USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1160 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 67 HIS : no HE2:sc= 0.307 K(o=0.55,f=-9.2!) USER MOD Set 1.2: B 69 ASN : amide:sc= 0.244! C(o=0.55!,f=-12!) USER MOD Set 2.1: A 69 ASN : amide:sc= -0.988 K(o=-2.7,f=-6.9) USER MOD Set 2.2: B 67 HIS : no HE2:sc= -1.75! C(o=-2.7!,f=-9!) USER MOD Set 3.1: B 9 HIS : no HD1:sc= -0.0021 K(o=-5.2,f=-6.1) USER MOD Set 3.2: B 15 CYS SG : rot 70:sc= -4.89! USER MOD Set 3.3: B 37 HIS :FLIP no HD1:sc= -0.205 F(o=-6.7,f=-5.2) USER MOD Set 3.4: B 40 THR OG1 : rot 180:sc= -0.135 USER MOD Set 4.1: A 31 TYR OH : rot -162:sc= 0.29 USER MOD Set 4.2: B 24 ASN : amide:sc= 0.276 X(o=0.57,f=0.4) USER MOD Set 5.1: A 37 HIS : no HD1:sc= 0.892 K(o=2,f=-0.91) USER MOD Set 5.2: A 40 THR OG1 : rot 94:sc= 1.07 USER MOD Set 6.1: A 9 HIS : no HD1:sc= 1.71 K(o=1.7,f=-7.6!) USER MOD Set 6.2: A 15 CYS SG : rot 173:sc= 0.0159 USER MOD Single : A 1 VAL N :NH3+ -164:sc= -0.107 (180deg=-0.56) USER MOD Single : A 3 SER OG : rot 153:sc= 1.36 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 CYS SG : rot 180:sc= -2.15 USER MOD Single : A 17 SER OG : rot 180:sc= 0.0265 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 24 ASN : amide:sc= 0.0415 K(o=0.041,f=-0.51) USER MOD Single : A 29 SER OG : rot 180:sc= 0.0124 USER MOD Single : A 30 LYS NZ :NH3+ 175:sc= 1.26 (180deg=1.16) USER MOD Single : A 32 THR OG1 : rot 77:sc= 0.466 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.106) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 160:sc= -0.0758 USER MOD Single : A 78 LYS NZ :NH3+ 149:sc= 1.07 (180deg=-0.607!) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : B 1 VAL N :NH3+ -165:sc= -0.0401 (180deg=-0.348) USER MOD Single : B 3 SER OG : rot 112:sc= 1.52 USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 TYR OH : rot 180:sc= 0 USER MOD Single : B 12 CYS SG : rot 180:sc= 0 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 20 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 29 SER OG : rot -35:sc= 0.17 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 1.25 (180deg=1.25) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 165:sc= -0.0242 (180deg=-0.239) USER MOD Single : B 50 LYS NZ :NH3+ -141:sc= 0.00146 (180deg=-0.108) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot 160:sc= -0.738 USER MOD Single : B 78 LYS NZ :NH3+ 177:sc= 1.27 (180deg=1.11) USER MOD Single : B 80 SER OG : rot 46:sc= 0.566 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 29.820 17.635 -15.317 1.00 0.00 N ATOM 2 CA VAL A 1 29.939 18.114 -13.922 1.00 0.00 C ATOM 3 C VAL A 1 28.871 17.474 -13.044 1.00 0.00 C ATOM 4 O VAL A 1 27.679 17.547 -13.346 1.00 0.00 O ATOM 5 CB VAL A 1 29.800 19.650 -13.841 1.00 0.00 C ATOM 6 CG1 VAL A 1 30.064 20.139 -12.425 1.00 0.00 C ATOM 7 CG2 VAL A 1 30.735 20.327 -14.829 1.00 0.00 C ATOM 0 H1 VAL A 1 30.694 17.856 -15.836 1.00 0.00 H new ATOM 0 H2 VAL A 1 29.666 16.606 -15.319 1.00 0.00 H new ATOM 0 H3 VAL A 1 29.016 18.106 -15.778 1.00 0.00 H new ATOM 0 HA VAL A 1 30.929 17.829 -13.565 1.00 0.00 H new ATOM 0 HB VAL A 1 28.777 19.915 -14.107 1.00 0.00 H new ATOM 0 HG11 VAL A 1 29.961 21.224 -12.389 1.00 0.00 H new ATOM 0 HG12 VAL A 1 29.346 19.684 -11.743 1.00 0.00 H new ATOM 0 HG13 VAL A 1 31.075 19.861 -12.126 1.00 0.00 H new ATOM 0 HG21 VAL A 1 30.621 21.409 -14.755 1.00 0.00 H new ATOM 0 HG22 VAL A 1 31.765 20.054 -14.600 1.00 0.00 H new ATOM 0 HG23 VAL A 1 30.490 20.004 -15.841 1.00 0.00 H new ATOM 19 N ALA A 2 29.307 16.848 -11.962 1.00 0.00 N ATOM 20 CA ALA A 2 28.399 16.209 -11.025 1.00 0.00 C ATOM 21 C ALA A 2 28.617 16.763 -9.624 1.00 0.00 C ATOM 22 O ALA A 2 29.742 16.782 -9.124 1.00 0.00 O ATOM 23 CB ALA A 2 28.596 14.702 -11.038 1.00 0.00 C ATOM 0 H ALA A 2 30.292 16.769 -11.711 1.00 0.00 H new ATOM 0 HA ALA A 2 27.375 16.423 -11.329 1.00 0.00 H new ATOM 0 HB1 ALA A 2 27.908 14.239 -10.331 1.00 0.00 H new ATOM 0 HB2 ALA A 2 28.400 14.318 -12.039 1.00 0.00 H new ATOM 0 HB3 ALA A 2 29.622 14.467 -10.754 1.00 0.00 H new ATOM 29 N SER A 3 27.544 17.220 -9.001 1.00 0.00 N ATOM 30 CA SER A 3 27.621 17.783 -7.665 1.00 0.00 C ATOM 31 C SER A 3 27.563 16.677 -6.605 1.00 0.00 C ATOM 32 O SER A 3 27.823 15.510 -6.912 1.00 0.00 O ATOM 33 CB SER A 3 26.500 18.799 -7.484 1.00 0.00 C ATOM 34 OG SER A 3 25.247 18.259 -7.872 1.00 0.00 O ATOM 0 H SER A 3 26.606 17.212 -9.402 1.00 0.00 H new ATOM 0 HA SER A 3 28.575 18.294 -7.538 1.00 0.00 H new ATOM 0 HB2 SER A 3 26.456 19.113 -6.441 1.00 0.00 H new ATOM 0 HB3 SER A 3 26.714 19.689 -8.076 1.00 0.00 H new ATOM 0 HG SER A 3 24.530 18.709 -7.378 1.00 0.00 H new ATOM 40 N LYS A 4 27.229 17.027 -5.366 1.00 0.00 N ATOM 41 CA LYS A 4 27.315 16.066 -4.273 1.00 0.00 C ATOM 42 C LYS A 4 25.967 15.842 -3.591 1.00 0.00 C ATOM 43 O LYS A 4 25.094 16.707 -3.594 1.00 0.00 O ATOM 44 CB LYS A 4 28.352 16.521 -3.237 1.00 0.00 C ATOM 45 CG LYS A 4 27.982 17.803 -2.503 1.00 0.00 C ATOM 46 CD LYS A 4 28.986 18.123 -1.406 1.00 0.00 C ATOM 47 CE LYS A 4 28.545 19.317 -0.577 1.00 0.00 C ATOM 48 NZ LYS A 4 29.486 19.599 0.541 1.00 0.00 N ATOM 0 H LYS A 4 26.901 17.955 -5.097 1.00 0.00 H new ATOM 0 HA LYS A 4 27.627 15.117 -4.709 1.00 0.00 H new ATOM 0 HB2 LYS A 4 28.492 15.725 -2.506 1.00 0.00 H new ATOM 0 HB3 LYS A 4 29.309 16.666 -3.738 1.00 0.00 H new ATOM 0 HG2 LYS A 4 27.939 18.630 -3.211 1.00 0.00 H new ATOM 0 HG3 LYS A 4 26.987 17.702 -2.070 1.00 0.00 H new ATOM 0 HD2 LYS A 4 29.108 17.255 -0.759 1.00 0.00 H new ATOM 0 HD3 LYS A 4 29.960 18.328 -1.851 1.00 0.00 H new ATOM 0 HE2 LYS A 4 28.470 20.195 -1.218 1.00 0.00 H new ATOM 0 HE3 LYS A 4 27.549 19.131 -0.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 29.147 20.421 1.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 29.538 18.771 1.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 30.431 19.803 0.157 1.00 0.00 H new ATOM 62 N ALA A 5 25.819 14.665 -3.005 1.00 0.00 N ATOM 63 CA ALA A 5 24.635 14.315 -2.239 1.00 0.00 C ATOM 64 C ALA A 5 25.055 13.704 -0.909 1.00 0.00 C ATOM 65 O ALA A 5 25.693 12.649 -0.876 1.00 0.00 O ATOM 66 CB ALA A 5 23.757 13.351 -3.025 1.00 0.00 C ATOM 0 H ALA A 5 26.519 13.924 -3.048 1.00 0.00 H new ATOM 0 HA ALA A 5 24.052 15.215 -2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 5 22.875 13.100 -2.436 1.00 0.00 H new ATOM 0 HB2 ALA A 5 23.448 13.820 -3.959 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.319 12.443 -3.243 1.00 0.00 H new ATOM 72 N ILE A 6 24.714 14.372 0.181 1.00 0.00 N ATOM 73 CA ILE A 6 25.158 13.957 1.502 1.00 0.00 C ATOM 74 C ILE A 6 24.036 13.251 2.256 1.00 0.00 C ATOM 75 O ILE A 6 22.990 13.838 2.524 1.00 0.00 O ATOM 76 CB ILE A 6 25.636 15.159 2.341 1.00 0.00 C ATOM 77 CG1 ILE A 6 26.500 16.097 1.495 1.00 0.00 C ATOM 78 CG2 ILE A 6 26.422 14.667 3.548 1.00 0.00 C ATOM 79 CD1 ILE A 6 26.845 17.393 2.197 1.00 0.00 C ATOM 0 H ILE A 6 24.129 15.207 0.177 1.00 0.00 H new ATOM 0 HA ILE A 6 25.992 13.270 1.354 1.00 0.00 H new ATOM 0 HB ILE A 6 24.763 15.714 2.685 1.00 0.00 H new ATOM 0 HG12 ILE A 6 27.422 15.583 1.223 1.00 0.00 H new ATOM 0 HG13 ILE A 6 25.976 16.324 0.567 1.00 0.00 H new ATOM 0 HG21 ILE A 6 26.757 15.521 4.137 1.00 0.00 H new ATOM 0 HG22 ILE A 6 25.785 14.030 4.162 1.00 0.00 H new ATOM 0 HG23 ILE A 6 27.288 14.097 3.211 1.00 0.00 H new ATOM 0 HD11 ILE A 6 27.459 18.010 1.541 1.00 0.00 H new ATOM 0 HD12 ILE A 6 25.928 17.928 2.445 1.00 0.00 H new ATOM 0 HD13 ILE A 6 27.397 17.176 3.111 1.00 0.00 H new ATOM 91 N PHE A 7 24.260 11.995 2.597 1.00 0.00 N ATOM 92 CA PHE A 7 23.272 11.216 3.322 1.00 0.00 C ATOM 93 C PHE A 7 23.582 11.228 4.816 1.00 0.00 C ATOM 94 O PHE A 7 24.608 10.708 5.253 1.00 0.00 O ATOM 95 CB PHE A 7 23.237 9.779 2.788 1.00 0.00 C ATOM 96 CG PHE A 7 22.162 8.925 3.402 1.00 0.00 C ATOM 97 CD1 PHE A 7 20.823 9.191 3.159 1.00 0.00 C ATOM 98 CD2 PHE A 7 22.490 7.856 4.218 1.00 0.00 C ATOM 99 CE1 PHE A 7 19.834 8.408 3.720 1.00 0.00 C ATOM 100 CE2 PHE A 7 21.504 7.068 4.781 1.00 0.00 C ATOM 101 CZ PHE A 7 20.175 7.345 4.532 1.00 0.00 C ATOM 0 H PHE A 7 25.120 11.491 2.383 1.00 0.00 H new ATOM 0 HA PHE A 7 22.290 11.664 3.172 1.00 0.00 H new ATOM 0 HB2 PHE A 7 23.092 9.807 1.708 1.00 0.00 H new ATOM 0 HB3 PHE A 7 24.205 9.312 2.968 1.00 0.00 H new ATOM 0 HD1 PHE A 7 20.551 10.021 2.523 1.00 0.00 H new ATOM 0 HD2 PHE A 7 23.528 7.635 4.417 1.00 0.00 H new ATOM 0 HE1 PHE A 7 18.795 8.627 3.524 1.00 0.00 H new ATOM 0 HE2 PHE A 7 21.773 6.236 5.415 1.00 0.00 H new ATOM 0 HZ PHE A 7 19.403 6.731 4.972 1.00 0.00 H new ATOM 111 N TYR A 8 22.701 11.841 5.587 1.00 0.00 N ATOM 112 CA TYR A 8 22.856 11.910 7.031 1.00 0.00 C ATOM 113 C TYR A 8 21.958 10.886 7.709 1.00 0.00 C ATOM 114 O TYR A 8 20.758 10.822 7.433 1.00 0.00 O ATOM 115 CB TYR A 8 22.508 13.308 7.547 1.00 0.00 C ATOM 116 CG TYR A 8 23.495 14.385 7.157 1.00 0.00 C ATOM 117 CD1 TYR A 8 24.637 14.608 7.916 1.00 0.00 C ATOM 118 CD2 TYR A 8 23.280 15.186 6.044 1.00 0.00 C ATOM 119 CE1 TYR A 8 25.537 15.599 7.577 1.00 0.00 C ATOM 120 CE2 TYR A 8 24.178 16.178 5.697 1.00 0.00 C ATOM 121 CZ TYR A 8 25.305 16.380 6.468 1.00 0.00 C ATOM 122 OH TYR A 8 26.202 17.366 6.128 1.00 0.00 O ATOM 0 H TYR A 8 21.863 12.302 5.234 1.00 0.00 H new ATOM 0 HA TYR A 8 23.897 11.692 7.268 1.00 0.00 H new ATOM 0 HB2 TYR A 8 21.522 13.584 7.173 1.00 0.00 H new ATOM 0 HB3 TYR A 8 22.439 13.273 8.634 1.00 0.00 H new ATOM 0 HD1 TYR A 8 24.824 13.996 8.786 1.00 0.00 H new ATOM 0 HD2 TYR A 8 22.398 15.032 5.440 1.00 0.00 H new ATOM 0 HE1 TYR A 8 26.419 15.760 8.179 1.00 0.00 H new ATOM 0 HE2 TYR A 8 23.999 16.792 4.827 1.00 0.00 H new ATOM 0 HH TYR A 8 25.892 17.825 5.320 1.00 0.00 H new ATOM 132 N HIS A 9 22.535 10.084 8.591 1.00 0.00 N ATOM 133 CA HIS A 9 21.761 9.100 9.333 1.00 0.00 C ATOM 134 C HIS A 9 22.375 8.868 10.708 1.00 0.00 C ATOM 135 O HIS A 9 23.406 9.446 11.033 1.00 0.00 O ATOM 136 CB HIS A 9 21.662 7.782 8.557 1.00 0.00 C ATOM 137 CG HIS A 9 22.958 7.042 8.407 1.00 0.00 C ATOM 138 ND1 HIS A 9 23.291 6.015 9.254 1.00 0.00 N ATOM 139 CD2 HIS A 9 23.936 7.190 7.485 1.00 0.00 C ATOM 140 CE1 HIS A 9 24.456 5.561 8.827 1.00 0.00 C ATOM 141 NE2 HIS A 9 24.888 6.240 7.756 1.00 0.00 N ATOM 0 H HIS A 9 23.531 10.095 8.810 1.00 0.00 H new ATOM 0 HA HIS A 9 20.752 9.490 9.465 1.00 0.00 H new ATOM 0 HB2 HIS A 9 20.945 7.133 9.060 1.00 0.00 H new ATOM 0 HB3 HIS A 9 21.261 7.990 7.565 1.00 0.00 H new ATOM 0 HD2 HIS A 9 23.963 7.917 6.687 1.00 0.00 H new ATOM 0 HE1 HIS A 9 24.993 4.744 9.285 1.00 0.00 H new ATOM 0 HE2 HIS A 9 25.755 6.082 7.243 1.00 0.00 H new ATOM 149 N ALA A 10 21.744 8.019 11.508 1.00 0.00 N ATOM 150 CA ALA A 10 22.202 7.783 12.872 1.00 0.00 C ATOM 151 C ALA A 10 22.506 6.310 13.120 1.00 0.00 C ATOM 152 O ALA A 10 22.722 5.900 14.258 1.00 0.00 O ATOM 153 CB ALA A 10 21.160 8.281 13.863 1.00 0.00 C ATOM 0 H ALA A 10 20.918 7.485 11.239 1.00 0.00 H new ATOM 0 HA ALA A 10 23.130 8.337 13.013 1.00 0.00 H new ATOM 0 HB1 ALA A 10 21.510 8.101 14.880 1.00 0.00 H new ATOM 0 HB2 ALA A 10 21.001 9.350 13.718 1.00 0.00 H new ATOM 0 HB3 ALA A 10 20.222 7.750 13.702 1.00 0.00 H new ATOM 159 N GLY A 11 22.530 5.518 12.055 1.00 0.00 N ATOM 160 CA GLY A 11 22.800 4.097 12.196 1.00 0.00 C ATOM 161 C GLY A 11 21.536 3.279 12.382 1.00 0.00 C ATOM 162 O GLY A 11 21.557 2.055 12.243 1.00 0.00 O ATOM 0 H GLY A 11 22.368 5.832 11.098 1.00 0.00 H new ATOM 0 HA2 GLY A 11 23.331 3.742 11.313 1.00 0.00 H new ATOM 0 HA3 GLY A 11 23.460 3.939 13.049 1.00 0.00 H new ATOM 166 N CYS A 12 20.443 3.961 12.706 1.00 0.00 N ATOM 167 CA CYS A 12 19.143 3.320 12.880 1.00 0.00 C ATOM 168 C CYS A 12 18.732 2.572 11.611 1.00 0.00 C ATOM 169 O CYS A 12 18.870 3.098 10.512 1.00 0.00 O ATOM 170 CB CYS A 12 18.092 4.375 13.235 1.00 0.00 C ATOM 171 SG CYS A 12 16.408 3.739 13.387 1.00 0.00 S ATOM 0 H CYS A 12 20.432 4.970 12.855 1.00 0.00 H new ATOM 0 HA CYS A 12 19.216 2.596 13.692 1.00 0.00 H new ATOM 0 HB2 CYS A 12 18.374 4.847 14.176 1.00 0.00 H new ATOM 0 HB3 CYS A 12 18.105 5.153 12.471 1.00 0.00 H new ATOM 0 HG CYS A 12 15.602 4.713 13.691 1.00 0.00 H new ATOM 177 N PRO A 13 18.205 1.342 11.763 1.00 0.00 N ATOM 178 CA PRO A 13 17.841 0.462 10.635 1.00 0.00 C ATOM 179 C PRO A 13 17.007 1.148 9.550 1.00 0.00 C ATOM 180 O PRO A 13 17.008 0.719 8.395 1.00 0.00 O ATOM 181 CB PRO A 13 17.023 -0.641 11.305 1.00 0.00 C ATOM 182 CG PRO A 13 17.549 -0.704 12.694 1.00 0.00 C ATOM 183 CD PRO A 13 17.928 0.702 13.063 1.00 0.00 C ATOM 0 HA PRO A 13 18.731 0.118 10.108 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.958 -0.408 11.294 1.00 0.00 H new ATOM 0 HB3 PRO A 13 17.146 -1.594 10.791 1.00 0.00 H new ATOM 0 HG2 PRO A 13 16.796 -1.096 13.378 1.00 0.00 H new ATOM 0 HG3 PRO A 13 18.411 -1.368 12.754 1.00 0.00 H new ATOM 0 HD2 PRO A 13 17.122 1.208 13.595 1.00 0.00 H new ATOM 0 HD3 PRO A 13 18.802 0.723 13.714 1.00 0.00 H new ATOM 191 N VAL A 14 16.307 2.214 9.919 1.00 0.00 N ATOM 192 CA VAL A 14 15.495 2.971 8.970 1.00 0.00 C ATOM 193 C VAL A 14 16.355 3.526 7.829 1.00 0.00 C ATOM 194 O VAL A 14 15.916 3.592 6.679 1.00 0.00 O ATOM 195 CB VAL A 14 14.754 4.134 9.670 1.00 0.00 C ATOM 196 CG1 VAL A 14 13.864 4.885 8.689 1.00 0.00 C ATOM 197 CG2 VAL A 14 13.934 3.617 10.843 1.00 0.00 C ATOM 0 H VAL A 14 16.285 2.576 10.872 1.00 0.00 H new ATOM 0 HA VAL A 14 14.758 2.283 8.556 1.00 0.00 H new ATOM 0 HB VAL A 14 15.503 4.830 10.049 1.00 0.00 H new ATOM 0 HG11 VAL A 14 13.355 5.697 9.208 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.474 5.295 7.884 1.00 0.00 H new ATOM 0 HG13 VAL A 14 13.125 4.201 8.272 1.00 0.00 H new ATOM 0 HG21 VAL A 14 13.420 4.450 11.323 1.00 0.00 H new ATOM 0 HG22 VAL A 14 13.200 2.896 10.484 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.594 3.134 11.564 1.00 0.00 H new ATOM 207 N CYS A 15 17.594 3.896 8.140 1.00 0.00 N ATOM 208 CA CYS A 15 18.474 4.480 7.138 1.00 0.00 C ATOM 209 C CYS A 15 19.029 3.401 6.219 1.00 0.00 C ATOM 210 O CYS A 15 19.350 3.670 5.066 1.00 0.00 O ATOM 211 CB CYS A 15 19.620 5.252 7.792 1.00 0.00 C ATOM 212 SG CYS A 15 20.792 4.230 8.713 1.00 0.00 S ATOM 0 H CYS A 15 18.006 3.802 9.068 1.00 0.00 H new ATOM 0 HA CYS A 15 17.884 5.180 6.546 1.00 0.00 H new ATOM 0 HB2 CYS A 15 20.163 5.795 7.018 1.00 0.00 H new ATOM 0 HB3 CYS A 15 19.199 5.997 8.468 1.00 0.00 H new ATOM 0 HG CYS A 15 21.796 4.961 9.097 1.00 0.00 H new ATOM 218 N VAL A 16 19.123 2.178 6.732 1.00 0.00 N ATOM 219 CA VAL A 16 19.621 1.055 5.947 1.00 0.00 C ATOM 220 C VAL A 16 18.720 0.821 4.742 1.00 0.00 C ATOM 221 O VAL A 16 19.193 0.686 3.611 1.00 0.00 O ATOM 222 CB VAL A 16 19.694 -0.238 6.788 1.00 0.00 C ATOM 223 CG1 VAL A 16 20.270 -1.385 5.970 1.00 0.00 C ATOM 224 CG2 VAL A 16 20.514 -0.010 8.048 1.00 0.00 C ATOM 0 H VAL A 16 18.861 1.940 7.688 1.00 0.00 H new ATOM 0 HA VAL A 16 20.629 1.306 5.615 1.00 0.00 H new ATOM 0 HB VAL A 16 18.681 -0.510 7.083 1.00 0.00 H new ATOM 0 HG11 VAL A 16 20.311 -2.285 6.584 1.00 0.00 H new ATOM 0 HG12 VAL A 16 19.636 -1.567 5.102 1.00 0.00 H new ATOM 0 HG13 VAL A 16 21.275 -1.126 5.638 1.00 0.00 H new ATOM 0 HG21 VAL A 16 20.554 -0.932 8.628 1.00 0.00 H new ATOM 0 HG22 VAL A 16 21.525 0.291 7.774 1.00 0.00 H new ATOM 0 HG23 VAL A 16 20.051 0.775 8.646 1.00 0.00 H new ATOM 234 N SER A 17 17.417 0.800 4.995 1.00 0.00 N ATOM 235 CA SER A 17 16.428 0.645 3.943 1.00 0.00 C ATOM 236 C SER A 17 16.585 1.756 2.902 1.00 0.00 C ATOM 237 O SER A 17 16.631 1.500 1.696 1.00 0.00 O ATOM 238 CB SER A 17 15.026 0.694 4.554 1.00 0.00 C ATOM 239 OG SER A 17 14.978 -0.028 5.776 1.00 0.00 O ATOM 0 H SER A 17 17.021 0.890 5.931 1.00 0.00 H new ATOM 0 HA SER A 17 16.575 -0.316 3.450 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.737 1.731 4.728 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.305 0.276 3.852 1.00 0.00 H new ATOM 0 HG SER A 17 14.073 0.019 6.148 1.00 0.00 H new ATOM 245 N ALA A 18 16.700 2.986 3.392 1.00 0.00 N ATOM 246 CA ALA A 18 16.809 4.158 2.536 1.00 0.00 C ATOM 247 C ALA A 18 18.103 4.149 1.727 1.00 0.00 C ATOM 248 O ALA A 18 18.102 4.457 0.535 1.00 0.00 O ATOM 249 CB ALA A 18 16.730 5.419 3.379 1.00 0.00 C ATOM 0 H ALA A 18 16.720 3.196 4.390 1.00 0.00 H new ATOM 0 HA ALA A 18 15.979 4.136 1.830 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.812 6.294 2.734 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.776 5.445 3.906 1.00 0.00 H new ATOM 0 HB3 ALA A 18 17.545 5.424 4.103 1.00 0.00 H new ATOM 255 N GLU A 19 19.201 3.792 2.378 1.00 0.00 N ATOM 256 CA GLU A 19 20.508 3.790 1.738 1.00 0.00 C ATOM 257 C GLU A 19 20.570 2.749 0.627 1.00 0.00 C ATOM 258 O GLU A 19 20.868 3.072 -0.521 1.00 0.00 O ATOM 259 CB GLU A 19 21.605 3.510 2.765 1.00 0.00 C ATOM 260 CG GLU A 19 23.009 3.592 2.189 1.00 0.00 C ATOM 261 CD GLU A 19 24.062 3.077 3.145 1.00 0.00 C ATOM 262 OE1 GLU A 19 24.421 3.801 4.095 1.00 0.00 O ATOM 263 OE2 GLU A 19 24.533 1.934 2.951 1.00 0.00 O ATOM 0 H GLU A 19 19.212 3.498 3.355 1.00 0.00 H new ATOM 0 HA GLU A 19 20.667 4.776 1.302 1.00 0.00 H new ATOM 0 HB2 GLU A 19 21.515 4.223 3.585 1.00 0.00 H new ATOM 0 HB3 GLU A 19 21.451 2.517 3.188 1.00 0.00 H new ATOM 0 HG2 GLU A 19 23.052 3.018 1.264 1.00 0.00 H new ATOM 0 HG3 GLU A 19 23.232 4.628 1.932 1.00 0.00 H new ATOM 270 N GLN A 20 20.256 1.506 0.967 1.00 0.00 N ATOM 271 CA GLN A 20 20.390 0.403 0.024 1.00 0.00 C ATOM 272 C GLN A 20 19.393 0.523 -1.129 1.00 0.00 C ATOM 273 O GLN A 20 19.589 -0.069 -2.191 1.00 0.00 O ATOM 274 CB GLN A 20 20.216 -0.937 0.740 1.00 0.00 C ATOM 275 CG GLN A 20 21.223 -1.162 1.859 1.00 0.00 C ATOM 276 CD GLN A 20 21.103 -2.535 2.494 1.00 0.00 C ATOM 277 OE1 GLN A 20 20.029 -3.133 2.509 1.00 0.00 O ATOM 278 NE2 GLN A 20 22.203 -3.040 3.030 1.00 0.00 N ATOM 0 H GLN A 20 19.907 1.236 1.887 1.00 0.00 H new ATOM 0 HA GLN A 20 21.394 0.451 -0.399 1.00 0.00 H new ATOM 0 HB2 GLN A 20 19.208 -0.992 1.152 1.00 0.00 H new ATOM 0 HB3 GLN A 20 20.307 -1.743 0.012 1.00 0.00 H new ATOM 0 HG2 GLN A 20 22.231 -1.037 1.464 1.00 0.00 H new ATOM 0 HG3 GLN A 20 21.084 -0.399 2.625 1.00 0.00 H new ATOM 0 HE21 GLN A 20 23.075 -2.512 2.997 1.00 0.00 H new ATOM 0 HE22 GLN A 20 22.178 -3.957 3.476 1.00 0.00 H new ATOM 287 N ALA A 21 18.326 1.282 -0.924 1.00 0.00 N ATOM 288 CA ALA A 21 17.346 1.492 -1.979 1.00 0.00 C ATOM 289 C ALA A 21 17.617 2.781 -2.754 1.00 0.00 C ATOM 290 O ALA A 21 17.964 2.740 -3.934 1.00 0.00 O ATOM 291 CB ALA A 21 15.940 1.507 -1.402 1.00 0.00 C ATOM 0 H ALA A 21 18.118 1.758 -0.046 1.00 0.00 H new ATOM 0 HA ALA A 21 17.433 0.661 -2.679 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.219 1.665 -2.204 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.737 0.554 -0.914 1.00 0.00 H new ATOM 0 HB3 ALA A 21 15.854 2.313 -0.673 1.00 0.00 H new ATOM 297 N VAL A 22 17.486 3.917 -2.077 1.00 0.00 N ATOM 298 CA VAL A 22 17.531 5.219 -2.739 1.00 0.00 C ATOM 299 C VAL A 22 18.965 5.663 -3.019 1.00 0.00 C ATOM 300 O VAL A 22 19.299 6.026 -4.144 1.00 0.00 O ATOM 301 CB VAL A 22 16.824 6.306 -1.898 1.00 0.00 C ATOM 302 CG1 VAL A 22 16.682 7.597 -2.694 1.00 0.00 C ATOM 303 CG2 VAL A 22 15.463 5.819 -1.419 1.00 0.00 C ATOM 0 H VAL A 22 17.347 3.964 -1.068 1.00 0.00 H new ATOM 0 HA VAL A 22 17.006 5.099 -3.687 1.00 0.00 H new ATOM 0 HB VAL A 22 17.440 6.510 -1.023 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.182 8.348 -2.083 1.00 0.00 H new ATOM 0 HG12 VAL A 22 17.670 7.960 -2.978 1.00 0.00 H new ATOM 0 HG13 VAL A 22 16.093 7.408 -3.591 1.00 0.00 H new ATOM 0 HG21 VAL A 22 14.984 6.600 -0.829 1.00 0.00 H new ATOM 0 HG22 VAL A 22 14.839 5.580 -2.280 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.591 4.928 -0.805 1.00 0.00 H new ATOM 313 N ALA A 23 19.815 5.619 -1.998 1.00 0.00 N ATOM 314 CA ALA A 23 21.197 6.073 -2.140 1.00 0.00 C ATOM 315 C ALA A 23 21.980 5.153 -3.070 1.00 0.00 C ATOM 316 O ALA A 23 22.944 5.570 -3.706 1.00 0.00 O ATOM 317 CB ALA A 23 21.869 6.163 -0.779 1.00 0.00 C ATOM 0 H ALA A 23 19.575 5.276 -1.068 1.00 0.00 H new ATOM 0 HA ALA A 23 21.185 7.068 -2.585 1.00 0.00 H new ATOM 0 HB1 ALA A 23 22.897 6.502 -0.903 1.00 0.00 H new ATOM 0 HB2 ALA A 23 21.326 6.870 -0.151 1.00 0.00 H new ATOM 0 HB3 ALA A 23 21.866 5.181 -0.306 1.00 0.00 H new ATOM 323 N ASN A 24 21.554 3.903 -3.140 1.00 0.00 N ATOM 324 CA ASN A 24 22.168 2.926 -4.032 1.00 0.00 C ATOM 325 C ASN A 24 21.626 3.092 -5.451 1.00 0.00 C ATOM 326 O ASN A 24 22.279 2.729 -6.430 1.00 0.00 O ATOM 327 CB ASN A 24 21.898 1.514 -3.509 1.00 0.00 C ATOM 328 CG ASN A 24 22.495 0.418 -4.373 1.00 0.00 C ATOM 329 OD1 ASN A 24 23.519 0.601 -5.031 1.00 0.00 O ATOM 330 ND2 ASN A 24 21.859 -0.740 -4.365 1.00 0.00 N ATOM 0 H ASN A 24 20.780 3.536 -2.586 1.00 0.00 H new ATOM 0 HA ASN A 24 23.245 3.089 -4.060 1.00 0.00 H new ATOM 0 HB2 ASN A 24 22.299 1.427 -2.499 1.00 0.00 H new ATOM 0 HB3 ASN A 24 20.821 1.362 -3.438 1.00 0.00 H new ATOM 0 HD21 ASN A 24 22.214 -1.521 -4.917 1.00 0.00 H new ATOM 0 HD22 ASN A 24 21.013 -0.853 -3.807 1.00 0.00 H new ATOM 337 N ALA A 25 20.426 3.650 -5.562 1.00 0.00 N ATOM 338 CA ALA A 25 19.847 3.941 -6.865 1.00 0.00 C ATOM 339 C ALA A 25 20.618 5.068 -7.539 1.00 0.00 C ATOM 340 O ALA A 25 20.791 5.075 -8.758 1.00 0.00 O ATOM 341 CB ALA A 25 18.376 4.307 -6.735 1.00 0.00 C ATOM 0 H ALA A 25 19.839 3.908 -4.769 1.00 0.00 H new ATOM 0 HA ALA A 25 19.919 3.046 -7.482 1.00 0.00 H new ATOM 0 HB1 ALA A 25 17.966 4.520 -7.722 1.00 0.00 H new ATOM 0 HB2 ALA A 25 17.832 3.475 -6.288 1.00 0.00 H new ATOM 0 HB3 ALA A 25 18.275 5.189 -6.102 1.00 0.00 H new ATOM 347 N ILE A 26 21.093 6.006 -6.731 1.00 0.00 N ATOM 348 CA ILE A 26 21.887 7.120 -7.227 1.00 0.00 C ATOM 349 C ILE A 26 23.344 6.698 -7.389 1.00 0.00 C ATOM 350 O ILE A 26 24.045 6.460 -6.408 1.00 0.00 O ATOM 351 CB ILE A 26 21.809 8.334 -6.272 1.00 0.00 C ATOM 352 CG1 ILE A 26 20.348 8.711 -6.010 1.00 0.00 C ATOM 353 CG2 ILE A 26 22.572 9.518 -6.856 1.00 0.00 C ATOM 354 CD1 ILE A 26 20.173 9.784 -4.957 1.00 0.00 C ATOM 0 H ILE A 26 20.940 6.016 -5.723 1.00 0.00 H new ATOM 0 HA ILE A 26 21.479 7.412 -8.195 1.00 0.00 H new ATOM 0 HB ILE A 26 22.270 8.062 -5.323 1.00 0.00 H new ATOM 0 HG12 ILE A 26 19.898 9.053 -6.942 1.00 0.00 H new ATOM 0 HG13 ILE A 26 19.802 7.819 -5.701 1.00 0.00 H new ATOM 0 HG21 ILE A 26 22.508 10.365 -6.173 1.00 0.00 H new ATOM 0 HG22 ILE A 26 23.617 9.243 -6.997 1.00 0.00 H new ATOM 0 HG23 ILE A 26 22.137 9.793 -7.817 1.00 0.00 H new ATOM 0 HD11 ILE A 26 19.112 9.997 -4.827 1.00 0.00 H new ATOM 0 HD12 ILE A 26 20.592 9.438 -4.012 1.00 0.00 H new ATOM 0 HD13 ILE A 26 20.689 10.691 -5.272 1.00 0.00 H new ATOM 366 N ASP A 27 23.786 6.585 -8.632 1.00 0.00 N ATOM 367 CA ASP A 27 25.157 6.183 -8.918 1.00 0.00 C ATOM 368 C ASP A 27 26.142 7.272 -8.522 1.00 0.00 C ATOM 369 O ASP A 27 25.909 8.456 -8.774 1.00 0.00 O ATOM 370 CB ASP A 27 25.333 5.850 -10.402 1.00 0.00 C ATOM 371 CG ASP A 27 24.729 4.515 -10.771 1.00 0.00 C ATOM 372 OD1 ASP A 27 23.528 4.472 -11.103 1.00 0.00 O ATOM 373 OD2 ASP A 27 25.449 3.497 -10.717 1.00 0.00 O ATOM 0 H ASP A 27 23.217 6.766 -9.459 1.00 0.00 H new ATOM 0 HA ASP A 27 25.363 5.290 -8.327 1.00 0.00 H new ATOM 0 HB2 ASP A 27 24.871 6.633 -11.004 1.00 0.00 H new ATOM 0 HB3 ASP A 27 26.395 5.845 -10.646 1.00 0.00 H new ATOM 378 N PRO A 28 27.272 6.877 -7.909 1.00 0.00 N ATOM 379 CA PRO A 28 28.330 7.812 -7.504 1.00 0.00 C ATOM 380 C PRO A 28 29.059 8.414 -8.705 1.00 0.00 C ATOM 381 O PRO A 28 29.951 9.249 -8.556 1.00 0.00 O ATOM 382 CB PRO A 28 29.281 6.942 -6.676 1.00 0.00 C ATOM 383 CG PRO A 28 29.050 5.555 -7.163 1.00 0.00 C ATOM 384 CD PRO A 28 27.599 5.485 -7.550 1.00 0.00 C ATOM 0 HA PRO A 28 27.932 8.666 -6.955 1.00 0.00 H new ATOM 0 HB2 PRO A 28 30.319 7.244 -6.819 1.00 0.00 H new ATOM 0 HB3 PRO A 28 29.068 7.027 -5.610 1.00 0.00 H new ATOM 0 HG2 PRO A 28 29.692 5.329 -8.015 1.00 0.00 H new ATOM 0 HG3 PRO A 28 29.282 4.826 -6.387 1.00 0.00 H new ATOM 0 HD2 PRO A 28 27.439 4.806 -8.388 1.00 0.00 H new ATOM 0 HD3 PRO A 28 26.981 5.127 -6.727 1.00 0.00 H new ATOM 392 N SER A 29 28.684 7.963 -9.892 1.00 0.00 N ATOM 393 CA SER A 29 29.207 8.517 -11.128 1.00 0.00 C ATOM 394 C SER A 29 28.253 9.578 -11.673 1.00 0.00 C ATOM 395 O SER A 29 28.608 10.362 -12.555 1.00 0.00 O ATOM 396 CB SER A 29 29.400 7.396 -12.147 1.00 0.00 C ATOM 397 OG SER A 29 28.283 6.522 -12.148 1.00 0.00 O ATOM 0 H SER A 29 28.012 7.207 -10.024 1.00 0.00 H new ATOM 0 HA SER A 29 30.170 8.989 -10.934 1.00 0.00 H new ATOM 0 HB2 SER A 29 29.536 7.821 -13.141 1.00 0.00 H new ATOM 0 HB3 SER A 29 30.306 6.837 -11.913 1.00 0.00 H new ATOM 0 HG SER A 29 28.424 5.812 -12.808 1.00 0.00 H new ATOM 403 N LYS A 30 27.042 9.596 -11.135 1.00 0.00 N ATOM 404 CA LYS A 30 26.038 10.568 -11.536 1.00 0.00 C ATOM 405 C LYS A 30 26.020 11.717 -10.533 1.00 0.00 C ATOM 406 O LYS A 30 25.883 12.884 -10.903 1.00 0.00 O ATOM 407 CB LYS A 30 24.661 9.896 -11.616 1.00 0.00 C ATOM 408 CG LYS A 30 23.586 10.753 -12.266 1.00 0.00 C ATOM 409 CD LYS A 30 22.239 10.047 -12.263 1.00 0.00 C ATOM 410 CE LYS A 30 21.164 10.878 -12.947 1.00 0.00 C ATOM 411 NZ LYS A 30 21.369 10.947 -14.417 1.00 0.00 N ATOM 0 H LYS A 30 26.731 8.944 -10.415 1.00 0.00 H new ATOM 0 HA LYS A 30 26.283 10.963 -12.522 1.00 0.00 H new ATOM 0 HB2 LYS A 30 24.755 8.965 -12.175 1.00 0.00 H new ATOM 0 HB3 LYS A 30 24.339 9.631 -10.609 1.00 0.00 H new ATOM 0 HG2 LYS A 30 23.503 11.701 -11.735 1.00 0.00 H new ATOM 0 HG3 LYS A 30 23.874 10.986 -13.291 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.331 9.086 -12.768 1.00 0.00 H new ATOM 0 HD3 LYS A 30 21.939 9.840 -11.236 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.184 10.449 -12.737 1.00 0.00 H new ATOM 0 HE3 LYS A 30 21.166 11.886 -12.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 20.571 11.450 -14.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 22.253 11.456 -14.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 21.427 9.984 -14.805 1.00 0.00 H new ATOM 425 N TYR A 31 26.163 11.370 -9.259 1.00 0.00 N ATOM 426 CA TYR A 31 26.273 12.353 -8.190 1.00 0.00 C ATOM 427 C TYR A 31 27.283 11.879 -7.155 1.00 0.00 C ATOM 428 O TYR A 31 27.418 10.680 -6.915 1.00 0.00 O ATOM 429 CB TYR A 31 24.915 12.602 -7.521 1.00 0.00 C ATOM 430 CG TYR A 31 23.980 13.461 -8.343 1.00 0.00 C ATOM 431 CD1 TYR A 31 24.039 14.845 -8.266 1.00 0.00 C ATOM 432 CD2 TYR A 31 23.044 12.891 -9.196 1.00 0.00 C ATOM 433 CE1 TYR A 31 23.195 15.638 -9.016 1.00 0.00 C ATOM 434 CE2 TYR A 31 22.196 13.677 -9.949 1.00 0.00 C ATOM 435 CZ TYR A 31 22.274 15.050 -9.854 1.00 0.00 C ATOM 436 OH TYR A 31 21.437 15.840 -10.609 1.00 0.00 O ATOM 0 H TYR A 31 26.206 10.402 -8.940 1.00 0.00 H new ATOM 0 HA TYR A 31 26.612 13.293 -8.626 1.00 0.00 H new ATOM 0 HB2 TYR A 31 24.435 11.643 -7.325 1.00 0.00 H new ATOM 0 HB3 TYR A 31 25.078 13.080 -6.555 1.00 0.00 H new ATOM 0 HD1 TYR A 31 24.758 15.310 -7.608 1.00 0.00 H new ATOM 0 HD2 TYR A 31 22.979 11.816 -9.271 1.00 0.00 H new ATOM 0 HE1 TYR A 31 23.256 16.714 -8.946 1.00 0.00 H new ATOM 0 HE2 TYR A 31 21.475 13.219 -10.610 1.00 0.00 H new ATOM 0 HH TYR A 31 20.671 15.309 -10.912 1.00 0.00 H new ATOM 446 N THR A 32 27.995 12.817 -6.554 1.00 0.00 N ATOM 447 CA THR A 32 29.006 12.488 -5.564 1.00 0.00 C ATOM 448 C THR A 32 28.350 12.155 -4.223 1.00 0.00 C ATOM 449 O THR A 32 27.966 13.046 -3.467 1.00 0.00 O ATOM 450 CB THR A 32 29.997 13.655 -5.386 1.00 0.00 C ATOM 451 OG1 THR A 32 30.395 14.149 -6.675 1.00 0.00 O ATOM 452 CG2 THR A 32 31.228 13.212 -4.609 1.00 0.00 C ATOM 0 H THR A 32 27.891 13.815 -6.735 1.00 0.00 H new ATOM 0 HA THR A 32 29.555 11.615 -5.918 1.00 0.00 H new ATOM 0 HB THR A 32 29.500 14.445 -4.823 1.00 0.00 H new ATOM 0 HG1 THR A 32 29.674 14.694 -7.053 1.00 0.00 H new ATOM 0 HG21 THR A 32 31.911 14.054 -4.498 1.00 0.00 H new ATOM 0 HG22 THR A 32 30.928 12.856 -3.624 1.00 0.00 H new ATOM 0 HG23 THR A 32 31.729 12.408 -5.148 1.00 0.00 H new ATOM 460 N VAL A 33 28.197 10.868 -3.952 1.00 0.00 N ATOM 461 CA VAL A 33 27.521 10.414 -2.742 1.00 0.00 C ATOM 462 C VAL A 33 28.459 10.438 -1.537 1.00 0.00 C ATOM 463 O VAL A 33 29.481 9.748 -1.515 1.00 0.00 O ATOM 464 CB VAL A 33 26.951 8.988 -2.920 1.00 0.00 C ATOM 465 CG1 VAL A 33 26.197 8.545 -1.674 1.00 0.00 C ATOM 466 CG2 VAL A 33 26.048 8.919 -4.143 1.00 0.00 C ATOM 0 H VAL A 33 28.532 10.116 -4.554 1.00 0.00 H new ATOM 0 HA VAL A 33 26.698 11.105 -2.561 1.00 0.00 H new ATOM 0 HB VAL A 33 27.788 8.307 -3.071 1.00 0.00 H new ATOM 0 HG11 VAL A 33 25.806 7.539 -1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 33 26.873 8.548 -0.819 1.00 0.00 H new ATOM 0 HG13 VAL A 33 25.371 9.231 -1.485 1.00 0.00 H new ATOM 0 HG21 VAL A 33 25.657 7.907 -4.250 1.00 0.00 H new ATOM 0 HG22 VAL A 33 25.219 9.617 -4.023 1.00 0.00 H new ATOM 0 HG23 VAL A 33 26.620 9.183 -5.033 1.00 0.00 H new ATOM 476 N GLU A 34 28.103 11.239 -0.543 1.00 0.00 N ATOM 477 CA GLU A 34 28.860 11.325 0.697 1.00 0.00 C ATOM 478 C GLU A 34 27.933 11.031 1.872 1.00 0.00 C ATOM 479 O GLU A 34 26.869 11.627 1.989 1.00 0.00 O ATOM 480 CB GLU A 34 29.492 12.714 0.836 1.00 0.00 C ATOM 481 CG GLU A 34 30.434 12.848 2.023 1.00 0.00 C ATOM 482 CD GLU A 34 31.168 14.174 2.039 1.00 0.00 C ATOM 483 OE1 GLU A 34 32.053 14.374 1.180 1.00 0.00 O ATOM 484 OE2 GLU A 34 30.883 15.014 2.917 1.00 0.00 O ATOM 0 H GLU A 34 27.284 11.846 -0.573 1.00 0.00 H new ATOM 0 HA GLU A 34 29.664 10.589 0.687 1.00 0.00 H new ATOM 0 HB2 GLU A 34 30.040 12.946 -0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 34 28.699 13.456 0.929 1.00 0.00 H new ATOM 0 HG2 GLU A 34 29.866 12.741 2.947 1.00 0.00 H new ATOM 0 HG3 GLU A 34 31.160 12.035 1.999 1.00 0.00 H new ATOM 491 N ILE A 35 28.315 10.091 2.720 1.00 0.00 N ATOM 492 CA ILE A 35 27.462 9.682 3.828 1.00 0.00 C ATOM 493 C ILE A 35 28.103 10.023 5.172 1.00 0.00 C ATOM 494 O ILE A 35 29.286 9.752 5.392 1.00 0.00 O ATOM 495 CB ILE A 35 27.151 8.169 3.760 1.00 0.00 C ATOM 496 CG1 ILE A 35 26.450 7.835 2.438 1.00 0.00 C ATOM 497 CG2 ILE A 35 26.290 7.745 4.942 1.00 0.00 C ATOM 498 CD1 ILE A 35 26.125 6.365 2.265 1.00 0.00 C ATOM 0 H ILE A 35 29.206 9.597 2.665 1.00 0.00 H new ATOM 0 HA ILE A 35 26.526 10.234 3.740 1.00 0.00 H new ATOM 0 HB ILE A 35 28.090 7.618 3.808 1.00 0.00 H new ATOM 0 HG12 ILE A 35 25.527 8.410 2.373 1.00 0.00 H new ATOM 0 HG13 ILE A 35 27.084 8.156 1.612 1.00 0.00 H new ATOM 0 HG21 ILE A 35 26.082 6.677 4.876 1.00 0.00 H new ATOM 0 HG22 ILE A 35 26.819 7.955 5.871 1.00 0.00 H new ATOM 0 HG23 ILE A 35 25.351 8.299 4.926 1.00 0.00 H new ATOM 0 HD11 ILE A 35 25.631 6.212 1.306 1.00 0.00 H new ATOM 0 HD12 ILE A 35 27.046 5.783 2.296 1.00 0.00 H new ATOM 0 HD13 ILE A 35 25.464 6.041 3.069 1.00 0.00 H new ATOM 510 N VAL A 36 27.318 10.616 6.064 1.00 0.00 N ATOM 511 CA VAL A 36 27.810 11.032 7.371 1.00 0.00 C ATOM 512 C VAL A 36 27.013 10.364 8.491 1.00 0.00 C ATOM 513 O VAL A 36 25.783 10.460 8.543 1.00 0.00 O ATOM 514 CB VAL A 36 27.740 12.568 7.540 1.00 0.00 C ATOM 515 CG1 VAL A 36 28.257 12.987 8.910 1.00 0.00 C ATOM 516 CG2 VAL A 36 28.523 13.267 6.438 1.00 0.00 C ATOM 0 H VAL A 36 26.332 10.820 5.904 1.00 0.00 H new ATOM 0 HA VAL A 36 28.853 10.720 7.434 1.00 0.00 H new ATOM 0 HB VAL A 36 26.695 12.868 7.463 1.00 0.00 H new ATOM 0 HG11 VAL A 36 28.198 14.071 9.005 1.00 0.00 H new ATOM 0 HG12 VAL A 36 27.650 12.521 9.686 1.00 0.00 H new ATOM 0 HG13 VAL A 36 29.294 12.669 9.020 1.00 0.00 H new ATOM 0 HG21 VAL A 36 28.461 14.346 6.576 1.00 0.00 H new ATOM 0 HG22 VAL A 36 29.567 12.956 6.480 1.00 0.00 H new ATOM 0 HG23 VAL A 36 28.103 13.000 5.468 1.00 0.00 H new ATOM 526 N HIS A 37 27.723 9.677 9.376 1.00 0.00 N ATOM 527 CA HIS A 37 27.101 9.021 10.520 1.00 0.00 C ATOM 528 C HIS A 37 26.963 10.008 11.679 1.00 0.00 C ATOM 529 O HIS A 37 27.952 10.396 12.302 1.00 0.00 O ATOM 530 CB HIS A 37 27.940 7.812 10.950 1.00 0.00 C ATOM 531 CG HIS A 37 27.187 6.804 11.769 1.00 0.00 C ATOM 532 ND1 HIS A 37 26.899 7.016 13.096 1.00 0.00 N ATOM 533 CD2 HIS A 37 26.701 5.595 11.400 1.00 0.00 C ATOM 534 CE1 HIS A 37 26.247 5.938 13.499 1.00 0.00 C ATOM 535 NE2 HIS A 37 26.105 5.049 12.508 1.00 0.00 N ATOM 0 H HIS A 37 28.735 9.559 9.324 1.00 0.00 H new ATOM 0 HA HIS A 37 26.107 8.676 10.234 1.00 0.00 H new ATOM 0 HB2 HIS A 37 28.333 7.321 10.060 1.00 0.00 H new ATOM 0 HB3 HIS A 37 28.797 8.164 11.524 1.00 0.00 H new ATOM 0 HD2 HIS A 37 26.770 5.146 10.420 1.00 0.00 H new ATOM 0 HE1 HIS A 37 25.875 5.793 14.503 1.00 0.00 H new ATOM 0 HE2 HIS A 37 25.643 4.141 12.566 1.00 0.00 H new ATOM 543 N LEU A 38 25.734 10.422 11.953 1.00 0.00 N ATOM 544 CA LEU A 38 25.463 11.396 13.004 1.00 0.00 C ATOM 545 C LEU A 38 25.270 10.715 14.350 1.00 0.00 C ATOM 546 O LEU A 38 25.418 11.340 15.398 1.00 0.00 O ATOM 547 CB LEU A 38 24.208 12.204 12.671 1.00 0.00 C ATOM 548 CG LEU A 38 24.257 12.991 11.364 1.00 0.00 C ATOM 549 CD1 LEU A 38 22.931 13.690 11.129 1.00 0.00 C ATOM 550 CD2 LEU A 38 25.396 14.000 11.389 1.00 0.00 C ATOM 0 H LEU A 38 24.903 10.097 11.459 1.00 0.00 H new ATOM 0 HA LEU A 38 26.325 12.061 13.064 1.00 0.00 H new ATOM 0 HB2 LEU A 38 23.359 11.522 12.632 1.00 0.00 H new ATOM 0 HB3 LEU A 38 24.020 12.901 13.487 1.00 0.00 H new ATOM 0 HG LEU A 38 24.437 12.296 10.544 1.00 0.00 H new ATOM 0 HD11 LEU A 38 22.975 14.249 10.194 1.00 0.00 H new ATOM 0 HD12 LEU A 38 22.134 12.949 11.071 1.00 0.00 H new ATOM 0 HD13 LEU A 38 22.730 14.375 11.952 1.00 0.00 H new ATOM 0 HD21 LEU A 38 25.415 14.551 10.449 1.00 0.00 H new ATOM 0 HD22 LEU A 38 25.248 14.696 12.215 1.00 0.00 H new ATOM 0 HD23 LEU A 38 26.343 13.477 11.521 1.00 0.00 H new ATOM 562 N GLY A 39 24.960 9.425 14.317 1.00 0.00 N ATOM 563 CA GLY A 39 24.654 8.699 15.539 1.00 0.00 C ATOM 564 C GLY A 39 25.895 8.264 16.290 1.00 0.00 C ATOM 565 O GLY A 39 25.911 7.202 16.913 1.00 0.00 O ATOM 0 H GLY A 39 24.914 8.866 13.465 1.00 0.00 H new ATOM 0 HA2 GLY A 39 24.045 9.329 16.187 1.00 0.00 H new ATOM 0 HA3 GLY A 39 24.056 7.821 15.294 1.00 0.00 H new ATOM 569 N THR A 40 26.931 9.082 16.226 1.00 0.00 N ATOM 570 CA THR A 40 28.184 8.798 16.899 1.00 0.00 C ATOM 571 C THR A 40 28.802 10.091 17.419 1.00 0.00 C ATOM 572 O THR A 40 29.030 10.246 18.620 1.00 0.00 O ATOM 573 CB THR A 40 29.182 8.093 15.954 1.00 0.00 C ATOM 574 OG1 THR A 40 28.607 6.880 15.445 1.00 0.00 O ATOM 575 CG2 THR A 40 30.483 7.774 16.674 1.00 0.00 C ATOM 0 H THR A 40 26.926 9.960 15.707 1.00 0.00 H new ATOM 0 HA THR A 40 27.971 8.130 17.734 1.00 0.00 H new ATOM 0 HB THR A 40 29.398 8.770 15.127 1.00 0.00 H new ATOM 0 HG1 THR A 40 28.179 7.058 14.581 1.00 0.00 H new ATOM 0 HG21 THR A 40 31.168 7.278 15.986 1.00 0.00 H new ATOM 0 HG22 THR A 40 30.936 8.698 17.033 1.00 0.00 H new ATOM 0 HG23 THR A 40 30.279 7.117 17.519 1.00 0.00 H new ATOM 583 N ASP A 41 29.043 11.027 16.510 1.00 0.00 N ATOM 584 CA ASP A 41 29.695 12.280 16.859 1.00 0.00 C ATOM 585 C ASP A 41 28.672 13.369 17.130 1.00 0.00 C ATOM 586 O ASP A 41 27.904 13.748 16.245 1.00 0.00 O ATOM 587 CB ASP A 41 30.630 12.736 15.739 1.00 0.00 C ATOM 588 CG ASP A 41 31.679 11.705 15.397 1.00 0.00 C ATOM 589 OD1 ASP A 41 31.414 10.854 14.524 1.00 0.00 O ATOM 590 OD2 ASP A 41 32.774 11.742 15.995 1.00 0.00 O ATOM 0 H ASP A 41 28.796 10.941 15.524 1.00 0.00 H new ATOM 0 HA ASP A 41 30.276 12.104 17.764 1.00 0.00 H new ATOM 0 HB2 ASP A 41 30.042 12.958 14.849 1.00 0.00 H new ATOM 0 HB3 ASP A 41 31.121 13.663 16.036 1.00 0.00 H new ATOM 595 N LYS A 42 28.677 13.882 18.349 1.00 0.00 N ATOM 596 CA LYS A 42 27.795 14.977 18.724 1.00 0.00 C ATOM 597 C LYS A 42 28.190 16.249 17.981 1.00 0.00 C ATOM 598 O LYS A 42 27.346 17.087 17.666 1.00 0.00 O ATOM 599 CB LYS A 42 27.842 15.204 20.235 1.00 0.00 C ATOM 600 CG LYS A 42 27.357 14.009 21.040 1.00 0.00 C ATOM 601 CD LYS A 42 27.493 14.251 22.533 1.00 0.00 C ATOM 602 CE LYS A 42 26.987 13.065 23.339 1.00 0.00 C ATOM 603 NZ LYS A 42 27.195 13.256 24.799 1.00 0.00 N ATOM 0 H LYS A 42 29.285 13.556 19.100 1.00 0.00 H new ATOM 0 HA LYS A 42 26.774 14.715 18.446 1.00 0.00 H new ATOM 0 HB2 LYS A 42 28.865 15.439 20.528 1.00 0.00 H new ATOM 0 HB3 LYS A 42 27.232 16.072 20.484 1.00 0.00 H new ATOM 0 HG2 LYS A 42 26.314 13.804 20.797 1.00 0.00 H new ATOM 0 HG3 LYS A 42 27.929 13.124 20.760 1.00 0.00 H new ATOM 0 HD2 LYS A 42 28.538 14.439 22.778 1.00 0.00 H new ATOM 0 HD3 LYS A 42 26.934 15.145 22.810 1.00 0.00 H new ATOM 0 HE2 LYS A 42 25.926 12.917 23.140 1.00 0.00 H new ATOM 0 HE3 LYS A 42 27.501 12.160 23.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 26.837 12.426 25.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 28.210 13.371 24.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 26.684 14.105 25.114 1.00 0.00 H new ATOM 617 N ALA A 43 29.479 16.377 17.687 1.00 0.00 N ATOM 618 CA ALA A 43 29.985 17.508 16.917 1.00 0.00 C ATOM 619 C ALA A 43 29.433 17.489 15.492 1.00 0.00 C ATOM 620 O ALA A 43 29.282 18.535 14.859 1.00 0.00 O ATOM 621 CB ALA A 43 31.505 17.498 16.899 1.00 0.00 C ATOM 0 H ALA A 43 30.195 15.709 17.971 1.00 0.00 H new ATOM 0 HA ALA A 43 29.648 18.426 17.398 1.00 0.00 H new ATOM 0 HB1 ALA A 43 31.868 18.348 16.321 1.00 0.00 H new ATOM 0 HB2 ALA A 43 31.881 17.566 17.920 1.00 0.00 H new ATOM 0 HB3 ALA A 43 31.857 16.572 16.444 1.00 0.00 H new ATOM 627 N ARG A 44 29.119 16.298 14.997 1.00 0.00 N ATOM 628 CA ARG A 44 28.559 16.151 13.659 1.00 0.00 C ATOM 629 C ARG A 44 27.095 16.566 13.634 1.00 0.00 C ATOM 630 O ARG A 44 26.557 16.910 12.581 1.00 0.00 O ATOM 631 CB ARG A 44 28.718 14.715 13.157 1.00 0.00 C ATOM 632 CG ARG A 44 30.082 14.446 12.550 1.00 0.00 C ATOM 633 CD ARG A 44 30.224 13.009 12.085 1.00 0.00 C ATOM 634 NE ARG A 44 31.244 12.878 11.046 1.00 0.00 N ATOM 635 CZ ARG A 44 32.155 11.906 11.002 1.00 0.00 C ATOM 636 NH1 ARG A 44 32.262 11.033 11.999 1.00 0.00 N ATOM 637 NH2 ARG A 44 32.980 11.824 9.964 1.00 0.00 N ATOM 0 H ARG A 44 29.243 15.420 15.502 1.00 0.00 H new ATOM 0 HA ARG A 44 29.112 16.811 12.990 1.00 0.00 H new ATOM 0 HB2 ARG A 44 28.553 14.026 13.985 1.00 0.00 H new ATOM 0 HB3 ARG A 44 27.948 14.509 12.413 1.00 0.00 H new ATOM 0 HG2 ARG A 44 30.242 15.117 11.706 1.00 0.00 H new ATOM 0 HG3 ARG A 44 30.856 14.667 13.285 1.00 0.00 H new ATOM 0 HD2 ARG A 44 30.484 12.376 12.933 1.00 0.00 H new ATOM 0 HD3 ARG A 44 29.267 12.653 11.703 1.00 0.00 H new ATOM 0 HE ARG A 44 31.260 13.578 10.304 1.00 0.00 H new ATOM 0 HH11 ARG A 44 31.644 11.103 12.807 1.00 0.00 H new ATOM 0 HH12 ARG A 44 32.962 10.293 11.956 1.00 0.00 H new ATOM 0 HH21 ARG A 44 32.915 12.503 9.206 1.00 0.00 H new ATOM 0 HH22 ARG A 44 33.679 11.082 9.925 1.00 0.00 H new ATOM 651 N ILE A 45 26.459 16.553 14.798 1.00 0.00 N ATOM 652 CA ILE A 45 25.086 17.023 14.922 1.00 0.00 C ATOM 653 C ILE A 45 25.018 18.514 14.600 1.00 0.00 C ATOM 654 O ILE A 45 24.050 18.993 14.010 1.00 0.00 O ATOM 655 CB ILE A 45 24.527 16.761 16.340 1.00 0.00 C ATOM 656 CG1 ILE A 45 24.524 15.256 16.633 1.00 0.00 C ATOM 657 CG2 ILE A 45 23.126 17.339 16.492 1.00 0.00 C ATOM 658 CD1 ILE A 45 24.032 14.900 18.021 1.00 0.00 C ATOM 0 H ILE A 45 26.872 16.222 15.670 1.00 0.00 H new ATOM 0 HA ILE A 45 24.472 16.469 14.212 1.00 0.00 H new ATOM 0 HB ILE A 45 25.173 17.260 17.062 1.00 0.00 H new ATOM 0 HG12 ILE A 45 23.897 14.754 15.896 1.00 0.00 H new ATOM 0 HG13 ILE A 45 25.535 14.870 16.507 1.00 0.00 H new ATOM 0 HG21 ILE A 45 22.758 17.140 17.498 1.00 0.00 H new ATOM 0 HG22 ILE A 45 23.156 18.415 16.323 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.460 16.876 15.764 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.060 13.818 18.151 1.00 0.00 H new ATOM 0 HD12 ILE A 45 24.673 15.371 18.766 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.009 15.254 18.146 1.00 0.00 H new ATOM 670 N ALA A 46 26.075 19.235 14.963 1.00 0.00 N ATOM 671 CA ALA A 46 26.176 20.653 14.651 1.00 0.00 C ATOM 672 C ALA A 46 26.265 20.865 13.142 1.00 0.00 C ATOM 673 O ALA A 46 25.682 21.804 12.603 1.00 0.00 O ATOM 674 CB ALA A 46 27.379 21.268 15.352 1.00 0.00 C ATOM 0 H ALA A 46 26.873 18.858 15.474 1.00 0.00 H new ATOM 0 HA ALA A 46 25.277 21.151 15.013 1.00 0.00 H new ATOM 0 HB1 ALA A 46 27.439 22.329 15.108 1.00 0.00 H new ATOM 0 HB2 ALA A 46 27.272 21.149 16.430 1.00 0.00 H new ATOM 0 HB3 ALA A 46 28.289 20.767 15.021 1.00 0.00 H new ATOM 680 N GLU A 47 26.986 19.977 12.465 1.00 0.00 N ATOM 681 CA GLU A 47 27.106 20.036 11.012 1.00 0.00 C ATOM 682 C GLU A 47 25.758 19.746 10.361 1.00 0.00 C ATOM 683 O GLU A 47 25.386 20.367 9.365 1.00 0.00 O ATOM 684 CB GLU A 47 28.152 19.037 10.512 1.00 0.00 C ATOM 685 CG GLU A 47 29.548 19.288 11.058 1.00 0.00 C ATOM 686 CD GLU A 47 30.578 18.353 10.459 1.00 0.00 C ATOM 687 OE1 GLU A 47 31.119 18.669 9.381 1.00 0.00 O ATOM 688 OE2 GLU A 47 30.854 17.294 11.063 1.00 0.00 O ATOM 0 H GLU A 47 27.496 19.208 12.899 1.00 0.00 H new ATOM 0 HA GLU A 47 27.428 21.040 10.737 1.00 0.00 H new ATOM 0 HB2 GLU A 47 27.840 18.030 10.787 1.00 0.00 H new ATOM 0 HB3 GLU A 47 28.185 19.074 9.423 1.00 0.00 H new ATOM 0 HG2 GLU A 47 29.835 20.319 10.854 1.00 0.00 H new ATOM 0 HG3 GLU A 47 29.539 19.168 12.141 1.00 0.00 H new ATOM 695 N ALA A 48 25.027 18.800 10.943 1.00 0.00 N ATOM 696 CA ALA A 48 23.691 18.461 10.471 1.00 0.00 C ATOM 697 C ALA A 48 22.744 19.643 10.643 1.00 0.00 C ATOM 698 O ALA A 48 21.965 19.963 9.746 1.00 0.00 O ATOM 699 CB ALA A 48 23.162 17.243 11.211 1.00 0.00 C ATOM 0 H ALA A 48 25.340 18.253 11.745 1.00 0.00 H new ATOM 0 HA ALA A 48 23.751 18.223 9.409 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.163 17.002 10.848 1.00 0.00 H new ATOM 0 HB2 ALA A 48 23.825 16.396 11.038 1.00 0.00 H new ATOM 0 HB3 ALA A 48 23.118 17.457 12.279 1.00 0.00 H new ATOM 705 N GLU A 49 22.830 20.290 11.799 1.00 0.00 N ATOM 706 CA GLU A 49 22.033 21.475 12.087 1.00 0.00 C ATOM 707 C GLU A 49 22.295 22.567 11.050 1.00 0.00 C ATOM 708 O GLU A 49 21.367 23.223 10.574 1.00 0.00 O ATOM 709 CB GLU A 49 22.359 21.993 13.488 1.00 0.00 C ATOM 710 CG GLU A 49 21.606 23.256 13.866 1.00 0.00 C ATOM 711 CD GLU A 49 22.028 23.800 15.212 1.00 0.00 C ATOM 712 OE1 GLU A 49 23.082 24.463 15.287 1.00 0.00 O ATOM 713 OE2 GLU A 49 21.305 23.573 16.207 1.00 0.00 O ATOM 0 H GLU A 49 23.450 20.010 12.559 1.00 0.00 H new ATOM 0 HA GLU A 49 20.978 21.204 12.041 1.00 0.00 H new ATOM 0 HB2 GLU A 49 22.131 21.214 14.215 1.00 0.00 H new ATOM 0 HB3 GLU A 49 23.430 22.186 13.554 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.771 24.016 13.102 1.00 0.00 H new ATOM 0 HG3 GLU A 49 20.536 23.047 13.881 1.00 0.00 H new ATOM 720 N LYS A 50 23.564 22.742 10.699 1.00 0.00 N ATOM 721 CA LYS A 50 23.965 23.736 9.708 1.00 0.00 C ATOM 722 C LYS A 50 23.450 23.377 8.317 1.00 0.00 C ATOM 723 O LYS A 50 23.204 24.256 7.492 1.00 0.00 O ATOM 724 CB LYS A 50 25.488 23.865 9.678 1.00 0.00 C ATOM 725 CG LYS A 50 26.069 24.490 10.933 1.00 0.00 C ATOM 726 CD LYS A 50 27.584 24.372 10.961 1.00 0.00 C ATOM 727 CE LYS A 50 28.182 25.135 12.131 1.00 0.00 C ATOM 728 NZ LYS A 50 28.078 26.606 11.946 1.00 0.00 N ATOM 0 H LYS A 50 24.338 22.205 11.089 1.00 0.00 H new ATOM 0 HA LYS A 50 23.524 24.690 9.997 1.00 0.00 H new ATOM 0 HB2 LYS A 50 25.925 22.876 9.538 1.00 0.00 H new ATOM 0 HB3 LYS A 50 25.777 24.466 8.816 1.00 0.00 H new ATOM 0 HG2 LYS A 50 25.783 25.541 10.984 1.00 0.00 H new ATOM 0 HG3 LYS A 50 25.648 24.002 11.812 1.00 0.00 H new ATOM 0 HD2 LYS A 50 27.867 23.321 11.028 1.00 0.00 H new ATOM 0 HD3 LYS A 50 27.997 24.754 10.027 1.00 0.00 H new ATOM 0 HE2 LYS A 50 27.671 24.848 13.050 1.00 0.00 H new ATOM 0 HE3 LYS A 50 29.229 24.857 12.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 28.669 27.088 12.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 28.404 26.860 10.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 27.088 26.901 12.063 1.00 0.00 H new ATOM 742 N ALA A 51 23.282 22.084 8.068 1.00 0.00 N ATOM 743 CA ALA A 51 22.819 21.607 6.769 1.00 0.00 C ATOM 744 C ALA A 51 21.295 21.619 6.684 1.00 0.00 C ATOM 745 O ALA A 51 20.726 21.453 5.607 1.00 0.00 O ATOM 746 CB ALA A 51 23.357 20.209 6.500 1.00 0.00 C ATOM 0 H ALA A 51 23.459 21.346 8.749 1.00 0.00 H new ATOM 0 HA ALA A 51 23.199 22.285 6.005 1.00 0.00 H new ATOM 0 HB1 ALA A 51 23.004 19.864 5.528 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.447 20.232 6.504 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.006 19.528 7.276 1.00 0.00 H new ATOM 752 N GLY A 52 20.641 21.807 7.825 1.00 0.00 N ATOM 753 CA GLY A 52 19.191 21.851 7.849 1.00 0.00 C ATOM 754 C GLY A 52 18.573 20.495 8.121 1.00 0.00 C ATOM 755 O GLY A 52 17.406 20.259 7.805 1.00 0.00 O ATOM 0 H GLY A 52 21.089 21.930 8.733 1.00 0.00 H new ATOM 0 HA2 GLY A 52 18.865 22.555 8.614 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.826 22.228 6.893 1.00 0.00 H new ATOM 759 N VAL A 53 19.356 19.599 8.707 1.00 0.00 N ATOM 760 CA VAL A 53 18.873 18.272 9.047 1.00 0.00 C ATOM 761 C VAL A 53 18.028 18.331 10.313 1.00 0.00 C ATOM 762 O VAL A 53 18.535 18.605 11.401 1.00 0.00 O ATOM 763 CB VAL A 53 20.038 17.277 9.247 1.00 0.00 C ATOM 764 CG1 VAL A 53 19.517 15.891 9.598 1.00 0.00 C ATOM 765 CG2 VAL A 53 20.909 17.219 8.001 1.00 0.00 C ATOM 0 H VAL A 53 20.330 19.770 8.956 1.00 0.00 H new ATOM 0 HA VAL A 53 18.264 17.919 8.215 1.00 0.00 H new ATOM 0 HB VAL A 53 20.646 17.631 10.080 1.00 0.00 H new ATOM 0 HG11 VAL A 53 20.357 15.210 9.733 1.00 0.00 H new ATOM 0 HG12 VAL A 53 18.939 15.942 10.521 1.00 0.00 H new ATOM 0 HG13 VAL A 53 18.881 15.526 8.791 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.724 16.513 8.160 1.00 0.00 H new ATOM 0 HG22 VAL A 53 20.308 16.894 7.152 1.00 0.00 H new ATOM 0 HG23 VAL A 53 21.319 18.208 7.798 1.00 0.00 H new ATOM 775 N LYS A 54 16.732 18.104 10.157 1.00 0.00 N ATOM 776 CA LYS A 54 15.808 18.154 11.279 1.00 0.00 C ATOM 777 C LYS A 54 15.573 16.761 11.846 1.00 0.00 C ATOM 778 O LYS A 54 15.301 16.599 13.037 1.00 0.00 O ATOM 779 CB LYS A 54 14.473 18.766 10.847 1.00 0.00 C ATOM 780 CG LYS A 54 14.588 20.181 10.308 1.00 0.00 C ATOM 781 CD LYS A 54 13.227 20.734 9.923 1.00 0.00 C ATOM 782 CE LYS A 54 13.321 22.163 9.413 1.00 0.00 C ATOM 783 NZ LYS A 54 11.977 22.734 9.130 1.00 0.00 N ATOM 0 H LYS A 54 16.296 17.883 9.262 1.00 0.00 H new ATOM 0 HA LYS A 54 16.253 18.779 12.053 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.025 18.132 10.082 1.00 0.00 H new ATOM 0 HB3 LYS A 54 13.793 18.767 11.699 1.00 0.00 H new ATOM 0 HG2 LYS A 54 15.045 20.824 11.061 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.246 20.190 9.439 1.00 0.00 H new ATOM 0 HD2 LYS A 54 12.782 20.102 9.154 1.00 0.00 H new ATOM 0 HD3 LYS A 54 12.563 20.699 10.787 1.00 0.00 H new ATOM 0 HE2 LYS A 54 13.831 22.781 10.152 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.925 22.187 8.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 12.080 23.709 8.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 11.501 22.159 8.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 11.409 22.734 10.001 1.00 0.00 H new ATOM 797 N SER A 55 15.660 15.756 10.989 1.00 0.00 N ATOM 798 CA SER A 55 15.443 14.380 11.404 1.00 0.00 C ATOM 799 C SER A 55 16.308 13.431 10.584 1.00 0.00 C ATOM 800 O SER A 55 16.880 13.821 9.567 1.00 0.00 O ATOM 801 CB SER A 55 13.964 14.018 11.246 1.00 0.00 C ATOM 802 OG SER A 55 13.145 14.919 11.972 1.00 0.00 O ATOM 0 H SER A 55 15.880 15.868 9.999 1.00 0.00 H new ATOM 0 HA SER A 55 15.725 14.281 12.452 1.00 0.00 H new ATOM 0 HB2 SER A 55 13.690 14.040 10.191 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.794 13.001 11.598 1.00 0.00 H new ATOM 0 HG SER A 55 12.231 14.886 11.620 1.00 0.00 H new ATOM 808 N VAL A 56 16.417 12.193 11.040 1.00 0.00 N ATOM 809 CA VAL A 56 17.164 11.177 10.318 1.00 0.00 C ATOM 810 C VAL A 56 16.253 10.008 9.953 1.00 0.00 C ATOM 811 O VAL A 56 15.323 9.679 10.699 1.00 0.00 O ATOM 812 CB VAL A 56 18.374 10.658 11.134 1.00 0.00 C ATOM 813 CG1 VAL A 56 19.405 11.761 11.326 1.00 0.00 C ATOM 814 CG2 VAL A 56 17.928 10.102 12.480 1.00 0.00 C ATOM 0 H VAL A 56 15.996 11.868 11.910 1.00 0.00 H new ATOM 0 HA VAL A 56 17.546 11.642 9.409 1.00 0.00 H new ATOM 0 HB VAL A 56 18.837 9.848 10.571 1.00 0.00 H new ATOM 0 HG11 VAL A 56 20.247 11.376 11.902 1.00 0.00 H new ATOM 0 HG12 VAL A 56 19.757 12.103 10.353 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.951 12.595 11.861 1.00 0.00 H new ATOM 0 HG21 VAL A 56 18.797 9.745 13.032 1.00 0.00 H new ATOM 0 HG22 VAL A 56 17.432 10.887 13.052 1.00 0.00 H new ATOM 0 HG23 VAL A 56 17.235 9.276 12.321 1.00 0.00 H new ATOM 824 N PRO A 57 16.503 9.367 8.801 1.00 0.00 N ATOM 825 CA PRO A 57 17.596 9.731 7.901 1.00 0.00 C ATOM 826 C PRO A 57 17.219 10.849 6.927 1.00 0.00 C ATOM 827 O PRO A 57 16.059 10.987 6.540 1.00 0.00 O ATOM 828 CB PRO A 57 17.852 8.429 7.147 1.00 0.00 C ATOM 829 CG PRO A 57 16.522 7.754 7.085 1.00 0.00 C ATOM 830 CD PRO A 57 15.730 8.223 8.284 1.00 0.00 C ATOM 0 HA PRO A 57 18.460 10.119 8.440 1.00 0.00 H new ATOM 0 HB2 PRO A 57 18.245 8.621 6.148 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.585 7.810 7.664 1.00 0.00 H new ATOM 0 HG2 PRO A 57 16.005 8.006 6.159 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.639 6.670 7.100 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.719 8.519 8.003 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.635 7.436 9.032 1.00 0.00 H new ATOM 838 N ALA A 58 18.208 11.634 6.528 1.00 0.00 N ATOM 839 CA ALA A 58 17.979 12.743 5.615 1.00 0.00 C ATOM 840 C ALA A 58 19.047 12.776 4.533 1.00 0.00 C ATOM 841 O ALA A 58 20.242 12.784 4.829 1.00 0.00 O ATOM 842 CB ALA A 58 17.957 14.060 6.377 1.00 0.00 C ATOM 0 H ALA A 58 19.178 11.523 6.823 1.00 0.00 H new ATOM 0 HA ALA A 58 17.010 12.600 5.137 1.00 0.00 H new ATOM 0 HB1 ALA A 58 17.785 14.881 5.680 1.00 0.00 H new ATOM 0 HB2 ALA A 58 17.157 14.039 7.117 1.00 0.00 H new ATOM 0 HB3 ALA A 58 18.913 14.206 6.880 1.00 0.00 H new ATOM 848 N LEU A 59 18.616 12.783 3.285 1.00 0.00 N ATOM 849 CA LEU A 59 19.536 12.845 2.163 1.00 0.00 C ATOM 850 C LEU A 59 19.553 14.264 1.609 1.00 0.00 C ATOM 851 O LEU A 59 18.575 14.725 1.023 1.00 0.00 O ATOM 852 CB LEU A 59 19.120 11.841 1.077 1.00 0.00 C ATOM 853 CG LEU A 59 20.251 11.307 0.183 1.00 0.00 C ATOM 854 CD1 LEU A 59 19.728 10.204 -0.725 1.00 0.00 C ATOM 855 CD2 LEU A 59 20.873 12.419 -0.651 1.00 0.00 C ATOM 0 H LEU A 59 17.631 12.746 3.022 1.00 0.00 H new ATOM 0 HA LEU A 59 20.539 12.581 2.498 1.00 0.00 H new ATOM 0 HB2 LEU A 59 18.635 10.993 1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 59 18.373 12.314 0.440 1.00 0.00 H new ATOM 0 HG LEU A 59 21.026 10.900 0.833 1.00 0.00 H new ATOM 0 HD11 LEU A 59 20.539 9.835 -1.353 1.00 0.00 H new ATOM 0 HD12 LEU A 59 19.338 9.387 -0.118 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.932 10.599 -1.356 1.00 0.00 H new ATOM 0 HD21 LEU A 59 21.669 12.007 -1.271 1.00 0.00 H new ATOM 0 HD22 LEU A 59 20.110 12.866 -1.289 1.00 0.00 H new ATOM 0 HD23 LEU A 59 21.286 13.182 0.009 1.00 0.00 H new ATOM 867 N VAL A 60 20.654 14.959 1.824 1.00 0.00 N ATOM 868 CA VAL A 60 20.794 16.332 1.372 1.00 0.00 C ATOM 869 C VAL A 60 21.488 16.379 0.019 1.00 0.00 C ATOM 870 O VAL A 60 22.694 16.147 -0.080 1.00 0.00 O ATOM 871 CB VAL A 60 21.589 17.185 2.383 1.00 0.00 C ATOM 872 CG1 VAL A 60 21.655 18.639 1.934 1.00 0.00 C ATOM 873 CG2 VAL A 60 20.977 17.083 3.772 1.00 0.00 C ATOM 0 H VAL A 60 21.471 14.592 2.313 1.00 0.00 H new ATOM 0 HA VAL A 60 19.790 16.747 1.284 1.00 0.00 H new ATOM 0 HB VAL A 60 22.606 16.795 2.426 1.00 0.00 H new ATOM 0 HG11 VAL A 60 22.220 19.220 2.663 1.00 0.00 H new ATOM 0 HG12 VAL A 60 22.147 18.698 0.963 1.00 0.00 H new ATOM 0 HG13 VAL A 60 20.645 19.041 1.854 1.00 0.00 H new ATOM 0 HG21 VAL A 60 21.553 17.692 4.469 1.00 0.00 H new ATOM 0 HG22 VAL A 60 19.948 17.440 3.743 1.00 0.00 H new ATOM 0 HG23 VAL A 60 20.991 16.044 4.101 1.00 0.00 H new ATOM 883 N ILE A 61 20.731 16.665 -1.021 1.00 0.00 N ATOM 884 CA ILE A 61 21.282 16.771 -2.358 1.00 0.00 C ATOM 885 C ILE A 61 21.711 18.204 -2.616 1.00 0.00 C ATOM 886 O ILE A 61 20.876 19.064 -2.919 1.00 0.00 O ATOM 887 CB ILE A 61 20.273 16.324 -3.439 1.00 0.00 C ATOM 888 CG1 ILE A 61 19.742 14.921 -3.128 1.00 0.00 C ATOM 889 CG2 ILE A 61 20.926 16.354 -4.816 1.00 0.00 C ATOM 890 CD1 ILE A 61 18.697 14.432 -4.108 1.00 0.00 C ATOM 0 H ILE A 61 19.726 16.829 -0.965 1.00 0.00 H new ATOM 0 HA ILE A 61 22.142 16.104 -2.418 1.00 0.00 H new ATOM 0 HB ILE A 61 19.432 17.018 -3.438 1.00 0.00 H new ATOM 0 HG12 ILE A 61 20.577 14.220 -3.121 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.315 14.918 -2.125 1.00 0.00 H new ATOM 0 HG21 ILE A 61 20.204 16.037 -5.568 1.00 0.00 H new ATOM 0 HG22 ILE A 61 21.260 17.367 -5.038 1.00 0.00 H new ATOM 0 HG23 ILE A 61 21.782 15.679 -4.828 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.370 13.432 -3.822 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.844 15.110 -4.098 1.00 0.00 H new ATOM 0 HD13 ILE A 61 19.124 14.401 -5.110 1.00 0.00 H new ATOM 902 N ASP A 62 23.009 18.453 -2.462 1.00 0.00 N ATOM 903 CA ASP A 62 23.601 19.783 -2.613 1.00 0.00 C ATOM 904 C ASP A 62 23.107 20.747 -1.540 1.00 0.00 C ATOM 905 O ASP A 62 23.814 21.033 -0.573 1.00 0.00 O ATOM 906 CB ASP A 62 23.330 20.363 -4.005 1.00 0.00 C ATOM 907 CG ASP A 62 24.100 19.641 -5.087 1.00 0.00 C ATOM 908 OD1 ASP A 62 25.317 19.438 -4.914 1.00 0.00 O ATOM 909 OD2 ASP A 62 23.489 19.283 -6.123 1.00 0.00 O ATOM 0 H ASP A 62 23.689 17.730 -2.226 1.00 0.00 H new ATOM 0 HA ASP A 62 24.677 19.662 -2.492 1.00 0.00 H new ATOM 0 HB2 ASP A 62 22.263 20.303 -4.220 1.00 0.00 H new ATOM 0 HB3 ASP A 62 23.598 21.419 -4.015 1.00 0.00 H new ATOM 914 N GLY A 63 21.903 21.255 -1.723 1.00 0.00 N ATOM 915 CA GLY A 63 21.333 22.179 -0.768 1.00 0.00 C ATOM 916 C GLY A 63 19.886 21.866 -0.458 1.00 0.00 C ATOM 917 O GLY A 63 19.196 22.666 0.172 1.00 0.00 O ATOM 0 H GLY A 63 21.305 21.043 -2.522 1.00 0.00 H new ATOM 0 HA2 GLY A 63 21.914 22.150 0.154 1.00 0.00 H new ATOM 0 HA3 GLY A 63 21.407 23.194 -1.159 1.00 0.00 H new ATOM 921 N ALA A 64 19.421 20.709 -0.905 1.00 0.00 N ATOM 922 CA ALA A 64 18.049 20.293 -0.655 1.00 0.00 C ATOM 923 C ALA A 64 18.022 19.045 0.218 1.00 0.00 C ATOM 924 O ALA A 64 18.514 17.989 -0.180 1.00 0.00 O ATOM 925 CB ALA A 64 17.323 20.044 -1.968 1.00 0.00 C ATOM 0 H ALA A 64 19.974 20.041 -1.443 1.00 0.00 H new ATOM 0 HA ALA A 64 17.535 21.094 -0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 64 16.298 19.734 -1.764 1.00 0.00 H new ATOM 0 HB2 ALA A 64 17.314 20.960 -2.558 1.00 0.00 H new ATOM 0 HB3 ALA A 64 17.836 19.259 -2.524 1.00 0.00 H new ATOM 931 N ALA A 65 17.455 19.175 1.405 1.00 0.00 N ATOM 932 CA ALA A 65 17.429 18.084 2.365 1.00 0.00 C ATOM 933 C ALA A 65 16.145 17.275 2.238 1.00 0.00 C ATOM 934 O ALA A 65 15.046 17.794 2.435 1.00 0.00 O ATOM 935 CB ALA A 65 17.579 18.622 3.781 1.00 0.00 C ATOM 0 H ALA A 65 17.004 20.031 1.729 1.00 0.00 H new ATOM 0 HA ALA A 65 18.268 17.422 2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 65 17.558 17.794 4.489 1.00 0.00 H new ATOM 0 HB2 ALA A 65 18.527 19.152 3.870 1.00 0.00 H new ATOM 0 HB3 ALA A 65 16.759 19.307 3.999 1.00 0.00 H new ATOM 941 N PHE A 66 16.284 16.007 1.892 1.00 0.00 N ATOM 942 CA PHE A 66 15.137 15.126 1.763 1.00 0.00 C ATOM 943 C PHE A 66 15.147 14.071 2.859 1.00 0.00 C ATOM 944 O PHE A 66 15.936 13.127 2.824 1.00 0.00 O ATOM 945 CB PHE A 66 15.120 14.464 0.384 1.00 0.00 C ATOM 946 CG PHE A 66 15.023 15.448 -0.748 1.00 0.00 C ATOM 947 CD1 PHE A 66 13.801 15.994 -1.110 1.00 0.00 C ATOM 948 CD2 PHE A 66 16.156 15.830 -1.448 1.00 0.00 C ATOM 949 CE1 PHE A 66 13.711 16.903 -2.144 1.00 0.00 C ATOM 950 CE2 PHE A 66 16.071 16.738 -2.484 1.00 0.00 C ATOM 951 CZ PHE A 66 14.848 17.275 -2.833 1.00 0.00 C ATOM 0 H PHE A 66 17.181 15.564 1.695 1.00 0.00 H new ATOM 0 HA PHE A 66 14.232 15.724 1.869 1.00 0.00 H new ATOM 0 HB2 PHE A 66 16.026 13.870 0.263 1.00 0.00 H new ATOM 0 HB3 PHE A 66 14.277 13.775 0.330 1.00 0.00 H new ATOM 0 HD1 PHE A 66 12.908 15.704 -0.576 1.00 0.00 H new ATOM 0 HD2 PHE A 66 17.116 15.413 -1.180 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.753 17.323 -2.414 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.961 17.028 -3.022 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.781 17.985 -3.644 1.00 0.00 H new ATOM 961 N HIS A 67 14.285 14.257 3.846 1.00 0.00 N ATOM 962 CA HIS A 67 14.148 13.309 4.942 1.00 0.00 C ATOM 963 C HIS A 67 13.429 12.061 4.450 1.00 0.00 C ATOM 964 O HIS A 67 12.268 12.126 4.044 1.00 0.00 O ATOM 965 CB HIS A 67 13.365 13.934 6.103 1.00 0.00 C ATOM 966 CG HIS A 67 14.010 15.153 6.694 1.00 0.00 C ATOM 967 ND1 HIS A 67 13.834 16.429 6.206 1.00 0.00 N ATOM 968 CD2 HIS A 67 14.837 15.273 7.763 1.00 0.00 C ATOM 969 CE1 HIS A 67 14.544 17.267 6.974 1.00 0.00 C ATOM 970 NE2 HIS A 67 15.173 16.615 7.936 1.00 0.00 N ATOM 0 H HIS A 67 13.664 15.064 3.911 1.00 0.00 H new ATOM 0 HA HIS A 67 15.143 13.042 5.299 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.367 14.198 5.753 1.00 0.00 H new ATOM 0 HB3 HIS A 67 13.240 13.187 6.887 1.00 0.00 H new ATOM 0 HD1 HIS A 67 13.264 16.690 5.402 1.00 0.00 H new ATOM 0 HD2 HIS A 67 15.181 14.458 8.382 1.00 0.00 H new ATOM 0 HE1 HIS A 67 14.595 18.336 6.826 1.00 0.00 H new ATOM 978 N ILE A 68 14.118 10.935 4.471 1.00 0.00 N ATOM 979 CA ILE A 68 13.541 9.696 3.984 1.00 0.00 C ATOM 980 C ILE A 68 12.810 8.987 5.116 1.00 0.00 C ATOM 981 O ILE A 68 13.416 8.256 5.904 1.00 0.00 O ATOM 982 CB ILE A 68 14.609 8.764 3.372 1.00 0.00 C ATOM 983 CG1 ILE A 68 15.441 9.529 2.336 1.00 0.00 C ATOM 984 CG2 ILE A 68 13.943 7.552 2.728 1.00 0.00 C ATOM 985 CD1 ILE A 68 16.565 8.717 1.727 1.00 0.00 C ATOM 0 H ILE A 68 15.073 10.853 4.818 1.00 0.00 H new ATOM 0 HA ILE A 68 12.834 9.946 3.192 1.00 0.00 H new ATOM 0 HB ILE A 68 15.271 8.416 4.165 1.00 0.00 H new ATOM 0 HG12 ILE A 68 14.782 9.873 1.539 1.00 0.00 H new ATOM 0 HG13 ILE A 68 15.862 10.417 2.807 1.00 0.00 H new ATOM 0 HG21 ILE A 68 14.706 6.902 2.300 1.00 0.00 H new ATOM 0 HG22 ILE A 68 13.380 7.002 3.482 1.00 0.00 H new ATOM 0 HG23 ILE A 68 13.266 7.884 1.941 1.00 0.00 H new ATOM 0 HD11 ILE A 68 17.106 9.329 1.005 1.00 0.00 H new ATOM 0 HD12 ILE A 68 17.248 8.395 2.513 1.00 0.00 H new ATOM 0 HD13 ILE A 68 16.151 7.843 1.225 1.00 0.00 H new ATOM 997 N ASN A 69 11.503 9.230 5.180 1.00 0.00 N ATOM 998 CA ASN A 69 10.649 8.764 6.273 1.00 0.00 C ATOM 999 C ASN A 69 11.034 9.468 7.574 1.00 0.00 C ATOM 1000 O ASN A 69 11.788 10.443 7.558 1.00 0.00 O ATOM 1001 CB ASN A 69 10.714 7.238 6.442 1.00 0.00 C ATOM 1002 CG ASN A 69 10.344 6.491 5.172 1.00 0.00 C ATOM 1003 OD1 ASN A 69 9.166 6.285 4.873 1.00 0.00 O ATOM 1004 ND2 ASN A 69 11.351 6.065 4.426 1.00 0.00 N ATOM 0 H ASN A 69 11.001 9.761 4.468 1.00 0.00 H new ATOM 0 HA ASN A 69 9.619 9.015 6.022 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.721 6.953 6.746 1.00 0.00 H new ATOM 0 HB3 ASN A 69 10.041 6.937 7.245 1.00 0.00 H new ATOM 0 HD21 ASN A 69 11.166 5.545 3.568 1.00 0.00 H new ATOM 0 HD22 ASN A 69 12.312 6.257 4.709 1.00 0.00 H new ATOM 1011 N PHE A 70 10.504 9.000 8.692 1.00 0.00 N ATOM 1012 CA PHE A 70 10.781 9.625 9.974 1.00 0.00 C ATOM 1013 C PHE A 70 11.208 8.585 11.002 1.00 0.00 C ATOM 1014 O PHE A 70 10.391 7.790 11.479 1.00 0.00 O ATOM 1015 CB PHE A 70 9.553 10.397 10.470 1.00 0.00 C ATOM 1016 CG PHE A 70 9.772 11.113 11.776 1.00 0.00 C ATOM 1017 CD1 PHE A 70 10.639 12.193 11.854 1.00 0.00 C ATOM 1018 CD2 PHE A 70 9.107 10.712 12.925 1.00 0.00 C ATOM 1019 CE1 PHE A 70 10.839 12.854 13.051 1.00 0.00 C ATOM 1020 CE2 PHE A 70 9.305 11.370 14.124 1.00 0.00 C ATOM 1021 CZ PHE A 70 10.172 12.442 14.187 1.00 0.00 C ATOM 0 H PHE A 70 9.882 8.193 8.738 1.00 0.00 H new ATOM 0 HA PHE A 70 11.603 10.329 9.840 1.00 0.00 H new ATOM 0 HB2 PHE A 70 9.262 11.124 9.712 1.00 0.00 H new ATOM 0 HB3 PHE A 70 8.720 9.703 10.582 1.00 0.00 H new ATOM 0 HD1 PHE A 70 11.164 12.521 10.969 1.00 0.00 H new ATOM 0 HD2 PHE A 70 8.426 9.875 12.882 1.00 0.00 H new ATOM 0 HE1 PHE A 70 11.517 13.693 13.098 1.00 0.00 H new ATOM 0 HE2 PHE A 70 8.782 11.046 15.011 1.00 0.00 H new ATOM 0 HZ PHE A 70 10.328 12.957 15.123 1.00 0.00 H new ATOM 1031 N GLY A 71 12.491 8.580 11.322 1.00 0.00 N ATOM 1032 CA GLY A 71 13.002 7.676 12.330 1.00 0.00 C ATOM 1033 C GLY A 71 13.187 8.373 13.660 1.00 0.00 C ATOM 1034 O GLY A 71 12.492 8.074 14.631 1.00 0.00 O ATOM 0 H GLY A 71 13.192 9.189 10.900 1.00 0.00 H new ATOM 0 HA2 GLY A 71 12.315 6.838 12.450 1.00 0.00 H new ATOM 0 HA3 GLY A 71 13.955 7.262 11.999 1.00 0.00 H new ATOM 1038 N ALA A 72 14.128 9.301 13.706 1.00 0.00 N ATOM 1039 CA ALA A 72 14.386 10.073 14.912 1.00 0.00 C ATOM 1040 C ALA A 72 14.648 11.528 14.563 1.00 0.00 C ATOM 1041 O ALA A 72 15.182 11.824 13.492 1.00 0.00 O ATOM 1042 CB ALA A 72 15.564 9.485 15.677 1.00 0.00 C ATOM 0 H ALA A 72 14.730 9.540 12.918 1.00 0.00 H new ATOM 0 HA ALA A 72 13.504 10.026 15.550 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.744 10.074 16.576 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.339 8.456 15.956 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.453 9.504 15.047 1.00 0.00 H new ATOM 1048 N GLY A 73 14.267 12.433 15.451 1.00 0.00 N ATOM 1049 CA GLY A 73 14.548 13.838 15.245 1.00 0.00 C ATOM 1050 C GLY A 73 15.938 14.195 15.725 1.00 0.00 C ATOM 1051 O GLY A 73 16.568 13.418 16.445 1.00 0.00 O ATOM 0 H GLY A 73 13.767 12.219 16.314 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.453 14.079 14.186 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.811 14.440 15.776 1.00 0.00 H new ATOM 1055 N ILE A 74 16.425 15.366 15.341 1.00 0.00 N ATOM 1056 CA ILE A 74 17.765 15.786 15.726 1.00 0.00 C ATOM 1057 C ILE A 74 17.851 16.006 17.239 1.00 0.00 C ATOM 1058 O ILE A 74 18.892 15.771 17.851 1.00 0.00 O ATOM 1059 CB ILE A 74 18.207 17.060 14.961 1.00 0.00 C ATOM 1060 CG1 ILE A 74 19.671 17.390 15.270 1.00 0.00 C ATOM 1061 CG2 ILE A 74 17.307 18.243 15.296 1.00 0.00 C ATOM 1062 CD1 ILE A 74 20.223 18.544 14.459 1.00 0.00 C ATOM 0 H ILE A 74 15.917 16.039 14.767 1.00 0.00 H new ATOM 0 HA ILE A 74 18.451 14.984 15.453 1.00 0.00 H new ATOM 0 HB ILE A 74 18.114 16.862 13.893 1.00 0.00 H new ATOM 0 HG12 ILE A 74 19.764 17.626 16.330 1.00 0.00 H new ATOM 0 HG13 ILE A 74 20.280 16.505 15.086 1.00 0.00 H new ATOM 0 HG21 ILE A 74 17.641 19.122 14.745 1.00 0.00 H new ATOM 0 HG22 ILE A 74 16.280 18.009 15.017 1.00 0.00 H new ATOM 0 HG23 ILE A 74 17.355 18.446 16.366 1.00 0.00 H new ATOM 0 HD11 ILE A 74 21.263 18.717 14.734 1.00 0.00 H new ATOM 0 HD12 ILE A 74 20.163 18.304 13.397 1.00 0.00 H new ATOM 0 HD13 ILE A 74 19.640 19.443 14.661 1.00 0.00 H new ATOM 1074 N ASP A 75 16.741 16.419 17.847 1.00 0.00 N ATOM 1075 CA ASP A 75 16.694 16.626 19.291 1.00 0.00 C ATOM 1076 C ASP A 75 16.630 15.301 20.033 1.00 0.00 C ATOM 1077 O ASP A 75 17.011 15.214 21.201 1.00 0.00 O ATOM 1078 CB ASP A 75 15.514 17.516 19.685 1.00 0.00 C ATOM 1079 CG ASP A 75 15.796 18.980 19.415 1.00 0.00 C ATOM 1080 OD1 ASP A 75 15.856 19.369 18.229 1.00 0.00 O ATOM 1081 OD2 ASP A 75 16.000 19.737 20.386 1.00 0.00 O ATOM 0 H ASP A 75 15.865 16.616 17.363 1.00 0.00 H new ATOM 0 HA ASP A 75 17.614 17.135 19.578 1.00 0.00 H new ATOM 0 HB2 ASP A 75 14.627 17.209 19.131 1.00 0.00 H new ATOM 0 HB3 ASP A 75 15.293 17.378 20.743 1.00 0.00 H new ATOM 1086 N ASP A 76 16.165 14.263 19.347 1.00 0.00 N ATOM 1087 CA ASP A 76 16.167 12.919 19.912 1.00 0.00 C ATOM 1088 C ASP A 76 17.597 12.408 20.014 1.00 0.00 C ATOM 1089 O ASP A 76 17.921 11.586 20.870 1.00 0.00 O ATOM 1090 CB ASP A 76 15.330 11.955 19.064 1.00 0.00 C ATOM 1091 CG ASP A 76 13.842 12.235 19.141 1.00 0.00 C ATOM 1092 OD1 ASP A 76 13.246 12.018 20.218 1.00 0.00 O ATOM 1093 OD2 ASP A 76 13.256 12.650 18.120 1.00 0.00 O ATOM 0 H ASP A 76 15.783 14.326 18.403 1.00 0.00 H new ATOM 0 HA ASP A 76 15.721 12.968 20.905 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.653 12.020 18.025 1.00 0.00 H new ATOM 0 HB3 ASP A 76 15.519 10.933 19.393 1.00 0.00 H new ATOM 1098 N LEU A 77 18.451 12.912 19.131 1.00 0.00 N ATOM 1099 CA LEU A 77 19.867 12.570 19.146 1.00 0.00 C ATOM 1100 C LEU A 77 20.608 13.421 20.174 1.00 0.00 C ATOM 1101 O LEU A 77 21.639 13.011 20.709 1.00 0.00 O ATOM 1102 CB LEU A 77 20.477 12.774 17.758 1.00 0.00 C ATOM 1103 CG LEU A 77 19.838 11.947 16.639 1.00 0.00 C ATOM 1104 CD1 LEU A 77 20.476 12.283 15.301 1.00 0.00 C ATOM 1105 CD2 LEU A 77 19.964 10.460 16.933 1.00 0.00 C ATOM 0 H LEU A 77 18.185 13.563 18.392 1.00 0.00 H new ATOM 0 HA LEU A 77 19.967 11.520 19.423 1.00 0.00 H new ATOM 0 HB2 LEU A 77 20.402 13.830 17.497 1.00 0.00 H new ATOM 0 HB3 LEU A 77 21.539 12.533 17.806 1.00 0.00 H new ATOM 0 HG LEU A 77 18.778 12.196 16.589 1.00 0.00 H new ATOM 0 HD11 LEU A 77 20.011 11.687 14.516 1.00 0.00 H new ATOM 0 HD12 LEU A 77 20.333 13.342 15.085 1.00 0.00 H new ATOM 0 HD13 LEU A 77 21.543 12.062 15.341 1.00 0.00 H new ATOM 0 HD21 LEU A 77 19.504 9.889 16.126 1.00 0.00 H new ATOM 0 HD22 LEU A 77 21.018 10.193 17.011 1.00 0.00 H new ATOM 0 HD23 LEU A 77 19.461 10.231 17.872 1.00 0.00 H new ATOM 1117 N LYS A 78 20.075 14.607 20.443 1.00 0.00 N ATOM 1118 CA LYS A 78 20.649 15.500 21.442 1.00 0.00 C ATOM 1119 C LYS A 78 20.431 14.928 22.837 1.00 0.00 C ATOM 1120 O LYS A 78 21.386 14.665 23.571 1.00 0.00 O ATOM 1121 CB LYS A 78 20.011 16.890 21.355 1.00 0.00 C ATOM 1122 CG LYS A 78 20.175 17.564 20.003 1.00 0.00 C ATOM 1123 CD LYS A 78 19.320 18.817 19.906 1.00 0.00 C ATOM 1124 CE LYS A 78 19.335 19.403 18.503 1.00 0.00 C ATOM 1125 NZ LYS A 78 18.373 20.529 18.359 1.00 0.00 N ATOM 0 H LYS A 78 19.243 14.974 19.981 1.00 0.00 H new ATOM 0 HA LYS A 78 21.718 15.590 21.247 1.00 0.00 H new ATOM 0 HB2 LYS A 78 18.948 16.805 21.580 1.00 0.00 H new ATOM 0 HB3 LYS A 78 20.449 17.528 22.123 1.00 0.00 H new ATOM 0 HG2 LYS A 78 21.222 17.822 19.847 1.00 0.00 H new ATOM 0 HG3 LYS A 78 19.897 16.869 19.211 1.00 0.00 H new ATOM 0 HD2 LYS A 78 18.295 18.580 20.190 1.00 0.00 H new ATOM 0 HD3 LYS A 78 19.684 19.561 20.615 1.00 0.00 H new ATOM 0 HE2 LYS A 78 20.340 19.752 18.267 1.00 0.00 H new ATOM 0 HE3 LYS A 78 19.091 18.623 17.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 18.737 21.209 17.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 17.454 20.162 18.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 18.254 21.004 19.277 1.00 0.00 H new ATOM 1139 N GLY A 79 19.167 14.724 23.182 1.00 0.00 N ATOM 1140 CA GLY A 79 18.829 14.203 24.489 1.00 0.00 C ATOM 1141 C GLY A 79 18.308 15.286 25.408 1.00 0.00 C ATOM 1142 O GLY A 79 17.746 16.281 24.947 1.00 0.00 O ATOM 0 H GLY A 79 18.368 14.911 22.577 1.00 0.00 H new ATOM 0 HA2 GLY A 79 18.076 13.421 24.385 1.00 0.00 H new ATOM 0 HA3 GLY A 79 19.710 13.741 24.935 1.00 0.00 H new ATOM 1146 N SER A 80 18.491 15.095 26.703 1.00 0.00 N ATOM 1147 CA SER A 80 18.070 16.076 27.685 1.00 0.00 C ATOM 1148 C SER A 80 18.907 15.919 28.950 1.00 0.00 C ATOM 1149 O SER A 80 19.940 16.607 29.063 1.00 0.00 O ATOM 1150 CB SER A 80 16.574 15.921 27.992 1.00 0.00 C ATOM 1151 OG SER A 80 16.086 17.008 28.765 1.00 0.00 O ATOM 1152 OXT SER A 80 18.552 15.084 29.808 1.00 0.00 O ATOM 0 H SER A 80 18.931 14.264 27.099 1.00 0.00 H new ATOM 0 HA SER A 80 18.224 17.078 27.284 1.00 0.00 H new ATOM 0 HB2 SER A 80 16.015 15.857 27.059 1.00 0.00 H new ATOM 0 HB3 SER A 80 16.406 14.987 28.529 1.00 0.00 H new ATOM 0 HG SER A 80 15.131 16.880 28.942 1.00 0.00 H new TER 1158 SER A 80 ATOM 1159 N VAL B 1 16.600 -5.199 -17.947 1.00 0.00 N ATOM 1160 CA VAL B 1 15.271 -4.644 -17.606 1.00 0.00 C ATOM 1161 C VAL B 1 15.384 -3.685 -16.428 1.00 0.00 C ATOM 1162 O VAL B 1 16.030 -3.993 -15.425 1.00 0.00 O ATOM 1163 CB VAL B 1 14.260 -5.765 -17.262 1.00 0.00 C ATOM 1164 CG1 VAL B 1 12.917 -5.186 -16.835 1.00 0.00 C ATOM 1165 CG2 VAL B 1 14.077 -6.698 -18.447 1.00 0.00 C ATOM 0 H1 VAL B 1 16.561 -5.641 -18.888 1.00 0.00 H new ATOM 0 H2 VAL B 1 17.305 -4.434 -17.953 1.00 0.00 H new ATOM 0 H3 VAL B 1 16.870 -5.913 -17.240 1.00 0.00 H new ATOM 0 HA VAL B 1 14.906 -4.107 -18.481 1.00 0.00 H new ATOM 0 HB VAL B 1 14.665 -6.333 -16.425 1.00 0.00 H new ATOM 0 HG11 VAL B 1 12.229 -5.998 -16.600 1.00 0.00 H new ATOM 0 HG12 VAL B 1 13.054 -4.560 -15.953 1.00 0.00 H new ATOM 0 HG13 VAL B 1 12.506 -4.585 -17.646 1.00 0.00 H new ATOM 0 HG21 VAL B 1 13.363 -7.480 -18.188 1.00 0.00 H new ATOM 0 HG22 VAL B 1 13.702 -6.133 -19.300 1.00 0.00 H new ATOM 0 HG23 VAL B 1 15.034 -7.151 -18.704 1.00 0.00 H new ATOM 1177 N ALA B 2 14.766 -2.521 -16.559 1.00 0.00 N ATOM 1178 CA ALA B 2 14.763 -1.532 -15.495 1.00 0.00 C ATOM 1179 C ALA B 2 13.554 -1.739 -14.593 1.00 0.00 C ATOM 1180 O ALA B 2 12.461 -2.040 -15.075 1.00 0.00 O ATOM 1181 CB ALA B 2 14.762 -0.126 -16.076 1.00 0.00 C ATOM 0 H ALA B 2 14.258 -2.238 -17.397 1.00 0.00 H new ATOM 0 HA ALA B 2 15.668 -1.655 -14.899 1.00 0.00 H new ATOM 0 HB1 ALA B 2 14.760 0.603 -15.265 1.00 0.00 H new ATOM 0 HB2 ALA B 2 15.653 0.015 -16.688 1.00 0.00 H new ATOM 0 HB3 ALA B 2 13.873 0.013 -16.691 1.00 0.00 H new ATOM 1187 N SER B 3 13.751 -1.586 -13.295 1.00 0.00 N ATOM 1188 CA SER B 3 12.680 -1.802 -12.337 1.00 0.00 C ATOM 1189 C SER B 3 11.789 -0.567 -12.227 1.00 0.00 C ATOM 1190 O SER B 3 12.181 0.535 -12.617 1.00 0.00 O ATOM 1191 CB SER B 3 13.269 -2.184 -10.979 1.00 0.00 C ATOM 1192 OG SER B 3 14.610 -1.735 -10.863 1.00 0.00 O ATOM 0 H SER B 3 14.642 -1.313 -12.880 1.00 0.00 H new ATOM 0 HA SER B 3 12.055 -2.623 -12.687 1.00 0.00 H new ATOM 0 HB2 SER B 3 12.666 -1.750 -10.182 1.00 0.00 H new ATOM 0 HB3 SER B 3 13.232 -3.266 -10.854 1.00 0.00 H new ATOM 0 HG SER B 3 14.659 -1.019 -10.196 1.00 0.00 H new ATOM 1198 N LYS B 4 10.590 -0.761 -11.699 1.00 0.00 N ATOM 1199 CA LYS B 4 9.586 0.291 -11.653 1.00 0.00 C ATOM 1200 C LYS B 4 9.652 1.080 -10.348 1.00 0.00 C ATOM 1201 O LYS B 4 9.727 0.503 -9.265 1.00 0.00 O ATOM 1202 CB LYS B 4 8.196 -0.326 -11.833 1.00 0.00 C ATOM 1203 CG LYS B 4 7.050 0.625 -11.528 1.00 0.00 C ATOM 1204 CD LYS B 4 5.700 -0.027 -11.779 1.00 0.00 C ATOM 1205 CE LYS B 4 5.535 -1.303 -10.968 1.00 0.00 C ATOM 1206 NZ LYS B 4 4.209 -1.932 -11.189 1.00 0.00 N ATOM 0 H LYS B 4 10.287 -1.646 -11.293 1.00 0.00 H new ATOM 0 HA LYS B 4 9.786 0.991 -12.464 1.00 0.00 H new ATOM 0 HB2 LYS B 4 8.097 -0.679 -12.859 1.00 0.00 H new ATOM 0 HB3 LYS B 4 8.111 -1.199 -11.186 1.00 0.00 H new ATOM 0 HG2 LYS B 4 7.111 0.948 -10.489 1.00 0.00 H new ATOM 0 HG3 LYS B 4 7.144 1.518 -12.145 1.00 0.00 H new ATOM 0 HD2 LYS B 4 4.904 0.673 -11.523 1.00 0.00 H new ATOM 0 HD3 LYS B 4 5.596 -0.254 -12.840 1.00 0.00 H new ATOM 0 HE2 LYS B 4 6.321 -2.009 -11.238 1.00 0.00 H new ATOM 0 HE3 LYS B 4 5.658 -1.078 -9.909 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 4.136 -2.799 -10.619 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 3.459 -1.269 -10.908 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 4.101 -2.170 -12.196 1.00 0.00 H new ATOM 1220 N ALA B 5 9.622 2.400 -10.464 1.00 0.00 N ATOM 1221 CA ALA B 5 9.587 3.278 -9.306 1.00 0.00 C ATOM 1222 C ALA B 5 8.439 4.270 -9.447 1.00 0.00 C ATOM 1223 O ALA B 5 8.458 5.132 -10.322 1.00 0.00 O ATOM 1224 CB ALA B 5 10.914 4.010 -9.148 1.00 0.00 C ATOM 0 H ALA B 5 9.621 2.889 -11.359 1.00 0.00 H new ATOM 0 HA ALA B 5 9.426 2.677 -8.411 1.00 0.00 H new ATOM 0 HB1 ALA B 5 10.868 4.662 -8.276 1.00 0.00 H new ATOM 0 HB2 ALA B 5 11.716 3.284 -9.016 1.00 0.00 H new ATOM 0 HB3 ALA B 5 11.108 4.608 -10.038 1.00 0.00 H new ATOM 1230 N ILE B 6 7.432 4.140 -8.602 1.00 0.00 N ATOM 1231 CA ILE B 6 6.248 4.981 -8.706 1.00 0.00 C ATOM 1232 C ILE B 6 6.308 6.132 -7.709 1.00 0.00 C ATOM 1233 O ILE B 6 6.427 5.919 -6.503 1.00 0.00 O ATOM 1234 CB ILE B 6 4.949 4.177 -8.473 1.00 0.00 C ATOM 1235 CG1 ILE B 6 4.865 2.991 -9.439 1.00 0.00 C ATOM 1236 CG2 ILE B 6 3.732 5.076 -8.639 1.00 0.00 C ATOM 1237 CD1 ILE B 6 4.783 3.392 -10.897 1.00 0.00 C ATOM 0 H ILE B 6 7.408 3.464 -7.839 1.00 0.00 H new ATOM 0 HA ILE B 6 6.234 5.378 -9.721 1.00 0.00 H new ATOM 0 HB ILE B 6 4.965 3.792 -7.454 1.00 0.00 H new ATOM 0 HG12 ILE B 6 5.739 2.356 -9.296 1.00 0.00 H new ATOM 0 HG13 ILE B 6 3.990 2.391 -9.187 1.00 0.00 H new ATOM 0 HG21 ILE B 6 2.825 4.495 -8.472 1.00 0.00 H new ATOM 0 HG22 ILE B 6 3.780 5.890 -7.916 1.00 0.00 H new ATOM 0 HG23 ILE B 6 3.718 5.487 -9.648 1.00 0.00 H new ATOM 0 HD11 ILE B 6 4.726 2.498 -11.518 1.00 0.00 H new ATOM 0 HD12 ILE B 6 3.894 4.002 -11.057 1.00 0.00 H new ATOM 0 HD13 ILE B 6 5.670 3.965 -11.167 1.00 0.00 H new ATOM 1249 N PHE B 7 6.230 7.348 -8.218 1.00 0.00 N ATOM 1250 CA PHE B 7 6.238 8.529 -7.373 1.00 0.00 C ATOM 1251 C PHE B 7 4.815 9.026 -7.170 1.00 0.00 C ATOM 1252 O PHE B 7 4.111 9.322 -8.136 1.00 0.00 O ATOM 1253 CB PHE B 7 7.101 9.632 -7.997 1.00 0.00 C ATOM 1254 CG PHE B 7 7.180 10.882 -7.163 1.00 0.00 C ATOM 1255 CD1 PHE B 7 8.027 10.947 -6.068 1.00 0.00 C ATOM 1256 CD2 PHE B 7 6.407 11.991 -7.474 1.00 0.00 C ATOM 1257 CE1 PHE B 7 8.101 12.092 -5.299 1.00 0.00 C ATOM 1258 CE2 PHE B 7 6.478 13.138 -6.708 1.00 0.00 C ATOM 1259 CZ PHE B 7 7.325 13.189 -5.619 1.00 0.00 C ATOM 0 H PHE B 7 6.160 7.544 -9.216 1.00 0.00 H new ATOM 0 HA PHE B 7 6.666 8.266 -6.406 1.00 0.00 H new ATOM 0 HB2 PHE B 7 8.108 9.247 -8.155 1.00 0.00 H new ATOM 0 HB3 PHE B 7 6.699 9.885 -8.978 1.00 0.00 H new ATOM 0 HD1 PHE B 7 8.636 10.092 -5.813 1.00 0.00 H new ATOM 0 HD2 PHE B 7 5.742 11.957 -8.325 1.00 0.00 H new ATOM 0 HE1 PHE B 7 8.765 12.130 -4.448 1.00 0.00 H new ATOM 0 HE2 PHE B 7 5.871 13.995 -6.961 1.00 0.00 H new ATOM 0 HZ PHE B 7 7.381 14.085 -5.018 1.00 0.00 H new ATOM 1269 N TYR B 8 4.394 9.111 -5.922 1.00 0.00 N ATOM 1270 CA TYR B 8 3.050 9.567 -5.608 1.00 0.00 C ATOM 1271 C TYR B 8 3.077 10.979 -5.051 1.00 0.00 C ATOM 1272 O TYR B 8 3.878 11.296 -4.168 1.00 0.00 O ATOM 1273 CB TYR B 8 2.377 8.628 -4.605 1.00 0.00 C ATOM 1274 CG TYR B 8 1.978 7.292 -5.186 1.00 0.00 C ATOM 1275 CD1 TYR B 8 0.827 7.167 -5.952 1.00 0.00 C ATOM 1276 CD2 TYR B 8 2.743 6.156 -4.963 1.00 0.00 C ATOM 1277 CE1 TYR B 8 0.447 5.948 -6.476 1.00 0.00 C ATOM 1278 CE2 TYR B 8 2.372 4.933 -5.486 1.00 0.00 C ATOM 1279 CZ TYR B 8 1.223 4.835 -6.242 1.00 0.00 C ATOM 1280 OH TYR B 8 0.849 3.619 -6.765 1.00 0.00 O ATOM 0 H TYR B 8 4.961 8.871 -5.109 1.00 0.00 H new ATOM 0 HA TYR B 8 2.474 9.564 -6.533 1.00 0.00 H new ATOM 0 HB2 TYR B 8 3.055 8.461 -3.768 1.00 0.00 H new ATOM 0 HB3 TYR B 8 1.490 9.118 -4.203 1.00 0.00 H new ATOM 0 HD1 TYR B 8 0.218 8.039 -6.141 1.00 0.00 H new ATOM 0 HD2 TYR B 8 3.643 6.230 -4.371 1.00 0.00 H new ATOM 0 HE1 TYR B 8 -0.454 5.868 -7.066 1.00 0.00 H new ATOM 0 HE2 TYR B 8 2.978 4.058 -5.304 1.00 0.00 H new ATOM 0 HH TYR B 8 1.504 2.937 -6.508 1.00 0.00 H new ATOM 1290 N HIS B 9 2.206 11.828 -5.574 1.00 0.00 N ATOM 1291 CA HIS B 9 2.080 13.189 -5.080 1.00 0.00 C ATOM 1292 C HIS B 9 0.619 13.622 -5.132 1.00 0.00 C ATOM 1293 O HIS B 9 -0.234 12.871 -5.607 1.00 0.00 O ATOM 1294 CB HIS B 9 2.968 14.150 -5.887 1.00 0.00 C ATOM 1295 CG HIS B 9 2.370 14.639 -7.175 1.00 0.00 C ATOM 1296 ND1 HIS B 9 1.852 15.908 -7.274 1.00 0.00 N ATOM 1297 CD2 HIS B 9 2.245 14.015 -8.370 1.00 0.00 C ATOM 1298 CE1 HIS B 9 1.432 16.031 -8.518 1.00 0.00 C ATOM 1299 NE2 HIS B 9 1.646 14.911 -9.221 1.00 0.00 N ATOM 0 H HIS B 9 1.575 11.597 -6.342 1.00 0.00 H new ATOM 0 HA HIS B 9 2.419 13.221 -4.044 1.00 0.00 H new ATOM 0 HB2 HIS B 9 3.204 15.012 -5.263 1.00 0.00 H new ATOM 0 HB3 HIS B 9 3.911 13.650 -6.109 1.00 0.00 H new ATOM 0 HD2 HIS B 9 2.556 13.008 -8.608 1.00 0.00 H new ATOM 0 HE1 HIS B 9 0.973 16.922 -8.919 1.00 0.00 H new ATOM 0 HE2 HIS B 9 1.409 14.754 -10.201 1.00 0.00 H new ATOM 1307 N ALA B 10 0.330 14.822 -4.648 1.00 0.00 N ATOM 1308 CA ALA B 10 -1.038 15.320 -4.635 1.00 0.00 C ATOM 1309 C ALA B 10 -1.082 16.840 -4.546 1.00 0.00 C ATOM 1310 O ALA B 10 -2.123 17.416 -4.235 1.00 0.00 O ATOM 1311 CB ALA B 10 -1.810 14.706 -3.473 1.00 0.00 C ATOM 0 H ALA B 10 1.020 15.466 -4.261 1.00 0.00 H new ATOM 0 HA ALA B 10 -1.506 15.027 -5.575 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -2.832 15.086 -3.474 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -1.826 13.621 -3.580 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -1.325 14.971 -2.534 1.00 0.00 H new ATOM 1317 N GLY B 11 0.035 17.497 -4.836 1.00 0.00 N ATOM 1318 CA GLY B 11 0.073 18.934 -4.719 1.00 0.00 C ATOM 1319 C GLY B 11 0.956 19.567 -5.763 1.00 0.00 C ATOM 1320 O GLY B 11 0.625 19.569 -6.949 1.00 0.00 O ATOM 0 H GLY B 11 0.904 17.062 -5.146 1.00 0.00 H new ATOM 0 HA2 GLY B 11 -0.938 19.331 -4.811 1.00 0.00 H new ATOM 0 HA3 GLY B 11 0.433 19.207 -3.727 1.00 0.00 H new ATOM 1324 N CYS B 12 2.098 20.068 -5.321 1.00 0.00 N ATOM 1325 CA CYS B 12 3.008 20.804 -6.190 1.00 0.00 C ATOM 1326 C CYS B 12 4.306 21.196 -5.460 1.00 0.00 C ATOM 1327 O CYS B 12 5.385 20.825 -5.911 1.00 0.00 O ATOM 1328 CB CYS B 12 2.316 22.048 -6.769 1.00 0.00 C ATOM 1329 SG CYS B 12 3.332 23.010 -7.915 1.00 0.00 S ATOM 0 H CYS B 12 2.421 19.978 -4.358 1.00 0.00 H new ATOM 0 HA CYS B 12 3.282 20.142 -7.011 1.00 0.00 H new ATOM 0 HB2 CYS B 12 1.408 21.736 -7.284 1.00 0.00 H new ATOM 0 HB3 CYS B 12 2.010 22.694 -5.946 1.00 0.00 H new ATOM 0 HG CYS B 12 2.653 24.032 -8.344 1.00 0.00 H new ATOM 1335 N PRO B 13 4.236 21.914 -4.306 1.00 0.00 N ATOM 1336 CA PRO B 13 5.432 22.473 -3.646 1.00 0.00 C ATOM 1337 C PRO B 13 6.554 21.452 -3.445 1.00 0.00 C ATOM 1338 O PRO B 13 7.631 21.572 -4.031 1.00 0.00 O ATOM 1339 CB PRO B 13 4.906 22.953 -2.292 1.00 0.00 C ATOM 1340 CG PRO B 13 3.468 23.239 -2.530 1.00 0.00 C ATOM 1341 CD PRO B 13 3.006 22.230 -3.543 1.00 0.00 C ATOM 0 HA PRO B 13 5.882 23.257 -4.255 1.00 0.00 H new ATOM 0 HB2 PRO B 13 5.037 22.192 -1.523 1.00 0.00 H new ATOM 0 HB3 PRO B 13 5.437 23.843 -1.953 1.00 0.00 H new ATOM 0 HG2 PRO B 13 2.896 23.154 -1.606 1.00 0.00 H new ATOM 0 HG3 PRO B 13 3.328 24.255 -2.900 1.00 0.00 H new ATOM 0 HD2 PRO B 13 2.592 21.342 -3.065 1.00 0.00 H new ATOM 0 HD3 PRO B 13 2.227 22.637 -4.188 1.00 0.00 H new ATOM 1349 N VAL B 14 6.297 20.443 -2.622 1.00 0.00 N ATOM 1350 CA VAL B 14 7.296 19.416 -2.341 1.00 0.00 C ATOM 1351 C VAL B 14 7.380 18.426 -3.502 1.00 0.00 C ATOM 1352 O VAL B 14 8.417 17.802 -3.737 1.00 0.00 O ATOM 1353 CB VAL B 14 6.962 18.657 -1.035 1.00 0.00 C ATOM 1354 CG1 VAL B 14 8.066 17.673 -0.674 1.00 0.00 C ATOM 1355 CG2 VAL B 14 6.727 19.636 0.106 1.00 0.00 C ATOM 0 H VAL B 14 5.409 20.313 -2.138 1.00 0.00 H new ATOM 0 HA VAL B 14 8.259 19.912 -2.218 1.00 0.00 H new ATOM 0 HB VAL B 14 6.046 18.089 -1.201 1.00 0.00 H new ATOM 0 HG11 VAL B 14 7.804 17.154 0.248 1.00 0.00 H new ATOM 0 HG12 VAL B 14 8.183 16.947 -1.478 1.00 0.00 H new ATOM 0 HG13 VAL B 14 9.003 18.213 -0.533 1.00 0.00 H new ATOM 0 HG21 VAL B 14 6.493 19.084 1.017 1.00 0.00 H new ATOM 0 HG22 VAL B 14 7.625 20.233 0.264 1.00 0.00 H new ATOM 0 HG23 VAL B 14 5.894 20.293 -0.144 1.00 0.00 H new ATOM 1365 N CYS B 15 6.290 18.328 -4.247 1.00 0.00 N ATOM 1366 CA CYS B 15 6.172 17.362 -5.330 1.00 0.00 C ATOM 1367 C CYS B 15 7.135 17.689 -6.468 1.00 0.00 C ATOM 1368 O CYS B 15 7.845 16.812 -6.962 1.00 0.00 O ATOM 1369 CB CYS B 15 4.729 17.346 -5.827 1.00 0.00 C ATOM 1370 SG CYS B 15 3.520 17.202 -4.489 1.00 0.00 S ATOM 0 H CYS B 15 5.464 18.913 -4.119 1.00 0.00 H new ATOM 0 HA CYS B 15 6.438 16.373 -4.957 1.00 0.00 H new ATOM 0 HB2 CYS B 15 4.534 18.260 -6.388 1.00 0.00 H new ATOM 0 HB3 CYS B 15 4.598 16.513 -6.518 1.00 0.00 H new ATOM 0 HG CYS B 15 3.501 18.305 -3.801 1.00 0.00 H new ATOM 1376 N VAL B 16 7.174 18.957 -6.863 1.00 0.00 N ATOM 1377 CA VAL B 16 8.055 19.398 -7.938 1.00 0.00 C ATOM 1378 C VAL B 16 9.512 19.402 -7.474 1.00 0.00 C ATOM 1379 O VAL B 16 10.427 19.161 -8.262 1.00 0.00 O ATOM 1380 CB VAL B 16 7.659 20.804 -8.447 1.00 0.00 C ATOM 1381 CG1 VAL B 16 8.573 21.258 -9.577 1.00 0.00 C ATOM 1382 CG2 VAL B 16 6.208 20.812 -8.904 1.00 0.00 C ATOM 0 H VAL B 16 6.605 19.698 -6.454 1.00 0.00 H new ATOM 0 HA VAL B 16 7.948 18.693 -8.762 1.00 0.00 H new ATOM 0 HB VAL B 16 7.772 21.506 -7.620 1.00 0.00 H new ATOM 0 HG11 VAL B 16 8.270 22.249 -9.914 1.00 0.00 H new ATOM 0 HG12 VAL B 16 9.602 21.295 -9.220 1.00 0.00 H new ATOM 0 HG13 VAL B 16 8.502 20.555 -10.407 1.00 0.00 H new ATOM 0 HG21 VAL B 16 5.944 21.808 -9.259 1.00 0.00 H new ATOM 0 HG22 VAL B 16 6.077 20.092 -9.712 1.00 0.00 H new ATOM 0 HG23 VAL B 16 5.562 20.542 -8.069 1.00 0.00 H new ATOM 1392 N SER B 17 9.720 19.654 -6.185 1.00 0.00 N ATOM 1393 CA SER B 17 11.059 19.643 -5.613 1.00 0.00 C ATOM 1394 C SER B 17 11.677 18.252 -5.761 1.00 0.00 C ATOM 1395 O SER B 17 12.771 18.096 -6.308 1.00 0.00 O ATOM 1396 CB SER B 17 11.013 20.051 -4.136 1.00 0.00 C ATOM 1397 OG SER B 17 12.317 20.189 -3.595 1.00 0.00 O ATOM 0 H SER B 17 8.978 19.868 -5.519 1.00 0.00 H new ATOM 0 HA SER B 17 11.677 20.363 -6.150 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.474 20.993 -4.034 1.00 0.00 H new ATOM 0 HB3 SER B 17 10.459 19.304 -3.568 1.00 0.00 H new ATOM 0 HG SER B 17 12.254 20.451 -2.653 1.00 0.00 H new ATOM 1403 N ALA B 18 10.947 17.238 -5.309 1.00 0.00 N ATOM 1404 CA ALA B 18 11.417 15.862 -5.388 1.00 0.00 C ATOM 1405 C ALA B 18 11.550 15.411 -6.840 1.00 0.00 C ATOM 1406 O ALA B 18 12.395 14.580 -7.168 1.00 0.00 O ATOM 1407 CB ALA B 18 10.478 14.937 -4.629 1.00 0.00 C ATOM 0 H ALA B 18 10.026 17.345 -4.884 1.00 0.00 H new ATOM 0 HA ALA B 18 12.404 15.814 -4.927 1.00 0.00 H new ATOM 0 HB1 ALA B 18 10.843 13.912 -4.697 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.438 15.239 -3.582 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.480 14.996 -5.063 1.00 0.00 H new ATOM 1413 N GLU B 19 10.719 15.976 -7.707 1.00 0.00 N ATOM 1414 CA GLU B 19 10.734 15.635 -9.124 1.00 0.00 C ATOM 1415 C GLU B 19 12.022 16.111 -9.796 1.00 0.00 C ATOM 1416 O GLU B 19 12.604 15.402 -10.615 1.00 0.00 O ATOM 1417 CB GLU B 19 9.531 16.261 -9.832 1.00 0.00 C ATOM 1418 CG GLU B 19 9.418 15.877 -11.298 1.00 0.00 C ATOM 1419 CD GLU B 19 8.436 16.746 -12.052 1.00 0.00 C ATOM 1420 OE1 GLU B 19 7.216 16.566 -11.873 1.00 0.00 O ATOM 1421 OE2 GLU B 19 8.881 17.622 -12.823 1.00 0.00 O ATOM 0 H GLU B 19 10.023 16.676 -7.452 1.00 0.00 H new ATOM 0 HA GLU B 19 10.682 14.549 -9.203 1.00 0.00 H new ATOM 0 HB2 GLU B 19 8.620 15.960 -9.315 1.00 0.00 H new ATOM 0 HB3 GLU B 19 9.599 17.346 -9.754 1.00 0.00 H new ATOM 0 HG2 GLU B 19 10.399 15.953 -11.767 1.00 0.00 H new ATOM 0 HG3 GLU B 19 9.108 14.835 -11.374 1.00 0.00 H new ATOM 1428 N GLN B 20 12.464 17.312 -9.448 1.00 0.00 N ATOM 1429 CA GLN B 20 13.609 17.919 -10.120 1.00 0.00 C ATOM 1430 C GLN B 20 14.906 17.694 -9.350 1.00 0.00 C ATOM 1431 O GLN B 20 15.979 18.101 -9.796 1.00 0.00 O ATOM 1432 CB GLN B 20 13.366 19.412 -10.324 1.00 0.00 C ATOM 1433 CG GLN B 20 12.139 19.708 -11.173 1.00 0.00 C ATOM 1434 CD GLN B 20 11.919 21.189 -11.397 1.00 0.00 C ATOM 1435 OE1 GLN B 20 12.282 22.019 -10.562 1.00 0.00 O ATOM 1436 NE2 GLN B 20 11.314 21.531 -12.522 1.00 0.00 N ATOM 0 H GLN B 20 12.052 17.883 -8.710 1.00 0.00 H new ATOM 0 HA GLN B 20 13.718 17.435 -11.091 1.00 0.00 H new ATOM 0 HB2 GLN B 20 13.252 19.891 -9.352 1.00 0.00 H new ATOM 0 HB3 GLN B 20 14.243 19.855 -10.797 1.00 0.00 H new ATOM 0 HG2 GLN B 20 12.243 19.212 -12.138 1.00 0.00 H new ATOM 0 HG3 GLN B 20 11.259 19.284 -10.690 1.00 0.00 H new ATOM 0 HE21 GLN B 20 11.030 20.812 -13.187 1.00 0.00 H new ATOM 0 HE22 GLN B 20 11.132 22.514 -12.725 1.00 0.00 H new ATOM 1445 N ALA B 21 14.812 17.056 -8.193 1.00 0.00 N ATOM 1446 CA ALA B 21 16.000 16.743 -7.413 1.00 0.00 C ATOM 1447 C ALA B 21 16.171 15.236 -7.244 1.00 0.00 C ATOM 1448 O ALA B 21 17.151 14.661 -7.712 1.00 0.00 O ATOM 1449 CB ALA B 21 15.950 17.433 -6.061 1.00 0.00 C ATOM 0 H ALA B 21 13.934 16.747 -7.776 1.00 0.00 H new ATOM 0 HA ALA B 21 16.866 17.117 -7.959 1.00 0.00 H new ATOM 0 HB1 ALA B 21 16.847 17.186 -5.493 1.00 0.00 H new ATOM 0 HB2 ALA B 21 15.897 18.512 -6.205 1.00 0.00 H new ATOM 0 HB3 ALA B 21 15.070 17.096 -5.513 1.00 0.00 H new ATOM 1455 N VAL B 22 15.204 14.595 -6.597 1.00 0.00 N ATOM 1456 CA VAL B 22 15.288 13.163 -6.323 1.00 0.00 C ATOM 1457 C VAL B 22 15.143 12.349 -7.606 1.00 0.00 C ATOM 1458 O VAL B 22 15.969 11.485 -7.899 1.00 0.00 O ATOM 1459 CB VAL B 22 14.215 12.711 -5.310 1.00 0.00 C ATOM 1460 CG1 VAL B 22 14.353 11.225 -5.005 1.00 0.00 C ATOM 1461 CG2 VAL B 22 14.305 13.532 -4.034 1.00 0.00 C ATOM 0 H VAL B 22 14.354 15.042 -6.253 1.00 0.00 H new ATOM 0 HA VAL B 22 16.273 12.984 -5.891 1.00 0.00 H new ATOM 0 HB VAL B 22 13.234 12.876 -5.755 1.00 0.00 H new ATOM 0 HG11 VAL B 22 13.587 10.928 -4.289 1.00 0.00 H new ATOM 0 HG12 VAL B 22 14.232 10.652 -5.924 1.00 0.00 H new ATOM 0 HG13 VAL B 22 15.339 11.030 -4.583 1.00 0.00 H new ATOM 0 HG21 VAL B 22 13.541 13.199 -3.332 1.00 0.00 H new ATOM 0 HG22 VAL B 22 15.290 13.402 -3.586 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.149 14.585 -4.267 1.00 0.00 H new ATOM 1471 N ALA B 23 14.103 12.648 -8.379 1.00 0.00 N ATOM 1472 CA ALA B 23 13.849 11.935 -9.629 1.00 0.00 C ATOM 1473 C ALA B 23 14.855 12.337 -10.703 1.00 0.00 C ATOM 1474 O ALA B 23 14.882 11.768 -11.791 1.00 0.00 O ATOM 1475 CB ALA B 23 12.426 12.189 -10.104 1.00 0.00 C ATOM 0 H ALA B 23 13.423 13.377 -8.163 1.00 0.00 H new ATOM 0 HA ALA B 23 13.967 10.868 -9.442 1.00 0.00 H new ATOM 0 HB1 ALA B 23 12.252 11.651 -11.036 1.00 0.00 H new ATOM 0 HB2 ALA B 23 11.722 11.841 -9.348 1.00 0.00 H new ATOM 0 HB3 ALA B 23 12.283 13.257 -10.269 1.00 0.00 H new ATOM 1481 N ASN B 24 15.673 13.331 -10.388 1.00 0.00 N ATOM 1482 CA ASN B 24 16.735 13.764 -11.284 1.00 0.00 C ATOM 1483 C ASN B 24 18.040 13.073 -10.904 1.00 0.00 C ATOM 1484 O ASN B 24 18.917 12.856 -11.741 1.00 0.00 O ATOM 1485 CB ASN B 24 16.898 15.284 -11.211 1.00 0.00 C ATOM 1486 CG ASN B 24 17.823 15.829 -12.282 1.00 0.00 C ATOM 1487 OD1 ASN B 24 19.039 15.916 -12.093 1.00 0.00 O ATOM 1488 ND2 ASN B 24 17.254 16.222 -13.409 1.00 0.00 N ATOM 0 H ASN B 24 15.621 13.855 -9.514 1.00 0.00 H new ATOM 0 HA ASN B 24 16.474 13.492 -12.307 1.00 0.00 H new ATOM 0 HB2 ASN B 24 15.920 15.755 -11.309 1.00 0.00 H new ATOM 0 HB3 ASN B 24 17.286 15.556 -10.230 1.00 0.00 H new ATOM 0 HD21 ASN B 24 17.824 16.613 -14.159 1.00 0.00 H new ATOM 0 HD22 ASN B 24 16.245 16.134 -13.528 1.00 0.00 H new ATOM 1495 N ALA B 25 18.155 12.725 -9.625 1.00 0.00 N ATOM 1496 CA ALA B 25 19.329 12.031 -9.117 1.00 0.00 C ATOM 1497 C ALA B 25 19.265 10.550 -9.461 1.00 0.00 C ATOM 1498 O ALA B 25 20.281 9.927 -9.773 1.00 0.00 O ATOM 1499 CB ALA B 25 19.451 12.229 -7.614 1.00 0.00 C ATOM 0 H ALA B 25 17.443 12.915 -8.920 1.00 0.00 H new ATOM 0 HA ALA B 25 20.214 12.453 -9.593 1.00 0.00 H new ATOM 0 HB1 ALA B 25 20.334 11.704 -7.248 1.00 0.00 H new ATOM 0 HB2 ALA B 25 19.544 13.292 -7.393 1.00 0.00 H new ATOM 0 HB3 ALA B 25 18.563 11.832 -7.122 1.00 0.00 H new ATOM 1505 N ILE B 26 18.067 9.989 -9.399 1.00 0.00 N ATOM 1506 CA ILE B 26 17.852 8.610 -9.808 1.00 0.00 C ATOM 1507 C ILE B 26 17.639 8.561 -11.315 1.00 0.00 C ATOM 1508 O ILE B 26 16.733 9.206 -11.838 1.00 0.00 O ATOM 1509 CB ILE B 26 16.635 7.984 -9.090 1.00 0.00 C ATOM 1510 CG1 ILE B 26 16.810 8.086 -7.571 1.00 0.00 C ATOM 1511 CG2 ILE B 26 16.459 6.531 -9.514 1.00 0.00 C ATOM 1512 CD1 ILE B 26 15.632 7.557 -6.782 1.00 0.00 C ATOM 0 H ILE B 26 17.229 10.468 -9.069 1.00 0.00 H new ATOM 0 HA ILE B 26 18.734 8.032 -9.532 1.00 0.00 H new ATOM 0 HB ILE B 26 15.738 8.534 -9.374 1.00 0.00 H new ATOM 0 HG12 ILE B 26 17.706 7.537 -7.280 1.00 0.00 H new ATOM 0 HG13 ILE B 26 16.975 9.130 -7.303 1.00 0.00 H new ATOM 0 HG21 ILE B 26 15.598 6.104 -9.000 1.00 0.00 H new ATOM 0 HG22 ILE B 26 16.299 6.483 -10.591 1.00 0.00 H new ATOM 0 HG23 ILE B 26 17.354 5.965 -9.255 1.00 0.00 H new ATOM 0 HD11 ILE B 26 15.831 7.664 -5.716 1.00 0.00 H new ATOM 0 HD12 ILE B 26 14.737 8.122 -7.042 1.00 0.00 H new ATOM 0 HD13 ILE B 26 15.479 6.504 -7.019 1.00 0.00 H new ATOM 1524 N ASP B 27 18.483 7.812 -12.011 1.00 0.00 N ATOM 1525 CA ASP B 27 18.445 7.785 -13.467 1.00 0.00 C ATOM 1526 C ASP B 27 17.230 7.000 -13.964 1.00 0.00 C ATOM 1527 O ASP B 27 17.043 5.839 -13.597 1.00 0.00 O ATOM 1528 CB ASP B 27 19.731 7.176 -14.022 1.00 0.00 C ATOM 1529 CG ASP B 27 19.999 7.622 -15.443 1.00 0.00 C ATOM 1530 OD1 ASP B 27 19.514 6.962 -16.385 1.00 0.00 O ATOM 1531 OD2 ASP B 27 20.692 8.648 -15.620 1.00 0.00 O ATOM 0 H ASP B 27 19.199 7.218 -11.594 1.00 0.00 H new ATOM 0 HA ASP B 27 18.360 8.811 -13.824 1.00 0.00 H new ATOM 0 HB2 ASP B 27 20.571 7.460 -13.388 1.00 0.00 H new ATOM 0 HB3 ASP B 27 19.661 6.089 -13.990 1.00 0.00 H new ATOM 1536 N PRO B 28 16.392 7.629 -14.809 1.00 0.00 N ATOM 1537 CA PRO B 28 15.142 7.029 -15.304 1.00 0.00 C ATOM 1538 C PRO B 28 15.360 5.754 -16.118 1.00 0.00 C ATOM 1539 O PRO B 28 14.459 4.922 -16.235 1.00 0.00 O ATOM 1540 CB PRO B 28 14.538 8.122 -16.193 1.00 0.00 C ATOM 1541 CG PRO B 28 15.202 9.383 -15.764 1.00 0.00 C ATOM 1542 CD PRO B 28 16.585 8.991 -15.335 1.00 0.00 C ATOM 0 HA PRO B 28 14.504 6.723 -14.475 1.00 0.00 H new ATOM 0 HB2 PRO B 28 14.723 7.919 -17.248 1.00 0.00 H new ATOM 0 HB3 PRO B 28 13.457 8.182 -16.064 1.00 0.00 H new ATOM 0 HG2 PRO B 28 15.236 10.105 -16.580 1.00 0.00 H new ATOM 0 HG3 PRO B 28 14.657 9.853 -14.945 1.00 0.00 H new ATOM 0 HD2 PRO B 28 17.286 9.006 -16.169 1.00 0.00 H new ATOM 0 HD3 PRO B 28 16.979 9.666 -14.575 1.00 0.00 H new ATOM 1550 N SER B 29 16.551 5.596 -16.680 1.00 0.00 N ATOM 1551 CA SER B 29 16.858 4.416 -17.470 1.00 0.00 C ATOM 1552 C SER B 29 17.341 3.285 -16.563 1.00 0.00 C ATOM 1553 O SER B 29 17.467 2.136 -16.993 1.00 0.00 O ATOM 1554 CB SER B 29 17.908 4.743 -18.534 1.00 0.00 C ATOM 1555 OG SER B 29 18.095 3.655 -19.425 1.00 0.00 O ATOM 0 H SER B 29 17.315 6.267 -16.603 1.00 0.00 H new ATOM 0 HA SER B 29 15.951 4.088 -17.977 1.00 0.00 H new ATOM 0 HB2 SER B 29 17.599 5.625 -19.094 1.00 0.00 H new ATOM 0 HB3 SER B 29 18.854 4.987 -18.051 1.00 0.00 H new ATOM 0 HG SER B 29 18.006 2.811 -18.934 1.00 0.00 H new ATOM 1561 N LYS B 30 17.610 3.622 -15.309 1.00 0.00 N ATOM 1562 CA LYS B 30 18.000 2.641 -14.309 1.00 0.00 C ATOM 1563 C LYS B 30 16.768 2.212 -13.520 1.00 0.00 C ATOM 1564 O LYS B 30 16.535 1.024 -13.291 1.00 0.00 O ATOM 1565 CB LYS B 30 19.052 3.242 -13.373 1.00 0.00 C ATOM 1566 CG LYS B 30 19.571 2.287 -12.310 1.00 0.00 C ATOM 1567 CD LYS B 30 20.586 2.975 -11.414 1.00 0.00 C ATOM 1568 CE LYS B 30 21.171 2.028 -10.381 1.00 0.00 C ATOM 1569 NZ LYS B 30 22.228 2.689 -9.570 1.00 0.00 N ATOM 0 H LYS B 30 17.564 4.579 -14.959 1.00 0.00 H new ATOM 0 HA LYS B 30 18.432 1.768 -14.799 1.00 0.00 H new ATOM 0 HB2 LYS B 30 19.894 3.592 -13.971 1.00 0.00 H new ATOM 0 HB3 LYS B 30 18.625 4.116 -12.881 1.00 0.00 H new ATOM 0 HG2 LYS B 30 18.740 1.919 -11.709 1.00 0.00 H new ATOM 0 HG3 LYS B 30 20.029 1.420 -12.786 1.00 0.00 H new ATOM 0 HD2 LYS B 30 21.390 3.385 -12.026 1.00 0.00 H new ATOM 0 HD3 LYS B 30 20.111 3.815 -10.907 1.00 0.00 H new ATOM 0 HE2 LYS B 30 20.378 1.670 -9.724 1.00 0.00 H new ATOM 0 HE3 LYS B 30 21.589 1.155 -10.882 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 22.605 2.014 -8.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 22.996 3.009 -10.194 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 21.823 3.508 -9.073 1.00 0.00 H new ATOM 1583 N TYR B 31 15.988 3.201 -13.110 1.00 0.00 N ATOM 1584 CA TYR B 31 14.713 2.964 -12.456 1.00 0.00 C ATOM 1585 C TYR B 31 13.625 3.755 -13.161 1.00 0.00 C ATOM 1586 O TYR B 31 13.703 4.980 -13.261 1.00 0.00 O ATOM 1587 CB TYR B 31 14.774 3.344 -10.973 1.00 0.00 C ATOM 1588 CG TYR B 31 15.396 2.276 -10.101 1.00 0.00 C ATOM 1589 CD1 TYR B 31 16.772 2.203 -9.917 1.00 0.00 C ATOM 1590 CD2 TYR B 31 14.599 1.330 -9.469 1.00 0.00 C ATOM 1591 CE1 TYR B 31 17.334 1.218 -9.126 1.00 0.00 C ATOM 1592 CE2 TYR B 31 15.153 0.341 -8.680 1.00 0.00 C ATOM 1593 CZ TYR B 31 16.519 0.288 -8.513 1.00 0.00 C ATOM 1594 OH TYR B 31 17.073 -0.702 -7.733 1.00 0.00 O ATOM 0 H TYR B 31 16.222 4.188 -13.222 1.00 0.00 H new ATOM 0 HA TYR B 31 14.483 1.900 -12.517 1.00 0.00 H new ATOM 0 HB2 TYR B 31 15.344 4.267 -10.866 1.00 0.00 H new ATOM 0 HB3 TYR B 31 13.765 3.550 -10.617 1.00 0.00 H new ATOM 0 HD1 TYR B 31 17.412 2.927 -10.399 1.00 0.00 H new ATOM 0 HD2 TYR B 31 13.527 1.369 -9.597 1.00 0.00 H new ATOM 0 HE1 TYR B 31 18.404 1.177 -8.989 1.00 0.00 H new ATOM 0 HE2 TYR B 31 14.518 -0.387 -8.197 1.00 0.00 H new ATOM 0 HH TYR B 31 16.361 -1.273 -7.374 1.00 0.00 H new ATOM 1604 N THR B 32 12.623 3.051 -13.658 1.00 0.00 N ATOM 1605 CA THR B 32 11.551 3.678 -14.409 1.00 0.00 C ATOM 1606 C THR B 32 10.599 4.410 -13.469 1.00 0.00 C ATOM 1607 O THR B 32 9.705 3.806 -12.875 1.00 0.00 O ATOM 1608 CB THR B 32 10.775 2.637 -15.236 1.00 0.00 C ATOM 1609 OG1 THR B 32 11.699 1.824 -15.973 1.00 0.00 O ATOM 1610 CG2 THR B 32 9.814 3.315 -16.203 1.00 0.00 C ATOM 0 H THR B 32 12.530 2.041 -13.554 1.00 0.00 H new ATOM 0 HA THR B 32 11.998 4.399 -15.094 1.00 0.00 H new ATOM 0 HB THR B 32 10.197 2.016 -14.552 1.00 0.00 H new ATOM 0 HG1 THR B 32 11.204 1.160 -16.498 1.00 0.00 H new ATOM 0 HG21 THR B 32 9.278 2.557 -16.775 1.00 0.00 H new ATOM 0 HG22 THR B 32 9.100 3.919 -15.643 1.00 0.00 H new ATOM 0 HG23 THR B 32 10.375 3.955 -16.884 1.00 0.00 H new ATOM 1618 N VAL B 33 10.821 5.707 -13.320 1.00 0.00 N ATOM 1619 CA VAL B 33 10.014 6.527 -12.432 1.00 0.00 C ATOM 1620 C VAL B 33 8.730 6.972 -13.122 1.00 0.00 C ATOM 1621 O VAL B 33 8.767 7.652 -14.149 1.00 0.00 O ATOM 1622 CB VAL B 33 10.792 7.770 -11.943 1.00 0.00 C ATOM 1623 CG1 VAL B 33 9.945 8.596 -10.986 1.00 0.00 C ATOM 1624 CG2 VAL B 33 12.100 7.359 -11.283 1.00 0.00 C ATOM 0 H VAL B 33 11.559 6.216 -13.807 1.00 0.00 H new ATOM 0 HA VAL B 33 9.764 5.912 -11.568 1.00 0.00 H new ATOM 0 HB VAL B 33 11.025 8.388 -12.810 1.00 0.00 H new ATOM 0 HG11 VAL B 33 10.513 9.465 -10.655 1.00 0.00 H new ATOM 0 HG12 VAL B 33 9.039 8.926 -11.494 1.00 0.00 H new ATOM 0 HG13 VAL B 33 9.675 7.989 -10.122 1.00 0.00 H new ATOM 0 HG21 VAL B 33 12.633 8.248 -10.946 1.00 0.00 H new ATOM 0 HG22 VAL B 33 11.890 6.716 -10.428 1.00 0.00 H new ATOM 0 HG23 VAL B 33 12.716 6.818 -12.001 1.00 0.00 H new ATOM 1634 N GLU B 34 7.602 6.567 -12.562 1.00 0.00 N ATOM 1635 CA GLU B 34 6.304 6.969 -13.072 1.00 0.00 C ATOM 1636 C GLU B 34 5.554 7.736 -11.989 1.00 0.00 C ATOM 1637 O GLU B 34 5.393 7.251 -10.872 1.00 0.00 O ATOM 1638 CB GLU B 34 5.507 5.744 -13.529 1.00 0.00 C ATOM 1639 CG GLU B 34 4.208 6.082 -14.241 1.00 0.00 C ATOM 1640 CD GLU B 34 3.562 4.868 -14.878 1.00 0.00 C ATOM 1641 OE1 GLU B 34 4.130 4.341 -15.858 1.00 0.00 O ATOM 1642 OE2 GLU B 34 2.493 4.432 -14.402 1.00 0.00 O ATOM 0 H GLU B 34 7.561 5.955 -11.747 1.00 0.00 H new ATOM 0 HA GLU B 34 6.438 7.619 -13.937 1.00 0.00 H new ATOM 0 HB2 GLU B 34 6.129 5.146 -14.195 1.00 0.00 H new ATOM 0 HB3 GLU B 34 5.283 5.125 -12.661 1.00 0.00 H new ATOM 0 HG2 GLU B 34 3.513 6.528 -13.530 1.00 0.00 H new ATOM 0 HG3 GLU B 34 4.403 6.831 -15.009 1.00 0.00 H new ATOM 1649 N ILE B 35 5.125 8.944 -12.317 1.00 0.00 N ATOM 1650 CA ILE B 35 4.492 9.819 -11.341 1.00 0.00 C ATOM 1651 C ILE B 35 2.973 9.694 -11.393 1.00 0.00 C ATOM 1652 O ILE B 35 2.365 9.811 -12.459 1.00 0.00 O ATOM 1653 CB ILE B 35 4.903 11.291 -11.569 1.00 0.00 C ATOM 1654 CG1 ILE B 35 6.426 11.435 -11.462 1.00 0.00 C ATOM 1655 CG2 ILE B 35 4.209 12.205 -10.568 1.00 0.00 C ATOM 1656 CD1 ILE B 35 6.932 12.837 -11.733 1.00 0.00 C ATOM 0 H ILE B 35 5.203 9.342 -13.253 1.00 0.00 H new ATOM 0 HA ILE B 35 4.834 9.507 -10.354 1.00 0.00 H new ATOM 0 HB ILE B 35 4.592 11.587 -12.571 1.00 0.00 H new ATOM 0 HG12 ILE B 35 6.740 11.133 -10.463 1.00 0.00 H new ATOM 0 HG13 ILE B 35 6.896 10.748 -12.165 1.00 0.00 H new ATOM 0 HG21 ILE B 35 4.512 13.237 -10.746 1.00 0.00 H new ATOM 0 HG22 ILE B 35 3.129 12.119 -10.685 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.489 11.914 -9.555 1.00 0.00 H new ATOM 0 HD11 ILE B 35 8.018 12.857 -11.638 1.00 0.00 H new ATOM 0 HD12 ILE B 35 6.651 13.137 -12.743 1.00 0.00 H new ATOM 0 HD13 ILE B 35 6.492 13.528 -11.014 1.00 0.00 H new ATOM 1668 N VAL B 36 2.372 9.447 -10.235 1.00 0.00 N ATOM 1669 CA VAL B 36 0.926 9.313 -10.126 1.00 0.00 C ATOM 1670 C VAL B 36 0.363 10.356 -9.164 1.00 0.00 C ATOM 1671 O VAL B 36 0.848 10.512 -8.040 1.00 0.00 O ATOM 1672 CB VAL B 36 0.522 7.898 -9.649 1.00 0.00 C ATOM 1673 CG1 VAL B 36 -0.991 7.777 -9.517 1.00 0.00 C ATOM 1674 CG2 VAL B 36 1.059 6.837 -10.597 1.00 0.00 C ATOM 0 H VAL B 36 2.870 9.335 -9.352 1.00 0.00 H new ATOM 0 HA VAL B 36 0.508 9.473 -11.120 1.00 0.00 H new ATOM 0 HB VAL B 36 0.963 7.738 -8.665 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -1.248 6.773 -9.180 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -1.352 8.506 -8.792 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -1.457 7.966 -10.484 1.00 0.00 H new ATOM 0 HG21 VAL B 36 0.763 5.849 -10.243 1.00 0.00 H new ATOM 0 HG22 VAL B 36 0.652 7.001 -11.595 1.00 0.00 H new ATOM 0 HG23 VAL B 36 2.147 6.899 -10.634 1.00 0.00 H new ATOM 1684 N HIS B 37 -0.650 11.075 -9.622 1.00 0.00 N ATOM 1685 CA HIS B 37 -1.296 12.102 -8.820 1.00 0.00 C ATOM 1686 C HIS B 37 -2.469 11.509 -8.040 1.00 0.00 C ATOM 1687 O HIS B 37 -3.385 10.930 -8.622 1.00 0.00 O ATOM 1688 CB HIS B 37 -1.773 13.236 -9.734 1.00 0.00 C ATOM 1689 CG HIS B 37 -2.379 14.400 -9.016 1.00 0.00 C ATOM 1690 ND1 HIS B 37 -1.810 15.270 -8.151 1.00 0.00 N flip ATOM 1691 CD2 HIS B 37 -3.687 14.757 -9.217 1.00 0.00 C flip ATOM 1692 CE1 HIS B 37 -2.774 16.184 -7.813 1.00 0.00 C flip ATOM 1693 NE2 HIS B 37 -3.885 15.832 -8.478 1.00 0.00 N flip ATOM 0 H HIS B 37 -1.046 10.964 -10.555 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.581 12.501 -8.101 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.927 13.590 -10.324 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -2.506 12.836 -10.435 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -4.407 14.260 -9.850 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -2.661 17.023 -7.143 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -4.772 16.333 -8.420 1.00 0.00 H new ATOM 1701 N LEU B 38 -2.424 11.641 -6.721 1.00 0.00 N ATOM 1702 CA LEU B 38 -3.482 11.124 -5.858 1.00 0.00 C ATOM 1703 C LEU B 38 -4.370 12.252 -5.352 1.00 0.00 C ATOM 1704 O LEU B 38 -5.237 12.043 -4.506 1.00 0.00 O ATOM 1705 CB LEU B 38 -2.881 10.384 -4.659 1.00 0.00 C ATOM 1706 CG LEU B 38 -2.093 9.115 -4.990 1.00 0.00 C ATOM 1707 CD1 LEU B 38 -1.501 8.517 -3.722 1.00 0.00 C ATOM 1708 CD2 LEU B 38 -2.986 8.101 -5.687 1.00 0.00 C ATOM 0 H LEU B 38 -1.664 12.103 -6.222 1.00 0.00 H new ATOM 0 HA LEU B 38 -4.084 10.434 -6.449 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -2.223 11.069 -4.125 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -3.689 10.120 -3.976 1.00 0.00 H new ATOM 0 HG LEU B 38 -1.279 9.378 -5.665 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -0.943 7.615 -3.971 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -0.832 9.241 -3.257 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -2.304 8.267 -3.028 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.409 7.205 -5.915 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -3.819 7.840 -5.034 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -3.371 8.530 -6.612 1.00 0.00 H new ATOM 1720 N GLY B 39 -4.167 13.445 -5.886 1.00 0.00 N ATOM 1721 CA GLY B 39 -4.869 14.608 -5.382 1.00 0.00 C ATOM 1722 C GLY B 39 -6.178 14.867 -6.099 1.00 0.00 C ATOM 1723 O GLY B 39 -6.602 16.014 -6.225 1.00 0.00 O ATOM 0 H GLY B 39 -3.529 13.630 -6.660 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -5.064 14.475 -4.318 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -4.228 15.484 -5.481 1.00 0.00 H new ATOM 1727 N THR B 40 -6.812 13.810 -6.585 1.00 0.00 N ATOM 1728 CA THR B 40 -8.098 13.930 -7.258 1.00 0.00 C ATOM 1729 C THR B 40 -8.877 12.621 -7.172 1.00 0.00 C ATOM 1730 O THR B 40 -9.907 12.551 -6.501 1.00 0.00 O ATOM 1731 CB THR B 40 -7.937 14.340 -8.740 1.00 0.00 C ATOM 1732 OG1 THR B 40 -7.231 15.585 -8.831 1.00 0.00 O ATOM 1733 CG2 THR B 40 -9.294 14.477 -9.419 1.00 0.00 C ATOM 0 H THR B 40 -6.456 12.856 -6.526 1.00 0.00 H new ATOM 0 HA THR B 40 -8.653 14.716 -6.746 1.00 0.00 H new ATOM 0 HB THR B 40 -7.370 13.559 -9.247 1.00 0.00 H new ATOM 0 HG1 THR B 40 -7.132 15.837 -9.773 1.00 0.00 H new ATOM 0 HG21 THR B 40 -9.152 14.766 -10.460 1.00 0.00 H new ATOM 0 HG22 THR B 40 -9.820 13.524 -9.376 1.00 0.00 H new ATOM 0 HG23 THR B 40 -9.881 15.239 -8.908 1.00 0.00 H new ATOM 1741 N ASP B 41 -8.381 11.590 -7.845 1.00 0.00 N ATOM 1742 CA ASP B 41 -9.047 10.291 -7.862 1.00 0.00 C ATOM 1743 C ASP B 41 -8.960 9.619 -6.497 1.00 0.00 C ATOM 1744 O ASP B 41 -7.870 9.392 -5.975 1.00 0.00 O ATOM 1745 CB ASP B 41 -8.427 9.390 -8.931 1.00 0.00 C ATOM 1746 CG ASP B 41 -9.127 8.052 -9.036 1.00 0.00 C ATOM 1747 OD1 ASP B 41 -10.198 7.986 -9.673 1.00 0.00 O ATOM 1748 OD2 ASP B 41 -8.613 7.061 -8.486 1.00 0.00 O ATOM 0 H ASP B 41 -7.518 11.627 -8.388 1.00 0.00 H new ATOM 0 HA ASP B 41 -10.098 10.452 -8.100 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -8.468 9.895 -9.896 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -7.374 9.229 -8.700 1.00 0.00 H new ATOM 1753 N LYS B 42 -10.114 9.295 -5.930 1.00 0.00 N ATOM 1754 CA LYS B 42 -10.176 8.713 -4.596 1.00 0.00 C ATOM 1755 C LYS B 42 -9.938 7.210 -4.656 1.00 0.00 C ATOM 1756 O LYS B 42 -9.476 6.603 -3.689 1.00 0.00 O ATOM 1757 CB LYS B 42 -11.535 8.995 -3.950 1.00 0.00 C ATOM 1758 CG LYS B 42 -11.915 10.466 -3.943 1.00 0.00 C ATOM 1759 CD LYS B 42 -13.239 10.697 -3.232 1.00 0.00 C ATOM 1760 CE LYS B 42 -13.721 12.129 -3.401 1.00 0.00 C ATOM 1761 NZ LYS B 42 -14.104 12.424 -4.808 1.00 0.00 N ATOM 0 H LYS B 42 -11.023 9.426 -6.375 1.00 0.00 H new ATOM 0 HA LYS B 42 -9.394 9.171 -3.991 1.00 0.00 H new ATOM 0 HB2 LYS B 42 -12.303 8.433 -4.481 1.00 0.00 H new ATOM 0 HB3 LYS B 42 -11.523 8.627 -2.924 1.00 0.00 H new ATOM 0 HG2 LYS B 42 -11.132 11.043 -3.451 1.00 0.00 H new ATOM 0 HG3 LYS B 42 -11.983 10.830 -4.968 1.00 0.00 H new ATOM 0 HD2 LYS B 42 -13.989 10.011 -3.626 1.00 0.00 H new ATOM 0 HD3 LYS B 42 -13.127 10.473 -2.171 1.00 0.00 H new ATOM 0 HE2 LYS B 42 -14.576 12.303 -2.748 1.00 0.00 H new ATOM 0 HE3 LYS B 42 -12.935 12.816 -3.087 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 -14.656 13.305 -4.840 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 -13.246 12.532 -5.386 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 -14.678 11.642 -5.183 1.00 0.00 H new ATOM 1775 N ALA B 43 -10.241 6.620 -5.803 1.00 0.00 N ATOM 1776 CA ALA B 43 -10.115 5.182 -5.984 1.00 0.00 C ATOM 1777 C ALA B 43 -8.655 4.740 -5.886 1.00 0.00 C ATOM 1778 O ALA B 43 -8.354 3.676 -5.344 1.00 0.00 O ATOM 1779 CB ALA B 43 -10.720 4.767 -7.316 1.00 0.00 C ATOM 0 H ALA B 43 -10.578 7.119 -6.627 1.00 0.00 H new ATOM 0 HA ALA B 43 -10.663 4.685 -5.183 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -10.620 3.689 -7.441 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -11.775 5.038 -7.337 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -10.199 5.276 -8.127 1.00 0.00 H new ATOM 1785 N ARG B 44 -7.751 5.555 -6.417 1.00 0.00 N ATOM 1786 CA ARG B 44 -6.324 5.266 -6.329 1.00 0.00 C ATOM 1787 C ARG B 44 -5.783 5.558 -4.936 1.00 0.00 C ATOM 1788 O ARG B 44 -4.769 4.994 -4.531 1.00 0.00 O ATOM 1789 CB ARG B 44 -5.536 6.038 -7.386 1.00 0.00 C ATOM 1790 CG ARG B 44 -5.564 5.364 -8.743 1.00 0.00 C ATOM 1791 CD ARG B 44 -4.638 6.043 -9.734 1.00 0.00 C ATOM 1792 NE ARG B 44 -4.393 5.193 -10.895 1.00 0.00 N ATOM 1793 CZ ARG B 44 -3.805 5.599 -12.016 1.00 0.00 C ATOM 1794 NH1 ARG B 44 -3.414 6.863 -12.155 1.00 0.00 N ATOM 1795 NH2 ARG B 44 -3.613 4.735 -13.003 1.00 0.00 N ATOM 0 H ARG B 44 -7.979 6.418 -6.911 1.00 0.00 H new ATOM 0 HA ARG B 44 -6.196 4.201 -6.523 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -5.945 7.044 -7.476 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -4.502 6.143 -7.058 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -5.275 4.319 -8.635 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -6.582 5.375 -9.132 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -5.076 6.987 -10.057 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -3.692 6.281 -9.248 1.00 0.00 H new ATOM 0 HE ARG B 44 -4.694 4.220 -10.843 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -3.565 7.530 -11.398 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -2.964 7.165 -13.019 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -3.916 3.767 -12.899 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -3.163 5.039 -13.866 1.00 0.00 H new ATOM 1809 N ILE B 45 -6.460 6.430 -4.200 1.00 0.00 N ATOM 1810 CA ILE B 45 -6.110 6.661 -2.805 1.00 0.00 C ATOM 1811 C ILE B 45 -6.365 5.385 -2.010 1.00 0.00 C ATOM 1812 O ILE B 45 -5.564 4.990 -1.161 1.00 0.00 O ATOM 1813 CB ILE B 45 -6.916 7.829 -2.191 1.00 0.00 C ATOM 1814 CG1 ILE B 45 -6.652 9.122 -2.968 1.00 0.00 C ATOM 1815 CG2 ILE B 45 -6.563 8.010 -0.718 1.00 0.00 C ATOM 1816 CD1 ILE B 45 -7.462 10.305 -2.478 1.00 0.00 C ATOM 0 H ILE B 45 -7.246 6.983 -4.541 1.00 0.00 H new ATOM 0 HA ILE B 45 -5.056 6.933 -2.760 1.00 0.00 H new ATOM 0 HB ILE B 45 -7.977 7.591 -2.261 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -5.592 9.366 -2.900 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -6.873 8.953 -4.022 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -7.141 8.837 -0.304 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -6.797 7.095 -0.173 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -5.499 8.227 -0.623 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -7.221 11.184 -3.076 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -8.525 10.082 -2.572 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -7.224 10.501 -1.433 1.00 0.00 H new ATOM 1828 N ALA B 46 -7.475 4.725 -2.328 1.00 0.00 N ATOM 1829 CA ALA B 46 -7.803 3.440 -1.728 1.00 0.00 C ATOM 1830 C ALA B 46 -6.744 2.398 -2.077 1.00 0.00 C ATOM 1831 O ALA B 46 -6.404 1.546 -1.259 1.00 0.00 O ATOM 1832 CB ALA B 46 -9.179 2.980 -2.186 1.00 0.00 C ATOM 0 H ALA B 46 -8.164 5.062 -3.001 1.00 0.00 H new ATOM 0 HA ALA B 46 -7.820 3.558 -0.645 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -9.411 2.018 -1.730 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -9.927 3.714 -1.886 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -9.186 2.878 -3.271 1.00 0.00 H new ATOM 1838 N GLU B 47 -6.219 2.473 -3.298 1.00 0.00 N ATOM 1839 CA GLU B 47 -5.149 1.578 -3.720 1.00 0.00 C ATOM 1840 C GLU B 47 -3.881 1.845 -2.919 1.00 0.00 C ATOM 1841 O GLU B 47 -3.191 0.912 -2.511 1.00 0.00 O ATOM 1842 CB GLU B 47 -4.849 1.734 -5.212 1.00 0.00 C ATOM 1843 CG GLU B 47 -5.968 1.259 -6.120 1.00 0.00 C ATOM 1844 CD GLU B 47 -5.538 1.196 -7.572 1.00 0.00 C ATOM 1845 OE1 GLU B 47 -4.786 0.265 -7.928 1.00 0.00 O ATOM 1846 OE2 GLU B 47 -5.940 2.077 -8.357 1.00 0.00 O ATOM 0 H GLU B 47 -6.517 3.142 -4.008 1.00 0.00 H new ATOM 0 HA GLU B 47 -5.486 0.558 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -4.645 2.784 -5.423 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -3.942 1.179 -5.450 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -6.301 0.272 -5.798 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -6.821 1.930 -6.024 1.00 0.00 H new ATOM 1853 N ALA B 48 -3.592 3.121 -2.689 1.00 0.00 N ATOM 1854 CA ALA B 48 -2.397 3.527 -1.956 1.00 0.00 C ATOM 1855 C ALA B 48 -2.340 2.870 -0.581 1.00 0.00 C ATOM 1856 O ALA B 48 -1.289 2.366 -0.173 1.00 0.00 O ATOM 1857 CB ALA B 48 -2.347 5.042 -1.825 1.00 0.00 C ATOM 0 H ALA B 48 -4.174 3.898 -3.002 1.00 0.00 H new ATOM 0 HA ALA B 48 -1.526 3.193 -2.521 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -1.450 5.330 -1.276 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -2.326 5.492 -2.817 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -3.229 5.390 -1.288 1.00 0.00 H new ATOM 1863 N GLU B 49 -3.478 2.857 0.113 1.00 0.00 N ATOM 1864 CA GLU B 49 -3.584 2.226 1.430 1.00 0.00 C ATOM 1865 C GLU B 49 -3.078 0.791 1.377 1.00 0.00 C ATOM 1866 O GLU B 49 -2.298 0.350 2.225 1.00 0.00 O ATOM 1867 CB GLU B 49 -5.039 2.180 1.896 1.00 0.00 C ATOM 1868 CG GLU B 49 -5.802 3.483 1.757 1.00 0.00 C ATOM 1869 CD GLU B 49 -7.277 3.292 2.043 1.00 0.00 C ATOM 1870 OE1 GLU B 49 -7.916 2.469 1.347 1.00 0.00 O ATOM 1871 OE2 GLU B 49 -7.800 3.938 2.973 1.00 0.00 O ATOM 0 H GLU B 49 -4.346 3.279 -0.217 1.00 0.00 H new ATOM 0 HA GLU B 49 -2.984 2.820 2.120 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -5.561 1.409 1.329 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -5.059 1.875 2.942 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -5.390 4.223 2.443 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.673 3.876 0.749 1.00 0.00 H new ATOM 1878 N LYS B 50 -3.530 0.076 0.359 1.00 0.00 N ATOM 1879 CA LYS B 50 -3.308 -1.357 0.253 1.00 0.00 C ATOM 1880 C LYS B 50 -1.946 -1.654 -0.370 1.00 0.00 C ATOM 1881 O LYS B 50 -1.427 -2.765 -0.252 1.00 0.00 O ATOM 1882 CB LYS B 50 -4.427 -1.978 -0.588 1.00 0.00 C ATOM 1883 CG LYS B 50 -5.787 -1.341 -0.325 1.00 0.00 C ATOM 1884 CD LYS B 50 -6.893 -1.986 -1.142 1.00 0.00 C ATOM 1885 CE LYS B 50 -8.107 -1.070 -1.261 1.00 0.00 C ATOM 1886 NZ LYS B 50 -8.577 -0.563 0.057 1.00 0.00 N ATOM 0 H LYS B 50 -4.061 0.473 -0.417 1.00 0.00 H new ATOM 0 HA LYS B 50 -3.318 -1.793 1.252 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -4.181 -1.875 -1.645 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -4.484 -3.046 -0.377 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -6.026 -1.424 0.735 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -5.739 -0.277 -0.558 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -6.519 -2.227 -2.137 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -7.189 -2.926 -0.677 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -7.857 -0.225 -1.903 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -8.919 -1.611 -1.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -9.617 -0.546 0.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -8.231 -1.188 0.813 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -8.213 0.399 0.209 1.00 0.00 H new ATOM 1900 N ALA B 51 -1.377 -0.654 -1.031 1.00 0.00 N ATOM 1901 CA ALA B 51 -0.072 -0.796 -1.663 1.00 0.00 C ATOM 1902 C ALA B 51 1.050 -0.534 -0.665 1.00 0.00 C ATOM 1903 O ALA B 51 2.139 -1.093 -0.781 1.00 0.00 O ATOM 1904 CB ALA B 51 0.046 0.149 -2.851 1.00 0.00 C ATOM 0 H ALA B 51 -1.801 0.267 -1.143 1.00 0.00 H new ATOM 0 HA ALA B 51 0.023 -1.822 -2.018 1.00 0.00 H new ATOM 0 HB1 ALA B 51 1.026 0.032 -3.313 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -0.729 -0.085 -3.580 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -0.074 1.178 -2.511 1.00 0.00 H new ATOM 1910 N GLY B 52 0.780 0.323 0.310 1.00 0.00 N ATOM 1911 CA GLY B 52 1.778 0.634 1.316 1.00 0.00 C ATOM 1912 C GLY B 52 2.111 2.109 1.360 1.00 0.00 C ATOM 1913 O GLY B 52 2.912 2.550 2.184 1.00 0.00 O ATOM 0 H GLY B 52 -0.110 0.808 0.423 1.00 0.00 H new ATOM 0 HA2 GLY B 52 1.416 0.317 2.294 1.00 0.00 H new ATOM 0 HA3 GLY B 52 2.685 0.065 1.112 1.00 0.00 H new ATOM 1917 N VAL B 53 1.492 2.873 0.471 1.00 0.00 N ATOM 1918 CA VAL B 53 1.700 4.312 0.423 1.00 0.00 C ATOM 1919 C VAL B 53 0.842 4.985 1.484 1.00 0.00 C ATOM 1920 O VAL B 53 -0.374 5.082 1.341 1.00 0.00 O ATOM 1921 CB VAL B 53 1.350 4.888 -0.964 1.00 0.00 C ATOM 1922 CG1 VAL B 53 1.718 6.362 -1.049 1.00 0.00 C ATOM 1923 CG2 VAL B 53 2.040 4.093 -2.060 1.00 0.00 C ATOM 0 H VAL B 53 0.840 2.518 -0.228 1.00 0.00 H new ATOM 0 HA VAL B 53 2.755 4.508 0.614 1.00 0.00 H new ATOM 0 HB VAL B 53 0.273 4.804 -1.107 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.461 6.745 -2.037 1.00 0.00 H new ATOM 0 HG12 VAL B 53 1.168 6.919 -0.290 1.00 0.00 H new ATOM 0 HG13 VAL B 53 2.789 6.480 -0.881 1.00 0.00 H new ATOM 0 HG21 VAL B 53 1.782 4.513 -3.032 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.120 4.141 -1.919 1.00 0.00 H new ATOM 0 HG23 VAL B 53 1.714 3.054 -2.016 1.00 0.00 H new ATOM 1933 N LYS B 54 1.476 5.428 2.556 1.00 0.00 N ATOM 1934 CA LYS B 54 0.745 5.952 3.697 1.00 0.00 C ATOM 1935 C LYS B 54 0.839 7.470 3.765 1.00 0.00 C ATOM 1936 O LYS B 54 0.204 8.103 4.609 1.00 0.00 O ATOM 1937 CB LYS B 54 1.268 5.309 4.982 1.00 0.00 C ATOM 1938 CG LYS B 54 1.283 3.790 4.907 1.00 0.00 C ATOM 1939 CD LYS B 54 1.797 3.154 6.182 1.00 0.00 C ATOM 1940 CE LYS B 54 2.062 1.671 5.975 1.00 0.00 C ATOM 1941 NZ LYS B 54 2.577 1.012 7.203 1.00 0.00 N ATOM 0 H LYS B 54 2.491 5.436 2.660 1.00 0.00 H new ATOM 0 HA LYS B 54 -0.309 5.701 3.581 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.277 5.670 5.181 1.00 0.00 H new ATOM 0 HB3 LYS B 54 0.646 5.622 5.821 1.00 0.00 H new ATOM 0 HG2 LYS B 54 0.275 3.429 4.705 1.00 0.00 H new ATOM 0 HG3 LYS B 54 1.907 3.476 4.070 1.00 0.00 H new ATOM 0 HD2 LYS B 54 2.714 3.651 6.498 1.00 0.00 H new ATOM 0 HD3 LYS B 54 1.069 3.290 6.981 1.00 0.00 H new ATOM 0 HE2 LYS B 54 1.141 1.180 5.661 1.00 0.00 H new ATOM 0 HE3 LYS B 54 2.783 1.542 5.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 2.742 0.003 7.012 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 3.470 1.461 7.489 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 1.879 1.110 7.968 1.00 0.00 H new ATOM 1955 N SER B 55 1.645 8.052 2.890 1.00 0.00 N ATOM 1956 CA SER B 55 1.703 9.499 2.750 1.00 0.00 C ATOM 1957 C SER B 55 2.072 9.884 1.319 1.00 0.00 C ATOM 1958 O SER B 55 2.828 9.173 0.655 1.00 0.00 O ATOM 1959 CB SER B 55 2.727 10.086 3.728 1.00 0.00 C ATOM 1960 OG SER B 55 2.435 9.705 5.063 1.00 0.00 O ATOM 0 H SER B 55 2.270 7.543 2.265 1.00 0.00 H new ATOM 0 HA SER B 55 0.718 9.906 2.980 1.00 0.00 H new ATOM 0 HB2 SER B 55 3.727 9.746 3.460 1.00 0.00 H new ATOM 0 HB3 SER B 55 2.728 11.173 3.649 1.00 0.00 H new ATOM 0 HG SER B 55 3.239 9.805 5.615 1.00 0.00 H new ATOM 1966 N VAL B 56 1.515 10.992 0.837 1.00 0.00 N ATOM 1967 CA VAL B 56 1.930 11.548 -0.443 1.00 0.00 C ATOM 1968 C VAL B 56 3.268 12.276 -0.263 1.00 0.00 C ATOM 1969 O VAL B 56 3.761 12.349 0.870 1.00 0.00 O ATOM 1970 CB VAL B 56 0.851 12.454 -1.077 1.00 0.00 C ATOM 1971 CG1 VAL B 56 -0.308 11.617 -1.587 1.00 0.00 C ATOM 1972 CG2 VAL B 56 0.358 13.499 -0.097 1.00 0.00 C ATOM 0 H VAL B 56 0.781 11.518 1.311 1.00 0.00 H new ATOM 0 HA VAL B 56 2.064 10.729 -1.150 1.00 0.00 H new ATOM 0 HB VAL B 56 1.307 12.977 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -1.060 12.269 -2.031 1.00 0.00 H new ATOM 0 HG12 VAL B 56 0.053 10.915 -2.339 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -0.750 11.065 -0.758 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -0.400 14.119 -0.576 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -0.074 13.006 0.774 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.193 14.125 0.218 1.00 0.00 H new ATOM 1982 N PRO B 57 3.763 13.006 -1.292 1.00 0.00 N ATOM 1983 CA PRO B 57 5.149 13.002 -1.694 1.00 0.00 C ATOM 1984 C PRO B 57 5.994 11.868 -1.111 1.00 0.00 C ATOM 1985 O PRO B 57 6.626 11.978 -0.057 1.00 0.00 O ATOM 1986 CB PRO B 57 5.529 14.410 -1.278 1.00 0.00 C ATOM 1987 CG PRO B 57 4.293 15.203 -1.668 1.00 0.00 C ATOM 1988 CD PRO B 57 3.175 14.180 -1.909 1.00 0.00 C ATOM 0 HA PRO B 57 5.327 12.788 -2.748 1.00 0.00 H new ATOM 0 HB2 PRO B 57 5.736 14.477 -0.210 1.00 0.00 H new ATOM 0 HB3 PRO B 57 6.420 14.762 -1.798 1.00 0.00 H new ATOM 0 HG2 PRO B 57 4.016 15.902 -0.879 1.00 0.00 H new ATOM 0 HG3 PRO B 57 4.478 15.793 -2.565 1.00 0.00 H new ATOM 0 HD2 PRO B 57 2.236 14.471 -1.438 1.00 0.00 H new ATOM 0 HD3 PRO B 57 2.967 14.033 -2.969 1.00 0.00 H new ATOM 1996 N ALA B 58 5.971 10.760 -1.850 1.00 0.00 N ATOM 1997 CA ALA B 58 6.715 9.558 -1.517 1.00 0.00 C ATOM 1998 C ALA B 58 7.092 8.815 -2.795 1.00 0.00 C ATOM 1999 O ALA B 58 6.458 9.003 -3.836 1.00 0.00 O ATOM 2000 CB ALA B 58 5.885 8.659 -0.614 1.00 0.00 C ATOM 0 H ALA B 58 5.426 10.676 -2.708 1.00 0.00 H new ATOM 0 HA ALA B 58 7.625 9.839 -0.986 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.454 7.761 -0.372 1.00 0.00 H new ATOM 0 HB2 ALA B 58 5.640 9.192 0.305 1.00 0.00 H new ATOM 0 HB3 ALA B 58 4.965 8.378 -1.127 1.00 0.00 H new ATOM 2006 N LEU B 59 8.111 7.973 -2.717 1.00 0.00 N ATOM 2007 CA LEU B 59 8.589 7.237 -3.879 1.00 0.00 C ATOM 2008 C LEU B 59 8.590 5.736 -3.605 1.00 0.00 C ATOM 2009 O LEU B 59 9.238 5.267 -2.672 1.00 0.00 O ATOM 2010 CB LEU B 59 10.000 7.706 -4.249 1.00 0.00 C ATOM 2011 CG LEU B 59 10.648 6.995 -5.440 1.00 0.00 C ATOM 2012 CD1 LEU B 59 9.857 7.241 -6.714 1.00 0.00 C ATOM 2013 CD2 LEU B 59 12.086 7.456 -5.608 1.00 0.00 C ATOM 0 H LEU B 59 8.625 7.781 -1.857 1.00 0.00 H new ATOM 0 HA LEU B 59 7.916 7.432 -4.714 1.00 0.00 H new ATOM 0 HB2 LEU B 59 9.963 8.774 -4.464 1.00 0.00 H new ATOM 0 HB3 LEU B 59 10.645 7.578 -3.379 1.00 0.00 H new ATOM 0 HG LEU B 59 10.645 5.923 -5.243 1.00 0.00 H new ATOM 0 HD11 LEU B 59 10.337 6.726 -7.546 1.00 0.00 H new ATOM 0 HD12 LEU B 59 8.842 6.863 -6.591 1.00 0.00 H new ATOM 0 HD13 LEU B 59 9.824 8.311 -6.921 1.00 0.00 H new ATOM 0 HD21 LEU B 59 12.536 6.943 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU B 59 12.105 8.532 -5.782 1.00 0.00 H new ATOM 0 HD23 LEU B 59 12.650 7.224 -4.705 1.00 0.00 H new ATOM 2025 N VAL B 60 7.854 4.992 -4.412 1.00 0.00 N ATOM 2026 CA VAL B 60 7.796 3.543 -4.282 1.00 0.00 C ATOM 2027 C VAL B 60 8.803 2.888 -5.220 1.00 0.00 C ATOM 2028 O VAL B 60 8.563 2.773 -6.422 1.00 0.00 O ATOM 2029 CB VAL B 60 6.381 3.003 -4.587 1.00 0.00 C ATOM 2030 CG1 VAL B 60 6.313 1.499 -4.365 1.00 0.00 C ATOM 2031 CG2 VAL B 60 5.343 3.717 -3.738 1.00 0.00 C ATOM 0 H VAL B 60 7.284 5.369 -5.169 1.00 0.00 H new ATOM 0 HA VAL B 60 8.042 3.296 -3.249 1.00 0.00 H new ATOM 0 HB VAL B 60 6.162 3.199 -5.637 1.00 0.00 H new ATOM 0 HG11 VAL B 60 5.307 1.144 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.026 1.002 -5.022 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.557 1.273 -3.327 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.353 3.323 -3.967 1.00 0.00 H new ATOM 0 HG22 VAL B 60 5.563 3.556 -2.683 1.00 0.00 H new ATOM 0 HG23 VAL B 60 5.368 4.785 -3.955 1.00 0.00 H new ATOM 2041 N ILE B 61 9.929 2.472 -4.668 1.00 0.00 N ATOM 2042 CA ILE B 61 11.004 1.901 -5.462 1.00 0.00 C ATOM 2043 C ILE B 61 10.877 0.385 -5.537 1.00 0.00 C ATOM 2044 O ILE B 61 11.042 -0.308 -4.532 1.00 0.00 O ATOM 2045 CB ILE B 61 12.389 2.275 -4.890 1.00 0.00 C ATOM 2046 CG1 ILE B 61 12.543 3.796 -4.833 1.00 0.00 C ATOM 2047 CG2 ILE B 61 13.499 1.654 -5.729 1.00 0.00 C ATOM 2048 CD1 ILE B 61 13.862 4.255 -4.249 1.00 0.00 C ATOM 0 H ILE B 61 10.124 2.519 -3.668 1.00 0.00 H new ATOM 0 HA ILE B 61 10.919 2.318 -6.466 1.00 0.00 H new ATOM 0 HB ILE B 61 12.467 1.880 -3.877 1.00 0.00 H new ATOM 0 HG12 ILE B 61 12.442 4.200 -5.840 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.729 4.212 -4.240 1.00 0.00 H new ATOM 0 HG21 ILE B 61 14.468 1.928 -5.311 1.00 0.00 H new ATOM 0 HG22 ILE B 61 13.395 0.569 -5.724 1.00 0.00 H new ATOM 0 HG23 ILE B 61 13.429 2.020 -6.753 1.00 0.00 H new ATOM 0 HD11 ILE B 61 13.897 5.344 -4.242 1.00 0.00 H new ATOM 0 HD12 ILE B 61 13.958 3.882 -3.229 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.682 3.870 -4.855 1.00 0.00 H new ATOM 2060 N ASP B 62 10.527 -0.104 -6.729 1.00 0.00 N ATOM 2061 CA ASP B 62 10.453 -1.541 -7.039 1.00 0.00 C ATOM 2062 C ASP B 62 9.250 -2.211 -6.375 1.00 0.00 C ATOM 2063 O ASP B 62 8.706 -3.186 -6.896 1.00 0.00 O ATOM 2064 CB ASP B 62 11.751 -2.261 -6.646 1.00 0.00 C ATOM 2065 CG ASP B 62 11.808 -3.683 -7.172 1.00 0.00 C ATOM 2066 OD1 ASP B 62 11.918 -3.859 -8.403 1.00 0.00 O ATOM 2067 OD2 ASP B 62 11.743 -4.632 -6.360 1.00 0.00 O ATOM 0 H ASP B 62 10.283 0.492 -7.520 1.00 0.00 H new ATOM 0 HA ASP B 62 10.323 -1.624 -8.118 1.00 0.00 H new ATOM 0 HB2 ASP B 62 12.604 -1.701 -7.029 1.00 0.00 H new ATOM 0 HB3 ASP B 62 11.841 -2.275 -5.560 1.00 0.00 H new ATOM 2072 N GLY B 63 8.825 -1.674 -5.244 1.00 0.00 N ATOM 2073 CA GLY B 63 7.725 -2.248 -4.502 1.00 0.00 C ATOM 2074 C GLY B 63 7.649 -1.699 -3.093 1.00 0.00 C ATOM 2075 O GLY B 63 6.590 -1.715 -2.464 1.00 0.00 O ATOM 0 H GLY B 63 9.229 -0.838 -4.822 1.00 0.00 H new ATOM 0 HA2 GLY B 63 6.790 -2.043 -5.023 1.00 0.00 H new ATOM 0 HA3 GLY B 63 7.838 -3.331 -4.464 1.00 0.00 H new ATOM 2079 N ALA B 64 8.776 -1.210 -2.595 1.00 0.00 N ATOM 2080 CA ALA B 64 8.834 -0.626 -1.263 1.00 0.00 C ATOM 2081 C ALA B 64 8.608 0.881 -1.327 1.00 0.00 C ATOM 2082 O ALA B 64 9.252 1.581 -2.109 1.00 0.00 O ATOM 2083 CB ALA B 64 10.167 -0.941 -0.603 1.00 0.00 C ATOM 0 H ALA B 64 9.665 -1.206 -3.095 1.00 0.00 H new ATOM 0 HA ALA B 64 8.039 -1.064 -0.659 1.00 0.00 H new ATOM 0 HB1 ALA B 64 10.194 -0.497 0.392 1.00 0.00 H new ATOM 0 HB2 ALA B 64 10.287 -2.021 -0.522 1.00 0.00 H new ATOM 0 HB3 ALA B 64 10.977 -0.531 -1.206 1.00 0.00 H new ATOM 2089 N ALA B 65 7.688 1.371 -0.510 1.00 0.00 N ATOM 2090 CA ALA B 65 7.354 2.788 -0.497 1.00 0.00 C ATOM 2091 C ALA B 65 8.244 3.560 0.472 1.00 0.00 C ATOM 2092 O ALA B 65 8.285 3.265 1.665 1.00 0.00 O ATOM 2093 CB ALA B 65 5.889 2.979 -0.133 1.00 0.00 C ATOM 0 H ALA B 65 7.158 0.807 0.154 1.00 0.00 H new ATOM 0 HA ALA B 65 7.527 3.183 -1.498 1.00 0.00 H new ATOM 0 HB1 ALA B 65 5.651 4.043 -0.127 1.00 0.00 H new ATOM 0 HB2 ALA B 65 5.263 2.472 -0.867 1.00 0.00 H new ATOM 0 HB3 ALA B 65 5.702 2.560 0.856 1.00 0.00 H new ATOM 2099 N PHE B 66 8.962 4.541 -0.053 1.00 0.00 N ATOM 2100 CA PHE B 66 9.807 5.396 0.765 1.00 0.00 C ATOM 2101 C PHE B 66 9.309 6.834 0.704 1.00 0.00 C ATOM 2102 O PHE B 66 9.332 7.461 -0.353 1.00 0.00 O ATOM 2103 CB PHE B 66 11.262 5.326 0.295 1.00 0.00 C ATOM 2104 CG PHE B 66 11.857 3.949 0.374 1.00 0.00 C ATOM 2105 CD1 PHE B 66 12.369 3.469 1.568 1.00 0.00 C ATOM 2106 CD2 PHE B 66 11.902 3.135 -0.746 1.00 0.00 C ATOM 2107 CE1 PHE B 66 12.914 2.201 1.645 1.00 0.00 C ATOM 2108 CE2 PHE B 66 12.447 1.867 -0.676 1.00 0.00 C ATOM 2109 CZ PHE B 66 12.953 1.400 0.521 1.00 0.00 C ATOM 0 H PHE B 66 8.976 4.765 -1.048 1.00 0.00 H new ATOM 0 HA PHE B 66 9.759 5.044 1.796 1.00 0.00 H new ATOM 0 HB2 PHE B 66 11.319 5.678 -0.735 1.00 0.00 H new ATOM 0 HB3 PHE B 66 11.863 6.007 0.898 1.00 0.00 H new ATOM 0 HD1 PHE B 66 12.342 4.093 2.449 1.00 0.00 H new ATOM 0 HD2 PHE B 66 11.507 3.495 -1.684 1.00 0.00 H new ATOM 0 HE1 PHE B 66 13.308 1.838 2.582 1.00 0.00 H new ATOM 0 HE2 PHE B 66 12.477 1.242 -1.556 1.00 0.00 H new ATOM 0 HZ PHE B 66 13.379 0.409 0.578 1.00 0.00 H new ATOM 2119 N HIS B 67 8.845 7.345 1.832 1.00 0.00 N ATOM 2120 CA HIS B 67 8.333 8.708 1.897 1.00 0.00 C ATOM 2121 C HIS B 67 9.492 9.699 1.892 1.00 0.00 C ATOM 2122 O HIS B 67 10.438 9.555 2.664 1.00 0.00 O ATOM 2123 CB HIS B 67 7.469 8.886 3.152 1.00 0.00 C ATOM 2124 CG HIS B 67 6.329 7.911 3.238 1.00 0.00 C ATOM 2125 ND1 HIS B 67 6.363 6.754 3.987 1.00 0.00 N ATOM 2126 CD2 HIS B 67 5.108 7.932 2.645 1.00 0.00 C ATOM 2127 CE1 HIS B 67 5.190 6.124 3.829 1.00 0.00 C ATOM 2128 NE2 HIS B 67 4.390 6.798 3.021 1.00 0.00 N ATOM 0 H HIS B 67 8.811 6.838 2.717 1.00 0.00 H new ATOM 0 HA HIS B 67 7.711 8.900 1.023 1.00 0.00 H new ATOM 0 HB2 HIS B 67 8.098 8.776 4.035 1.00 0.00 H new ATOM 0 HB3 HIS B 67 7.071 9.901 3.169 1.00 0.00 H new ATOM 0 HD1 HIS B 67 7.143 6.434 4.560 1.00 0.00 H new ATOM 0 HD2 HIS B 67 4.749 8.707 1.984 1.00 0.00 H new ATOM 0 HE1 HIS B 67 4.932 5.187 4.301 1.00 0.00 H new ATOM 2136 N ILE B 68 9.423 10.699 1.021 1.00 0.00 N ATOM 2137 CA ILE B 68 10.530 11.632 0.852 1.00 0.00 C ATOM 2138 C ILE B 68 10.105 13.033 1.261 1.00 0.00 C ATOM 2139 O ILE B 68 9.429 13.725 0.502 1.00 0.00 O ATOM 2140 CB ILE B 68 11.044 11.645 -0.604 1.00 0.00 C ATOM 2141 CG1 ILE B 68 11.467 10.235 -1.026 1.00 0.00 C ATOM 2142 CG2 ILE B 68 12.207 12.619 -0.753 1.00 0.00 C ATOM 2143 CD1 ILE B 68 11.936 10.143 -2.462 1.00 0.00 C ATOM 0 H ILE B 68 8.617 10.884 0.424 1.00 0.00 H new ATOM 0 HA ILE B 68 11.344 11.298 1.495 1.00 0.00 H new ATOM 0 HB ILE B 68 10.236 11.977 -1.256 1.00 0.00 H new ATOM 0 HG12 ILE B 68 12.267 9.894 -0.369 1.00 0.00 H new ATOM 0 HG13 ILE B 68 10.627 9.556 -0.884 1.00 0.00 H new ATOM 0 HG21 ILE B 68 12.556 12.614 -1.786 1.00 0.00 H new ATOM 0 HG22 ILE B 68 11.877 13.623 -0.486 1.00 0.00 H new ATOM 0 HG23 ILE B 68 13.021 12.317 -0.094 1.00 0.00 H new ATOM 0 HD11 ILE B 68 12.219 9.115 -2.687 1.00 0.00 H new ATOM 0 HD12 ILE B 68 11.131 10.452 -3.128 1.00 0.00 H new ATOM 0 HD13 ILE B 68 12.797 10.796 -2.606 1.00 0.00 H new ATOM 2155 N ASN B 69 10.523 13.436 2.462 1.00 0.00 N ATOM 2156 CA ASN B 69 10.036 14.659 3.097 1.00 0.00 C ATOM 2157 C ASN B 69 8.535 14.566 3.287 1.00 0.00 C ATOM 2158 O ASN B 69 7.775 14.808 2.354 1.00 0.00 O ATOM 2159 CB ASN B 69 10.403 15.920 2.304 1.00 0.00 C ATOM 2160 CG ASN B 69 11.801 16.421 2.611 1.00 0.00 C ATOM 2161 OD1 ASN B 69 12.321 16.221 3.709 1.00 0.00 O ATOM 2162 ND2 ASN B 69 12.419 17.084 1.646 1.00 0.00 N ATOM 0 H ASN B 69 11.207 12.924 3.020 1.00 0.00 H new ATOM 0 HA ASN B 69 10.526 14.748 4.066 1.00 0.00 H new ATOM 0 HB2 ASN B 69 10.324 15.709 1.238 1.00 0.00 H new ATOM 0 HB3 ASN B 69 9.683 16.707 2.528 1.00 0.00 H new ATOM 0 HD21 ASN B 69 13.359 17.449 1.799 1.00 0.00 H new ATOM 0 HD22 ASN B 69 11.955 17.230 0.749 1.00 0.00 H new ATOM 2169 N PHE B 70 8.134 14.193 4.505 1.00 0.00 N ATOM 2170 CA PHE B 70 6.734 13.925 4.839 1.00 0.00 C ATOM 2171 C PHE B 70 5.792 14.937 4.200 1.00 0.00 C ATOM 2172 O PHE B 70 5.670 16.072 4.665 1.00 0.00 O ATOM 2173 CB PHE B 70 6.550 13.914 6.362 1.00 0.00 C ATOM 2174 CG PHE B 70 5.137 13.643 6.807 1.00 0.00 C ATOM 2175 CD1 PHE B 70 4.609 12.364 6.749 1.00 0.00 C ATOM 2176 CD2 PHE B 70 4.340 14.671 7.289 1.00 0.00 C ATOM 2177 CE1 PHE B 70 3.315 12.115 7.160 1.00 0.00 C ATOM 2178 CE2 PHE B 70 3.044 14.427 7.702 1.00 0.00 C ATOM 2179 CZ PHE B 70 2.531 13.147 7.637 1.00 0.00 C ATOM 0 H PHE B 70 8.774 14.068 5.289 1.00 0.00 H new ATOM 0 HA PHE B 70 6.480 12.945 4.436 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.207 13.157 6.791 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.868 14.876 6.763 1.00 0.00 H new ATOM 0 HD1 PHE B 70 5.217 11.552 6.378 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.737 15.674 7.342 1.00 0.00 H new ATOM 0 HE1 PHE B 70 2.916 11.113 7.109 1.00 0.00 H new ATOM 0 HE2 PHE B 70 2.434 15.236 8.075 1.00 0.00 H new ATOM 0 HZ PHE B 70 1.518 12.953 7.959 1.00 0.00 H new ATOM 2189 N GLY B 71 5.162 14.521 3.111 1.00 0.00 N ATOM 2190 CA GLY B 71 4.212 15.366 2.438 1.00 0.00 C ATOM 2191 C GLY B 71 2.895 15.391 3.165 1.00 0.00 C ATOM 2192 O GLY B 71 2.679 16.224 4.050 1.00 0.00 O ATOM 0 H GLY B 71 5.297 13.605 2.683 1.00 0.00 H new ATOM 0 HA2 GLY B 71 4.609 16.378 2.365 1.00 0.00 H new ATOM 0 HA3 GLY B 71 4.061 15.009 1.419 1.00 0.00 H new ATOM 2196 N ALA B 72 2.007 14.478 2.812 1.00 0.00 N ATOM 2197 CA ALA B 72 0.705 14.428 3.474 1.00 0.00 C ATOM 2198 C ALA B 72 0.270 12.998 3.737 1.00 0.00 C ATOM 2199 O ALA B 72 0.137 12.204 2.809 1.00 0.00 O ATOM 2200 CB ALA B 72 -0.350 15.180 2.675 1.00 0.00 C ATOM 0 H ALA B 72 2.153 13.774 2.088 1.00 0.00 H new ATOM 0 HA ALA B 72 0.812 14.924 4.439 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -1.307 15.124 3.193 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -0.053 16.224 2.572 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -0.446 14.731 1.686 1.00 0.00 H new ATOM 2206 N GLY B 73 0.042 12.678 5.000 1.00 0.00 N ATOM 2207 CA GLY B 73 -0.355 11.333 5.364 1.00 0.00 C ATOM 2208 C GLY B 73 -1.763 11.000 4.909 1.00 0.00 C ATOM 2209 O GLY B 73 -2.574 11.898 4.668 1.00 0.00 O ATOM 0 H GLY B 73 0.125 13.327 5.783 1.00 0.00 H new ATOM 0 HA2 GLY B 73 0.343 10.620 4.925 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -0.290 11.219 6.446 1.00 0.00 H new ATOM 2213 N ILE B 74 -2.048 9.708 4.786 1.00 0.00 N ATOM 2214 CA ILE B 74 -3.375 9.237 4.406 1.00 0.00 C ATOM 2215 C ILE B 74 -4.430 9.773 5.366 1.00 0.00 C ATOM 2216 O ILE B 74 -5.496 10.212 4.945 1.00 0.00 O ATOM 2217 CB ILE B 74 -3.430 7.689 4.370 1.00 0.00 C ATOM 2218 CG1 ILE B 74 -2.596 7.150 3.201 1.00 0.00 C ATOM 2219 CG2 ILE B 74 -4.863 7.180 4.277 1.00 0.00 C ATOM 2220 CD1 ILE B 74 -3.056 7.638 1.841 1.00 0.00 C ATOM 0 H ILE B 74 -1.371 8.962 4.946 1.00 0.00 H new ATOM 0 HA ILE B 74 -3.585 9.612 3.404 1.00 0.00 H new ATOM 0 HB ILE B 74 -3.007 7.322 5.305 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -1.555 7.439 3.347 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -2.630 6.061 3.216 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -4.861 6.090 4.254 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -5.428 7.524 5.143 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -5.326 7.561 3.367 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -2.417 7.213 1.067 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -4.087 7.326 1.672 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -2.996 8.726 1.805 1.00 0.00 H new ATOM 2232 N ASP B 75 -4.109 9.774 6.654 1.00 0.00 N ATOM 2233 CA ASP B 75 -5.030 10.264 7.677 1.00 0.00 C ATOM 2234 C ASP B 75 -5.318 11.751 7.502 1.00 0.00 C ATOM 2235 O ASP B 75 -6.399 12.228 7.851 1.00 0.00 O ATOM 2236 CB ASP B 75 -4.465 10.013 9.076 1.00 0.00 C ATOM 2237 CG ASP B 75 -4.810 8.641 9.617 1.00 0.00 C ATOM 2238 OD1 ASP B 75 -4.227 7.638 9.151 1.00 0.00 O ATOM 2239 OD2 ASP B 75 -5.657 8.559 10.536 1.00 0.00 O ATOM 0 H ASP B 75 -3.216 9.441 7.017 1.00 0.00 H new ATOM 0 HA ASP B 75 -5.965 9.715 7.562 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -3.381 10.125 9.049 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -4.847 10.773 9.758 1.00 0.00 H new ATOM 2244 N ASP B 76 -4.354 12.478 6.953 1.00 0.00 N ATOM 2245 CA ASP B 76 -4.500 13.918 6.758 1.00 0.00 C ATOM 2246 C ASP B 76 -5.395 14.206 5.559 1.00 0.00 C ATOM 2247 O ASP B 76 -6.284 15.052 5.626 1.00 0.00 O ATOM 2248 CB ASP B 76 -3.130 14.574 6.558 1.00 0.00 C ATOM 2249 CG ASP B 76 -3.209 16.088 6.490 1.00 0.00 C ATOM 2250 OD1 ASP B 76 -3.110 16.740 7.553 1.00 0.00 O ATOM 2251 OD2 ASP B 76 -3.351 16.637 5.379 1.00 0.00 O ATOM 0 H ASP B 76 -3.463 12.097 6.635 1.00 0.00 H new ATOM 0 HA ASP B 76 -4.963 14.338 7.651 1.00 0.00 H new ATOM 0 HB2 ASP B 76 -2.471 14.285 7.377 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -2.682 14.196 5.639 1.00 0.00 H new ATOM 2256 N LEU B 77 -5.163 13.480 4.470 1.00 0.00 N ATOM 2257 CA LEU B 77 -5.943 13.650 3.247 1.00 0.00 C ATOM 2258 C LEU B 77 -7.349 13.081 3.414 1.00 0.00 C ATOM 2259 O LEU B 77 -8.309 13.573 2.818 1.00 0.00 O ATOM 2260 CB LEU B 77 -5.248 12.951 2.074 1.00 0.00 C ATOM 2261 CG LEU B 77 -3.862 13.484 1.711 1.00 0.00 C ATOM 2262 CD1 LEU B 77 -3.228 12.616 0.638 1.00 0.00 C ATOM 2263 CD2 LEU B 77 -3.953 14.928 1.241 1.00 0.00 C ATOM 0 H LEU B 77 -4.438 12.765 4.409 1.00 0.00 H new ATOM 0 HA LEU B 77 -6.018 14.718 3.042 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -5.159 11.890 2.308 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -5.889 13.031 1.196 1.00 0.00 H new ATOM 0 HG LEU B 77 -3.234 13.451 2.601 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.242 13.007 0.389 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.131 11.595 1.006 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -3.856 12.622 -0.253 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -2.957 15.291 0.987 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -4.595 14.985 0.362 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -4.372 15.544 2.037 1.00 0.00 H new ATOM 2275 N LYS B 78 -7.457 12.035 4.222 1.00 0.00 N ATOM 2276 CA LYS B 78 -8.725 11.359 4.444 1.00 0.00 C ATOM 2277 C LYS B 78 -9.617 12.178 5.370 1.00 0.00 C ATOM 2278 O LYS B 78 -10.795 12.393 5.081 1.00 0.00 O ATOM 2279 CB LYS B 78 -8.474 9.972 5.046 1.00 0.00 C ATOM 2280 CG LYS B 78 -9.696 9.070 5.097 1.00 0.00 C ATOM 2281 CD LYS B 78 -10.188 8.706 3.704 1.00 0.00 C ATOM 2282 CE LYS B 78 -11.171 7.545 3.744 1.00 0.00 C ATOM 2283 NZ LYS B 78 -12.363 7.841 4.584 1.00 0.00 N ATOM 0 H LYS B 78 -6.674 11.635 4.738 1.00 0.00 H new ATOM 0 HA LYS B 78 -9.234 11.249 3.487 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -7.696 9.475 4.466 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -8.088 10.095 6.058 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -9.454 8.160 5.646 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -10.494 9.570 5.645 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -10.666 9.573 3.248 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -9.338 8.443 3.074 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -11.494 7.310 2.730 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -10.668 6.659 4.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -13.026 7.041 4.539 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -12.065 7.989 5.569 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -12.832 8.700 4.231 1.00 0.00 H new ATOM 2297 N GLY B 79 -9.051 12.631 6.485 1.00 0.00 N ATOM 2298 CA GLY B 79 -9.825 13.364 7.473 1.00 0.00 C ATOM 2299 C GLY B 79 -10.680 12.441 8.319 1.00 0.00 C ATOM 2300 O GLY B 79 -10.537 12.385 9.542 1.00 0.00 O ATOM 0 H GLY B 79 -8.067 12.503 6.723 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -9.150 13.927 8.118 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -10.463 14.090 6.969 1.00 0.00 H new ATOM 2304 N SER B 80 -11.570 11.720 7.657 1.00 0.00 N ATOM 2305 CA SER B 80 -12.406 10.727 8.300 1.00 0.00 C ATOM 2306 C SER B 80 -12.797 9.658 7.284 1.00 0.00 C ATOM 2307 O SER B 80 -13.794 9.857 6.558 1.00 0.00 O ATOM 2308 CB SER B 80 -13.649 11.383 8.912 1.00 0.00 C ATOM 2309 OG SER B 80 -14.343 12.164 7.951 1.00 0.00 O ATOM 2310 OXT SER B 80 -12.084 8.638 7.185 1.00 0.00 O ATOM 0 H SER B 80 -11.731 11.810 6.654 1.00 0.00 H new ATOM 0 HA SER B 80 -11.848 10.257 9.110 1.00 0.00 H new ATOM 0 HB2 SER B 80 -14.312 10.614 9.307 1.00 0.00 H new ATOM 0 HB3 SER B 80 -13.355 12.012 9.752 1.00 0.00 H new ATOM 0 HG SER B 80 -14.427 11.657 7.116 1.00 0.00 H new TER 2316 SER B 80