.00 H new ATOM 0 HH TYR A 53 13.322 -12.791 6.938 1.00 0.00 H new ATOM 842 N ASP A 54 4.928 -9.077 5.615 1.00 0.00 N ATOM 843 CA ASP A 54 4.019 -7.981 5.290 1.00 0.00 C ATOM 844 C ASP A 54 3.559 -7.228 6.545 1.00 0.00 C ATOM 845 O ASP A 54 2.933 -7.783 7.449 1.00 0.00 O ATOM 846 CB ASP A 54 2.827 -8.492 4.464 1.00 0.00 C ATOM 847 CG ASP A 54 1.770 -9.210 5.283 1.00 0.00 C ATOM 848 OD1 ASP A 54 2.033 -10.335 5.759 1.00 0.00 O ATOM 849 OD2 ASP A 54 0.661 -8.660 5.425 1.00 0.00 O ATOM 0 H ASP A 54 4.751 -9.937 5.096 1.00 0.00 H new ATOM 0 HA ASP A 54 4.568 -7.264 4.680 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.364 -7.648 3.953 1.00 0.00 H new ATOM 0 HB3 ASP A 54 3.196 -9.168 3.693 1.00 0.00 H new ATOM 854 N GLN A 55 3.951 -5.965 6.610 1.00 0.00 N ATOM 855 CA GLN A 55 3.566 -5.084 7.705 1.00 0.00 C ATOM 856 C GLN A 55 2.300 -4.307 7.363 1.00 0.00 C ATOM 857 O GLN A 55 1.891 -4.224 6.206 1.00 0.00 O ATOM 858 CB GLN A 55 4.687 -4.085 8.013 1.00 0.00 C ATOM 859 CG GLN A 55 6.028 -4.725 8.270 1.00 0.00 C ATOM 860 CD GLN A 55 6.976 -4.520 7.117 1.00 0.00 C ATOM 861 OE1 GLN A 55 6.558 -4.424 5.972 1.00 0.00 O ATOM 862 NE2 GLN A 55 8.257 -4.425 7.413 1.00 0.00 N ATOM 0 H GLN A 55 4.543 -5.521 5.908 1.00 0.00 H new ATOM 0 HA GLN A 55 3.380 -5.711 8.577 1.00 0.00 H new ATOM 0 HB2 GLN A 55 4.781 -3.392 7.177 1.00 0.00 H new ATOM 0 HB3 GLN A 55 4.404 -3.496 8.885 1.00 0.00 H new ATOM 0 HG2 GLN A 55 6.463 -4.306 9.177 1.00 0.00 H new ATOM 0 HG3 GLN A 55 5.894 -5.792 8.445 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.564 -4.511 8.382 1.00 0.00 H new ATOM 0 HE22 GLN A 55 8.941 -4.266 6.673 1.00 0.00 H new ATOM 871 N VAL A 56 1.710 -3.715 8.384 1.00 0.00 N ATOM 872 CA VAL A 56 0.479 -2.966 8.262 1.00 0.00 C ATOM 873 C VAL A 56 0.682 -1.632 8.935 1.00 0.00 C ATOM 874 O VAL A 56 0.831 -1.555 10.153 1.00 0.00 O ATOM 875 CB VAL A 56 -0.724 -3.693 8.901 1.00 0.00 C ATOM 876 CG1 VAL A 56 -1.899 -2.740 9.066 1.00 0.00 C ATOM 877 CG2 VAL A 56 -1.132 -4.889 8.058 1.00 0.00 C ATOM 0 H VAL A 56 2.080 -3.743 9.334 1.00 0.00 H new ATOM 0 HA VAL A 56 0.247 -2.849 7.203 1.00 0.00 H new ATOM 0 HB VAL A 56 -0.424 -4.048 9.887 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -2.737 -3.271 9.518 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -1.606 -1.910 9.709 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.196 -2.356 8.090 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.981 -5.389 8.523 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.412 -4.552 7.060 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -0.296 -5.585 7.985 1.00 0.00 H new ATOM 887 N LEU A 57 0.729 -0.596 8.137 1.00 0.00 N ATOM 888 CA LEU A 57 1.116 0.704 8.623 1.00 0.00 C ATOM 889 C LEU A 57 -0.031 1.398 9.341 1.00 0.00 C ATOM 890 O LEU A 57 0.171 2.028 10.378 1.00 0.00 O ATOM 891 CB LEU A 57 1.640 1.548 7.466 1.00 0.00 C ATOM 892 CG LEU A 57 2.994 1.103 6.921 1.00 0.00 C ATOM 893 CD1 LEU A 57 3.993 1.035 8.043 1.00 0.00 C ATOM 894 CD2 LEU A 57 2.900 -0.232 6.205 1.00 0.00 C ATOM 0 H LEU A 57 0.503 -0.628 7.143 1.00 0.00 H new ATOM 0 HA LEU A 57 1.913 0.578 9.355 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.911 1.524 6.656 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.718 2.584 7.795 1.00 0.00 H new ATOM 0 HG LEU A 57 3.325 1.838 6.188 1.00 0.00 H new ATOM 0 HD11 LEU A 57 4.959 0.717 7.651 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.093 2.019 8.501 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.652 0.320 8.791 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.884 -0.515 5.831 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.543 -0.993 6.899 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.205 -0.149 5.369 1.00 0.00 H new ATOM 906 N ASP A 58 -1.227 1.264 8.793 1.00 0.00 N ATOM 907 CA ASP A 58 -2.416 1.870 9.376 1.00 0.00 C ATOM 908 C ASP A 58 -3.639 1.419 8.594 1.00 0.00 C ATOM 909 O ASP A 58 -3.512 0.997 7.438 1.00 0.00 O ATOM 910 CB ASP A 58 -2.306 3.403 9.351 1.00 0.00 C ATOM 911 CG ASP A 58 -3.423 4.106 10.095 1.00 0.00 C ATOM 912 OD1 ASP A 58 -3.304 4.281 11.327 1.00 0.00 O ATOM 913 OD2 ASP A 58 -4.409 4.513 9.452 1.00 0.00 O ATOM 0 H ASP A 58 -1.403 0.737 7.938 1.00 0.00 H new ATOM 0 HA ASP A 58 -2.509 1.553 10.415 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.351 3.697 9.786 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -2.302 3.741 8.315 1.00 0.00 H new ATOM 918 N SER A 59 -4.805 1.484 9.214 1.00 0.00 N ATOM 919 CA SER A 59 -6.031 1.152 8.560 1.00 0.00 C ATOM 920 C SER A 59 -7.081 2.151 9.009 1.00 0.00 C ATOM 921 O SER A 59 -7.418 2.236 10.191 1.00 0.00 O ATOM 922 CB SER A 59 -6.435 -0.291 8.875 1.00 0.00 C ATOM 923 OG SER A 59 -6.402 -0.540 10.271 1.00 0.00 O ATOM 0 H SER A 59 -4.914 1.771 10.187 1.00 0.00 H new ATOM 0 HA SER A 59 -5.921 1.210 7.477 1.00 0.00 H new ATOM 0 HB2 SER A 59 -7.438 -0.482 8.492 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.762 -0.980 8.364 1.00 0.00 H new ATOM 0 HG SER A 59 -6.772 0.231 10.750 1.00 0.00 H new ATOM 929 N VAL A 60 -7.582 2.901 8.058 1.00 0.00 N ATOM 930 CA VAL A 60 -8.459 4.019 8.332 1.00 0.00 C ATOM 931 C VAL A 60 -9.893 3.602 8.134 1.00 0.00 C ATOM 932 O VAL A 60 -10.204 2.837 7.220 1.00 0.00 O ATOM 933 CB VAL A 60 -8.151 5.203 7.390 1.00 0.00 C ATOM 934 CG1 VAL A 60 -8.047 4.705 5.967 1.00 0.00 C ATOM 935 CG2 VAL A 60 -9.226 6.270 7.469 1.00 0.00 C ATOM 0 H VAL A 60 -7.393 2.754 7.066 1.00 0.00 H new ATOM 0 HA VAL A 60 -8.297 4.332 9.363 1.00 0.00 H new ATOM 0 HB VAL A 60 -7.206 5.645 7.705 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -7.830 5.542 5.304 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -7.246 3.969 5.897 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -8.990 4.244 5.673 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -8.977 7.088 6.793 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -10.186 5.841 7.181 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -9.289 6.648 8.489 1.00 0.00 H new ATOM 945 N LEU A 61 -10.757 4.087 8.999 1.00 0.00 N ATOM 946 CA LEU A 61 -12.149 3.747 8.906 1.00 0.00 C ATOM 947 C LEU A 61 -12.953 4.968 8.479 1.00 0.00 C ATOM 948 O LEU A 61 -13.173 5.894 9.263 1.00 0.00 O ATOM 949 CB LEU A 61 -12.691 3.202 10.238 1.00 0.00 C ATOM 950 CG LEU A 61 -11.843 2.137 10.960 1.00 0.00 C ATOM 951 CD1 LEU A 61 -11.290 1.110 9.985 1.00 0.00 C ATOM 952 CD2 LEU A 61 -10.723 2.778 11.770 1.00 0.00 C ATOM 0 H LEU A 61 -10.517 4.713 9.768 1.00 0.00 H new ATOM 0 HA LEU A 61 -12.251 2.961 8.158 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -12.826 4.044 10.917 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -13.679 2.779 10.053 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.501 1.614 11.654 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -10.697 0.374 10.529 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.115 0.609 9.478 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -10.661 1.610 9.248 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -10.143 2.001 12.267 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.073 3.347 11.105 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -11.151 3.446 12.518 1.00 0.00 H new ATOM 964 N VAL A 62 -13.365 4.965 7.228 1.00 0.00 N ATOM 965 CA VAL A 62 -14.291 5.960 6.710 1.00 0.00 C ATOM 966 C VAL A 62 -15.687 5.488 7.074 1.00 0.00 C ATOM 967 O VAL A 62 -15.873 4.318 7.319 1.00 0.00 O ATOM 968 CB VAL A 62 -14.148 6.109 5.173 1.00 0.00 C ATOM 969 CG1 VAL A 62 -15.135 7.126 4.607 1.00 0.00 C ATOM 970 CG2 VAL A 62 -12.722 6.499 4.813 1.00 0.00 C ATOM 0 H VAL A 62 -13.069 4.274 6.539 1.00 0.00 H new ATOM 0 HA VAL A 62 -14.083 6.940 7.141 1.00 0.00 H new ATOM 0 HB VAL A 62 -14.380 5.143 4.725 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -15.002 7.200 3.528 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -16.154 6.805 4.826 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -14.956 8.100 5.063 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -12.635 6.600 3.731 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -12.474 7.448 5.288 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -12.035 5.728 5.162 1.00 0.00 H new ATOM 980 N GLY A 63 -16.650 6.366 7.202 1.00 0.00 N ATOM 981 CA GLY A 63 -17.956 5.905 7.592 1.00 0.00 C ATOM 982 C GLY A 63 -18.863 5.695 6.418 1.00 0.00 C ATOM 983 O GLY A 63 -18.399 5.592 5.282 1.00 0.00 O ATOM 0 H GLY A 63 -16.560 7.370 7.048 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -17.858 4.970 8.144 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -18.406 6.630 8.270 1.00 0.00 H new ATOM 987 N PRO A 64 -20.172 5.622 6.660 1.00 0.00 N ATOM 988 CA PRO A 64 -21.146 5.565 5.591 1.00 0.00 C ATOM 989 C PRO A 64 -21.144 6.870 4.821 1.00 0.00 C ATOM 990 O PRO A 64 -21.402 7.942 5.375 1.00 0.00 O ATOM 991 CB PRO A 64 -22.469 5.365 6.316 1.00 0.00 C ATOM 992 CG PRO A 64 -22.238 5.916 7.666 1.00 0.00 C ATOM 993 CD PRO A 64 -20.807 5.602 7.985 1.00 0.00 C ATOM 0 HA PRO A 64 -20.946 4.776 4.866 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.282 5.885 5.809 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -22.743 4.311 6.359 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -22.419 6.991 7.688 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -22.911 5.465 8.395 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -20.369 6.342 8.656 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -20.703 4.631 8.470 1.00 0.00 H new ATOM 1001 N VAL A 65 -20.831 6.777 3.554 1.00 0.00 N ATOM 1002 CA VAL A 65 -20.659 7.937 2.729 1.00 0.00 C ATOM 1003 C VAL A 65 -21.626 7.902 1.558 1.00 0.00 C ATOM 1004 O VAL A 65 -21.795 6.872 0.905 1.00 0.00 O ATOM 1005 CB VAL A 65 -19.197 8.028 2.243 1.00 0.00 C ATOM 1006 CG1 VAL A 65 -18.287 8.184 3.450 1.00 0.00 C ATOM 1007 CG2 VAL A 65 -18.793 6.798 1.428 1.00 0.00 C ATOM 0 H VAL A 65 -20.689 5.892 3.068 1.00 0.00 H new ATOM 0 HA VAL A 65 -20.879 8.828 3.317 1.00 0.00 H new ATOM 0 HB VAL A 65 -19.101 8.893 1.587 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -17.251 8.249 3.118 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -18.553 9.092 3.991 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -18.404 7.323 4.108 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -17.757 6.900 1.104 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -18.894 5.904 2.044 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -19.439 6.712 0.555 1.00 0.00 H new ATOM 1017 N PRO A 66 -22.319 9.016 1.320 1.00 0.00 N ATOM 1018 CA PRO A 66 -23.234 9.144 0.189 1.00 0.00 C ATOM 1019 C PRO A 66 -22.474 9.100 -1.128 1.00 0.00 C ATOM 1020 O PRO A 66 -21.383 9.673 -1.235 1.00 0.00 O ATOM 1021 CB PRO A 66 -23.874 10.519 0.400 1.00 0.00 C ATOM 1022 CG PRO A 66 -22.914 11.266 1.259 1.00 0.00 C ATOM 1023 CD PRO A 66 -22.266 10.239 2.137 1.00 0.00 C ATOM 0 HA PRO A 66 -23.965 8.337 0.141 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -24.033 11.030 -0.550 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -24.848 10.431 0.882 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -22.172 11.787 0.654 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -23.428 12.021 1.854 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -21.241 10.512 2.387 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.802 10.118 3.078 1.00 0.00 H new ATOM 1031 N ALA A 67 -23.040 8.381 -2.101 1.00 0.00 N ATOM 1032 CA ALA A 67 -22.460 8.266 -3.441 1.00 0.00 C ATOM 1033 C ALA A 67 -21.894 9.584 -3.943 1.00 0.00 C ATOM 1034 O ALA A 67 -22.471 10.654 -3.732 1.00 0.00 O ATOM 1035 CB ALA A 67 -23.471 7.746 -4.447 1.00 0.00 C ATOM 0 H ALA A 67 -23.911 7.864 -1.982 1.00 0.00 H new ATOM 0 HA ALA A 67 -21.643 7.551 -3.348 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -23.003 7.675 -5.429 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -23.818 6.760 -4.138 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -24.319 8.430 -4.498 1.00 0.00 H new ATOM 1041 N GLY A 68 -20.771 9.487 -4.625 1.00 0.00 N ATOM 1042 CA GLY A 68 -20.047 10.654 -5.038 1.00 0.00 C ATOM 1043 C GLY A 68 -18.635 10.566 -4.541 1.00 0.00 C ATOM 1044 O GLY A 68 -18.379 9.946 -3.513 1.00 0.00 O ATOM 0 H GLY A 68 -20.345 8.603 -4.902 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -20.057 10.736 -6.125 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -20.527 11.551 -4.646 1.00 0.00 H new ATOM 1048 N ARG A 69 -17.708 11.137 -5.266 1.00 0.00 N ATOM 1049 CA ARG A 69 -16.316 11.030 -4.883 1.00 0.00 C ATOM 1050 C ARG A 69 -15.999 11.940 -3.713 1.00 0.00 C ATOM 1051 O ARG A 69 -16.544 13.035 -3.571 1.00 0.00 O ATOM 1052 CB ARG A 69 -15.392 11.319 -6.052 1.00 0.00 C ATOM 1053 CG ARG A 69 -15.020 12.761 -6.134 1.00 0.00 C ATOM 1054 CD ARG A 69 -14.376 13.092 -7.460 1.00 0.00 C ATOM 1055 NE ARG A 69 -13.867 14.463 -7.505 1.00 0.00 N ATOM 1056 CZ ARG A 69 -13.996 15.266 -8.556 1.00 0.00 C ATOM 1057 NH1 ARG A 69 -14.591 14.826 -9.659 1.00 0.00 N ATOM 1058 NH2 ARG A 69 -13.523 16.506 -8.506 1.00 0.00 N ATOM 0 H ARG A 69 -17.883 11.675 -6.115 1.00 0.00 H new ATOM 0 HA ARG A 69 -16.145 10.000 -4.570 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -14.488 10.717 -5.956 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -15.878 11.018 -6.980 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -15.910 13.376 -5.997 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -14.334 13.008 -5.324 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -13.557 12.397 -7.647 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -15.103 12.951 -8.260 1.00 0.00 H new ATOM 0 HE ARG A 69 -13.385 14.824 -6.682 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -14.949 13.872 -9.699 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -14.690 15.442 -10.466 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -13.061 16.842 -7.661 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -13.622 17.122 -9.313 1.00 0.00 H new ATOM 1072 N HIS A 70 -15.138 11.439 -2.866 1.00 0.00 N ATOM 1073 CA HIS A 70 -14.653 12.155 -1.719 1.00 0.00 C ATOM 1074 C HIS A 70 -13.166 11.899 -1.615 1.00 0.00 C ATOM 1075 O HIS A 70 -12.721 10.762 -1.794 1.00 0.00 O ATOM 1076 CB HIS A 70 -15.319 11.647 -0.447 1.00 0.00 C ATOM 1077 CG HIS A 70 -16.809 11.754 -0.405 1.00 0.00 C ATOM 1078 ND1 HIS A 70 -17.751 10.823 -0.654 1.00 0.00 N flip ATOM 1079 CD2 HIS A 70 -17.484 12.888 -0.019 1.00 0.00 C flip ATOM 1080 CE1 HIS A 70 -18.972 11.390 -0.409 1.00 0.00 C flip ATOM 1081 NE2 HIS A 70 -18.783 12.644 -0.027 1.00 0.00 N flip ATOM 0 H HIS A 70 -14.747 10.501 -2.958 1.00 0.00 H new ATOM 0 HA HIS A 70 -14.874 13.217 -1.831 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -15.045 10.601 -0.309 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -14.910 12.198 0.400 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -17.584 9.867 -0.969 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -17.026 13.829 0.248 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -19.928 10.898 -0.510 1.00 0.00 H new ATOM 1090 N MET A 71 -12.396 12.925 -1.353 1.00 0.00 N ATOM 1091 CA MET A 71 -10.973 12.751 -1.203 1.00 0.00 C ATOM 1092 C MET A 71 -10.569 12.861 0.253 1.00 0.00 C ATOM 1093 O MET A 71 -10.856 13.850 0.930 1.00 0.00 O ATOM 1094 CB MET A 71 -10.219 13.758 -2.060 1.00 0.00 C ATOM 1095 CG MET A 71 -8.711 13.739 -1.856 1.00 0.00 C ATOM 1096 SD MET A 71 -8.009 15.385 -1.625 1.00 0.00 S ATOM 1097 CE MET A 71 -8.350 15.674 0.113 1.00 0.00 C ATOM 0 H MET A 71 -12.727 13.883 -1.240 1.00 0.00 H new ATOM 0 HA MET A 71 -10.710 11.751 -1.547 1.00 0.00 H new ATOM 0 HB2 MET A 71 -10.436 13.560 -3.110 1.00 0.00 H new ATOM 0 HB3 MET A 71 -10.592 14.758 -1.840 1.00 0.00 H new ATOM 0 HG2 MET A 71 -8.475 13.125 -0.987 1.00 0.00 H new ATOM 0 HG3 MET A 71 -8.239 13.267 -2.718 1.00 0.00 H new ATOM 0 HE1 MET A 71 -7.780 16.537 0.457 1.00 0.00 H new ATOM 0 HE2 MET A 71 -9.415 15.865 0.248 1.00 0.00 H new ATOM 0 HE3 MET A 71 -8.063 14.796 0.691 1.00 0.00 H new ATOM 1107 N PHE A 72 -9.920 11.821 0.724 1.00 0.00 N ATOM 1108 CA PHE A 72 -9.419 11.769 2.072 1.00 0.00 C ATOM 1109 C PHE A 72 -7.959 11.398 2.022 1.00 0.00 C ATOM 1110 O PHE A 72 -7.529 10.616 1.177 1.00 0.00 O ATOM 1111 CB PHE A 72 -10.226 10.764 2.908 1.00 0.00 C ATOM 1112 CG PHE A 72 -9.638 9.378 2.975 1.00 0.00 C ATOM 1113 CD1 PHE A 72 -9.799 8.457 1.942 1.00 0.00 C ATOM 1114 CD2 PHE A 72 -8.912 9.000 4.093 1.00 0.00 C ATOM 1115 CE1 PHE A 72 -9.248 7.194 2.037 1.00 0.00 C ATOM 1116 CE2 PHE A 72 -8.364 7.745 4.188 1.00 0.00 C ATOM 1117 CZ PHE A 72 -8.531 6.838 3.161 1.00 0.00 C ATOM 0 H PHE A 72 -9.725 10.983 0.176 1.00 0.00 H new ATOM 0 HA PHE A 72 -9.526 12.742 2.551 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -10.322 11.152 3.922 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -11.233 10.696 2.496 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -10.359 8.733 1.060 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.775 9.703 4.901 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -9.378 6.486 1.232 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -7.802 7.467 5.067 1.00 0.00 H new ATOM 0 HZ PHE A 72 -8.101 5.850 3.237 1.00 0.00 H new ATOM 1127 N VAL A 73 -7.200 11.965 2.914 1.00 0.00 N ATOM 1128 CA VAL A 73 -5.780 11.799 2.877 1.00 0.00 C ATOM 1129 C VAL A 73 -5.333 10.841 3.975 1.00 0.00 C ATOM 1130 O VAL A 73 -5.642 11.009 5.158 1.00 0.00 O ATOM 1131 CB VAL A 73 -5.063 13.160 2.928 1.00 0.00 C ATOM 1132 CG1 VAL A 73 -5.454 13.970 4.147 1.00 0.00 C ATOM 1133 CG2 VAL A 73 -3.570 12.972 2.822 1.00 0.00 C ATOM 0 H VAL A 73 -7.544 12.548 3.677 1.00 0.00 H new ATOM 0 HA VAL A 73 -5.495 11.346 1.927 1.00 0.00 H new ATOM 0 HB VAL A 73 -5.389 13.743 2.067 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.922 14.921 4.138 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -6.528 14.155 4.132 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.194 13.417 5.050 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -3.077 13.944 2.860 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -3.221 12.356 3.651 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -3.331 12.480 1.879 1.00 0.00 H new ATOM 1143 N PHE A 74 -4.610 9.830 3.544 1.00 0.00 N ATOM 1144 CA PHE A 74 -4.382 8.619 4.305 1.00 0.00 C ATOM 1145 C PHE A 74 -2.890 8.343 4.410 1.00 0.00 C ATOM 1146 O PHE A 74 -2.234 8.044 3.420 1.00 0.00 O ATOM 1147 CB PHE A 74 -5.120 7.507 3.563 1.00 0.00 C ATOM 1148 CG PHE A 74 -4.894 6.098 4.017 1.00 0.00 C ATOM 1149 CD1 PHE A 74 -4.763 5.756 5.353 1.00 0.00 C ATOM 1150 CD2 PHE A 74 -4.869 5.101 3.069 1.00 0.00 C ATOM 1151 CE1 PHE A 74 -4.608 4.430 5.722 1.00 0.00 C ATOM 1152 CE2 PHE A 74 -4.710 3.788 3.421 1.00 0.00 C ATOM 1153 CZ PHE A 74 -4.581 3.441 4.752 1.00 0.00 C ATOM 0 H PHE A 74 -4.153 9.827 2.632 1.00 0.00 H new ATOM 0 HA PHE A 74 -4.751 8.699 5.327 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -6.188 7.713 3.627 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.847 7.568 2.510 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -4.782 6.526 6.110 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -4.977 5.360 2.026 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -4.508 4.167 6.765 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -4.685 3.023 2.659 1.00 0.00 H new ATOM 0 HZ PHE A 74 -4.460 2.406 5.035 1.00 0.00 H new ATOM 1163 N GLN A 75 -2.368 8.440 5.614 1.00 0.00 N ATOM 1164 CA GLN A 75 -0.936 8.355 5.838 1.00 0.00 C ATOM 1165 C GLN A 75 -0.672 7.366 6.947 1.00 0.00 C ATOM 1166 O GLN A 75 -1.527 7.140 7.805 1.00 0.00 O ATOM 1167 CB GLN A 75 -0.350 9.709 6.227 1.00 0.00 C ATOM 1168 CG GLN A 75 -0.688 10.827 5.267 1.00 0.00 C ATOM 1169 CD GLN A 75 -0.541 12.185 5.909 1.00 0.00 C ATOM 1170 OE1 GLN A 75 -0.216 13.172 5.105 1.00 0.00 O flip ATOM 1171 NE2 GLN A 75 -0.718 12.341 7.119 1.00 0.00 N flip ATOM 0 H GLN A 75 -2.918 8.579 6.462 1.00 0.00 H new ATOM 0 HA GLN A 75 -0.462 8.033 4.911 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -0.710 9.977 7.221 1.00 0.00 H new ATOM 0 HB3 GLN A 75 0.734 9.618 6.294 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -0.037 10.766 4.395 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -1.711 10.703 4.911 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -0.969 11.545 7.704 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -0.613 13.267 7.535 1.00 0.00 H new ATOM 1180 N ALA A 76 0.498 6.786 6.932 1.00 0.00 N ATOM 1181 CA ALA A 76 0.890 5.837 7.947 1.00 0.00 C ATOM 1182 C ALA A 76 2.395 5.753 7.995 1.00 0.00 C ATOM 1183 O ALA A 76 3.042 6.018 6.999 1.00 0.00 O ATOM 1184 CB ALA A 76 0.285 4.484 7.658 1.00 0.00 C ATOM 0 H ALA A 76 1.207 6.955 6.219 1.00 0.00 H new ATOM 0 HA ALA A 76 0.523 6.169 8.918 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.588 3.777 8.431 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -0.802 4.566 7.648 1.00 0.00 H new ATOM 0 HB3 ALA A 76 0.631 4.130 6.687 1.00 0.00 H new ATOM 1190 N ASP A 77 2.952 5.378 9.130 1.00 0.00 N ATOM 1191 CA ASP A 77 4.399 5.441 9.321 1.00 0.00 C ATOM 1192 C ASP A 77 5.170 4.520 8.371 1.00 0.00 C ATOM 1193 O ASP A 77 4.608 3.904 7.465 1.00 0.00 O ATOM 1194 CB ASP A 77 4.761 5.118 10.771 1.00 0.00 C ATOM 1195 CG ASP A 77 4.203 6.138 11.738 1.00 0.00 C ATOM 1196 OD1 ASP A 77 4.803 7.224 11.873 1.00 0.00 O ATOM 1197 OD2 ASP A 77 3.160 5.864 12.365 1.00 0.00 O ATOM 0 H ASP A 77 2.432 5.027 9.934 1.00 0.00 H new ATOM 0 HA ASP A 77 4.698 6.462 9.086 1.00 0.00 H new ATOM 0 HB2 ASP A 77 4.380 4.130 11.028 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.845 5.078 10.873 1.00 0.00 H new ATOM 1202 N ALA A 78 6.472 4.465 8.577 1.00 0.00 N ATOM 1203 CA ALA A 78 7.352 3.644 7.780 1.00 0.00 C ATOM 1204 C ALA A 78 7.333 2.210 8.275 1.00 0.00 C ATOM 1205 O ALA A 78 7.100 1.953 9.457 1.00 0.00 O ATOM 1206 CB ALA A 78 8.766 4.197 7.830 1.00 0.00 C ATOM 0 H ALA A 78 6.948 4.994 9.308 1.00 0.00 H new ATOM 0 HA ALA A 78 7.002 3.658 6.748 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.423 3.571 7.226 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.773 5.214 7.439 1.00 0.00 H new ATOM 0 HB3 ALA A 78 9.118 4.203 8.862 1.00 0.00 H new ATOM 1212 N PRO A 79 7.563 1.262 7.361 1.00 0.00 N ATOM 1213 CA PRO A 79 7.619 -0.166 7.678 1.00 0.00 C ATOM 1214 C PRO A 79 8.746 -0.504 8.627 1.00 0.00 C ATOM 1215 O PRO A 79 9.598 0.329 8.937 1.00 0.00 O ATOM 1216 CB PRO A 79 7.869 -0.823 6.321 1.00 0.00 C ATOM 1217 CG PRO A 79 7.377 0.182 5.352 1.00 0.00 C ATOM 1218 CD PRO A 79 7.765 1.501 5.933 1.00 0.00 C ATOM 0 HA PRO A 79 6.710 -0.502 8.176 1.00 0.00 H new ATOM 0 HB2 PRO A 79 8.926 -1.042 6.170 1.00 0.00 H new ATOM 0 HB3 PRO A 79 7.332 -1.767 6.227 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.826 0.036 4.370 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.297 0.110 5.223 1.00 0.00 H new ATOM 0 HD2 PRO A 79 8.798 1.762 5.703 1.00 0.00 H new ATOM 0 HD3 PRO A 79 7.140 2.313 5.561 1.00 0.00 H new ATOM 1226 N ASN A 80 8.767 -1.749 9.048 1.00 0.00 N ATOM 1227 CA ASN A 80 9.716 -2.185 10.059 1.00 0.00 C ATOM 1228 C ASN A 80 11.062 -2.482 9.431 1.00 0.00 C ATOM 1229 O ASN A 80 11.199 -3.404 8.622 1.00 0.00 O ATOM 1230 CB ASN A 80 9.204 -3.415 10.812 1.00 0.00 C ATOM 1231 CG ASN A 80 7.890 -3.166 11.524 1.00 0.00 C ATOM 1232 OD1 ASN A 80 7.575 -2.042 11.904 1.00 0.00 O ATOM 1233 ND2 ASN A 80 7.123 -4.225 11.722 1.00 0.00 N ATOM 0 H ASN A 80 8.141 -2.479 8.709 1.00 0.00 H new ATOM 0 HA ASN A 80 9.831 -1.373 10.777 1.00 0.00 H new ATOM 0 HB2 ASN A 80 9.080 -4.239 10.110 1.00 0.00 H new ATOM 0 HB3 ASN A 80 9.953 -3.727 11.540 1.00 0.00 H new ATOM 0 HD21 ASN A 80 6.231 -4.125 12.207 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.423 -5.141 11.390 1.00 0.00 H new ATOM 1240 N PRO A 81 12.073 -1.700 9.812 1.00 0.00 N ATOM 1241 CA PRO A 81 13.425 -1.826 9.282 1.00 0.00 C ATOM 1242 C PRO A 81 14.117 -3.100 9.761 1.00 0.00 C ATOM 1243 O PRO A 81 15.186 -3.461 9.277 1.00 0.00 O ATOM 1244 CB PRO A 81 14.144 -0.585 9.804 1.00 0.00 C ATOM 1245 CG PRO A 81 13.359 -0.128 10.977 1.00 0.00 C ATOM 1246 CD PRO A 81 11.957 -0.626 10.805 1.00 0.00 C ATOM 0 HA PRO A 81 13.428 -1.896 8.194 1.00 0.00 H new ATOM 0 HB2 PRO A 81 15.171 -0.818 10.087 1.00 0.00 H new ATOM 0 HB3 PRO A 81 14.192 0.190 9.039 1.00 0.00 H new ATOM 0 HG2 PRO A 81 13.791 -0.513 11.901 1.00 0.00 H new ATOM 0 HG3 PRO A 81 13.373 0.960 11.047 1.00 0.00 H new ATOM 0 HD2 PRO A 81 11.548 -0.996 11.745 1.00 0.00 H new ATOM 0 HD3 PRO A 81 11.293 0.166 10.459 1.00 0.00 H new ATOM 1254 N GLY A 82 13.496 -3.781 10.715 1.00 0.00 N ATOM 1255 CA GLY A 82 14.013 -5.050 11.174 1.00 0.00 C ATOM 1256 C GLY A 82 13.328 -6.213 10.491 1.00 0.00 C ATOM 1257 O GLY A 82 13.547 -7.371 10.846 1.00 0.00 O ATOM 0 H GLY A 82 12.641 -3.474 11.179 1.00 0.00 H new ATOM 0 HA2 GLY A 82 15.085 -5.096 10.984 1.00 0.00 H new ATOM 0 HA3 GLY A 82 13.877 -5.130 12.253 1.00 0.00 H new ATOM 1261 N LEU A 83 12.485 -5.906 9.511 1.00 0.00 N ATOM 1262 CA LEU A 83 11.765 -6.937 8.781 1.00 0.00 C ATOM 1263 C LEU A 83 12.296 -7.075 7.363 1.00 0.00 C ATOM 1264 O LEU A 83 12.408 -8.179 6.845 1.00 0.00 O ATOM 1265 CB LEU A 83 10.259 -6.630 8.753 1.00 0.00 C ATOM 1266 CG LEU A 83 9.526 -6.832 10.082 1.00 0.00 C ATOM 1267 CD1 LEU A 83 8.031 -6.965 9.851 1.00 0.00 C ATOM 1268 CD2 LEU A 83 10.059 -8.052 10.819 1.00 0.00 C ATOM 0 H LEU A 83 12.285 -4.953 9.206 1.00 0.00 H new ATOM 0 HA LEU A 83 11.921 -7.883 9.300 1.00 0.00 H new ATOM 0 HB2 LEU A 83 10.121 -5.597 8.434 1.00 0.00 H new ATOM 0 HB3 LEU A 83 9.790 -7.262 7.998 1.00 0.00 H new ATOM 0 HG LEU A 83 9.706 -5.954 10.703 1.00 0.00 H new ATOM 0 HD11 LEU A 83 7.526 -7.108 10.807 1.00 0.00 H new ATOM 0 HD12 LEU A 83 7.655 -6.060 9.374 1.00 0.00 H new ATOM 0 HD13 LEU A 83 7.837 -7.823 9.207 1.00 0.00 H new ATOM 0 HD21 LEU A 83 9.521 -8.173 11.759 1.00 0.00 H new ATOM 0 HD22 LEU A 83 9.917 -8.940 10.203 1.00 0.00 H new ATOM 0 HD23 LEU A 83 11.121 -7.918 11.023 1.00 0.00 H new ATOM 1280 N ILE A 84 12.649 -5.956 6.750 1.00 0.00 N ATOM 1281 CA ILE A 84 13.038 -5.959 5.346 1.00 0.00 C ATOM 1282 C ILE A 84 14.375 -6.651 5.116 1.00 0.00 C ATOM 1283 O ILE A 84 15.359 -6.380 5.810 1.00 0.00 O ATOM 1284 CB ILE A 84 13.136 -4.543 4.775 1.00 0.00 C ATOM 1285 CG1 ILE A 84 11.801 -3.815 4.935 1.00 0.00 C ATOM 1286 CG2 ILE A 84 13.559 -4.610 3.311 1.00 0.00 C ATOM 1287 CD1 ILE A 84 11.795 -2.430 4.331 1.00 0.00 C ATOM 0 H ILE A 84 12.675 -5.040 7.197 1.00 0.00 H new ATOM 0 HA ILE A 84 12.250 -6.511 4.833 1.00 0.00 H new ATOM 0 HB ILE A 84 13.890 -3.980 5.325 1.00 0.00 H new ATOM 0 HG12 ILE A 84 11.014 -4.409 4.470 1.00 0.00 H new ATOM 0 HG13 ILE A 84 11.561 -3.742 5.996 1.00 0.00 H new ATOM 0 HG21 ILE A 84 13.628 -3.601 2.906 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.530 -5.099 3.235 1.00 0.00 H new ATOM 0 HG23 ILE A 84 12.821 -5.178 2.745 1.00 0.00 H new ATOM 0 HD11 ILE A 84 10.817 -1.972 4.481 1.00 0.00 H new ATOM 0 HD12 ILE A 84 12.559 -1.820 4.812 1.00 0.00 H new ATOM 0 HD13 ILE A 84 12.004 -2.498 3.263 1.00 0.00 H new ATOM 1299 N PRO A 85 14.407 -7.579 4.150 1.00 0.00 N ATOM 1300 CA PRO A 85 15.638 -8.204 3.692 1.00 0.00 C ATOM 1301 C PRO A 85 16.418 -7.316 2.717 1.00 0.00 C ATOM 1302 O PRO A 85 15.861 -6.386 2.133 1.00 0.00 O ATOM 1303 CB PRO A 85 15.151 -9.479 3.011 1.00 0.00 C ATOM 1304 CG PRO A 85 13.786 -9.149 2.510 1.00 0.00 C ATOM 1305 CD PRO A 85 13.229 -8.090 3.427 1.00 0.00 C ATOM 0 HA PRO A 85 16.336 -8.388 4.509 1.00 0.00 H new ATOM 0 HB2 PRO A 85 15.812 -9.768 2.194 1.00 0.00 H new ATOM 0 HB3 PRO A 85 15.124 -10.315 3.710 1.00 0.00 H new ATOM 0 HG2 PRO A 85 13.828 -8.787 1.483 1.00 0.00 H new ATOM 0 HG3 PRO A 85 13.150 -10.034 2.510 1.00 0.00 H new ATOM 0 HD2 PRO A 85 12.733 -7.299 2.866 1.00 0.00 H new ATOM 0 HD3 PRO A 85 12.491 -8.506 4.113 1.00 0.00 H new ATOM 1313 N ASP A 86 17.691 -7.619 2.547 1.00 0.00 N ATOM 1314 CA ASP A 86 18.607 -6.844 1.710 1.00 0.00 C ATOM 1315 C ASP A 86 18.017 -6.493 0.350 1.00 0.00 C ATOM 1316 O ASP A 86 17.953 -5.319 -0.013 1.00 0.00 O ATOM 1317 CB ASP A 86 19.896 -7.642 1.519 1.00 0.00 C ATOM 1318 CG ASP A 86 20.672 -7.834 2.811 1.00 0.00 C ATOM 1319 OD1 ASP A 86 20.083 -8.313 3.804 1.00 0.00 O ATOM 1320 OD2 ASP A 86 21.877 -7.524 2.839 1.00 0.00 O ATOM 0 H ASP A 86 18.132 -8.424 2.992 1.00 0.00 H new ATOM 0 HA ASP A 86 18.802 -5.901 2.221 1.00 0.00 H new ATOM 0 HB2 ASP A 86 19.654 -8.618 1.099 1.00 0.00 H new ATOM 0 HB3 ASP A 86 20.529 -7.131 0.794 1.00 0.00 H new ATOM 1325 N ALA A 87 17.528 -7.488 -0.373 1.00 0.00 N ATOM 1326 CA ALA A 87 17.144 -7.281 -1.765 1.00 0.00 C ATOM 1327 C ALA A 87 15.836 -6.520 -1.860 1.00 0.00 C ATOM 1328 O ALA A 87 15.542 -5.894 -2.880 1.00 0.00 O ATOM 1329 CB ALA A 87 17.045 -8.604 -2.514 1.00 0.00 C ATOM 0 H ALA A 87 17.388 -8.437 -0.027 1.00 0.00 H new ATOM 0 HA ALA A 87 17.925 -6.683 -2.235 1.00 0.00 H new ATOM 0 HB1 ALA A 87 16.757 -8.416 -3.548 1.00 0.00 H new ATOM 0 HB2 ALA A 87 18.011 -9.108 -2.492 1.00 0.00 H new ATOM 0 HB3 ALA A 87 16.296 -9.236 -2.038 1.00 0.00 H new ATOM 1335 N ASP A 88 15.042 -6.582 -0.802 1.00 0.00 N ATOM 1336 CA ASP A 88 13.777 -5.875 -0.770 1.00 0.00 C ATOM 1337 C ASP A 88 13.986 -4.425 -0.376 1.00 0.00 C ATOM 1338 O ASP A 88 13.231 -3.545 -0.779 1.00 0.00 O ATOM 1339 CB ASP A 88 12.822 -6.559 0.203 1.00 0.00 C ATOM 1340 CG ASP A 88 11.376 -6.356 -0.179 1.00 0.00 C ATOM 1341 OD1 ASP A 88 11.123 -5.959 -1.334 1.00 0.00 O ATOM 1342 OD2 ASP A 88 10.499 -6.644 0.649 1.00 0.00 O ATOM 0 H ASP A 88 15.253 -7.114 0.042 1.00 0.00 H new ATOM 0 HA ASP A 88 13.339 -5.897 -1.768 1.00 0.00 H new ATOM 0 HB2 ASP A 88 13.041 -7.626 0.235 1.00 0.00 H new ATOM 0 HB3 ASP A 88 12.989 -6.169 1.207 1.00 0.00 H new ATOM 1347 N ALA A 89 15.043 -4.176 0.377 1.00 0.00 N ATOM 1348 CA ALA A 89 15.284 -2.857 0.915 1.00 0.00 C ATOM 1349 C ALA A 89 15.763 -1.897 -0.149 1.00 0.00 C ATOM 1350 O ALA A 89 15.419 -0.733 -0.135 1.00 0.00 O ATOM 1351 CB ALA A 89 16.297 -2.912 2.040 1.00 0.00 C ATOM 0 H ALA A 89 15.745 -4.872 0.627 1.00 0.00 H new ATOM 0 HA ALA A 89 14.333 -2.492 1.303 1.00 0.00 H new ATOM 0 HB1 ALA A 89 16.463 -1.908 2.430 1.00 0.00 H new ATOM 0 HB2 ALA A 89 15.921 -3.553 2.837 1.00 0.00 H new ATOM 0 HB3 ALA A 89 17.237 -3.315 1.664 1.00 0.00 H new ATOM 1357 N VAL A 90 16.622 -2.368 -1.022 1.00 0.00 N ATOM 1358 CA VAL A 90 17.187 -1.530 -2.041 1.00 0.00 C ATOM 1359 C VAL A 90 16.612 -1.774 -3.440 1.00 0.00 C ATOM 1360 O VAL A 90 17.353 -1.853 -4.424 1.00 0.00 O ATOM 1361 CB VAL A 90 18.701 -1.622 -2.017 1.00 0.00 C ATOM 1362 CG1 VAL A 90 19.183 -0.551 -1.078 1.00 0.00 C ATOM 1363 CG2 VAL A 90 19.188 -2.983 -1.553 1.00 0.00 C ATOM 0 H VAL A 90 16.944 -3.336 -1.043 1.00 0.00 H new ATOM 0 HA VAL A 90 16.895 -0.507 -1.803 1.00 0.00 H new ATOM 0 HB VAL A 90 19.094 -1.486 -3.024 1.00 0.00 H new ATOM 0 HG11 VAL A 90 20.271 -0.576 -1.026 1.00 0.00 H new ATOM 0 HG12 VAL A 90 18.859 0.424 -1.442 1.00 0.00 H new ATOM 0 HG13 VAL A 90 18.768 -0.724 -0.085 1.00 0.00 H new ATOM 0 HG21 VAL A 90 20.278 -2.999 -1.553 1.00 0.00 H new ATOM 0 HG22 VAL A 90 18.822 -3.176 -0.544 1.00 0.00 H new ATOM 0 HG23 VAL A 90 18.814 -3.753 -2.228 1.00 0.00 H new ATOM 1373 N GLY A 91 15.293 -1.897 -3.523 1.00 0.00 N ATOM 1374 CA GLY A 91 14.655 -2.262 -4.775 1.00 0.00 C ATOM 1375 C GLY A 91 13.161 -2.229 -4.701 1.00 0.00 C ATOM 1376 O GLY A 91 12.567 -1.256 -4.244 1.00 0.00 O ATOM 0 H GLY A 91 14.652 -1.750 -2.744 1.00 0.00 H new ATOM 0 HA2 GLY A 91 14.990 -1.582 -5.559 1.00 0.00 H new ATOM 0 HA3 GLY A 91 14.977 -3.263 -5.062 1.00 0.00 H new ATOM 1380 N VAL A 92 12.567 -3.311 -5.140 1.00 0.00 N ATOM 1381 CA VAL A 92 11.166 -3.359 -5.422 1.00 0.00 C ATOM 1382 C VAL A 92 10.366 -4.058 -4.359 1.00 0.00 C ATOM 1383 O VAL A 92 10.561 -5.234 -4.060 1.00 0.00 O ATOM 1384 CB VAL A 92 10.943 -4.032 -6.766 1.00 0.00 C ATOM 1385 CG1 VAL A 92 10.585 -2.988 -7.766 1.00 0.00 C ATOM 1386 CG2 VAL A 92 12.180 -4.781 -7.210 1.00 0.00 C ATOM 0 H VAL A 92 13.055 -4.190 -5.311 1.00 0.00 H new ATOM 0 HA VAL A 92 10.812 -2.328 -5.446 1.00 0.00 H new ATOM 0 HB VAL A 92 10.134 -4.757 -6.676 1.00 0.00 H new ATOM 0 HG11 VAL A 92 10.422 -3.455 -8.737 1.00 0.00 H new ATOM 0 HG12 VAL A 92 9.674 -2.479 -7.450 1.00 0.00 H new ATOM 0 HG13 VAL A 92 11.397 -2.265 -7.843 1.00 0.00 H new ATOM 0 HG21 VAL A 92 11.993 -5.253 -8.174 1.00 0.00 H new ATOM 0 HG22 VAL A 92 13.013 -4.085 -7.302 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.426 -5.546 -6.473 1.00 0.00 H new ATOM 1396 N THR A 93 9.449 -3.297 -3.825 1.00 0.00 N ATOM 1397 CA THR A 93 8.530 -3.736 -2.831 1.00 0.00 C ATOM 1398 C THR A 93 7.171 -3.206 -3.238 1.00 0.00 C ATOM 1399 O THR A 93 7.081 -2.430 -4.180 1.00 0.00 O ATOM 1400 CB THR A 93 8.921 -3.185 -1.459 1.00 0.00 C ATOM 1401 OG1 THR A 93 10.335 -3.298 -1.265 1.00 0.00 O ATOM 1402 CG2 THR A 93 8.200 -3.923 -0.356 1.00 0.00 C ATOM 0 H THR A 93 9.324 -2.319 -4.086 1.00 0.00 H new ATOM 0 HA THR A 93 8.526 -4.823 -2.756 1.00 0.00 H new ATOM 0 HB THR A 93 8.633 -2.134 -1.424 1.00 0.00 H new ATOM 0 HG1 THR A 93 10.601 -4.238 -1.339 1.00 0.00 H new ATOM 0 HG21 THR A 93 8.495 -3.513 0.610 1.00 0.00 H new ATOM 0 HG22 THR A 93 7.124 -3.809 -0.485 1.00 0.00 H new ATOM 0 HG23 THR A 93 8.460 -4.981 -0.395 1.00 0.00 H new ATOM 1410 N VAL A 94 6.124 -3.653 -2.604 1.00 0.00 N ATOM 1411 CA VAL A 94 4.806 -3.110 -2.869 1.00 0.00 C ATOM 1412 C VAL A 94 4.109 -2.755 -1.581 1.00 0.00 C ATOM 1413 O VAL A 94 4.336 -3.398 -0.553 1.00 0.00 O ATOM 1414 CB VAL A 94 3.940 -4.081 -3.694 1.00 0.00 C ATOM 1415 CG1 VAL A 94 2.483 -3.762 -3.554 1.00 0.00 C ATOM 1416 CG2 VAL A 94 4.278 -3.935 -5.140 1.00 0.00 C ATOM 0 H VAL A 94 6.149 -4.390 -1.900 1.00 0.00 H new ATOM 0 HA VAL A 94 4.942 -2.204 -3.460 1.00 0.00 H new ATOM 0 HB VAL A 94 4.137 -5.089 -3.330 1.00 0.00 H new ATOM 0 HG11 VAL A 94 1.898 -4.464 -4.148 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.192 -3.842 -2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 94 2.297 -2.747 -3.906 1.00 0.00 H new ATOM 0 HG21 VAL A 94 3.667 -4.621 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.082 -2.911 -5.458 1.00 0.00 H new ATOM 0 HG23 VAL A 94 5.332 -4.167 -5.292 1.00 0.00 H new ATOM 1426 N VAL A 95 3.271 -1.730 -1.620 1.00 0.00 N ATOM 1427 CA VAL A 95 2.524 -1.382 -0.462 1.00 0.00 C ATOM 1428 C VAL A 95 1.072 -1.206 -0.892 1.00 0.00 C ATOM 1429 O VAL A 95 0.716 -0.274 -1.615 1.00 0.00 O ATOM 1430 CB VAL A 95 3.153 -0.146 0.226 1.00 0.00 C ATOM 1431 CG1 VAL A 95 2.892 1.146 -0.529 1.00 0.00 C ATOM 1432 CG2 VAL A 95 2.711 -0.056 1.664 1.00 0.00 C ATOM 0 H VAL A 95 3.105 -1.143 -2.438 1.00 0.00 H new ATOM 0 HA VAL A 95 2.548 -2.162 0.299 1.00 0.00 H new ATOM 0 HB VAL A 95 4.234 -0.285 0.210 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.357 1.977 0.001 1.00 0.00 H new ATOM 0 HG12 VAL A 95 3.314 1.073 -1.531 1.00 0.00 H new ATOM 0 HG13 VAL A 95 1.818 1.316 -0.599 1.00 0.00 H new ATOM 0 HG21 VAL A 95 3.164 0.819 2.130 1.00 0.00 H new ATOM 0 HG22 VAL A 95 1.625 0.032 1.706 1.00 0.00 H new ATOM 0 HG23 VAL A 95 3.024 -0.954 2.198 1.00 0.00 H new ATOM 1442 N LEU A 96 0.251 -2.169 -0.511 1.00 0.00 N ATOM 1443 CA LEU A 96 -1.094 -2.265 -1.046 1.00 0.00 C ATOM 1444 C LEU A 96 -2.107 -1.639 -0.121 1.00 0.00 C ATOM 1445 O LEU A 96 -2.132 -1.925 1.073 1.00 0.00 O ATOM 1446 CB LEU A 96 -1.506 -3.719 -1.369 1.00 0.00 C ATOM 1447 CG LEU A 96 -0.866 -4.830 -0.529 1.00 0.00 C ATOM 1448 CD1 LEU A 96 -1.811 -6.023 -0.392 1.00 0.00 C ATOM 1449 CD2 LEU A 96 0.412 -5.285 -1.189 1.00 0.00 C ATOM 0 H LEU A 96 0.492 -2.894 0.165 1.00 0.00 H new ATOM 0 HA LEU A 96 -1.080 -1.708 -1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.588 -3.795 -1.262 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.274 -3.911 -2.417 1.00 0.00 H new ATOM 0 HG LEU A 96 -0.657 -4.434 0.465 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.334 -6.798 0.208 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.733 -5.703 0.094 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.041 -6.420 -1.381 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.868 -6.075 -0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.191 -5.665 -2.187 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.101 -4.444 -1.265 1.00 0.00 H new ATOM 1461 N ILE A 97 -2.946 -0.782 -0.681 1.00 0.00 N ATOM 1462 CA ILE A 97 -4.051 -0.245 0.069 1.00 0.00 C ATOM 1463 C ILE A 97 -5.258 -1.072 -0.219 1.00 0.00 C ATOM 1464 O ILE A 97 -5.953 -0.893 -1.223 1.00 0.00 O ATOM 1465 CB ILE A 97 -4.358 1.230 -0.203 1.00 0.00 C ATOM 1466 CG1 ILE A 97 -3.162 2.071 0.197 1.00 0.00 C ATOM 1467 CG2 ILE A 97 -5.599 1.669 0.570 1.00 0.00 C ATOM 1468 CD1 ILE A 97 -3.399 3.548 0.040 1.00 0.00 C ATOM 0 H ILE A 97 -2.878 -0.451 -1.643 1.00 0.00 H new ATOM 0 HA ILE A 97 -3.765 -0.287 1.120 1.00 0.00 H new ATOM 0 HB ILE A 97 -4.556 1.366 -1.266 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -2.907 1.859 1.235 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -2.303 1.781 -0.408 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -5.803 2.720 0.365 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.453 1.067 0.260 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -5.429 1.534 1.638 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -2.506 4.094 0.343 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -3.625 3.771 -1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -4.239 3.850 0.666 1.00 0.00 H new ATOM 1480 N THR A 98 -5.442 -2.022 0.639 1.00 0.00 N ATOM 1481 CA THR A 98 -6.543 -2.905 0.551 1.00 0.00 C ATOM 1482 C THR A 98 -7.664 -2.356 1.374 1.00 0.00 C ATOM 1483 O THR A 98 -7.556 -2.228 2.599 1.00 0.00 O ATOM 1484 CB THR A 98 -6.185 -4.307 1.048 1.00 0.00 C ATOM 1485 OG1 THR A 98 -5.974 -4.299 2.466 1.00 0.00 O ATOM 1486 CG2 THR A 98 -4.928 -4.800 0.366 1.00 0.00 C ATOM 0 H THR A 98 -4.821 -2.203 1.427 1.00 0.00 H new ATOM 0 HA THR A 98 -6.836 -2.989 -0.495 1.00 0.00 H new ATOM 0 HB THR A 98 -7.015 -4.972 0.810 1.00 0.00 H new ATOM 0 HG1 THR A 98 -6.259 -3.437 2.834 1.00 0.00 H new ATOM 0 HG21 THR A 98 -4.685 -5.799 0.729 1.00 0.00 H new ATOM 0 HG22 THR A 98 -5.088 -4.835 -0.712 1.00 0.00 H new ATOM 0 HG23 THR A 98 -4.104 -4.122 0.588 1.00 0.00 H new ATOM 1494 N CYS A 99 -8.706 -1.968 0.708 1.00 0.00 N ATOM 1495 CA CYS A 99 -9.903 -1.613 1.416 1.00 0.00 C ATOM 1496 C CYS A 99 -10.574 -2.884 1.880 1.00 0.00 C ATOM 1497 O CYS A 99 -10.327 -3.950 1.331 1.00 0.00 O ATOM 1498 CB CYS A 99 -10.829 -0.831 0.538 1.00 0.00 C ATOM 1499 SG CYS A 99 -11.215 -1.725 -0.945 1.00 0.00 S ATOM 0 H CYS A 99 -8.757 -1.888 -0.308 1.00 0.00 H new ATOM 0 HA CYS A 99 -9.650 -0.986 2.271 1.00 0.00 H new ATOM 0 HB2 CYS A 99 -11.748 -0.608 1.081 1.00 0.00 H new ATOM 0 HB3 CYS A 99 -10.371 0.124 0.281 1.00 0.00 H new ATOM 0 HG CYS A 99 -12.505 -1.769 -1.102 1.00 0.00 H new ATOM 1505 N THR A 100 -11.415 -2.772 2.869 1.00 0.00 N ATOM 1506 CA THR A 100 -11.981 -3.919 3.518 1.00 0.00 C ATOM 1507 C THR A 100 -13.344 -3.536 4.048 1.00 0.00 C ATOM 1508 O THR A 100 -13.454 -2.806 5.026 1.00 0.00 O ATOM 1509 CB THR A 100 -11.074 -4.402 4.673 1.00 0.00 C ATOM 1510 OG1 THR A 100 -9.733 -4.587 4.199 1.00 0.00 O ATOM 1511 CG2 THR A 100 -11.583 -5.707 5.267 1.00 0.00 C ATOM 0 H THR A 100 -11.728 -1.879 3.249 1.00 0.00 H new ATOM 0 HA THR A 100 -12.069 -4.738 2.804 1.00 0.00 H new ATOM 0 HB THR A 100 -11.090 -3.639 5.451 1.00 0.00 H new ATOM 0 HG1 THR A 100 -9.164 -4.891 4.937 1.00 0.00 H new ATOM 0 HG21 THR A 100 -10.924 -6.020 6.077 1.00 0.00 H new ATOM 0 HG22 THR A 100 -12.591 -5.561 5.656 1.00 0.00 H new ATOM 0 HG23 THR A 100 -11.600 -6.476 4.495 1.00 0.00 H new ATOM 1519 N TYR A 101 -14.377 -3.968 3.367 1.00 0.00 N ATOM 1520 CA TYR A 101 -15.716 -3.649 3.788 1.00 0.00 C ATOM 1521 C TYR A 101 -16.471 -4.935 4.101 1.00 0.00 C ATOM 1522 O TYR A 101 -16.495 -5.872 3.295 1.00 0.00 O ATOM 1523 CB TYR A 101 -16.412 -2.795 2.718 1.00 0.00 C ATOM 1524 CG TYR A 101 -17.774 -2.300 3.117 1.00 0.00 C ATOM 1525 CD1 TYR A 101 -18.908 -3.065 2.918 1.00 0.00 C ATOM 1526 CD2 TYR A 101 -17.922 -1.053 3.686 1.00 0.00 C ATOM 1527 CE1 TYR A 101 -20.156 -2.600 3.284 1.00 0.00 C ATOM 1528 CE2 TYR A 101 -19.159 -0.583 4.048 1.00 0.00 C ATOM 1529 CZ TYR A 101 -20.275 -1.356 3.850 1.00 0.00 C ATOM 1530 OH TYR A 101 -21.512 -0.870 4.208 1.00 0.00 O ATOM 0 H TYR A 101 -14.316 -4.538 2.524 1.00 0.00 H new ATOM 0 HA TYR A 101 -15.695 -3.055 4.702 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -15.780 -1.938 2.485 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -16.504 -3.381 1.804 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -18.817 -4.043 2.469 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -17.050 -0.436 3.849 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -21.032 -3.211 3.126 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -19.254 0.398 4.490 1.00 0.00 H new ATOM 0 HH TYR A 101 -22.172 -1.125 3.530 1.00 0.00 H new ATOM 1540 N ARG A 102 -17.017 -4.994 5.315 1.00 0.00 N ATOM 1541 CA ARG A 102 -17.772 -6.154 5.809 1.00 0.00 C ATOM 1542 C ARG A 102 -16.879 -7.378 5.993 1.00 0.00 C ATOM 1543 O ARG A 102 -17.365 -8.502 6.127 1.00 0.00 O ATOM 1544 CB ARG A 102 -18.903 -6.504 4.867 1.00 0.00 C ATOM 1545 CG ARG A 102 -19.899 -5.402 4.684 1.00 0.00 C ATOM 1546 CD ARG A 102 -21.115 -5.604 5.542 1.00 0.00 C ATOM 1547 NE ARG A 102 -22.181 -4.647 5.246 1.00 0.00 N ATOM 1548 CZ ARG A 102 -23.192 -4.391 6.073 1.00 0.00 C ATOM 1549 NH1 ARG A 102 -23.213 -4.933 7.282 1.00 0.00 N ATOM 1550 NH2 ARG A 102 -24.176 -3.583 5.697 1.00 0.00 N ATOM 0 H ARG A 102 -16.949 -4.234 5.992 1.00 0.00 H new ATOM 0 HA ARG A 102 -18.179 -5.871 6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -18.486 -6.769 3.896 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -19.418 -7.388 5.245 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -19.435 -4.447 4.930 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -20.197 -5.351 3.637 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -21.492 -6.617 5.398 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -20.833 -5.514 6.591 1.00 0.00 H new ATOM 0 HE ARG A 102 -22.148 -4.148 4.357 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -22.454 -5.547 7.579 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -23.988 -4.737 7.916 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -24.159 -3.156 4.771 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -24.949 -3.390 6.334 1.00 0.00 H new ATOM 1564 N GLY A 103 -15.580 -7.158 5.982 1.00 0.00 N ATOM 1565 CA GLY A 103 -14.643 -8.237 6.215 1.00 0.00 C ATOM 1566 C GLY A 103 -14.044 -8.774 4.933 1.00 0.00 C ATOM 1567 O GLY A 103 -13.294 -9.751 4.952 1.00 0.00 O ATOM 0 H GLY A 103 -15.151 -6.248 5.815 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -13.843 -7.884 6.866 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -15.149 -9.046 6.742 1.00 0.00 H new ATOM 1571 N GLN A 104 -14.376 -8.139 3.817 1.00 0.00 N ATOM 1572 CA GLN A 104 -13.816 -8.525 2.530 1.00 0.00 C ATOM 1573 C GLN A 104 -13.093 -7.340 1.906 1.00 0.00 C ATOM 1574 O GLN A 104 -13.568 -6.212 1.969 1.00 0.00 O ATOM 1575 CB GLN A 104 -14.901 -9.049 1.577 1.00 0.00 C ATOM 1576 CG GLN A 104 -15.671 -10.243 2.115 1.00 0.00 C ATOM 1577 CD GLN A 104 -17.152 -9.960 2.295 1.00 0.00 C ATOM 1578 OE1 GLN A 104 -17.983 -10.846 2.121 1.00 0.00 O ATOM 1579 NE2 GLN A 104 -17.496 -8.732 2.671 1.00 0.00 N ATOM 0 H GLN A 104 -15.029 -7.356 3.777 1.00 0.00 H new ATOM 0 HA GLN A 104 -13.106 -9.335 2.699 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -15.603 -8.243 1.364 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -14.436 -9.326 0.631 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -15.548 -11.085 1.434 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -15.245 -10.542 3.072 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -16.778 -8.020 2.806 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -18.478 -8.502 2.824 1.00 0.00 H new ATOM 1588 N GLU A 105 -11.940 -7.599 1.325 1.00 0.00 N ATOM 1589 CA GLU A 105 -11.138 -6.551 0.716 1.00 0.00 C ATOM 1590 C GLU A 105 -11.559 -6.329 -0.735 1.00 0.00 C ATOM 1591 O GLU A 105 -11.606 -7.284 -1.510 1.00 0.00 O ATOM 1592 CB GLU A 105 -9.671 -6.946 0.786 1.00 0.00 C ATOM 1593 CG GLU A 105 -9.166 -7.117 2.201 1.00 0.00 C ATOM 1594 CD GLU A 105 -8.146 -8.227 2.305 1.00 0.00 C ATOM 1595 OE1 GLU A 105 -6.939 -7.965 2.092 1.00 0.00 O ATOM 1596 OE2 GLU A 105 -8.547 -9.372 2.557 1.00 0.00 O ATOM 0 H GLU A 105 -11.533 -8.532 1.260 1.00 0.00 H new ATOM 0 HA GLU A 105 -11.291 -5.618 1.258 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.526 -7.879 0.240 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.073 -6.186 0.283 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.722 -6.182 2.543 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.005 -7.332 2.862 1.00 0.00 H new ATOM 1603 N PHE A 106 -11.856 -5.084 -1.118 1.00 0.00 N ATOM 1604 CA PHE A 106 -12.417 -4.831 -2.449 1.00 0.00 C ATOM 1605 C PHE A 106 -11.522 -3.968 -3.347 1.00 0.00 C ATOM 1606 O PHE A 106 -11.912 -3.630 -4.458 1.00 0.00 O ATOM 1607 CB PHE A 106 -13.832 -4.234 -2.353 1.00 0.00 C ATOM 1608 CG PHE A 106 -13.928 -2.899 -1.669 1.00 0.00 C ATOM 1609 CD1 PHE A 106 -14.086 -2.837 -0.296 1.00 0.00 C ATOM 1610 CD2 PHE A 106 -13.884 -1.712 -2.387 1.00 0.00 C ATOM 1611 CE1 PHE A 106 -14.193 -1.633 0.354 1.00 0.00 C ATOM 1612 CE2 PHE A 106 -13.982 -0.497 -1.739 1.00 0.00 C ATOM 1613 CZ PHE A 106 -14.137 -0.463 -0.364 1.00 0.00 C ATOM 0 H PHE A 106 -11.722 -4.253 -0.542 1.00 0.00 H new ATOM 0 HA PHE A 106 -12.475 -5.807 -2.931 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -14.235 -4.136 -3.361 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -14.470 -4.941 -1.823 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -14.126 -3.753 0.275 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -13.772 -1.739 -3.461 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -14.321 -1.605 1.426 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -13.938 0.423 -2.303 1.00 0.00 H new ATOM 0 HZ PHE A 106 -14.214 0.486 0.146 1.00 0.00 H new ATOM 1623 N ILE A 107 -10.349 -3.570 -2.877 1.00 0.00 N ATOM 1624 CA ILE A 107 -9.357 -2.993 -3.760 1.00 0.00 C ATOM 1625 C ILE A 107 -7.982 -3.210 -3.172 1.00 0.00 C ATOM 1626 O ILE A 107 -7.838 -3.366 -1.961 1.00 0.00 O ATOM 1627 CB ILE A 107 -9.581 -1.492 -4.042 1.00 0.00 C ATOM 1628 CG1 ILE A 107 -8.752 -1.071 -5.240 1.00 0.00 C ATOM 1629 CG2 ILE A 107 -9.228 -0.620 -2.844 1.00 0.00 C ATOM 1630 CD1 ILE A 107 -8.771 0.421 -5.445 1.00 0.00 C ATOM 0 H ILE A 107 -10.066 -3.636 -1.899 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.451 -3.499 -4.721 1.00 0.00 H new ATOM 0 HB ILE A 107 -10.642 -1.351 -4.248 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.723 -1.405 -5.104 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.132 -1.564 -6.135 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.402 0.427 -3.092 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -9.850 -0.900 -1.994 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -8.178 -0.762 -2.587 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -8.164 0.677 -6.314 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.796 0.753 -5.608 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.366 0.915 -4.562 1.00 0.00 H new ATOM 1642 N ARG A 108 -6.991 -3.242 -4.031 1.00 0.00 N ATOM 1643 CA ARG A 108 -5.627 -3.453 -3.621 1.00 0.00 C ATOM 1644 C ARG A 108 -4.707 -2.623 -4.480 1.00 0.00 C ATOM 1645 O ARG A 108 -4.301 -3.057 -5.555 1.00 0.00 O ATOM 1646 CB ARG A 108 -5.295 -4.922 -3.776 1.00 0.00 C ATOM 1647 CG ARG A 108 -4.169 -5.382 -2.881 1.00 0.00 C ATOM 1648 CD ARG A 108 -4.293 -6.860 -2.565 1.00 0.00 C ATOM 1649 NE ARG A 108 -5.683 -7.239 -2.330 1.00 0.00 N ATOM 1650 CZ ARG A 108 -6.170 -7.664 -1.165 1.00 0.00 C ATOM 1651 NH1 ARG A 108 -5.380 -7.800 -0.106 1.00 0.00 N ATOM 1652 NH2 ARG A 108 -7.458 -7.953 -1.059 1.00 0.00 N ATOM 0 H ARG A 108 -7.111 -3.122 -5.037 1.00 0.00 H new ATOM 0 HA ARG A 108 -5.499 -3.156 -2.580 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -6.185 -5.513 -3.559 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -5.027 -5.118 -4.814 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -3.212 -5.190 -3.367 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -4.178 -4.807 -1.955 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -3.889 -7.445 -3.391 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -3.696 -7.097 -1.685 1.00 0.00 H new ATOM 0 HE ARG A 108 -6.330 -7.174 -3.116 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -4.387 -7.578 -0.179 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -5.766 -8.126 0.780 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -8.072 -7.850 -1.867 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.836 -8.279 -0.169 1.00 0.00 H new ATOM 1666 N VAL A 109 -4.415 -1.414 -4.046 1.00 0.00 N ATOM 1667 CA VAL A 109 -3.459 -0.617 -4.771 1.00 0.00 C ATOM 1668 C VAL A 109 -2.057 -1.021 -4.319 1.00 0.00 C ATOM 1669 O VAL A 109 -1.603 -0.695 -3.234 1.00 0.00 O ATOM 1670 CB VAL A 109 -3.722 0.915 -4.622 1.00 0.00 C ATOM 1671 CG1 VAL A 109 -2.982 1.547 -3.448 1.00 0.00 C ATOM 1672 CG2 VAL A 109 -3.384 1.634 -5.914 1.00 0.00 C ATOM 0 H VAL A 109 -4.816 -0.975 -3.217 1.00 0.00 H new ATOM 0 HA VAL A 109 -3.561 -0.812 -5.839 1.00 0.00 H new ATOM 0 HB VAL A 109 -4.785 1.027 -4.407 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -3.211 2.612 -3.405 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -3.297 1.070 -2.520 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.908 1.411 -3.579 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -3.572 2.701 -5.796 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.333 1.475 -6.155 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -4.004 1.243 -6.721 1.00 0.00 H new ATOM 1682 N GLY A 110 -1.404 -1.822 -5.117 1.00 0.00 N ATOM 1683 CA GLY A 110 -0.058 -2.193 -4.806 1.00 0.00 C ATOM 1684 C GLY A 110 0.915 -1.234 -5.400 1.00 0.00 C ATOM 1685 O GLY A 110 1.460 -1.459 -6.479 1.00 0.00 O ATOM 0 H GLY A 110 -1.780 -2.224 -5.976 1.00 0.00 H new ATOM 0 HA2 GLY A 110 0.073 -2.225 -3.724 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.141 -3.197 -5.181 1.00 0.00 H new ATOM 1689 N TYR A 111 1.102 -0.137 -4.712 1.00 0.00 N ATOM 1690 CA TYR A 111 2.104 0.817 -5.120 1.00 0.00 C ATOM 1691 C TYR A 111 3.446 0.224 -4.885 1.00 0.00 C ATOM 1692 O TYR A 111 3.822 -0.064 -3.749 1.00 0.00 O ATOM 1693 CB TYR A 111 1.999 2.152 -4.396 1.00 0.00 C ATOM 1694 CG TYR A 111 1.002 3.058 -5.039 1.00 0.00 C ATOM 1695 CD1 TYR A 111 1.368 3.893 -6.080 1.00 0.00 C ATOM 1696 CD2 TYR A 111 -0.305 3.054 -4.624 1.00 0.00 C ATOM 1697 CE1 TYR A 111 0.443 4.711 -6.690 1.00 0.00 C ATOM 1698 CE2 TYR A 111 -1.243 3.867 -5.227 1.00 0.00 C ATOM 1699 CZ TYR A 111 -0.864 4.694 -6.261 1.00 0.00 C ATOM 1700 OH TYR A 111 -1.794 5.506 -6.860 1.00 0.00 O ATOM 0 H TYR A 111 0.579 0.118 -3.874 1.00 0.00 H new ATOM 0 HA TYR A 111 1.943 1.029 -6.177 1.00 0.00 H new ATOM 0 HB2 TYR A 111 1.716 1.980 -3.357 1.00 0.00 H new ATOM 0 HB3 TYR A 111 2.975 2.636 -4.385 1.00 0.00 H new ATOM 0 HD1 TYR A 111 2.393 3.903 -6.419 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -0.604 2.406 -3.814 1.00 0.00 H new ATOM 0 HE1 TYR A 111 0.742 5.361 -7.499 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -2.269 3.855 -4.890 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.515 4.957 -7.234 1.00 0.00 H new ATOM 1710 N TYR A 112 4.152 0.007 -5.955 1.00 0.00 N ATOM 1711 CA TYR A 112 5.465 -0.525 -5.850 1.00 0.00 C ATOM 1712 C TYR A 112 6.348 0.506 -5.179 1.00 0.00 C ATOM 1713 O TYR A 112 6.627 1.553 -5.754 1.00 0.00 O ATOM 1714 CB TYR A 112 6.026 -0.828 -7.229 1.00 0.00 C ATOM 1715 CG TYR A 112 5.974 -2.276 -7.632 1.00 0.00 C ATOM 1716 CD1 TYR A 112 4.816 -2.838 -8.156 1.00 0.00 C ATOM 1717 CD2 TYR A 112 7.093 -3.079 -7.494 1.00 0.00 C ATOM 1718 CE1 TYR A 112 4.778 -4.167 -8.528 1.00 0.00 C ATOM 1719 CE2 TYR A 112 7.073 -4.405 -7.864 1.00 0.00 C ATOM 1720 CZ TYR A 112 5.911 -4.949 -8.380 1.00 0.00 C ATOM 1721 OH TYR A 112 5.882 -6.271 -8.756 1.00 0.00 O ATOM 0 H TYR A 112 3.835 0.192 -6.907 1.00 0.00 H new ATOM 0 HA TYR A 112 5.435 -1.447 -5.270 1.00 0.00 H new ATOM 0 HB2 TYR A 112 5.476 -0.242 -7.965 1.00 0.00 H new ATOM 0 HB3 TYR A 112 7.063 -0.493 -7.265 1.00 0.00 H new ATOM 0 HD1 TYR A 112 3.934 -2.227 -8.274 1.00 0.00 H new ATOM 0 HD2 TYR A 112 8.000 -2.657 -7.088 1.00 0.00 H new ATOM 0 HE1 TYR A 112 3.871 -4.593 -8.931 1.00 0.00 H new ATOM 0 HE2 TYR A 112 7.957 -5.015 -7.752 1.00 0.00 H new ATOM 0 HH TYR A 112 6.757 -6.678 -8.588 1.00 0.00 H new ATOM 1731 N VAL A 113 6.781 0.230 -3.973 1.00 0.00 N ATOM 1732 CA VAL A 113 7.645 1.151 -3.299 1.00 0.00 C ATOM 1733 C VAL A 113 9.053 0.747 -3.627 1.00 0.00 C ATOM 1734 O VAL A 113 9.537 -0.309 -3.222 1.00 0.00 O ATOM 1735 CB VAL A 113 7.407 1.222 -1.763 1.00 0.00 C ATOM 1736 CG1 VAL A 113 7.221 -0.157 -1.150 1.00 0.00 C ATOM 1737 CG2 VAL A 113 8.556 1.939 -1.071 1.00 0.00 C ATOM 0 H VAL A 113 6.550 -0.614 -3.449 1.00 0.00 H new ATOM 0 HA VAL A 113 7.433 2.162 -3.646 1.00 0.00 H new ATOM 0 HB VAL A 113 6.486 1.786 -1.612 1.00 0.00 H new ATOM 0 HG11 VAL A 113 7.058 -0.059 -0.077 1.00 0.00 H new ATOM 0 HG12 VAL A 113 6.359 -0.644 -1.605 1.00 0.00 H new ATOM 0 HG13 VAL A 113 8.113 -0.758 -1.328 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.368 1.977 0.002 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.486 1.401 -1.258 1.00 0.00 H new ATOM 0 HG23 VAL A 113 8.639 2.954 -1.461 1.00 0.00 H new ATOM 1747 N ASN A 114 9.674 1.571 -4.421 1.00 0.00 N ATOM 1748 CA ASN A 114 11.022 1.306 -4.868 1.00 0.00 C ATOM 1749 C ASN A 114 11.997 2.051 -3.991 1.00 0.00 C ATOM 1750 O ASN A 114 12.052 3.277 -4.000 1.00 0.00 O ATOM 1751 CB ASN A 114 11.194 1.687 -6.333 1.00 0.00 C ATOM 1752 CG ASN A 114 12.190 0.782 -7.018 1.00 0.00 C ATOM 1753 OD1 ASN A 114 11.714 -0.382 -7.416 1.00 0.00 O flip ATOM 1754 ND2 ASN A 114 13.368 1.108 -7.159 1.00 0.00 N flip ATOM 0 H ASN A 114 9.271 2.438 -4.777 1.00 0.00 H new ATOM 0 HA ASN A 114 11.222 0.238 -4.787 1.00 0.00 H new ATOM 0 HB2 ASN A 114 10.232 1.626 -6.843 1.00 0.00 H new ATOM 0 HB3 ASN A 114 11.529 2.722 -6.406 1.00 0.00 H new ATOM 0 HD21 ASN A 114 13.687 2.021 -6.834 1.00 0.00 H new ATOM 0 HD22 ASN A 114 14.026 0.466 -7.601 1.00 0.00 H new ATOM 1761 N ASN A 115 12.780 1.307 -3.247 1.00 0.00 N ATOM 1762 CA ASN A 115 13.539 1.873 -2.174 1.00 0.00 C ATOM 1763 C ASN A 115 14.973 2.045 -2.618 1.00 0.00 C ATOM 1764 O ASN A 115 15.716 1.084 -2.796 1.00 0.00 O ATOM 1765 CB ASN A 115 13.455 0.991 -0.932 1.00 0.00 C ATOM 1766 CG ASN A 115 12.054 0.881 -0.359 1.00 0.00 C ATOM 1767 OD1 ASN A 115 11.614 1.740 0.410 1.00 0.00 O ATOM 1768 ND2 ASN A 115 11.354 -0.190 -0.699 1.00 0.00 N ATOM 0 H ASN A 115 12.904 0.302 -3.372 1.00 0.00 H new ATOM 0 HA ASN A 115 13.127 2.848 -1.914 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.817 -0.007 -1.180 1.00 0.00 H new ATOM 0 HB3 ASN A 115 14.121 1.390 -0.167 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.416 -0.327 -0.322 1.00 0.00 H new ATOM 0 HD22 ASN A 115 11.753 -0.878 -1.338 1.00 0.00 H new ATOM 1775 N GLU A 116 15.339 3.281 -2.809 1.00 0.00 N ATOM 1776 CA GLU A 116 16.621 3.637 -3.352 1.00 0.00 C ATOM 1777 C GLU A 116 17.212 4.757 -2.517 1.00 0.00 C ATOM 1778 O GLU A 116 16.533 5.721 -2.217 1.00 0.00 O ATOM 1779 CB GLU A 116 16.440 4.086 -4.795 1.00 0.00 C ATOM 1780 CG GLU A 116 16.124 2.961 -5.758 1.00 0.00 C ATOM 1781 CD GLU A 116 16.159 3.416 -7.200 1.00 0.00 C ATOM 1782 OE1 GLU A 116 15.233 4.138 -7.624 1.00 0.00 O ATOM 1783 OE2 GLU A 116 17.121 3.067 -7.918 1.00 0.00 O ATOM 0 H GLU A 116 14.747 4.082 -2.589 1.00 0.00 H new ATOM 0 HA GLU A 116 17.297 2.782 -3.331 1.00 0.00 H new ATOM 0 HB2 GLU A 116 15.637 4.822 -4.837 1.00 0.00 H new ATOM 0 HB3 GLU A 116 17.350 4.587 -5.125 1.00 0.00 H new ATOM 0 HG2 GLU A 116 16.841 2.152 -5.617 1.00 0.00 H new ATOM 0 HG3 GLU A 116 15.138 2.556 -5.530 1.00 0.00 H new ATOM 1790 N TYR A 117 18.469 4.613 -2.143 1.00 0.00 N ATOM 1791 CA TYR A 117 19.132 5.527 -1.214 1.00 0.00 C ATOM 1792 C TYR A 117 18.966 7.007 -1.542 1.00 0.00 C ATOM 1793 O TYR A 117 18.751 7.397 -2.685 1.00 0.00 O ATOM 1794 CB TYR A 117 20.594 5.166 -1.136 1.00 0.00 C ATOM 1795 CG TYR A 117 20.793 3.884 -0.382 1.00 0.00 C ATOM 1796 CD1 TYR A 117 20.446 3.814 0.951 1.00 0.00 C ATOM 1797 CD2 TYR A 117 21.295 2.747 -0.992 1.00 0.00 C ATOM 1798 CE1 TYR A 117 20.584 2.656 1.662 1.00 0.00 C ATOM 1799 CE2 TYR A 117 21.444 1.574 -0.280 1.00 0.00 C ATOM 1800 CZ TYR A 117 21.086 1.534 1.048 1.00 0.00 C ATOM 1801 OH TYR A 117 21.210 0.365 1.757 1.00 0.00 O ATOM 0 H TYR A 117 19.068 3.856 -2.473 1.00 0.00 H new ATOM 0 HA TYR A 117 18.640 5.399 -0.250 1.00 0.00 H new ATOM 0 HB2 TYR A 117 21.002 5.067 -2.142 1.00 0.00 H new ATOM 0 HB3 TYR A 117 21.145 5.969 -0.646 1.00 0.00 H new ATOM 0 HD1 TYR A 117 20.057 4.693 1.443 1.00 0.00 H new ATOM 0 HD2 TYR A 117 21.573 2.778 -2.035 1.00 0.00 H new ATOM 0 HE1 TYR A 117 20.299 2.622 2.703 1.00 0.00 H new ATOM 0 HE2 TYR A 117 21.839 0.692 -0.763 1.00 0.00 H new ATOM 0 HH TYR A 117 22.158 0.129 1.836 1.00 0.00 H new ATOM 1811 N THR A 118 19.097 7.817 -0.497 1.00 0.00 N ATOM 1812 CA THR A 118 18.866 9.248 -0.566 1.00 0.00 C ATOM 1813 C THR A 118 20.162 9.945 -0.864 1.00 0.00 C ATOM 1814 O THR A 118 20.198 11.014 -1.467 1.00 0.00 O ATOM 1815 CB THR A 118 18.339 9.788 0.777 1.00 0.00 C ATOM 1816 OG1 THR A 118 19.149 9.280 1.847 1.00 0.00 O ATOM 1817 CG2 THR A 118 16.894 9.403 1.016 1.00 0.00 C ATOM 0 H THR A 118 19.370 7.491 0.430 1.00 0.00 H new ATOM 0 HA THR A 118 18.129 9.434 -1.347 1.00 0.00 H new ATOM 0 HB THR A 118 18.393 10.876 0.741 1.00 0.00 H new ATOM 0 HG1 THR A 118 18.815 9.624 2.702 1.00 0.00 H new ATOM 0 HG21 THR A 118 16.564 9.805 1.974 1.00 0.00 H new ATOM 0 HG22 THR A 118 16.272 9.810 0.219 1.00 0.00 H new ATOM 0 HG23 THR A 118 16.804 8.317 1.028 1.00 0.00 H new ATOM 1825 N GLU A 119 21.231 9.324 -0.429 1.00 0.00 N ATOM 1826 CA GLU A 119 22.535 9.860 -0.642 1.00 0.00 C ATOM 1827 C GLU A 119 22.968 9.512 -2.052 1.00 0.00 C ATOM 1828 O GLU A 119 22.968 8.349 -2.435 1.00 0.00 O ATOM 1829 CB GLU A 119 23.472 9.291 0.400 1.00 0.00 C ATOM 1830 CG GLU A 119 22.946 9.526 1.793 1.00 0.00 C ATOM 1831 CD GLU A 119 22.976 10.982 2.203 1.00 0.00 C ATOM 1832 OE1 GLU A 119 24.075 11.496 2.493 1.00 0.00 O ATOM 1833 OE2 GLU A 119 21.901 11.617 2.238 1.00 0.00 O ATOM 0 H GLU A 119 21.213 8.439 0.078 1.00 0.00 H new ATOM 0 HA GLU A 119 22.545 10.945 -0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 119 23.600 8.222 0.232 1.00 0.00 H new ATOM 0 HB3 GLU A 119 24.455 9.750 0.298 1.00 0.00 H new ATOM 0 HG2 GLU A 119 21.922 9.159 1.854 1.00 0.00 H new ATOM 0 HG3 GLU A 119 23.536 8.944 2.500 1.00 0.00 H new ATOM 1840 N THR A 120 23.292 10.548 -2.824 1.00 0.00 N ATOM 1841 CA THR A 120 23.535 10.429 -4.263 1.00 0.00 C ATOM 1842 C THR A 120 24.547 9.334 -4.592 1.00 0.00 C ATOM 1843 O THR A 120 24.414 8.653 -5.601 1.00 0.00 O ATOM 1844 CB THR A 120 24.021 11.772 -4.850 1.00 0.00 C ATOM 1845 OG1 THR A 120 23.145 12.828 -4.434 1.00 0.00 O ATOM 1846 CG2 THR A 120 24.066 11.724 -6.373 1.00 0.00 C ATOM 0 H THR A 120 23.394 11.499 -2.468 1.00 0.00 H new ATOM 0 HA THR A 120 22.583 10.155 -4.717 1.00 0.00 H new ATOM 0 HB THR A 120 25.029 11.957 -4.480 1.00 0.00 H new ATOM 0 HG1 THR A 120 23.458 13.679 -4.807 1.00 0.00 H new ATOM 0 HG21 THR A 120 24.412 12.684 -6.757 1.00 0.00 H new ATOM 0 HG22 THR A 120 24.750 10.938 -6.692 1.00 0.00 H new ATOM 0 HG23 THR A 120 23.068 11.516 -6.760 1.00 0.00 H new ATOM 1854 N GLU A 121 25.526 9.147 -3.717 1.00 0.00 N ATOM 1855 CA GLU A 121 26.543 8.120 -3.913 1.00 0.00 C ATOM 1856 C GLU A 121 25.907 6.746 -3.778 1.00 0.00 C ATOM 1857 O GLU A 121 26.214 5.819 -4.520 1.00 0.00 O ATOM 1858 CB GLU A 121 27.655 8.291 -2.874 1.00 0.00 C ATOM 1859 CG GLU A 121 28.841 7.367 -3.076 1.00 0.00 C ATOM 1860 CD GLU A 121 29.564 7.637 -4.376 1.00 0.00 C ATOM 1861 OE1 GLU A 121 30.097 8.753 -4.540 1.00 0.00 O ATOM 1862 OE2 GLU A 121 29.601 6.737 -5.241 1.00 0.00 O ATOM 0 H GLU A 121 25.638 9.693 -2.863 1.00 0.00 H new ATOM 0 HA GLU A 121 26.974 8.217 -4.910 1.00 0.00 H new ATOM 0 HB2 GLU A 121 28.004 9.323 -2.899 1.00 0.00 H new ATOM 0 HB3 GLU A 121 27.239 8.119 -1.881 1.00 0.00 H new ATOM 0 HG2 GLU A 121 29.536 7.485 -2.245 1.00 0.00 H new ATOM 0 HG3 GLU A 121 28.499 6.332 -3.061 1.00 0.00 H new ATOM 1869 N LEU A 122 24.973 6.654 -2.853 1.00 0.00 N ATOM 1870 CA LEU A 122 24.308 5.407 -2.545 1.00 0.00 C ATOM 1871 C LEU A 122 23.234 5.101 -3.586 1.00 0.00 C ATOM 1872 O LEU A 122 22.788 3.966 -3.709 1.00 0.00 O ATOM 1873 CB LEU A 122 23.668 5.510 -1.167 1.00 0.00 C ATOM 1874 CG LEU A 122 24.594 5.922 -0.020 1.00 0.00 C ATOM 1875 CD1 LEU A 122 23.844 5.904 1.302 1.00 0.00 C ATOM 1876 CD2 LEU A 122 25.806 5.013 0.049 1.00 0.00 C ATOM 0 H LEU A 122 24.654 7.445 -2.293 1.00 0.00 H new ATOM 0 HA LEU A 122 25.042 4.601 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 122 22.850 6.229 -1.222 1.00 0.00 H new ATOM 0 HB3 LEU A 122 23.227 4.544 -0.921 1.00 0.00 H new ATOM 0 HG LEU A 122 24.939 6.938 -0.211 1.00 0.00 H new ATOM 0 HD11 LEU A 122 24.518 6.199 2.106 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.007 6.601 1.255 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.469 4.899 1.494 1.00 0.00 H new ATOM 0 HD21 LEU A 122 26.449 5.326 0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.481 3.985 0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 122 26.360 5.074 -0.888 1.00 0.00 H new ATOM 1888 N ARG A 123 22.801 6.123 -4.323 1.00 0.00 N ATOM 1889 CA ARG A 123 21.815 5.923 -5.377 1.00 0.00 C ATOM 1890 C ARG A 123 22.510 5.328 -6.582 1.00 0.00 C ATOM 1891 O ARG A 123 21.946 4.515 -7.316 1.00 0.00 O ATOM 1892 CB ARG A 123 21.157 7.241 -5.790 1.00 0.00 C ATOM 1893 CG ARG A 123 20.781 8.147 -4.635 1.00 0.00 C ATOM 1894 CD ARG A 123 19.992 9.348 -5.126 1.00 0.00 C ATOM 1895 NE ARG A 123 19.994 10.460 -4.178 1.00 0.00 N ATOM 1896 CZ ARG A 123 19.706 11.722 -4.505 1.00 0.00 C ATOM 1897 NH1 ARG A 123 19.369 12.036 -5.751 1.00 0.00 N ATOM 1898 NH2 ARG A 123 19.732 12.671 -3.576 1.00 0.00 N ATOM 0 H ARG A 123 23.115 7.087 -4.210 1.00 0.00 H new ATOM 0 HA ARG A 123 21.039 5.257 -5.000 1.00 0.00 H new ATOM 0 HB2 ARG A 123 21.836 7.780 -6.451 1.00 0.00 H new ATOM 0 HB3 ARG A 123 20.260 7.019 -6.367 1.00 0.00 H new ATOM 0 HG2 ARG A 123 20.190 7.590 -3.908 1.00 0.00 H new ATOM 0 HG3 ARG A 123 21.682 8.483 -4.122 1.00 0.00 H new ATOM 0 HD2 ARG A 123 20.409 9.686 -6.075 1.00 0.00 H new ATOM 0 HD3 ARG A 123 18.963 9.045 -5.320 1.00 0.00 H new ATOM 0 HE ARG A 123 20.230 10.260 -3.206 1.00 0.00 H new ATOM 0 HH11 ARG A 123 19.329 11.310 -6.467 1.00 0.00 H new ATOM 0 HH12 ARG A 123 19.151 13.003 -5.992 1.00 0.00 H new ATOM 0 HH21 ARG A 123 19.972 12.436 -2.613 1.00 0.00 H new ATOM 0 HH22 ARG A 123 19.512 13.635 -3.826 1.00 0.00 H new ATOM 1912 N GLU A 124 23.745 5.760 -6.773 1.00 0.00 N ATOM 1913 CA GLU A 124 24.564 5.298 -7.873 1.00 0.00 C ATOM 1914 C GLU A 124 25.056 3.887 -7.611 1.00 0.00 C ATOM 1915 O GLU A 124 25.114 3.063 -8.524 1.00 0.00 O ATOM 1916 CB GLU A 124 25.739 6.248 -8.068 1.00 0.00 C ATOM 1917 CG GLU A 124 25.306 7.693 -8.248 1.00 0.00 C ATOM 1918 CD GLU A 124 24.600 7.946 -9.564 1.00 0.00 C ATOM 1919 OE1 GLU A 124 23.441 7.513 -9.721 1.00 0.00 O ATOM 1920 OE2 GLU A 124 25.194 8.599 -10.443 1.00 0.00 O ATOM 0 H GLU A 124 24.205 6.441 -6.168 1.00 0.00 H new ATOM 0 HA GLU A 124 23.965 5.284 -8.783 1.00 0.00 H new ATOM 0 HB2 GLU A 124 26.404 6.178 -7.207 1.00 0.00 H new ATOM 0 HB3 GLU A 124 26.313 5.934 -8.940 1.00 0.00 H new ATOM 0 HG2 GLU A 124 24.643 7.972 -7.429 1.00 0.00 H new ATOM 0 HG3 GLU A 124 26.182 8.339 -8.183 1.00 0.00 H new ATOM 1927 N ASN A 125 25.390 3.606 -6.361 1.00 0.00 N ATOM 1928 CA ASN A 125 25.853 2.281 -5.984 1.00 0.00 C ATOM 1929 C ASN A 125 25.316 1.901 -4.614 1.00 0.00 C ATOM 1930 O ASN A 125 25.979 2.084 -3.595 1.00 0.00 O ATOM 1931 CB ASN A 125 27.390 2.187 -6.030 1.00 0.00 C ATOM 1932 CG ASN A 125 28.100 3.368 -5.387 1.00 0.00 C ATOM 1933 OD1 ASN A 125 28.428 3.348 -4.198 1.00 0.00 O ATOM 1934 ND2 ASN A 125 28.366 4.398 -6.177 1.00 0.00 N ATOM 0 H ASN A 125 25.349 4.276 -5.593 1.00 0.00 H new ATOM 0 HA ASN A 125 25.466 1.567 -6.711 1.00 0.00 H new ATOM 0 HB2 ASN A 125 27.703 1.271 -5.529 1.00 0.00 H new ATOM 0 HB3 ASN A 125 27.708 2.107 -7.069 1.00 0.00 H new ATOM 0 HD21 ASN A 125 28.858 5.211 -5.807 1.00 0.00 H new ATOM 0 HD22 ASN A 125 28.079 4.378 -7.155 1.00 0.00 H new ATOM 1941 N PRO A 126 24.074 1.394 -4.580 1.00 0.00 N ATOM 1942 CA PRO A 126 23.441 0.912 -3.354 1.00 0.00 C ATOM 1943 C PRO A 126 24.259 -0.183 -2.685 1.00 0.00 C ATOM 1944 O PRO A 126 24.438 -1.267 -3.245 1.00 0.00 O ATOM 1945 CB PRO A 126 22.093 0.350 -3.828 1.00 0.00 C ATOM 1946 CG PRO A 126 22.243 0.179 -5.302 1.00 0.00 C ATOM 1947 CD PRO A 126 23.177 1.265 -5.735 1.00 0.00 C ATOM 0 HA PRO A 126 23.344 1.704 -2.612 1.00 0.00 H new ATOM 0 HB2 PRO A 126 21.868 -0.599 -3.341 1.00 0.00 H new ATOM 0 HB3 PRO A 126 21.276 1.031 -3.591 1.00 0.00 H new ATOM 0 HG2 PRO A 126 22.645 -0.805 -5.544 1.00 0.00 H new ATOM 0 HG3 PRO A 126 21.281 0.264 -5.807 1.00 0.00 H new ATOM 0 HD2 PRO A 126 23.719 0.996 -6.641 1.00 0.00 H new ATOM 0 HD3 PRO A 126 22.648 2.195 -5.944 1.00 0.00 H new ATOM 1955 N PRO A 127 24.776 0.093 -1.483 1.00 0.00 N ATOM 1956 CA PRO A 127 25.539 -0.884 -0.714 1.00 0.00 C ATOM 1957 C PRO A 127 24.666 -2.077 -0.361 1.00 0.00 C ATOM 1958 O PRO A 127 23.471 -1.928 -0.091 1.00 0.00 O ATOM 1959 CB PRO A 127 25.953 -0.108 0.545 1.00 0.00 C ATOM 1960 CG PRO A 127 25.806 1.327 0.172 1.00 0.00 C ATOM 1961 CD PRO A 127 24.649 1.371 -0.771 1.00 0.00 C ATOM 0 HA PRO A 127 26.394 -1.287 -1.256 1.00 0.00 H new ATOM 0 HB2 PRO A 127 25.318 -0.363 1.394 1.00 0.00 H new ATOM 0 HB3 PRO A 127 26.979 -0.339 0.833 1.00 0.00 H new ATOM 0 HG2 PRO A 127 25.621 1.945 1.051 1.00 0.00 H new ATOM 0 HG3 PRO A 127 26.713 1.706 -0.300 1.00 0.00 H new ATOM 0 HD2 PRO A 127 23.698 1.450 -0.244 1.00 0.00 H new ATOM 0 HD3 PRO A 127 24.709 2.222 -1.449 1.00 0.00 H new ATOM 1969 N VAL A 128 25.282 -3.259 -0.391 1.00 0.00 N ATOM 1970 CA VAL A 128 24.572 -4.526 -0.223 1.00 0.00 C ATOM 1971 C VAL A 128 23.788 -4.557 1.078 1.00 0.00 C ATOM 1972 O VAL A 128 22.731 -5.179 1.159 1.00 0.00 O ATOM 1973 CB VAL A 128 25.535 -5.726 -0.252 1.00 0.00 C ATOM 1974 CG1 VAL A 128 24.768 -7.033 -0.405 1.00 0.00 C ATOM 1975 CG2 VAL A 128 26.561 -5.574 -1.365 1.00 0.00 C ATOM 0 H VAL A 128 26.287 -3.364 -0.532 1.00 0.00 H new ATOM 0 HA VAL A 128 23.881 -4.603 -1.062 1.00 0.00 H new ATOM 0 HB VAL A 128 26.067 -5.751 0.699 1.00 0.00 H new ATOM 0 HG11 VAL A 128 25.470 -7.867 -0.423 1.00 0.00 H new ATOM 0 HG12 VAL A 128 24.083 -7.153 0.434 1.00 0.00 H new ATOM 0 HG13 VAL A 128 24.201 -7.016 -1.336 1.00 0.00 H new ATOM 0 HG21 VAL A 128 27.229 -6.435 -1.364 1.00 0.00 H new ATOM 0 HG22 VAL A 128 26.049 -5.513 -2.326 1.00 0.00 H new ATOM 0 HG23 VAL A 128 27.140 -4.665 -1.204 1.00 0.00 H new ATOM 1985 N LYS A 129 24.313 -3.895 2.099 1.00 0.00 N ATOM 1986 CA LYS A 129 23.592 -3.764 3.348 1.00 0.00 C ATOM 1987 C LYS A 129 22.541 -2.678 3.253 1.00 0.00 C ATOM 1988 O LYS A 129 22.815 -1.563 2.802 1.00 0.00 O ATOM 1989 CB LYS A 129 24.519 -3.475 4.518 1.00 0.00 C ATOM 1990 CG LYS A 129 25.164 -4.709 5.097 1.00 0.00 C ATOM 1991 CD LYS A 129 24.225 -5.901 5.091 1.00 0.00 C ATOM 1992 CE LYS A 129 24.821 -7.048 4.301 1.00 0.00 C ATOM 1993 NZ LYS A 129 23.933 -8.239 4.280 1.00 0.00 N ATOM 0 H LYS A 129 25.228 -3.445 2.084 1.00 0.00 H new ATOM 0 HA LYS A 129 23.107 -4.723 3.531 1.00 0.00 H new ATOM 0 HB2 LYS A 129 25.299 -2.787 4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 129 23.955 -2.969 5.301 1.00 0.00 H new ATOM 0 HG2 LYS A 129 26.060 -4.951 4.525 1.00 0.00 H new ATOM 0 HG3 LYS A 129 25.483 -4.505 6.119 1.00 0.00 H new ATOM 0 HD2 LYS A 129 24.029 -6.221 6.114 1.00 0.00 H new ATOM 0 HD3 LYS A 129 23.267 -5.613 4.658 1.00 0.00 H new ATOM 0 HE2 LYS A 129 25.012 -6.722 3.279 1.00 0.00 H new ATOM 0 HE3 LYS A 129 25.783 -7.323 4.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 24.505 -9.096 4.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 23.422 -8.307 5.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 23.249 -8.149 3.502 1.00 0.00 H new ATOM 2007 N PRO A 130 21.335 -2.999 3.717 1.00 0.00 N ATOM 2008 CA PRO A 130 20.179 -2.122 3.627 1.00 0.00 C ATOM 2009 C PRO A 130 20.210 -1.013 4.666 1.00 0.00 C ATOM 2010 O PRO A 130 20.395 -1.278 5.856 1.00 0.00 O ATOM 2011 CB PRO A 130 18.987 -3.031 3.911 1.00 0.00 C ATOM 2012 CG PRO A 130 19.530 -4.343 4.367 1.00 0.00 C ATOM 2013 CD PRO A 130 21.031 -4.257 4.393 1.00 0.00 C ATOM 0 HA PRO A 130 20.143 -1.632 2.654 1.00 0.00 H new ATOM 0 HB2 PRO A 130 18.344 -2.594 4.675 1.00 0.00 H new ATOM 0 HB3 PRO A 130 18.378 -3.157 3.016 1.00 0.00 H new ATOM 0 HG2 PRO A 130 19.148 -4.587 5.358 1.00 0.00 H new ATOM 0 HG3 PRO A 130 19.208 -5.140 3.696 1.00 0.00 H new ATOM 0 HD2 PRO A 130 21.411 -4.261 5.414 1.00 0.00 H new ATOM 0 HD3 PRO A 130 21.486 -5.104 3.880 1.00 0.00 H new ATOM 2021 N ASP A 131 20.026 0.224 4.241 1.00 0.00 N ATOM 2022 CA ASP A 131 19.896 1.313 5.202 1.00 0.00 C ATOM 2023 C ASP A 131 18.612 2.077 4.945 1.00 0.00 C ATOM 2024 O ASP A 131 18.498 2.815 3.973 1.00 0.00 O ATOM 2025 CB ASP A 131 21.095 2.262 5.177 1.00 0.00 C ATOM 2026 CG ASP A 131 21.192 3.071 6.458 1.00 0.00 C ATOM 2027 OD1 ASP A 131 20.259 3.844 6.758 1.00 0.00 O ATOM 2028 OD2 ASP A 131 22.197 2.919 7.184 1.00 0.00 O ATOM 0 H ASP A 131 19.964 0.500 3.261 1.00 0.00 H new ATOM 0 HA ASP A 131 19.865 0.868 6.197 1.00 0.00 H new ATOM 0 HB2 ASP A 131 22.011 1.688 5.038 1.00 0.00 H new ATOM 0 HB3 ASP A 131 21.009 2.937 4.325 1.00 0.00 H new ATOM 2033 N PHE A 132 17.662 1.892 5.843 1.00 0.00 N ATOM 2034 CA PHE A 132 16.306 2.412 5.694 1.00 0.00 C ATOM 2035 C PHE A 132 16.261 3.900 6.036 1.00 0.00 C ATOM 2036 O PHE A 132 15.335 4.625 5.686 1.00 0.00 O ATOM 2037 CB PHE A 132 15.388 1.609 6.614 1.00 0.00 C ATOM 2038 CG PHE A 132 15.617 0.126 6.511 1.00 0.00 C ATOM 2039 CD1 PHE A 132 16.588 -0.490 7.283 1.00 0.00 C ATOM 2040 CD2 PHE A 132 14.875 -0.646 5.634 1.00 0.00 C ATOM 2041 CE1 PHE A 132 16.818 -1.848 7.182 1.00 0.00 C ATOM 2042 CE2 PHE A 132 15.099 -2.005 5.532 1.00 0.00 C ATOM 2043 CZ PHE A 132 16.072 -2.606 6.305 1.00 0.00 C ATOM 0 H PHE A 132 17.807 1.371 6.708 1.00 0.00 H new ATOM 0 HA PHE A 132 15.974 2.309 4.661 1.00 0.00 H new ATOM 0 HB2 PHE A 132 15.546 1.926 7.645 1.00 0.00 H new ATOM 0 HB3 PHE A 132 14.350 1.830 6.368 1.00 0.00 H new ATOM 0 HD1 PHE A 132 17.173 0.100 7.973 1.00 0.00 H new ATOM 0 HD2 PHE A 132 14.114 -0.182 5.024 1.00 0.00 H new ATOM 0 HE1 PHE A 132 17.580 -2.315 7.788 1.00 0.00 H new ATOM 0 HE2 PHE A 132 14.512 -2.598 4.847 1.00 0.00 H new ATOM 0 HZ PHE A 132 16.249 -3.668 6.223 1.00 0.00 H new ATOM 2053 N SER A 133 17.300 4.324 6.706 1.00 0.00 N ATOM 2054 CA SER A 133 17.481 5.711 7.120 1.00 0.00 C ATOM 2055 C SER A 133 18.071 6.532 5.977 1.00 0.00 C ATOM 2056 O SER A 133 17.841 7.740 5.872 1.00 0.00 O ATOM 2057 CB SER A 133 18.398 5.769 8.348 1.00 0.00 C ATOM 2058 OG SER A 133 18.521 7.086 8.856 1.00 0.00 O ATOM 0 H SER A 133 18.065 3.712 6.990 1.00 0.00 H new ATOM 0 HA SER A 133 16.511 6.134 7.382 1.00 0.00 H new ATOM 0 HB2 SER A 133 18.004 5.115 9.126 1.00 0.00 H new ATOM 0 HB3 SER A 133 19.385 5.389 8.082 1.00 0.00 H new ATOM 0 HG SER A 133 19.111 7.081 9.638 1.00 0.00 H new ATOM 2064 N LYS A 134 18.822 5.863 5.112 1.00 0.00 N ATOM 2065 CA LYS A 134 19.372 6.497 3.929 1.00 0.00 C ATOM 2066 C LYS A 134 18.526 6.122 2.763 1.00 0.00 C ATOM 2067 O LYS A 134 18.910 6.296 1.627 1.00 0.00 O ATOM 2068 CB LYS A 134 20.781 6.016 3.628 1.00 0.00 C ATOM 2069 CG LYS A 134 21.815 6.411 4.644 1.00 0.00 C ATOM 2070 CD LYS A 134 22.078 7.908 4.665 1.00 0.00 C ATOM 2071 CE LYS A 134 22.985 8.277 5.825 1.00 0.00 C ATOM 2072 NZ LYS A 134 23.397 9.703 5.789 1.00 0.00 N ATOM 0 H LYS A 134 19.063 4.877 5.212 1.00 0.00 H new ATOM 0 HA LYS A 134 19.393 7.572 4.106 1.00 0.00 H new ATOM 0 HB2 LYS A 134 20.769 4.929 3.547 1.00 0.00 H new ATOM 0 HB3 LYS A 134 21.082 6.404 2.655 1.00 0.00 H new ATOM 0 HG2 LYS A 134 21.487 6.090 5.633 1.00 0.00 H new ATOM 0 HG3 LYS A 134 22.746 5.886 4.431 1.00 0.00 H new ATOM 0 HD2 LYS A 134 22.538 8.215 3.726 1.00 0.00 H new ATOM 0 HD3 LYS A 134 21.134 8.447 4.749 1.00 0.00 H new ATOM 0 HE2 LYS A 134 22.470 8.074 6.764 1.00 0.00 H new ATOM 0 HE3 LYS A 134 23.872 7.644 5.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 24.015 9.906 6.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 23.912 9.893 4.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 22.553 10.309 5.836 1.00 0.00 H new ATOM 2086 N LEU A 135 17.402 5.548 3.057 1.00 0.00 N ATOM 2087 CA LEU A 135 16.587 4.963 2.048 1.00 0.00 C ATOM 2088 C LEU A 135 15.542 5.956 1.591 1.00 0.00 C ATOM 2089 O LEU A 135 14.880 6.586 2.401 1.00 0.00 O ATOM 2090 CB LEU A 135 15.980 3.698 2.628 1.00 0.00 C ATOM 2091 CG LEU A 135 15.354 2.743 1.638 1.00 0.00 C ATOM 2092 CD1 LEU A 135 16.356 2.408 0.542 1.00 0.00 C ATOM 2093 CD2 LEU A 135 14.891 1.478 2.344 1.00 0.00 C ATOM 0 H LEU A 135 17.027 5.473 4.003 1.00 0.00 H new ATOM 0 HA LEU A 135 17.168 4.700 1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 135 16.758 3.164 3.174 1.00 0.00 H new ATOM 0 HB3 LEU A 135 15.220 3.985 3.355 1.00 0.00 H new ATOM 0 HG LEU A 135 14.484 3.219 1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 135 15.900 1.719 -0.169 1.00 0.00 H new ATOM 0 HD12 LEU A 135 16.649 3.322 0.025 1.00 0.00 H new ATOM 0 HD13 LEU A 135 17.237 1.943 0.984 1.00 0.00 H new ATOM 0 HD21 LEU A 135 14.442 0.800 1.618 1.00 0.00 H new ATOM 0 HD22 LEU A 135 15.745 0.991 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 135 14.154 1.735 3.105 1.00 0.00 H new ATOM 2105 N GLN A 136 15.453 6.140 0.290 1.00 0.00 N ATOM 2106 CA GLN A 136 14.449 7.007 -0.293 1.00 0.00 C ATOM 2107 C GLN A 136 13.481 6.159 -1.077 1.00 0.00 C ATOM 2108 O GLN A 136 13.868 5.470 -2.014 1.00 0.00 O ATOM 2109 CB GLN A 136 15.081 8.035 -1.224 1.00 0.00 C ATOM 2110 CG GLN A 136 14.242 9.280 -1.375 1.00 0.00 C ATOM 2111 CD GLN A 136 14.579 10.068 -2.619 1.00 0.00 C ATOM 2112 OE1 GLN A 136 13.978 9.674 -3.726 1.00 0.00 O flip ATOM 2113 NE2 GLN A 136 15.389 10.995 -2.592 1.00 0.00 N flip ATOM 0 H GLN A 136 16.070 5.696 -0.390 1.00 0.00 H new ATOM 0 HA GLN A 136 13.938 7.542 0.508 1.00 0.00 H new ATOM 0 HB2 GLN A 136 16.064 8.309 -0.842 1.00 0.00 H new ATOM 0 HB3 GLN A 136 15.235 7.585 -2.205 1.00 0.00 H new ATOM 0 HG2 GLN A 136 13.189 9.001 -1.402 1.00 0.00 H new ATOM 0 HG3 GLN A 136 14.382 9.915 -0.500 1.00 0.00 H new ATOM 0 HE21 GLN A 136 15.828 11.263 -1.711 1.00 0.00 H new ATOM 0 HE22 GLN A 136 15.621 11.495 -3.450 1.00 0.00 H new ATOM 2122 N ARG A 137 12.229 6.193 -0.711 1.00 0.00 N ATOM 2123 CA ARG A 137 11.287 5.310 -1.336 1.00 0.00 C ATOM 2124 C ARG A 137 10.499 6.013 -2.426 1.00 0.00 C ATOM 2125 O ARG A 137 9.661 6.873 -2.156 1.00 0.00 O ATOM 2126 CB ARG A 137 10.383 4.659 -0.292 1.00 0.00 C ATOM 2127 CG ARG A 137 10.146 5.479 0.957 1.00 0.00 C ATOM 2128 CD ARG A 137 8.824 6.191 0.864 1.00 0.00 C ATOM 2129 NE ARG A 137 8.036 6.171 2.098 1.00 0.00 N ATOM 2130 CZ ARG A 137 7.928 5.152 2.962 1.00 0.00 C ATOM 2131 NH1 ARG A 137 8.534 3.986 2.750 1.00 0.00 N ATOM 2132 NH2 ARG A 137 7.155 5.292 4.026 1.00 0.00 N ATOM 0 H ARG A 137 11.844 6.811 0.003 1.00 0.00 H new ATOM 0 HA ARG A 137 11.843 4.512 -1.827 1.00 0.00 H new ATOM 0 HB2 ARG A 137 9.419 4.443 -0.753 1.00 0.00 H new ATOM 0 HB3 ARG A 137 10.819 3.703 -0.002 1.00 0.00 H new ATOM 0 HG2 ARG A 137 10.159 4.832 1.834 1.00 0.00 H new ATOM 0 HG3 ARG A 137 10.950 6.204 1.084 1.00 0.00 H new ATOM 0 HD2 ARG A 137 9.003 7.228 0.579 1.00 0.00 H new ATOM 0 HD3 ARG A 137 8.237 5.738 0.065 1.00 0.00 H new ATOM 0 HE ARG A 137 7.516 7.019 2.323 1.00 0.00 H new ATOM 0 HH11 ARG A 137 9.099 3.850 1.912 1.00 0.00 H new ATOM 0 HH12 ARG A 137 8.433 3.229 3.426 1.00 0.00 H new ATOM 0 HH21 ARG A 137 6.652 6.166 4.179 1.00 0.00 H new ATOM 0 HH22 ARG A 137 7.062 4.526 4.693 1.00 0.00 H new ATOM 2146 N ASN A 138 10.831 5.666 -3.665 1.00 0.00 N ATOM 2147 CA ASN A 138 10.075 6.091 -4.825 1.00 0.00 C ATOM 2148 C ASN A 138 8.847 5.234 -4.944 1.00 0.00 C ATOM 2149 O ASN A 138 8.904 4.072 -5.353 1.00 0.00 O ATOM 2150 CB ASN A 138 10.911 5.993 -6.107 1.00 0.00 C ATOM 2151 CG ASN A 138 10.082 6.208 -7.367 1.00 0.00 C ATOM 2152 OD1 ASN A 138 9.155 7.014 -7.387 1.00 0.00 O ATOM 2153 ND2 ASN A 138 10.385 5.462 -8.418 1.00 0.00 N ATOM 0 H ASN A 138 11.636 5.080 -3.888 1.00 0.00 H new ATOM 0 HA ASN A 138 9.794 7.136 -4.696 1.00 0.00 H new ATOM 0 HB2 ASN A 138 11.710 6.733 -6.072 1.00 0.00 H new ATOM 0 HB3 ASN A 138 11.386 5.013 -6.152 1.00 0.00 H new ATOM 0 HD21 ASN A 138 9.842 5.547 -9.277 1.00 0.00 H new ATOM 0 HD22 ASN A 138 11.161 4.802 -8.368 1.00 0.00 H new ATOM 2160 N ILE A 139 7.748 5.805 -4.548 1.00 0.00 N ATOM 2161 CA ILE A 139 6.482 5.146 -4.628 1.00 0.00 C ATOM 2162 C ILE A 139 6.019 5.193 -6.083 1.00 0.00 C ATOM 2163 O ILE A 139 5.669 6.250 -6.604 1.00 0.00 O ATOM 2164 CB ILE A 139 5.501 5.836 -3.652 1.00 0.00 C ATOM 2165 CG1 ILE A 139 5.550 5.188 -2.262 1.00 0.00 C ATOM 2166 CG2 ILE A 139 4.086 5.840 -4.158 1.00 0.00 C ATOM 2167 CD1 ILE A 139 6.892 5.257 -1.582 1.00 0.00 C ATOM 0 H ILE A 139 7.706 6.747 -4.158 1.00 0.00 H new ATOM 0 HA ILE A 139 6.540 4.099 -4.332 1.00 0.00 H new ATOM 0 HB ILE A 139 5.830 6.872 -3.578 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.810 5.671 -1.625 1.00 0.00 H new ATOM 0 HG13 ILE A 139 5.258 4.142 -2.353 1.00 0.00 H new ATOM 0 HG21 ILE A 139 3.442 6.337 -3.433 1.00 0.00 H new ATOM 0 HG22 ILE A 139 4.041 6.372 -5.108 1.00 0.00 H new ATOM 0 HG23 ILE A 139 3.748 4.814 -4.301 1.00 0.00 H new ATOM 0 HD11 ILE A 139 6.831 4.774 -0.607 1.00 0.00 H new ATOM 0 HD12 ILE A 139 7.636 4.747 -2.193 1.00 0.00 H new ATOM 0 HD13 ILE A 139 7.181 6.300 -1.453 1.00 0.00 H new ATOM 2179 N LEU A 140 6.103 4.054 -6.758 1.00 0.00 N ATOM 2180 CA LEU A 140 5.844 3.996 -8.187 1.00 0.00 C ATOM 2181 C LEU A 140 4.385 4.281 -8.496 1.00 0.00 C ATOM 2182 O LEU A 140 3.545 3.385 -8.534 1.00 0.00 O ATOM 2183 CB LEU A 140 6.248 2.643 -8.764 1.00 0.00 C ATOM 2184 CG LEU A 140 7.747 2.357 -8.793 1.00 0.00 C ATOM 2185 CD1 LEU A 140 8.016 0.962 -9.332 1.00 0.00 C ATOM 2186 CD2 LEU A 140 8.456 3.398 -9.636 1.00 0.00 C ATOM 0 H LEU A 140 6.349 3.158 -6.337 1.00 0.00 H new ATOM 0 HA LEU A 140 6.451 4.769 -8.658 1.00 0.00 H new ATOM 0 HB2 LEU A 140 5.759 1.861 -8.184 1.00 0.00 H new ATOM 0 HB3 LEU A 140 5.864 2.573 -9.782 1.00 0.00 H new ATOM 0 HG LEU A 140 8.132 2.407 -7.775 1.00 0.00 H new ATOM 0 HD11 LEU A 140 9.090 0.778 -9.345 1.00 0.00 H new ATOM 0 HD12 LEU A 140 7.529 0.225 -8.694 1.00 0.00 H new ATOM 0 HD13 LEU A 140 7.622 0.881 -10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 140 9.525 3.187 -9.652 1.00 0.00 H new ATOM 0 HD22 LEU A 140 8.066 3.370 -10.653 1.00 0.00 H new ATOM 0 HD23 LEU A 140 8.288 4.387 -9.210 1.00 0.00 H new ATOM 2198 N ALA A 141 4.111 5.550 -8.720 1.00 0.00 N ATOM 2199 CA ALA A 141 2.781 6.018 -9.052 1.00 0.00 C ATOM 2200 C ALA A 141 2.496 5.804 -10.530 1.00 0.00 C ATOM 2201 O ALA A 141 1.346 5.789 -10.964 1.00 0.00 O ATOM 2202 CB ALA A 141 2.668 7.483 -8.680 1.00 0.00 C ATOM 0 H ALA A 141 4.810 6.291 -8.676 1.00 0.00 H new ATOM 0 HA ALA A 141 2.040 5.450 -8.490 1.00 0.00 H new ATOM 0 HB1 ALA A 141 1.670 7.845 -8.926 1.00 0.00 H new ATOM 0 HB2 ALA A 141 2.843 7.601 -7.611 1.00 0.00 H new ATOM 0 HB3 ALA A 141 3.409 8.058 -9.235 1.00 0.00 H new ATOM 2208 N SER A 142 3.564 5.638 -11.298 1.00 0.00 N ATOM 2209 CA SER A 142 3.459 5.317 -12.708 1.00 0.00 C ATOM 2210 C SER A 142 3.188 3.831 -12.883 1.00 0.00 C ATOM 2211 O SER A 142 2.746 3.379 -13.940 1.00 0.00 O ATOM 2212 CB SER A 142 4.760 5.701 -13.407 1.00 0.00 C ATOM 2213 OG SER A 142 5.877 5.194 -12.692 1.00 0.00 O ATOM 0 H SER A 142 4.522 5.722 -10.960 1.00 0.00 H new ATOM 0 HA SER A 142 2.633 5.875 -13.150 1.00 0.00 H new ATOM 0 HB2 SER A 142 4.763 5.308 -14.424 1.00 0.00 H new ATOM 0 HB3 SER A 142 4.832 6.786 -13.484 1.00 0.00 H new ATOM 0 HG SER A 142 5.946 4.227 -12.836 1.00 0.00 H new ATOM 2219 N ASN A 143 3.452 3.077 -11.824 1.00 0.00 N ATOM 2220 CA ASN A 143 3.284 1.635 -11.847 1.00 0.00 C ATOM 2221 C ASN A 143 2.496 1.163 -10.625 1.00 0.00 C ATOM 2222 O ASN A 143 3.012 0.395 -9.813 1.00 0.00 O ATOM 2223 CB ASN A 143 4.655 0.943 -11.877 1.00 0.00 C ATOM 2224 CG ASN A 143 5.478 1.308 -13.099 1.00 0.00 C ATOM 2225 OD1 ASN A 143 6.233 2.283 -13.086 1.00 0.00 O ATOM 2226 ND2 ASN A 143 5.346 0.528 -14.158 1.00 0.00 N ATOM 0 H ASN A 143 3.786 3.446 -10.934 1.00 0.00 H new ATOM 0 HA ASN A 143 2.727 1.371 -12.746 1.00 0.00 H new ATOM 0 HB2 ASN A 143 5.211 1.211 -10.978 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.511 -0.137 -11.852 1.00 0.00 H new ATOM 0 HD21 ASN A 143 5.880 0.723 -15.005 1.00 0.00 H new ATOM 0 HD22 ASN A 143 4.710 -0.269 -14.128 1.00 0.00 H new ATOM 2233 N PRO A 144 1.236 1.612 -10.463 1.00 0.00 N ATOM 2234 CA PRO A 144 0.409 1.183 -9.353 1.00 0.00 C ATOM 2235 C PRO A 144 -0.270 -0.144 -9.658 1.00 0.00 C ATOM 2236 O PRO A 144 -1.067 -0.255 -10.594 1.00 0.00 O ATOM 2237 CB PRO A 144 -0.609 2.312 -9.213 1.00 0.00 C ATOM 2238 CG PRO A 144 -0.747 2.890 -10.582 1.00 0.00 C ATOM 2239 CD PRO A 144 0.514 2.550 -11.348 1.00 0.00 C ATOM 0 HA PRO A 144 0.976 1.012 -8.438 1.00 0.00 H new ATOM 0 HB2 PRO A 144 -1.564 1.937 -8.846 1.00 0.00 H new ATOM 0 HB3 PRO A 144 -0.267 3.064 -8.501 1.00 0.00 H new ATOM 0 HG2 PRO A 144 -1.623 2.481 -11.085 1.00 0.00 H new ATOM 0 HG3 PRO A 144 -0.885 3.970 -10.530 1.00 0.00 H new ATOM 0 HD2 PRO A 144 0.284 2.092 -12.310 1.00 0.00 H new ATOM 0 HD3 PRO A 144 1.108 3.441 -11.553 1.00 0.00 H new ATOM 2247 N ARG A 145 0.064 -1.157 -8.886 1.00 0.00 N ATOM 2248 CA ARG A 145 -0.470 -2.487 -9.112 1.00 0.00 C ATOM 2249 C ARG A 145 -1.858 -2.601 -8.496 1.00 0.00 C ATOM 2250 O ARG A 145 -2.031 -3.136 -7.408 1.00 0.00 O ATOM 2251 CB ARG A 145 0.487 -3.535 -8.550 1.00 0.00 C ATOM 2252 CG ARG A 145 0.099 -4.965 -8.874 1.00 0.00 C ATOM 2253 CD ARG A 145 -0.853 -5.057 -10.059 1.00 0.00 C ATOM 2254 NE ARG A 145 -0.224 -4.667 -11.319 1.00 0.00 N ATOM 2255 CZ ARG A 145 -0.600 -5.132 -12.508 1.00 0.00 C ATOM 2256 NH1 ARG A 145 -1.569 -6.037 -12.596 1.00 0.00 N ATOM 2257 NH2 ARG A 145 -0.011 -4.688 -13.611 1.00 0.00 N ATOM 0 H ARG A 145 0.704 -1.086 -8.095 1.00 0.00 H new ATOM 0 HA ARG A 145 -0.566 -2.666 -10.183 1.00 0.00 H new ATOM 0 HB2 ARG A 145 1.487 -3.344 -8.939 1.00 0.00 H new ATOM 0 HB3 ARG A 145 0.539 -3.420 -7.467 1.00 0.00 H new ATOM 0 HG2 ARG A 145 0.998 -5.542 -9.089 1.00 0.00 H new ATOM 0 HG3 ARG A 145 -0.369 -5.418 -8.000 1.00 0.00 H new ATOM 0 HD2 ARG A 145 -1.224 -6.079 -10.144 1.00 0.00 H new ATOM 0 HD3 ARG A 145 -1.717 -4.418 -9.876 1.00 0.00 H new ATOM 0 HE ARG A 145 0.547 -4.000 -11.285 1.00 0.00 H new ATOM 0 HH11 ARG A 145 -2.027 -6.377 -11.751 1.00 0.00 H new ATOM 0 HH12 ARG A 145 -1.855 -6.391 -13.509 1.00 0.00 H new ATOM 0 HH21 ARG A 145 0.730 -3.990 -13.548 1.00 0.00 H new ATOM 0 HH22 ARG A 145 -0.299 -5.045 -14.522 1.00 0.00 H new ATOM 2271 N VAL A 146 -2.839 -2.104 -9.223 1.00 0.00 N ATOM 2272 CA VAL A 146 -4.205 -2.027 -8.731 1.00 0.00 C ATOM 2273 C VAL A 146 -4.995 -3.293 -9.053 1.00 0.00 C ATOM 2274 O VAL A 146 -4.876 -3.860 -10.140 1.00 0.00 O ATOM 2275 CB VAL A 146 -4.931 -0.805 -9.337 1.00 0.00 C ATOM 2276 CG1 VAL A 146 -4.153 0.459 -9.038 1.00 0.00 C ATOM 2277 CG2 VAL A 146 -5.117 -0.959 -10.839 1.00 0.00 C ATOM 0 H VAL A 146 -2.715 -1.743 -10.169 1.00 0.00 H new ATOM 0 HA VAL A 146 -4.150 -1.922 -7.647 1.00 0.00 H new ATOM 0 HB VAL A 146 -5.919 -0.739 -8.881 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -4.671 1.316 -9.469 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -4.071 0.589 -7.959 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.156 0.383 -9.471 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -5.631 -0.082 -11.234 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.143 -1.055 -11.318 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -5.711 -1.850 -11.043 1.00 0.00 H new ATOM 2287 N THR A 147 -5.764 -3.754 -8.082 1.00 0.00 N ATOM 2288 CA THR A 147 -6.730 -4.814 -8.301 1.00 0.00 C ATOM 2289 C THR A 147 -7.912 -4.639 -7.369 1.00 0.00 C ATOM 2290 O THR A 147 -7.804 -4.807 -6.159 1.00 0.00 O ATOM 2291 CB THR A 147 -6.102 -6.213 -8.126 1.00 0.00 C ATOM 2292 OG1 THR A 147 -5.045 -6.387 -9.079 1.00 0.00 O ATOM 2293 CG2 THR A 147 -7.139 -7.309 -8.322 1.00 0.00 C ATOM 0 H THR A 147 -5.736 -3.405 -7.124 1.00 0.00 H new ATOM 0 HA THR A 147 -7.074 -4.743 -9.333 1.00 0.00 H new ATOM 0 HB THR A 147 -5.709 -6.285 -7.112 1.00 0.00 H new ATOM 0 HG1 THR A 147 -4.965 -5.580 -9.629 1.00 0.00 H new ATOM 0 HG21 THR A 147 -6.668 -8.283 -8.193 1.00 0.00 H new ATOM 0 HG22 THR A 147 -7.936 -7.191 -7.588 1.00 0.00 H new ATOM 0 HG23 THR A 147 -7.557 -7.239 -9.326 1.00 0.00 H new ATOM 2301 N ARG A 148 -9.030 -4.255 -7.951 1.00 0.00 N ATOM 2302 CA ARG A 148 -10.251 -4.057 -7.204 1.00 0.00 C ATOM 2303 C ARG A 148 -11.169 -5.242 -7.391 1.00 0.00 C ATOM 2304 O ARG A 148 -11.273 -5.805 -8.481 1.00 0.00 O ATOM 2305 CB ARG A 148 -10.944 -2.755 -7.615 1.00 0.00 C ATOM 2306 CG ARG A 148 -10.557 -2.281 -9.001 1.00 0.00 C ATOM 2307 CD ARG A 148 -11.251 -0.979 -9.361 1.00 0.00 C ATOM 2308 NE ARG A 148 -10.916 -0.523 -10.712 1.00 0.00 N ATOM 2309 CZ ARG A 148 -10.745 0.759 -11.046 1.00 0.00 C ATOM 2310 NH1 ARG A 148 -10.870 1.710 -10.129 1.00 0.00 N ATOM 2311 NH2 ARG A 148 -10.448 1.094 -12.294 1.00 0.00 N ATOM 0 H ARG A 148 -9.116 -4.073 -8.951 1.00 0.00 H new ATOM 0 HA ARG A 148 -10.001 -3.974 -6.146 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -12.024 -2.898 -7.576 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -10.700 -1.977 -6.891 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -9.477 -2.144 -9.051 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -10.815 -3.046 -9.733 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -12.330 -1.112 -9.282 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -10.971 -0.210 -8.641 1.00 0.00 H new ATOM 0 HE ARG A 148 -10.807 -1.227 -11.442 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -11.097 1.463 -9.166 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -10.739 2.688 -10.387 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -10.349 0.371 -13.006 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -10.319 2.075 -12.542 1.00 0.00 H new ATOM 2325 N PHE A 149 -11.813 -5.607 -6.313 1.00 0.00 N ATOM 2326 CA PHE A 149 -12.649 -6.796 -6.273 1.00 0.00 C ATOM 2327 C PHE A 149 -14.094 -6.430 -5.976 1.00 0.00 C ATOM 2328 O PHE A 149 -14.404 -5.300 -5.604 1.00 0.00 O ATOM 2329 CB PHE A 149 -12.183 -7.765 -5.192 1.00 0.00 C ATOM 2330 CG PHE A 149 -10.694 -7.894 -5.060 1.00 0.00 C ATOM 2331 CD1 PHE A 149 -9.991 -7.020 -4.250 1.00 0.00 C ATOM 2332 CD2 PHE A 149 -10.002 -8.891 -5.727 1.00 0.00 C ATOM 2333 CE1 PHE A 149 -8.629 -7.132 -4.105 1.00 0.00 C ATOM 2334 CE2 PHE A 149 -8.632 -9.011 -5.584 1.00 0.00 C ATOM 2335 CZ PHE A 149 -7.945 -8.127 -4.772 1.00 0.00 C ATOM 0 H PHE A 149 -11.778 -5.093 -5.433 1.00 0.00 H new ATOM 0 HA PHE A 149 -12.571 -7.268 -7.252 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -12.592 -7.442 -4.234 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -12.601 -8.749 -5.402 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -10.520 -6.239 -3.724 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -10.537 -9.580 -6.364 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -8.095 -6.442 -3.469 1.00 0.00 H new ATOM 0 HE2 PHE A 149 -8.100 -9.793 -6.105 1.00 0.00 H new ATOM 0 HZ PHE A 149 -6.874 -8.216 -4.660 1.00 0.00 H new ATOM 2345 N HIS A 150 -14.971 -7.403 -6.151 1.00 0.00 N ATOM 2346 CA HIS A 150 -16.382 -7.240 -5.838 1.00 0.00 C ATOM 2347 C HIS A 150 -16.702 -7.976 -4.539 1.00 0.00 C ATOM 2348 O HIS A 150 -16.610 -9.203 -4.486 1.00 0.00 O ATOM 2349 CB HIS A 150 -17.246 -7.784 -6.984 1.00 0.00 C ATOM 2350 CG HIS A 150 -16.968 -7.151 -8.319 1.00 0.00 C ATOM 2351 ND1 HIS A 150 -15.833 -6.613 -8.827 1.00 0.00 N flip ATOM 2352 CD2 HIS A 150 -17.915 -7.047 -9.315 1.00 0.00 C flip ATOM 2353 CE1 HIS A 150 -16.117 -6.198 -10.102 1.00 0.00 C flip ATOM 2354 NE2 HIS A 150 -17.377 -6.470 -10.372 1.00 0.00 N flip ATOM 0 H HIS A 150 -14.728 -8.325 -6.513 1.00 0.00 H new ATOM 0 HA HIS A 150 -16.603 -6.180 -5.714 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -17.088 -8.859 -7.064 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -18.297 -7.634 -6.735 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -18.938 -7.385 -9.241 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -15.420 -5.724 -10.777 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -17.856 -6.269 -11.250 1.00 0.00 H new ATOM 2363 N ILE A 151 -17.072 -7.241 -3.493 1.00 0.00 N ATOM 2364 CA ILE A 151 -17.299 -7.841 -2.196 1.00 0.00 C ATOM 2365 C ILE A 151 -18.730 -7.639 -1.749 1.00 0.00 C ATOM 2366 O ILE A 151 -19.571 -7.140 -2.493 1.00 0.00 O ATOM 2367 CB ILE A 151 -16.354 -7.275 -1.111 1.00 0.00 C ATOM 2368 CG1 ILE A 151 -16.606 -5.780 -0.863 1.00 0.00 C ATOM 2369 CG2 ILE A 151 -14.910 -7.512 -1.513 1.00 0.00 C ATOM 2370 CD1 ILE A 151 -15.901 -5.233 0.370 1.00 0.00 C ATOM 0 H ILE A 151 -17.219 -6.232 -3.525 1.00 0.00 H new ATOM 0 HA ILE A 151 -17.092 -8.905 -2.313 1.00 0.00 H new ATOM 0 HB ILE A 151 -16.559 -7.798 -0.177 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -16.279 -5.216 -1.737 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -17.678 -5.614 -0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -14.248 -7.111 -0.745 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -14.734 -8.582 -1.622 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -14.710 -7.013 -2.461 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -16.127 -4.172 0.478 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -16.246 -5.769 1.254 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -14.824 -5.365 0.262 1.00 0.00 H new ATOM 2382 N ASN A 152 -18.986 -8.035 -0.525 1.00 0.00 N ATOM 2383 CA ASN A 152 -20.309 -7.973 0.059 1.00 0.00 C ATOM 2384 C ASN A 152 -20.473 -6.720 0.873 1.00 0.00 C ATOM 2385 O ASN A 152 -20.121 -6.688 2.044 1.00 0.00 O ATOM 2386 CB ASN A 152 -20.517 -9.188 0.934 1.00 0.00 C ATOM 2387 CG ASN A 152 -21.028 -10.359 0.144 1.00 0.00 C ATOM 2388 OD1 ASN A 152 -20.660 -10.386 -1.117 1.00 0.00 O flip ATOM 2389 ND2 ASN A 152 -21.735 -11.221 0.653 1.00 0.00 N flip ATOM 0 H ASN A 152 -18.276 -8.414 0.102 1.00 0.00 H new ATOM 0 HA ASN A 152 -21.052 -7.959 -0.739 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -19.576 -9.456 1.415 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -21.224 -8.948 1.728 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -21.993 -11.153 1.638 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -22.066 -12.006 0.092 1.00 0.00 H new ATOM 2396 N TRP A 153 -20.985 -5.682 0.243 1.00 0.00 N ATOM 2397 CA TRP A 153 -21.302 -4.458 0.934 1.00 0.00 C ATOM 2398 C TRP A 153 -22.592 -4.623 1.704 1.00 0.00 C ATOM 2399 O TRP A 153 -22.931 -3.812 2.569 1.00 0.00 O ATOM 2400 CB TRP A 153 -21.448 -3.331 -0.073 1.00 0.00 C ATOM 2401 CG TRP A 153 -20.245 -3.168 -0.933 1.00 0.00 C ATOM 2402 CD1 TRP A 153 -19.842 -3.985 -1.941 1.00 0.00 C ATOM 2403 CD2 TRP A 153 -19.296 -2.119 -0.862 1.00 0.00 C ATOM 2404 NE1 TRP A 153 -18.674 -3.527 -2.474 1.00 0.00 N ATOM 2405 CE2 TRP A 153 -18.317 -2.379 -1.832 1.00 0.00 C ATOM 2406 CE3 TRP A 153 -19.177 -0.990 -0.063 1.00 0.00 C ATOM 2407 CZ2 TRP A 153 -17.229 -1.548 -2.020 1.00 0.00 C ATOM 2408 CZ3 TRP A 153 -18.096 -0.159 -0.252 1.00 0.00 C ATOM 2409 CH2 TRP A 153 -17.132 -0.448 -1.221 1.00 0.00 C ATOM 0 H TRP A 153 -21.190 -5.667 -0.756 1.00 0.00 H new ATOM 0 HA TRP A 153 -20.499 -4.220 1.631 1.00 0.00 H new ATOM 0 HB2 TRP A 153 -22.316 -3.523 -0.703 1.00 0.00 H new ATOM 0 HB3 TRP A 153 -21.639 -2.398 0.457 1.00 0.00 H new ATOM 0 HD1 TRP A 153 -20.370 -4.868 -2.271 1.00 0.00 H new ATOM 0 HE1 TRP A 153 -18.152 -3.971 -3.230 1.00 0.00 H new ATOM 0 HE3 TRP A 153 -19.917 -0.768 0.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 153 -16.484 -1.762 -2.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 153 -17.992 0.727 0.356 1.00 0.00 H new ATOM 0 HH2 TRP A 153 -16.289 0.217 -1.340 1.00 0.00 H new ATOM 2420 N GLU A 154 -23.295 -5.700 1.408 1.00 0.00 N ATOM 2421 CA GLU A 154 -24.612 -5.894 1.940 1.00 0.00 C ATOM 2422 C GLU A 154 -24.737 -7.254 2.554 1.00 0.00 C ATOM 2423 O GLU A 154 -24.090 -8.217 2.138 1.00 0.00 O ATOM 2424 CB GLU A 154 -25.660 -5.728 0.850 1.00 0.00 C ATOM 2425 CG GLU A 154 -25.650 -4.350 0.244 1.00 0.00 C ATOM 2426 CD GLU A 154 -26.506 -4.241 -0.997 1.00 0.00 C ATOM 2427 OE1 GLU A 154 -25.998 -4.516 -2.105 1.00 0.00 O ATOM 2428 OE2 GLU A 154 -27.687 -3.860 -0.875 1.00 0.00 O ATOM 0 H GLU A 154 -22.967 -6.450 0.800 1.00 0.00 H new ATOM 0 HA GLU A 154 -24.778 -5.140 2.710 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -25.485 -6.467 0.068 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -26.647 -5.931 1.266 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -26.001 -3.632 0.985 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -24.625 -4.076 -0.004 1.00 0.00 H new ATOM 2435 N ASP A 155 -25.586 -7.308 3.532 1.00 0.00 N ATOM 2436 CA ASP A 155 -25.911 -8.540 4.210 1.00 0.00 C ATOM 2437 C ASP A 155 -26.961 -9.276 3.387 1.00 0.00 C ATOM 2438 O ASP A 155 -28.136 -9.336 3.751 1.00 0.00 O ATOM 2439 CB ASP A 155 -26.405 -8.204 5.612 1.00 0.00 C ATOM 2440 CG ASP A 155 -26.823 -9.407 6.435 1.00 0.00 C ATOM 2441 OD1 ASP A 155 -25.941 -10.154 6.905 1.00 0.00 O ATOM 2442 OD2 ASP A 155 -28.039 -9.590 6.649 1.00 0.00 O ATOM 0 H ASP A 155 -26.083 -6.493 3.892 1.00 0.00 H new ATOM 0 HA ASP A 155 -25.043 -9.191 4.309 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -25.616 -7.672 6.144 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -27.252 -7.522 5.532 1.00 0.00 H new ATOM 2447 N ASN A 156 -26.527 -9.799 2.244 1.00 0.00 N ATOM 2448 CA ASN A 156 -27.436 -10.431 1.296 1.00 0.00 C ATOM 2449 C ASN A 156 -26.711 -11.503 0.499 1.00 0.00 C ATOM 2450 O ASN A 156 -25.462 -11.509 0.520 1.00 0.00 O ATOM 2451 CB ASN A 156 -28.052 -9.386 0.346 1.00 0.00 C ATOM 2452 CG ASN A 156 -27.079 -8.826 -0.692 1.00 0.00 C ATOM 2453 OD1 ASN A 156 -25.802 -8.743 -0.354 1.00 0.00 O flip ATOM 2454 ND2 ASN A 156 -27.484 -8.460 -1.795 1.00 0.00 N flip ATOM 2455 OXT ASN A 156 -27.388 -12.329 -0.148 1.00 0.00 O ATOM 0 H ASN A 156 -25.550 -9.797 1.952 1.00 0.00 H new ATOM 0 HA ASN A 156 -28.243 -10.899 1.861 1.00 0.00 H new ATOM 0 HB2 ASN A 156 -28.897 -9.838 -0.173 1.00 0.00 H new ATOM 0 HB3 ASN A 156 -28.446 -8.561 0.939 1.00 0.00 H new ATOM 0 HD21 ASN A 156 -28.475 -8.537 -2.026 1.00 0.00 H new ATOM 0 HD22 ASN A 156 -26.829 -8.080 -2.478 1.00 0.00 H new TER 2462 ASN A 156 ATOM 2463 N GLY B 118 7.345 -20.467 -2.730 1.00 0.00 N ATOM 2464 CA GLY B 118 7.193 -19.468 -3.813 1.00 0.00 C ATOM 2465 C GLY B 118 7.858 -18.146 -3.488 1.00 0.00 C ATOM 2466 O GLY B 118 7.791 -17.204 -4.282 1.00 0.00 O ATOM 0 HA2 GLY B 118 7.620 -19.868 -4.733 1.00 0.00 H new ATOM 0 HA3 GLY B 118 6.132 -19.300 -4.000 1.00 0.00 H new ATOM 2470 N ALA B 119 8.507 -18.067 -2.328 1.00 0.00 N ATOM 2471 CA ALA B 119 9.162 -16.839 -1.903 1.00 0.00 C ATOM 2472 C ALA B 119 10.508 -16.675 -2.580 1.00 0.00 C ATOM 2473 O ALA B 119 11.546 -17.055 -2.033 1.00 0.00 O ATOM 2474 CB ALA B 119 9.334 -16.809 -0.398 1.00 0.00 C ATOM 0 H ALA B 119 8.591 -18.840 -1.668 1.00 0.00 H new ATOM 0 HA ALA B 119 8.522 -16.008 -2.199 1.00 0.00 H new ATOM 0 HB1 ALA B 119 9.826 -15.881 -0.106 1.00 0.00 H new ATOM 0 HB2 ALA B 119 8.357 -16.868 0.081 1.00 0.00 H new ATOM 0 HB3 ALA B 119 9.943 -17.657 -0.084 1.00 0.00 H new ATOM 2480 N MET B 120 10.484 -16.124 -3.777 1.00 0.00 N ATOM 2481 CA MET B 120 11.701 -15.835 -4.506 1.00 0.00 C ATOM 2482 C MET B 120 11.422 -14.820 -5.598 1.00 0.00 C ATOM 2483 O MET B 120 10.515 -15.004 -6.415 1.00 0.00 O ATOM 2484 CB MET B 120 12.285 -17.104 -5.127 1.00 0.00 C ATOM 2485 CG MET B 120 13.678 -16.904 -5.697 1.00 0.00 C ATOM 2486 SD MET B 120 13.935 -17.809 -7.232 1.00 0.00 S ATOM 2487 CE MET B 120 12.792 -16.941 -8.305 1.00 0.00 C ATOM 0 H MET B 120 9.628 -15.866 -4.268 1.00 0.00 H new ATOM 0 HA MET B 120 12.427 -15.428 -3.802 1.00 0.00 H new ATOM 0 HB2 MET B 120 12.318 -17.889 -4.371 1.00 0.00 H new ATOM 0 HB3 MET B 120 11.622 -17.452 -5.919 1.00 0.00 H new ATOM 0 HG2 MET B 120 13.845 -15.841 -5.874 1.00 0.00 H new ATOM 0 HG3 MET B 120 14.417 -17.225 -4.962 1.00 0.00 H new ATOM 0 HE1 MET B 120 13.145 -16.998 -9.335 1.00 0.00 H new ATOM 0 HE2 MET B 120 11.806 -17.400 -8.233 1.00 0.00 H new ATOM 0 HE3 MET B 120 12.729 -15.896 -8.001 1.00 0.00 H new ATOM 2497 N GLY B 121 12.191 -13.753 -5.597 1.00 0.00 N ATOM 2498 CA GLY B 121 12.062 -12.740 -6.619 1.00 0.00 C ATOM 2499 C GLY B 121 11.279 -11.540 -6.145 1.00 0.00 C ATOM 2500 O GLY B 121 11.247 -11.243 -4.953 1.00 0.00 O ATOM 0 H GLY B 121 12.912 -13.565 -4.900 1.00 0.00 H new ATOM 0 HA2 GLY B 121 13.054 -12.420 -6.937 1.00 0.00 H new ATOM 0 HA3 GLY B 121 11.570 -13.169 -7.492 1.00 0.00 H new ATOM 2504 N LYS B 122 10.654 -10.837 -7.080 1.00 0.00 N ATOM 2505 CA LYS B 122 9.813 -9.699 -6.743 1.00 0.00 C ATOM 2506 C LYS B 122 8.469 -9.833 -7.423 1.00 0.00 C ATOM 2507 O LYS B 122 7.465 -10.100 -6.775 1.00 0.00 O ATOM 2508 CB LYS B 122 10.449 -8.376 -7.176 1.00 0.00 C ATOM 2509 CG LYS B 122 11.797 -8.108 -6.546 1.00 0.00 C ATOM 2510 CD LYS B 122 11.679 -8.026 -5.041 1.00 0.00 C ATOM 2511 CE LYS B 122 12.990 -7.639 -4.401 1.00 0.00 C ATOM 2512 NZ LYS B 122 12.861 -7.525 -2.933 1.00 0.00 N ATOM 0 H LYS B 122 10.714 -11.036 -8.079 1.00 0.00 H new ATOM 0 HA LYS B 122 9.695 -9.692 -5.659 1.00 0.00 H new ATOM 0 HB2 LYS B 122 10.559 -8.375 -8.260 1.00 0.00 H new ATOM 0 HB3 LYS B 122 9.772 -7.559 -6.924 1.00 0.00 H new ATOM 0 HG2 LYS B 122 12.495 -8.900 -6.818 1.00 0.00 H new ATOM 0 HG3 LYS B 122 12.206 -7.175 -6.935 1.00 0.00 H new ATOM 0 HD2 LYS B 122 10.914 -7.296 -4.775 1.00 0.00 H new ATOM 0 HD3 LYS B 122 11.352 -8.989 -4.648 1.00 0.00 H new ATOM 0 HE2 LYS B 122 13.749 -8.383 -4.644 1.00 0.00 H new ATOM 0 HE3 LYS B 122 13.331 -6.689 -4.813 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 13.678 -7.006 -2.552 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 11.986 -7.013 -2.700 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 12.828 -8.476 -2.513 1.00 0.00 H new ATOM 2526 N ASP B 123 8.491 -9.624 -8.737 1.00 0.00 N ATOM 2527 CA ASP B 123 7.314 -9.710 -9.611 1.00 0.00 C ATOM 2528 C ASP B 123 6.197 -10.611 -9.067 1.00 0.00 C ATOM 2529 O ASP B 123 5.126 -10.117 -8.712 1.00 0.00 O ATOM 2530 CB ASP B 123 7.743 -10.174 -11.012 1.00 0.00 C ATOM 2531 CG ASP B 123 8.700 -11.357 -10.986 1.00 0.00 C ATOM 2532 OD1 ASP B 123 8.226 -12.511 -10.999 1.00 0.00 O ATOM 2533 OD2 ASP B 123 9.930 -11.137 -10.954 1.00 0.00 O ATOM 0 H ASP B 123 9.346 -9.384 -9.240 1.00 0.00 H new ATOM 0 HA ASP B 123 6.888 -8.708 -9.657 1.00 0.00 H new ATOM 0 HB2 ASP B 123 6.856 -10.445 -11.585 1.00 0.00 H new ATOM 0 HB3 ASP B 123 8.218 -9.343 -11.533 1.00 0.00 H new ATOM 2538 N ILE B 124 6.445 -11.913 -8.979 1.00 0.00 N ATOM 2539 CA ILE B 124 5.426 -12.858 -8.529 1.00 0.00 C ATOM 2540 C ILE B 124 5.018 -12.622 -7.070 1.00 0.00 C ATOM 2541 O ILE B 124 3.859 -12.782 -6.714 1.00 0.00 O ATOM 2542 CB ILE B 124 5.891 -14.323 -8.706 1.00 0.00 C ATOM 2543 CG1 ILE B 124 4.791 -15.294 -8.262 1.00 0.00 C ATOM 2544 CG2 ILE B 124 7.178 -14.580 -7.930 1.00 0.00 C ATOM 2545 CD1 ILE B 124 3.531 -15.217 -9.101 1.00 0.00 C ATOM 0 H ILE B 124 7.342 -12.339 -9.213 1.00 0.00 H new ATOM 0 HA ILE B 124 4.554 -12.684 -9.159 1.00 0.00 H new ATOM 0 HB ILE B 124 6.093 -14.491 -9.764 1.00 0.00 H new ATOM 0 HG12 ILE B 124 5.180 -16.311 -8.301 1.00 0.00 H new ATOM 0 HG13 ILE B 124 4.537 -15.089 -7.222 1.00 0.00 H new ATOM 0 HG21 ILE B 124 7.486 -15.616 -8.069 1.00 0.00 H new ATOM 0 HG22 ILE B 124 7.962 -13.916 -8.295 1.00 0.00 H new ATOM 0 HG23 ILE B 124 7.008 -14.391 -6.870 1.00 0.00 H new ATOM 0 HD11 ILE B 124 2.800 -15.933 -8.726 1.00 0.00 H new ATOM 0 HD12 ILE B 124 3.116 -14.211 -9.043 1.00 0.00 H new ATOM 0 HD13 ILE B 124 3.770 -15.452 -10.138 1.00 0.00 H new ATOM 2557 N GLN B 125 5.967 -12.231 -6.237 1.00 0.00 N ATOM 2558 CA GLN B 125 5.715 -12.019 -4.816 1.00 0.00 C ATOM 2559 C GLN B 125 4.774 -10.841 -4.574 1.00 0.00 C ATOM 2560 O GLN B 125 3.776 -10.961 -3.850 1.00 0.00 O ATOM 2561 CB GLN B 125 7.044 -11.812 -4.095 1.00 0.00 C ATOM 2562 CG GLN B 125 7.699 -13.122 -3.705 1.00 0.00 C ATOM 2563 CD GLN B 125 6.993 -13.776 -2.537 1.00 0.00 C ATOM 2564 OE1 GLN B 125 6.507 -12.960 -1.619 1.00 0.00 O flip ATOM 2565 NE2 GLN B 125 6.899 -14.997 -2.447 1.00 0.00 N flip ATOM 0 H GLN B 125 6.930 -12.051 -6.521 1.00 0.00 H new ATOM 0 HA GLN B 125 5.219 -12.904 -4.417 1.00 0.00 H new ATOM 0 HB2 GLN B 125 7.720 -11.248 -4.738 1.00 0.00 H new ATOM 0 HB3 GLN B 125 6.880 -11.211 -3.201 1.00 0.00 H new ATOM 0 HG2 GLN B 125 7.694 -13.800 -4.559 1.00 0.00 H new ATOM 0 HG3 GLN B 125 8.743 -12.944 -3.446 1.00 0.00 H new ATOM 0 HE21 GLN B 125 7.288 -15.594 -3.177 1.00 0.00 H new ATOM 0 HE22 GLN B 125 6.432 -15.415 -1.642 1.00 0.00 H new ATOM 2574 N LEU B 126 5.077 -9.707 -5.187 1.00 0.00 N ATOM 2575 CA LEU B 126 4.235 -8.534 -5.039 1.00 0.00 C ATOM 2576 C LEU B 126 2.893 -8.773 -5.728 1.00 0.00 C ATOM 2577 O LEU B 126 1.844 -8.318 -5.254 1.00 0.00 O ATOM 2578 CB LEU B 126 4.926 -7.277 -5.595 1.00 0.00 C ATOM 2579 CG LEU B 126 6.205 -6.815 -4.863 1.00 0.00 C ATOM 2580 CD1 LEU B 126 6.118 -7.088 -3.370 1.00 0.00 C ATOM 2581 CD2 LEU B 126 7.444 -7.458 -5.440 1.00 0.00 C ATOM 0 H LEU B 126 5.892 -9.576 -5.786 1.00 0.00 H new ATOM 0 HA LEU B 126 4.060 -8.363 -3.977 1.00 0.00 H new ATOM 0 HB2 LEU B 126 5.178 -7.459 -6.640 1.00 0.00 H new ATOM 0 HB3 LEU B 126 4.208 -6.457 -5.578 1.00 0.00 H new ATOM 0 HG LEU B 126 6.283 -5.738 -5.013 1.00 0.00 H new ATOM 0 HD11 LEU B 126 7.034 -6.751 -2.885 1.00 0.00 H new ATOM 0 HD12 LEU B 126 5.267 -6.551 -2.951 1.00 0.00 H new ATOM 0 HD13 LEU B 126 5.991 -8.158 -3.202 1.00 0.00 H new ATOM 0 HD21 LEU B 126 8.322 -7.107 -4.898 1.00 0.00 H new ATOM 0 HD22 LEU B 126 7.369 -8.541 -5.347 1.00 0.00 H new ATOM 0 HD23 LEU B 126 7.536 -7.190 -6.493 1.00 0.00 H new ATOM 2593 N ALA B 127 2.929 -9.523 -6.828 1.00 0.00 N ATOM 2594 CA ALA B 127 1.714 -9.903 -7.534 1.00 0.00 C ATOM 2595 C ALA B 127 0.849 -10.799 -6.663 1.00 0.00 C ATOM 2596 O ALA B 127 -0.370 -10.692 -6.679 1.00 0.00 O ATOM 2597 CB ALA B 127 2.040 -10.602 -8.845 1.00 0.00 C ATOM 0 H ALA B 127 3.788 -9.878 -7.247 1.00 0.00 H new ATOM 0 HA ALA B 127 1.160 -8.992 -7.761 1.00 0.00 H new ATOM 0 HB1 ALA B 127 1.114 -10.875 -9.352 1.00 0.00 H new ATOM 0 HB2 ALA B 127 2.618 -9.931 -9.481 1.00 0.00 H new ATOM 0 HB3 ALA B 127 2.622 -11.501 -8.643 1.00 0.00 H new ATOM 2603 N ARG B 128 1.494 -11.687 -5.908 1.00 0.00 N ATOM 2604 CA ARG B 128 0.797 -12.563 -4.973 1.00 0.00 C ATOM 2605 C ARG B 128 -0.115 -11.773 -4.054 1.00 0.00 C ATOM 2606 O ARG B 128 -1.321 -12.030 -3.997 1.00 0.00 O ATOM 2607 CB ARG B 128 1.787 -13.353 -4.117 1.00 0.00 C ATOM 2608 CG ARG B 128 2.279 -14.642 -4.746 1.00 0.00 C ATOM 2609 CD ARG B 128 3.111 -15.437 -3.754 1.00 0.00 C ATOM 2610 NE ARG B 128 2.387 -15.656 -2.500 1.00 0.00 N ATOM 2611 CZ ARG B 128 2.921 -16.193 -1.406 1.00 0.00 C ATOM 2612 NH1 ARG B 128 4.201 -16.548 -1.390 1.00 0.00 N ATOM 2613 NH2 ARG B 128 2.175 -16.360 -0.320 1.00 0.00 N ATOM 0 H ARG B 128 2.505 -11.818 -5.928 1.00 0.00 H new ATOM 0 HA ARG B 128 0.200 -13.252 -5.571 1.00 0.00 H new ATOM 0 HB2 ARG B 128 2.647 -12.719 -3.901 1.00 0.00 H new ATOM 0 HB3 ARG B 128 1.315 -13.587 -3.163 1.00 0.00 H new ATOM 0 HG2 ARG B 128 1.429 -15.239 -5.077 1.00 0.00 H new ATOM 0 HG3 ARG B 128 2.875 -14.417 -5.631 1.00 0.00 H new ATOM 0 HD2 ARG B 128 3.381 -16.398 -4.192 1.00 0.00 H new ATOM 0 HD3 ARG B 128 4.041 -14.907 -3.550 1.00 0.00 H new ATOM 0 HE ARG B 128 1.406 -15.378 -2.463 1.00 0.00 H new ATOM 0 HH11 ARG B 128 4.779 -16.409 -2.219 1.00 0.00 H new ATOM 0 HH12 ARG B 128 4.606 -16.959 -0.549 1.00 0.00 H new ATOM 0 HH21 ARG B 128 1.195 -16.077 -0.326 1.00 0.00 H new ATOM 0 HH22 ARG B 128 2.582 -16.771 0.520 1.00 0.00 H new ATOM 2627 N ARG B 129 0.461 -10.801 -3.342 1.00 0.00 N ATOM 2628 CA ARG B 129 -0.306 -10.033 -2.373 1.00 0.00 C ATOM 2629 C ARG B 129 -1.508 -9.374 -3.044 1.00 0.00 C ATOM 2630 O ARG B 129 -2.619 -9.409 -2.504 1.00 0.00 O ATOM 2631 CB ARG B 129 0.564 -8.979 -1.678 1.00 0.00 C ATOM 2632 CG ARG B 129 0.690 -9.178 -0.165 1.00 0.00 C ATOM 2633 CD ARG B 129 -0.673 -9.196 0.520 1.00 0.00 C ATOM 2634 NE ARG B 129 -0.577 -9.158 1.985 1.00 0.00 N ATOM 2635 CZ ARG B 129 -1.557 -9.543 2.812 1.00 0.00 C ATOM 2636 NH1 ARG B 129 -2.673 -10.070 2.327 1.00 0.00 N ATOM 2637 NH2 ARG B 129 -1.423 -9.416 4.125 1.00 0.00 N ATOM 0 H ARG B 129 1.442 -10.534 -3.420 1.00 0.00 H new ATOM 0 HA ARG B 129 -0.665 -10.724 -1.610 1.00 0.00 H new ATOM 0 HB2 ARG B 129 1.560 -8.995 -2.121 1.00 0.00 H new ATOM 0 HB3 ARG B 129 0.145 -7.991 -1.871 1.00 0.00 H new ATOM 0 HG2 ARG B 129 1.210 -10.114 0.036 1.00 0.00 H new ATOM 0 HG3 ARG B 129 1.298 -8.378 0.257 1.00 0.00 H new ATOM 0 HD2 ARG B 129 -1.258 -8.342 0.177 1.00 0.00 H new ATOM 0 HD3 ARG B 129 -1.213 -10.094 0.219 1.00 0.00 H new ATOM 0 HE ARG B 129 0.291 -8.817 2.398 1.00 0.00 H new ATOM 0 HH11 ARG B 129 -2.788 -10.184 1.320 1.00 0.00 H new ATOM 0 HH12 ARG B 129 -3.417 -10.362 2.961 1.00 0.00 H new ATOM 0 HH21 ARG B 129 -0.567 -9.022 4.514 1.00 0.00 H new ATOM 0 HH22 ARG B 129 -2.176 -9.713 4.746 1.00 0.00 H new ATOM 2651 N ILE B 130 -1.281 -8.821 -4.233 1.00 0.00 N ATOM 2652 CA ILE B 130 -2.320 -8.108 -4.975 1.00 0.00 C ATOM 2653 C ILE B 130 -3.405 -9.046 -5.515 1.00 0.00 C ATOM 2654 O ILE B 130 -4.593 -8.799 -5.303 1.00 0.00 O ATOM 2655 CB ILE B 130 -1.705 -7.270 -6.131 1.00 0.00 C ATOM 2656 CG1 ILE B 130 -1.320 -5.877 -5.632 1.00 0.00 C ATOM 2657 CG2 ILE B 130 -2.654 -7.152 -7.314 1.00 0.00 C ATOM 2658 CD1 ILE B 130 -0.279 -5.880 -4.541 1.00 0.00 C ATOM 0 H ILE B 130 -0.379 -8.853 -4.707 1.00 0.00 H new ATOM 0 HA ILE B 130 -2.799 -7.433 -4.266 1.00 0.00 H new ATOM 0 HB ILE B 130 -0.811 -7.793 -6.471 1.00 0.00 H new ATOM 0 HG12 ILE B 130 -0.948 -5.292 -6.473 1.00 0.00 H new ATOM 0 HG13 ILE B 130 -2.215 -5.374 -5.265 1.00 0.00 H new ATOM 0 HG21 ILE B 130 -2.185 -6.559 -8.099 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -2.882 -8.146 -7.698 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -3.576 -6.666 -6.994 1.00 0.00 H new ATOM 0 HD11 ILE B 130 -0.062 -4.854 -4.243 1.00 0.00 H new ATOM 0 HD12 ILE B 130 -0.654 -6.436 -3.682 1.00 0.00 H new ATOM 0 HD13 ILE B 130 0.632 -6.352 -4.909 1.00 0.00 H new ATOM 2670 N ARG B 131 -2.997 -10.118 -6.192 1.00 0.00 N ATOM 2671 CA ARG B 131 -3.937 -11.014 -6.858 1.00 0.00 C ATOM 2672 C ARG B 131 -4.927 -11.623 -5.879 1.00 0.00 C ATOM 2673 O ARG B 131 -6.132 -11.652 -6.138 1.00 0.00 O ATOM 2674 CB ARG B 131 -3.193 -12.127 -7.603 1.00 0.00 C ATOM 2675 CG ARG B 131 -2.501 -11.660 -8.874 1.00 0.00 C ATOM 2676 CD ARG B 131 -3.487 -11.028 -9.839 1.00 0.00 C ATOM 2677 NE ARG B 131 -2.872 -10.697 -11.121 1.00 0.00 N ATOM 2678 CZ ARG B 131 -3.220 -9.645 -11.858 1.00 0.00 C ATOM 2679 NH1 ARG B 131 -4.132 -8.791 -11.412 1.00 0.00 N ATOM 2680 NH2 ARG B 131 -2.647 -9.443 -13.036 1.00 0.00 N ATOM 0 H ARG B 131 -2.018 -10.387 -6.293 1.00 0.00 H new ATOM 0 HA ARG B 131 -4.496 -10.414 -7.576 1.00 0.00 H new ATOM 0 HB2 ARG B 131 -2.450 -12.564 -6.936 1.00 0.00 H new ATOM 0 HB3 ARG B 131 -3.900 -12.918 -7.855 1.00 0.00 H new ATOM 0 HG2 ARG B 131 -1.722 -10.940 -8.623 1.00 0.00 H new ATOM 0 HG3 ARG B 131 -2.010 -12.506 -9.355 1.00 0.00 H new ATOM 0 HD2 ARG B 131 -4.320 -11.712 -10.004 1.00 0.00 H new ATOM 0 HD3 ARG B 131 -3.900 -10.124 -9.392 1.00 0.00 H new ATOM 0 HE ARG B 131 -2.133 -11.307 -11.472 1.00 0.00 H new ATOM 0 HH11 ARG B 131 -4.568 -8.940 -10.502 1.00 0.00 H new ATOM 0 HH12 ARG B 131 -4.397 -7.985 -11.979 1.00 0.00 H new ATOM 0 HH21 ARG B 131 -1.940 -10.094 -13.377 1.00 0.00 H new ATOM 0 HH22 ARG B 131 -2.913 -8.637 -13.601 1.00 0.00 H new ATOM 2694 N GLY B 132 -4.426 -12.112 -4.757 1.00 0.00 N ATOM 2695 CA GLY B 132 -5.303 -12.707 -3.782 1.00 0.00 C ATOM 2696 C GLY B 132 -4.558 -13.303 -2.617 1.00 0.00 C ATOM 2697 O GLY B 132 -4.723 -14.484 -2.310 1.00 0.00 O ATOM 0 H GLY B 132 -3.437 -12.107 -4.508 1.00 0.00 H new ATOM 0 HA2 GLY B 132 -5.998 -11.951 -3.415 1.00 0.00 H new ATOM 0 HA3 GLY B 132 -5.900 -13.483 -4.262 1.00 0.00 H new ATOM 2701 N GLU B 133 -3.731 -12.498 -1.960 1.00 0.00 N ATOM 2702 CA GLU B 133 -3.065 -12.955 -0.749 1.00 0.00 C ATOM 2703 C GLU B 133 -3.870 -12.460 0.441 1.00 0.00 C ATOM 2704 O GLU B 133 -3.541 -12.703 1.599 1.00 0.00 O ATOM 2705 CB GLU B 133 -1.661 -12.390 -0.693 1.00 0.00 C ATOM 2706 CG GLU B 133 -0.672 -13.251 0.073 1.00 0.00 C ATOM 2707 CD GLU B 133 -0.412 -14.584 -0.608 1.00 0.00 C ATOM 2708 OE1 GLU B 133 -0.091 -14.594 -1.813 1.00 0.00 O ATOM 2709 OE2 GLU B 133 -0.500 -15.631 0.065 1.00 0.00 O ATOM 0 H GLU B 133 -3.509 -11.543 -2.240 1.00 0.00 H new ATOM 0 HA GLU B 133 -3.000 -14.043 -0.736 1.00 0.00 H new ATOM 0 HB2 GLU B 133 -1.295 -12.255 -1.711 1.00 0.00 H new ATOM 0 HB3 GLU B 133 -1.697 -11.402 -0.234 1.00 0.00 H new ATOM 0 HG2 GLU B 133 0.269 -12.711 0.179 1.00 0.00 H new ATOM 0 HG3 GLU B 133 -1.053 -13.429 1.079 1.00 0.00 H new ATOM 2716 N ARG B 134 -4.905 -11.715 0.081 1.00 0.00 N ATOM 2717 CA ARG B 134 -5.861 -11.093 0.990 1.00 0.00 C ATOM 2718 C ARG B 134 -6.188 -11.935 2.218 1.00 0.00 C ATOM 2719 O ARG B 134 -6.222 -13.165 2.163 1.00 0.00 O ATOM 2720 CB ARG B 134 -7.158 -10.792 0.229 1.00 0.00 C ATOM 2721 CG ARG B 134 -8.001 -12.019 -0.089 1.00 0.00 C ATOM 2722 CD ARG B 134 -9.256 -11.644 -0.862 1.00 0.00 C ATOM 2723 NE ARG B 134 -10.230 -12.733 -0.896 1.00 0.00 N ATOM 2724 CZ ARG B 134 -11.047 -12.979 -1.919 1.00 0.00 C ATOM 2725 NH1 ARG B 134 -10.966 -12.258 -3.032 1.00 0.00 N ATOM 2726 NH2 ARG B 134 -11.939 -13.955 -1.830 1.00 0.00 N ATOM 0 H ARG B 134 -5.112 -11.518 -0.898 1.00 0.00 H new ATOM 0 HA ARG B 134 -5.389 -10.181 1.356 1.00 0.00 H new ATOM 0 HB2 ARG B 134 -7.757 -10.097 0.818 1.00 0.00 H new ATOM 0 HB3 ARG B 134 -6.908 -10.286 -0.704 1.00 0.00 H new ATOM 0 HG2 ARG B 134 -7.411 -12.727 -0.671 1.00 0.00 H new ATOM 0 HG3 ARG B 134 -8.279 -12.522 0.837 1.00 0.00 H new ATOM 0 HD2 ARG B 134 -9.712 -10.765 -0.406 1.00 0.00 H new ATOM 0 HD3 ARG B 134 -8.984 -11.370 -1.881 1.00 0.00 H new ATOM 0 HE ARG B 134 -10.288 -13.345 -0.082 1.00 0.00 H new ATOM 0 HH11 ARG B 134 -10.275 -11.511 -3.107 1.00 0.00 H new ATOM 0 HH12 ARG B 134 -11.594 -12.451 -3.812 1.00 0.00 H new ATOM 0 HH21 ARG B 134 -11.999 -14.515 -0.980 1.00 0.00 H new ATOM 0 HH22 ARG B 134 -12.566 -14.146 -2.612 1.00 0.00 H new ATOM 2740 N ALA B 135 -6.457 -11.225 3.303 1.00 0.00 N ATOM 2741 CA ALA B 135 -6.865 -11.811 4.576 1.00 0.00 C ATOM 2742 C ALA B 135 -5.862 -12.848 5.084 1.00 0.00 C ATOM 2743 O ALA B 135 -4.744 -12.447 5.477 1.00 0.00 O ATOM 2744 CB ALA B 135 -8.262 -12.403 4.452 1.00 0.00 C ATOM 2745 OXT ALA B 135 -6.207 -14.048 5.135 1.00 0.00 O ATOM 0 H ALA B 135 -6.398 -10.207 3.327 1.00 0.00 H new ATOM 0 HA ALA B 135 -6.886 -11.015 5.320 1.00 0.00 H new ATOM 0 HB1 ALA B 135 -8.559 -12.838 5.406 1.00 0.00 H new ATOM 0 HB2 ALA B 135 -8.967 -11.618 4.176 1.00 0.00 H new ATOM 0 HB3 ALA B 135 -8.262 -13.177 3.685 1.00 0.00 H new TER 2751 ALA B 135