USER MOD reduce.3.24.130724 H: found=0, std=0, add=1001, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1003 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 42 THR OG1 : rot 64:sc= 1.3 USER MOD Set 1.2: B 68 SER OG : rot -77:sc= 0.469 USER MOD Set 2.1: B 43 ASN : amide:sc= -0.22 X(o=-0.43,f=0) USER MOD Set 2.2: B 47 GLN : amide:sc= -0.207 X(o=-0.43,f=0) USER MOD Set 3.1: A 43 ASN : amide:sc= 0.414 K(o=0.86,f=-0.17) USER MOD Set 3.2: A 47 GLN : amide:sc= 0.451 K(o=0.86,f=0) USER MOD Single : A 7 TYR OH : rot 100:sc= -0.39 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN :FLIP amide:sc= 0 F(o=-0.86,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 175:sc= 1.25 (180deg=1.15) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= -1.76! C(o=-1.8!,f=-8.4!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 69:sc= 1.14 USER MOD Single : A 35 MET CE :methyl 162:sc= -0.0626 (180deg=-0.594) USER MOD Single : A 39 ASN : amide:sc= -0.151 X(o=-0.15,f=-0.36) USER MOD Single : A 46 ASN :FLIP amide:sc= -0.615 F(o=-1.1,f=-0.62) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.318 K(o=-0.32,f=-0.91) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.0244 X(o=-0.024,f=-0.024) USER MOD Single : A 66 MET CE :methyl -115:sc= -0.262 (180deg=-2.63) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : B 8 THR OG1 : rot 26:sc= 0.118 USER MOD Single : B 11 GLN : amide:sc= -0.0617 X(o=-0.062,f=0) USER MOD Single : B 14 LYS NZ :NH3+ 179:sc= 1.01 (180deg=1.01) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= 0.245 K(o=0.24,f=-5.7!) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 71:sc= 1.32 USER MOD Single : B 35 MET CE :methyl -145:sc= -0.378 (180deg=-1.51) USER MOD Single : B 39 ASN : amide:sc= -0.965 K(o=-0.97,f=-2.3) USER MOD Single : B 42 THR OG1 : rot 84:sc= 1.25 USER MOD Single : B 46 ASN : amide:sc= -1.32 K(o=-1.3,f=-2.2) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.593 X(o=-0.59,f=-0.2) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 LYS NZ :NH3+ 146:sc= 1.24 (180deg=0.894) USER MOD Single : B 63 GLN : amide:sc= -0.241 K(o=-0.24,f=-0.79) USER MOD Single : B 66 MET CE :methyl -173:sc= -3.38! (180deg=-3.85!) USER MOD Single : B 67 SER OG : rot 75:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 97 N TYR A 7 -4.814 4.525 16.123 1.00 0.00 N ATOM 98 CA TYR A 7 -5.014 5.973 16.204 1.00 0.00 C ATOM 99 C TYR A 7 -6.492 6.325 16.278 1.00 0.00 C ATOM 100 O TYR A 7 -7.349 5.463 16.480 1.00 0.00 O ATOM 101 CB TYR A 7 -4.389 6.697 15.009 1.00 0.00 C ATOM 102 CG TYR A 7 -2.884 6.632 14.955 1.00 0.00 C ATOM 103 CD1 TYR A 7 -2.106 7.548 15.647 1.00 0.00 C ATOM 104 CD2 TYR A 7 -2.244 5.671 14.191 1.00 0.00 C ATOM 105 CE1 TYR A 7 -0.728 7.504 15.579 1.00 0.00 C ATOM 106 CE2 TYR A 7 -0.871 5.614 14.121 1.00 0.00 C ATOM 107 CZ TYR A 7 -0.115 6.536 14.813 1.00 0.00 C ATOM 108 OH TYR A 7 1.258 6.493 14.729 1.00 0.00 O ATOM 0 HA TYR A 7 -4.519 6.303 17.117 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -4.792 6.270 14.091 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.694 7.743 15.034 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -2.585 8.307 16.248 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -2.833 4.953 13.640 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.134 8.224 16.123 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -0.388 4.852 13.528 1.00 0.00 H new ATOM 0 HH TYR A 7 1.601 5.802 15.334 1.00 0.00 H new ATOM 118 N THR A 8 -6.774 7.608 16.150 1.00 0.00 N ATOM 119 CA THR A 8 -8.135 8.089 16.054 1.00 0.00 C ATOM 120 C THR A 8 -8.684 7.825 14.650 1.00 0.00 C ATOM 121 O THR A 8 -8.127 8.308 13.663 1.00 0.00 O ATOM 122 CB THR A 8 -8.193 9.597 16.363 1.00 0.00 C ATOM 123 OG1 THR A 8 -7.607 9.850 17.649 1.00 0.00 O ATOM 124 CG2 THR A 8 -9.624 10.115 16.340 1.00 0.00 C ATOM 0 H THR A 8 -6.067 8.342 16.110 1.00 0.00 H new ATOM 0 HA THR A 8 -8.746 7.557 16.784 1.00 0.00 H new ATOM 0 HB THR A 8 -7.631 10.122 15.590 1.00 0.00 H new ATOM 0 HG1 THR A 8 -7.644 10.810 17.842 1.00 0.00 H new ATOM 0 HG21 THR A 8 -9.628 11.182 16.562 1.00 0.00 H new ATOM 0 HG22 THR A 8 -10.056 9.948 15.353 1.00 0.00 H new ATOM 0 HG23 THR A 8 -10.214 9.586 17.088 1.00 0.00 H new ATOM 132 N ASP A 9 -9.760 7.041 14.574 1.00 0.00 N ATOM 133 CA ASP A 9 -10.391 6.695 13.297 1.00 0.00 C ATOM 134 C ASP A 9 -10.705 7.931 12.468 1.00 0.00 C ATOM 135 O ASP A 9 -10.536 7.926 11.249 1.00 0.00 O ATOM 136 CB ASP A 9 -11.674 5.894 13.532 1.00 0.00 C ATOM 137 CG ASP A 9 -11.429 4.401 13.575 1.00 0.00 C ATOM 138 OD1 ASP A 9 -10.981 3.888 14.622 1.00 0.00 O ATOM 139 OD2 ASP A 9 -11.677 3.728 12.553 1.00 0.00 O ATOM 0 H ASP A 9 -10.217 6.630 15.388 1.00 0.00 H new ATOM 0 HA ASP A 9 -9.679 6.086 12.741 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.129 6.211 14.470 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -12.388 6.118 12.740 1.00 0.00 H new ATOM 144 N GLU A 10 -11.156 8.989 13.134 1.00 0.00 N ATOM 145 CA GLU A 10 -11.450 10.247 12.463 1.00 0.00 C ATOM 146 C GLU A 10 -10.234 10.734 11.679 1.00 0.00 C ATOM 147 O GLU A 10 -10.332 11.027 10.488 1.00 0.00 O ATOM 148 CB GLU A 10 -11.872 11.310 13.479 1.00 0.00 C ATOM 149 CG GLU A 10 -12.046 12.692 12.869 1.00 0.00 C ATOM 150 CD GLU A 10 -12.389 13.752 13.893 1.00 0.00 C ATOM 151 OE1 GLU A 10 -11.652 13.880 14.893 1.00 0.00 O ATOM 152 OE2 GLU A 10 -13.390 14.469 13.695 1.00 0.00 O ATOM 0 H GLU A 10 -11.326 8.999 14.140 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.272 10.077 11.768 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.810 11.006 13.944 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.125 11.362 14.271 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -11.127 12.975 12.356 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -12.833 12.654 12.116 1.00 0.00 H new ATOM 159 N GLN A 11 -9.092 10.797 12.352 1.00 0.00 N ATOM 160 CA GLN A 11 -7.865 11.281 11.738 1.00 0.00 C ATOM 161 C GLN A 11 -7.542 10.495 10.471 1.00 0.00 C ATOM 162 O GLN A 11 -7.381 11.078 9.400 1.00 0.00 O ATOM 163 CB GLN A 11 -6.704 11.186 12.727 1.00 0.00 C ATOM 164 CG GLN A 11 -5.419 11.800 12.202 1.00 0.00 C ATOM 165 CD GLN A 11 -4.257 11.691 13.172 1.00 0.00 C ATOM 166 OE1 GLN A 11 -4.222 10.627 13.960 1.00 0.00 O flip ATOM 167 NE2 GLN A 11 -3.385 12.554 13.199 1.00 0.00 N flip ATOM 0 H GLN A 11 -8.991 10.517 13.328 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.012 12.326 11.464 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -6.984 11.684 13.655 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -6.526 10.138 12.969 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -5.148 11.312 11.266 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -5.594 12.851 11.974 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -3.446 13.360 12.577 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -2.600 12.465 13.844 1.00 0.00 H new ATOM 176 N VAL A 12 -7.480 9.172 10.597 1.00 0.00 N ATOM 177 CA VAL A 12 -7.148 8.310 9.468 1.00 0.00 C ATOM 178 C VAL A 12 -8.099 8.548 8.297 1.00 0.00 C ATOM 179 O VAL A 12 -7.662 8.819 7.176 1.00 0.00 O ATOM 180 CB VAL A 12 -7.196 6.811 9.855 1.00 0.00 C ATOM 181 CG1 VAL A 12 -6.909 5.932 8.644 1.00 0.00 C ATOM 182 CG2 VAL A 12 -6.220 6.496 10.984 1.00 0.00 C ATOM 0 H VAL A 12 -7.655 8.674 11.470 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.131 8.565 9.171 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.203 6.595 10.212 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -6.948 4.883 8.938 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.656 6.120 7.873 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.918 6.163 8.254 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.279 5.436 11.231 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.206 6.739 10.667 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -6.477 7.088 11.863 1.00 0.00 H new ATOM 192 N GLU A 13 -9.398 8.477 8.573 1.00 0.00 N ATOM 193 CA GLU A 13 -10.414 8.592 7.533 1.00 0.00 C ATOM 194 C GLU A 13 -10.313 9.919 6.780 1.00 0.00 C ATOM 195 O GLU A 13 -10.347 9.948 5.547 1.00 0.00 O ATOM 196 CB GLU A 13 -11.809 8.459 8.140 1.00 0.00 C ATOM 197 CG GLU A 13 -12.926 8.557 7.115 1.00 0.00 C ATOM 198 CD GLU A 13 -14.294 8.574 7.754 1.00 0.00 C ATOM 199 OE1 GLU A 13 -14.759 9.670 8.133 1.00 0.00 O ATOM 200 OE2 GLU A 13 -14.910 7.497 7.881 1.00 0.00 O ATOM 0 H GLU A 13 -9.772 8.340 9.512 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.241 7.784 6.822 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -11.883 7.502 8.656 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -11.946 9.237 8.891 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.793 9.462 6.523 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -12.860 7.714 6.428 1.00 0.00 H new ATOM 207 N LYS A 14 -10.189 11.016 7.515 1.00 0.00 N ATOM 208 CA LYS A 14 -10.184 12.333 6.893 1.00 0.00 C ATOM 209 C LYS A 14 -8.907 12.572 6.092 1.00 0.00 C ATOM 210 O LYS A 14 -8.940 13.261 5.073 1.00 0.00 O ATOM 211 CB LYS A 14 -10.399 13.446 7.924 1.00 0.00 C ATOM 212 CG LYS A 14 -11.867 13.693 8.261 1.00 0.00 C ATOM 213 CD LYS A 14 -12.459 12.573 9.101 1.00 0.00 C ATOM 214 CE LYS A 14 -13.960 12.735 9.289 1.00 0.00 C ATOM 215 NZ LYS A 14 -14.721 12.291 8.091 1.00 0.00 N ATOM 0 H LYS A 14 -10.092 11.021 8.530 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.023 12.359 6.197 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.863 13.191 8.838 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.962 14.370 7.545 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.961 14.637 8.798 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -12.438 13.794 7.338 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.255 11.615 8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.971 12.554 10.076 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.281 12.159 10.157 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.189 13.780 9.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.741 12.338 8.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.496 12.912 7.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.459 11.312 7.856 1.00 0.00 H new ATOM 229 N ILE A 15 -7.792 11.993 6.531 1.00 0.00 N ATOM 230 CA ILE A 15 -6.546 12.095 5.775 1.00 0.00 C ATOM 231 C ILE A 15 -6.661 11.304 4.474 1.00 0.00 C ATOM 232 O ILE A 15 -6.168 11.727 3.427 1.00 0.00 O ATOM 233 CB ILE A 15 -5.325 11.587 6.574 1.00 0.00 C ATOM 234 CG1 ILE A 15 -5.177 12.357 7.885 1.00 0.00 C ATOM 235 CG2 ILE A 15 -4.058 11.733 5.745 1.00 0.00 C ATOM 236 CD1 ILE A 15 -4.040 11.863 8.759 1.00 0.00 C ATOM 0 H ILE A 15 -7.725 11.455 7.395 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.387 13.153 5.564 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.483 10.534 6.805 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -5.019 13.412 7.660 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.110 12.287 8.444 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.204 11.372 6.318 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.153 11.149 4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.907 12.783 5.492 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.998 12.458 9.671 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.206 10.817 9.015 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -3.098 11.959 8.219 1.00 0.00 H new ATOM 248 N LEU A 16 -7.333 10.163 4.550 1.00 0.00 N ATOM 249 CA LEU A 16 -7.593 9.344 3.374 1.00 0.00 C ATOM 250 C LEU A 16 -8.414 10.120 2.352 1.00 0.00 C ATOM 251 O LEU A 16 -8.159 10.045 1.150 1.00 0.00 O ATOM 252 CB LEU A 16 -8.328 8.063 3.769 1.00 0.00 C ATOM 253 CG LEU A 16 -7.493 7.053 4.548 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.356 5.883 4.987 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.332 6.571 3.698 1.00 0.00 C ATOM 0 H LEU A 16 -7.709 9.782 5.418 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.636 9.078 2.925 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.198 8.332 4.369 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.701 7.583 2.864 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.093 7.538 5.439 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.747 5.170 5.542 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.163 6.245 5.625 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.779 5.394 4.110 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.742 5.850 4.264 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.715 6.097 2.794 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.704 7.419 3.425 1.00 0.00 H new ATOM 267 N ALA A 17 -9.396 10.869 2.843 1.00 0.00 N ATOM 268 CA ALA A 17 -10.226 11.708 1.987 1.00 0.00 C ATOM 269 C ALA A 17 -9.376 12.739 1.249 1.00 0.00 C ATOM 270 O ALA A 17 -9.606 13.020 0.072 1.00 0.00 O ATOM 271 CB ALA A 17 -11.302 12.396 2.812 1.00 0.00 C ATOM 0 H ALA A 17 -9.637 10.912 3.833 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.707 11.073 1.244 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -11.916 13.020 2.162 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.929 11.644 3.291 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.834 13.018 3.575 1.00 0.00 H new ATOM 277 N GLU A 18 -8.384 13.281 1.947 1.00 0.00 N ATOM 278 CA GLU A 18 -7.465 14.246 1.356 1.00 0.00 C ATOM 279 C GLU A 18 -6.735 13.624 0.172 1.00 0.00 C ATOM 280 O GLU A 18 -6.734 14.170 -0.931 1.00 0.00 O ATOM 281 CB GLU A 18 -6.435 14.700 2.389 1.00 0.00 C ATOM 282 CG GLU A 18 -7.032 15.219 3.685 1.00 0.00 C ATOM 283 CD GLU A 18 -7.642 16.594 3.548 1.00 0.00 C ATOM 284 OE1 GLU A 18 -8.761 16.705 3.012 1.00 0.00 O ATOM 285 OE2 GLU A 18 -7.008 17.568 4.005 1.00 0.00 O ATOM 0 H GLU A 18 -8.196 13.067 2.926 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.046 15.104 1.018 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.774 13.864 2.617 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.818 15.483 1.949 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -7.796 14.522 4.031 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -6.256 15.247 4.450 1.00 0.00 H new ATOM 292 N VAL A 19 -6.130 12.466 0.412 1.00 0.00 N ATOM 293 CA VAL A 19 -5.374 11.764 -0.618 1.00 0.00 C ATOM 294 C VAL A 19 -6.280 11.372 -1.783 1.00 0.00 C ATOM 295 O VAL A 19 -5.893 11.477 -2.948 1.00 0.00 O ATOM 296 CB VAL A 19 -4.689 10.502 -0.051 1.00 0.00 C ATOM 297 CG1 VAL A 19 -3.846 9.815 -1.117 1.00 0.00 C ATOM 298 CG2 VAL A 19 -3.837 10.851 1.159 1.00 0.00 C ATOM 0 H VAL A 19 -6.149 11.992 1.315 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.604 12.447 -0.976 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.469 9.809 0.265 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.374 8.929 -0.692 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.483 9.522 -1.952 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.077 10.501 -1.471 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.363 9.948 1.543 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.069 11.568 0.869 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.467 11.288 1.934 1.00 0.00 H new ATOM 308 N ALA A 20 -7.493 10.937 -1.460 1.00 0.00 N ATOM 309 CA ALA A 20 -8.470 10.564 -2.474 1.00 0.00 C ATOM 310 C ALA A 20 -8.767 11.735 -3.410 1.00 0.00 C ATOM 311 O ALA A 20 -8.947 11.548 -4.615 1.00 0.00 O ATOM 312 CB ALA A 20 -9.749 10.065 -1.818 1.00 0.00 C ATOM 0 H ALA A 20 -7.823 10.834 -0.500 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.047 9.757 -3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.470 9.790 -2.588 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.526 9.194 -1.202 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.169 10.853 -1.193 1.00 0.00 H new ATOM 318 N LEU A 21 -8.797 12.942 -2.857 1.00 0.00 N ATOM 319 CA LEU A 21 -9.040 14.137 -3.656 1.00 0.00 C ATOM 320 C LEU A 21 -7.847 14.434 -4.558 1.00 0.00 C ATOM 321 O LEU A 21 -8.009 14.926 -5.676 1.00 0.00 O ATOM 322 CB LEU A 21 -9.341 15.339 -2.763 1.00 0.00 C ATOM 323 CG LEU A 21 -10.608 15.215 -1.915 1.00 0.00 C ATOM 324 CD1 LEU A 21 -10.819 16.475 -1.095 1.00 0.00 C ATOM 325 CD2 LEU A 21 -11.821 14.937 -2.794 1.00 0.00 C ATOM 0 H LEU A 21 -8.657 13.119 -1.862 1.00 0.00 H new ATOM 0 HA LEU A 21 -9.911 13.949 -4.283 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.492 15.500 -2.099 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -9.428 16.226 -3.391 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.485 14.374 -1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.724 16.372 -0.497 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -9.964 16.628 -0.436 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.920 17.331 -1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -12.711 14.853 -2.170 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -11.951 15.754 -3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -11.670 14.005 -3.338 1.00 0.00 H new ATOM 337 N VAL A 22 -6.648 14.121 -4.078 1.00 0.00 N ATOM 338 CA VAL A 22 -5.444 14.280 -4.883 1.00 0.00 C ATOM 339 C VAL A 22 -5.483 13.312 -6.064 1.00 0.00 C ATOM 340 O VAL A 22 -5.128 13.667 -7.191 1.00 0.00 O ATOM 341 CB VAL A 22 -4.165 14.033 -4.051 1.00 0.00 C ATOM 342 CG1 VAL A 22 -2.918 14.259 -4.892 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.140 14.924 -2.818 1.00 0.00 C ATOM 0 H VAL A 22 -6.485 13.757 -3.139 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.416 15.308 -5.245 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.175 12.993 -3.724 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.031 14.079 -4.284 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.922 13.574 -5.740 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.906 15.286 -5.256 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.231 14.732 -2.249 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.162 15.970 -3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.009 14.709 -2.196 1.00 0.00 H new ATOM 353 N LEU A 23 -5.949 12.097 -5.800 1.00 0.00 N ATOM 354 CA LEU A 23 -6.082 11.077 -6.833 1.00 0.00 C ATOM 355 C LEU A 23 -7.172 11.465 -7.829 1.00 0.00 C ATOM 356 O LEU A 23 -7.091 11.145 -9.016 1.00 0.00 O ATOM 357 CB LEU A 23 -6.411 9.725 -6.197 1.00 0.00 C ATOM 358 CG LEU A 23 -5.423 9.251 -5.131 1.00 0.00 C ATOM 359 CD1 LEU A 23 -5.873 7.931 -4.534 1.00 0.00 C ATOM 360 CD2 LEU A 23 -4.025 9.129 -5.711 1.00 0.00 C ATOM 0 H LEU A 23 -6.243 11.793 -4.872 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.135 10.998 -7.367 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.403 9.783 -5.750 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.460 8.973 -6.985 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.397 9.995 -4.335 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.157 7.611 -3.778 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.854 8.055 -4.075 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.932 7.178 -5.320 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.338 8.790 -4.936 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.032 8.409 -6.529 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -3.700 10.100 -6.085 1.00 0.00 H new ATOM 372 N GLU A 24 -8.186 12.157 -7.326 1.00 0.00 N ATOM 373 CA GLU A 24 -9.286 12.641 -8.147 1.00 0.00 C ATOM 374 C GLU A 24 -8.814 13.731 -9.109 1.00 0.00 C ATOM 375 O GLU A 24 -8.998 13.626 -10.323 1.00 0.00 O ATOM 376 CB GLU A 24 -10.400 13.187 -7.245 1.00 0.00 C ATOM 377 CG GLU A 24 -11.571 13.783 -8.005 1.00 0.00 C ATOM 378 CD GLU A 24 -12.603 14.400 -7.088 1.00 0.00 C ATOM 379 OE1 GLU A 24 -12.399 15.549 -6.645 1.00 0.00 O ATOM 380 OE2 GLU A 24 -13.627 13.741 -6.812 1.00 0.00 O ATOM 0 H GLU A 24 -8.268 12.398 -6.338 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.668 11.809 -8.738 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.765 12.382 -6.608 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.981 13.949 -6.587 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.203 14.542 -8.696 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.043 13.006 -8.607 1.00 0.00 H new ATOM 387 N LYS A 25 -8.183 14.763 -8.560 1.00 0.00 N ATOM 388 CA LYS A 25 -7.763 15.920 -9.344 1.00 0.00 C ATOM 389 C LYS A 25 -6.700 15.564 -10.382 1.00 0.00 C ATOM 390 O LYS A 25 -6.536 16.268 -11.377 1.00 0.00 O ATOM 391 CB LYS A 25 -7.247 17.024 -8.420 1.00 0.00 C ATOM 392 CG LYS A 25 -8.336 17.636 -7.555 1.00 0.00 C ATOM 393 CD LYS A 25 -7.820 18.804 -6.728 1.00 0.00 C ATOM 394 CE LYS A 25 -6.911 18.354 -5.595 1.00 0.00 C ATOM 395 NZ LYS A 25 -6.501 19.497 -4.732 1.00 0.00 N ATOM 0 H LYS A 25 -7.950 14.822 -7.569 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.638 16.277 -9.887 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.467 16.616 -7.777 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.786 17.807 -9.022 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.155 17.975 -8.190 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.742 16.873 -6.891 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.276 19.492 -7.375 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.665 19.355 -6.315 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.425 17.607 -4.990 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.024 17.874 -6.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.882 19.153 -3.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.988 20.198 -5.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.346 19.940 -4.318 1.00 0.00 H new ATOM 409 N HIS A 26 -5.977 14.477 -10.152 1.00 0.00 N ATOM 410 CA HIS A 26 -4.960 14.042 -11.103 1.00 0.00 C ATOM 411 C HIS A 26 -5.472 12.906 -11.983 1.00 0.00 C ATOM 412 O HIS A 26 -4.781 12.481 -12.909 1.00 0.00 O ATOM 413 CB HIS A 26 -3.684 13.603 -10.382 1.00 0.00 C ATOM 414 CG HIS A 26 -2.896 14.734 -9.790 1.00 0.00 C ATOM 415 ND1 HIS A 26 -2.062 15.545 -10.529 1.00 0.00 N ATOM 416 CD2 HIS A 26 -2.800 15.168 -8.512 1.00 0.00 C ATOM 417 CE1 HIS A 26 -1.485 16.423 -9.731 1.00 0.00 C ATOM 418 NE2 HIS A 26 -1.917 16.214 -8.504 1.00 0.00 N ATOM 0 H HIS A 26 -6.072 13.886 -9.326 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.728 14.896 -11.739 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.950 12.905 -9.588 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.050 13.061 -11.084 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -3.323 14.764 -7.657 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -0.779 17.183 -10.032 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -1.638 16.746 -7.680 1.00 0.00 H new ATOM 427 N ALA A 27 -6.682 12.425 -11.686 1.00 0.00 N ATOM 428 CA ALA A 27 -7.295 11.324 -12.435 1.00 0.00 C ATOM 429 C ALA A 27 -6.370 10.106 -12.472 1.00 0.00 C ATOM 430 O ALA A 27 -6.168 9.492 -13.521 1.00 0.00 O ATOM 431 CB ALA A 27 -7.647 11.784 -13.845 1.00 0.00 C ATOM 0 H ALA A 27 -7.260 12.784 -10.926 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.213 11.027 -11.927 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -8.102 10.959 -14.394 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.350 12.616 -13.792 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.742 12.106 -14.359 1.00 0.00 H new ATOM 437 N ALA A 28 -5.831 9.757 -11.311 1.00 0.00 N ATOM 438 CA ALA A 28 -4.855 8.677 -11.201 1.00 0.00 C ATOM 439 C ALA A 28 -5.464 7.317 -11.539 1.00 0.00 C ATOM 440 O ALA A 28 -6.514 6.944 -11.010 1.00 0.00 O ATOM 441 CB ALA A 28 -4.259 8.652 -9.801 1.00 0.00 C ATOM 0 H ALA A 28 -6.055 10.210 -10.425 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.067 8.871 -11.928 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.532 7.843 -9.729 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.765 9.602 -9.599 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.052 8.493 -9.071 1.00 0.00 H new ATOM 447 N SER A 29 -4.794 6.589 -12.427 1.00 0.00 N ATOM 448 CA SER A 29 -5.201 5.240 -12.804 1.00 0.00 C ATOM 449 C SER A 29 -5.033 4.278 -11.620 1.00 0.00 C ATOM 450 O SER A 29 -4.300 4.580 -10.680 1.00 0.00 O ATOM 451 CB SER A 29 -4.359 4.775 -13.996 1.00 0.00 C ATOM 452 OG SER A 29 -4.374 5.741 -15.034 1.00 0.00 O ATOM 0 H SER A 29 -3.955 6.917 -12.905 1.00 0.00 H new ATOM 0 HA SER A 29 -6.254 5.246 -13.086 1.00 0.00 H new ATOM 0 HB2 SER A 29 -3.333 4.597 -13.674 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.744 3.827 -14.371 1.00 0.00 H new ATOM 0 HG SER A 29 -3.829 5.424 -15.784 1.00 0.00 H new ATOM 458 N PRO A 30 -5.704 3.108 -11.651 1.00 0.00 N ATOM 459 CA PRO A 30 -5.669 2.135 -10.547 1.00 0.00 C ATOM 460 C PRO A 30 -4.254 1.718 -10.142 1.00 0.00 C ATOM 461 O PRO A 30 -3.879 1.859 -8.978 1.00 0.00 O ATOM 462 CB PRO A 30 -6.441 0.935 -11.093 1.00 0.00 C ATOM 463 CG PRO A 30 -7.325 1.498 -12.151 1.00 0.00 C ATOM 464 CD PRO A 30 -6.567 2.647 -12.756 1.00 0.00 C ATOM 0 HA PRO A 30 -6.095 2.563 -9.640 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -5.766 0.183 -11.501 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.022 0.449 -10.309 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.560 0.746 -12.904 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.272 1.834 -11.730 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -5.981 2.331 -13.619 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -7.238 3.435 -13.098 1.00 0.00 H new ATOM 472 N GLU A 31 -3.464 1.213 -11.092 1.00 0.00 N ATOM 473 CA GLU A 31 -2.096 0.796 -10.786 1.00 0.00 C ATOM 474 C GLU A 31 -1.273 1.976 -10.290 1.00 0.00 C ATOM 475 O GLU A 31 -0.489 1.839 -9.360 1.00 0.00 O ATOM 476 CB GLU A 31 -1.405 0.160 -11.993 1.00 0.00 C ATOM 477 CG GLU A 31 -1.944 -1.208 -12.370 1.00 0.00 C ATOM 478 CD GLU A 31 -1.006 -1.955 -13.298 1.00 0.00 C ATOM 479 OE1 GLU A 31 -0.940 -1.596 -14.493 1.00 0.00 O ATOM 480 OE2 GLU A 31 -0.327 -2.899 -12.828 1.00 0.00 O ATOM 0 H GLU A 31 -3.743 1.085 -12.065 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.163 0.043 -10.001 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.507 0.827 -12.849 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.339 0.073 -11.783 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.103 -1.796 -11.466 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -2.915 -1.094 -12.852 1.00 0.00 H new ATOM 487 N LEU A 32 -1.462 3.132 -10.916 1.00 0.00 N ATOM 488 CA LEU A 32 -0.805 4.358 -10.479 1.00 0.00 C ATOM 489 C LEU A 32 -1.155 4.650 -9.023 1.00 0.00 C ATOM 490 O LEU A 32 -0.279 4.902 -8.200 1.00 0.00 O ATOM 491 CB LEU A 32 -1.230 5.525 -11.375 1.00 0.00 C ATOM 492 CG LEU A 32 -0.662 6.892 -10.991 1.00 0.00 C ATOM 493 CD1 LEU A 32 0.857 6.874 -11.039 1.00 0.00 C ATOM 494 CD2 LEU A 32 -1.212 7.966 -11.911 1.00 0.00 C ATOM 0 H LEU A 32 -2.066 3.246 -11.730 1.00 0.00 H new ATOM 0 HA LEU A 32 0.275 4.231 -10.557 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.931 5.302 -12.399 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.318 5.588 -11.368 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.967 7.119 -9.970 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.241 7.856 -10.763 1.00 0.00 H new ATOM 0 HD12 LEU A 32 1.234 6.127 -10.341 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.186 6.626 -12.048 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.800 8.934 -11.627 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.933 7.741 -12.940 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.298 7.995 -11.827 1.00 0.00 H new ATOM 506 N THR A 33 -2.444 4.588 -8.725 1.00 0.00 N ATOM 507 CA THR A 33 -2.957 4.783 -7.375 1.00 0.00 C ATOM 508 C THR A 33 -2.265 3.855 -6.377 1.00 0.00 C ATOM 509 O THR A 33 -1.764 4.293 -5.339 1.00 0.00 O ATOM 510 CB THR A 33 -4.475 4.510 -7.349 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.160 5.443 -8.195 1.00 0.00 O ATOM 512 CG2 THR A 33 -5.037 4.585 -5.940 1.00 0.00 C ATOM 0 H THR A 33 -3.169 4.400 -9.417 1.00 0.00 H new ATOM 0 HA THR A 33 -2.755 5.815 -7.087 1.00 0.00 H new ATOM 0 HB THR A 33 -4.632 3.497 -7.719 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.943 5.255 -9.132 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.109 4.387 -5.965 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.545 3.842 -5.312 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.861 5.580 -5.531 1.00 0.00 H new ATOM 520 N LEU A 34 -2.231 2.574 -6.707 1.00 0.00 N ATOM 521 CA LEU A 34 -1.672 1.575 -5.816 1.00 0.00 C ATOM 522 C LEU A 34 -0.149 1.704 -5.740 1.00 0.00 C ATOM 523 O LEU A 34 0.449 1.488 -4.685 1.00 0.00 O ATOM 524 CB LEU A 34 -2.099 0.178 -6.277 1.00 0.00 C ATOM 525 CG LEU A 34 -1.791 -0.957 -5.301 1.00 0.00 C ATOM 526 CD1 LEU A 34 -2.869 -2.027 -5.374 1.00 0.00 C ATOM 527 CD2 LEU A 34 -0.431 -1.563 -5.605 1.00 0.00 C ATOM 0 H LEU A 34 -2.585 2.203 -7.588 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.057 1.737 -4.809 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.172 0.189 -6.468 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.609 -0.039 -7.226 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.773 -0.547 -4.291 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.635 -2.828 -4.673 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -3.834 -1.590 -5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -2.913 -2.431 -6.385 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.227 -2.370 -4.901 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.428 -1.958 -6.621 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.338 -0.796 -5.511 1.00 0.00 H new ATOM 539 N MET A 35 0.477 2.073 -6.853 1.00 0.00 N ATOM 540 CA MET A 35 1.919 2.298 -6.872 1.00 0.00 C ATOM 541 C MET A 35 2.279 3.483 -5.985 1.00 0.00 C ATOM 542 O MET A 35 3.327 3.491 -5.345 1.00 0.00 O ATOM 543 CB MET A 35 2.427 2.531 -8.299 1.00 0.00 C ATOM 544 CG MET A 35 3.928 2.790 -8.375 1.00 0.00 C ATOM 545 SD MET A 35 4.533 2.941 -10.067 1.00 0.00 S ATOM 546 CE MET A 35 3.572 4.332 -10.657 1.00 0.00 C ATOM 0 H MET A 35 0.012 2.222 -7.749 1.00 0.00 H new ATOM 0 HA MET A 35 2.404 1.402 -6.484 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.185 1.661 -8.909 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.897 3.380 -8.731 1.00 0.00 H new ATOM 0 HG2 MET A 35 4.161 3.704 -7.829 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.457 1.977 -7.877 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.042 4.747 -11.549 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.562 4.000 -10.899 1.00 0.00 H new ATOM 0 HE3 MET A 35 3.526 5.097 -9.882 1.00 0.00 H new ATOM 556 N ILE A 36 1.399 4.477 -5.950 1.00 0.00 N ATOM 557 CA ILE A 36 1.563 5.617 -5.058 1.00 0.00 C ATOM 558 C ILE A 36 1.569 5.153 -3.606 1.00 0.00 C ATOM 559 O ILE A 36 2.420 5.567 -2.818 1.00 0.00 O ATOM 560 CB ILE A 36 0.451 6.667 -5.279 1.00 0.00 C ATOM 561 CG1 ILE A 36 0.657 7.355 -6.631 1.00 0.00 C ATOM 562 CG2 ILE A 36 0.421 7.690 -4.147 1.00 0.00 C ATOM 563 CD1 ILE A 36 -0.421 8.352 -6.982 1.00 0.00 C ATOM 0 H ILE A 36 0.562 4.516 -6.532 1.00 0.00 H new ATOM 0 HA ILE A 36 2.519 6.088 -5.286 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.513 6.158 -5.281 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.621 7.864 -6.625 1.00 0.00 H new ATOM 0 HG13 ILE A 36 0.703 6.595 -7.411 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -0.372 8.415 -4.332 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.234 7.181 -3.201 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.380 8.206 -4.098 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.204 8.796 -7.953 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.386 7.846 -7.022 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.453 9.135 -6.224 1.00 0.00 H new ATOM 575 N ALA A 37 0.632 4.273 -3.268 1.00 0.00 N ATOM 576 CA ALA A 37 0.589 3.672 -1.939 1.00 0.00 C ATOM 577 C ALA A 37 1.893 2.941 -1.642 1.00 0.00 C ATOM 578 O ALA A 37 2.449 3.050 -0.548 1.00 0.00 O ATOM 579 CB ALA A 37 -0.589 2.715 -1.829 1.00 0.00 C ATOM 0 H ALA A 37 -0.108 3.960 -3.896 1.00 0.00 H new ATOM 0 HA ALA A 37 0.462 4.467 -1.204 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.608 2.274 -0.832 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.517 3.259 -2.003 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.487 1.925 -2.573 1.00 0.00 H new ATOM 585 N GLY A 38 2.379 2.205 -2.631 1.00 0.00 N ATOM 586 CA GLY A 38 3.631 1.493 -2.485 1.00 0.00 C ATOM 587 C GLY A 38 4.809 2.424 -2.328 1.00 0.00 C ATOM 588 O GLY A 38 5.710 2.167 -1.531 1.00 0.00 O ATOM 0 H GLY A 38 1.925 2.088 -3.537 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.573 0.836 -1.617 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.788 0.857 -3.356 1.00 0.00 H new ATOM 592 N ASN A 39 4.798 3.510 -3.085 1.00 0.00 N ATOM 593 CA ASN A 39 5.854 4.510 -3.022 1.00 0.00 C ATOM 594 C ASN A 39 5.868 5.157 -1.637 1.00 0.00 C ATOM 595 O ASN A 39 6.931 5.415 -1.069 1.00 0.00 O ATOM 596 CB ASN A 39 5.643 5.555 -4.127 1.00 0.00 C ATOM 597 CG ASN A 39 6.908 6.323 -4.473 1.00 0.00 C ATOM 598 OD1 ASN A 39 7.736 6.607 -3.612 1.00 0.00 O ATOM 599 ND2 ASN A 39 7.078 6.645 -5.750 1.00 0.00 N ATOM 0 H ASN A 39 4.061 3.723 -3.757 1.00 0.00 H new ATOM 0 HA ASN A 39 6.823 4.037 -3.184 1.00 0.00 H new ATOM 0 HB2 ASN A 39 5.271 5.057 -5.023 1.00 0.00 H new ATOM 0 HB3 ASN A 39 4.873 6.259 -3.811 1.00 0.00 H new ATOM 0 HD21 ASN A 39 7.918 7.144 -6.043 1.00 0.00 H new ATOM 0 HD22 ASN A 39 6.369 6.393 -6.438 1.00 0.00 H new ATOM 606 N ILE A 40 4.674 5.379 -1.083 1.00 0.00 N ATOM 607 CA ILE A 40 4.539 5.862 0.288 1.00 0.00 C ATOM 608 C ILE A 40 5.247 4.919 1.255 1.00 0.00 C ATOM 609 O ILE A 40 6.135 5.333 2.003 1.00 0.00 O ATOM 610 CB ILE A 40 3.055 5.989 0.714 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.345 7.087 -0.079 1.00 0.00 C ATOM 612 CG2 ILE A 40 2.950 6.268 2.206 1.00 0.00 C ATOM 613 CD1 ILE A 40 0.877 7.221 0.265 1.00 0.00 C ATOM 0 H ILE A 40 3.788 5.231 -1.565 1.00 0.00 H new ATOM 0 HA ILE A 40 4.996 6.851 0.322 1.00 0.00 H new ATOM 0 HB ILE A 40 2.563 5.041 0.497 1.00 0.00 H new ATOM 0 HG12 ILE A 40 2.843 8.039 0.106 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.444 6.878 -1.144 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.900 6.354 2.487 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.409 5.450 2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.466 7.200 2.439 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.434 8.017 -0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.366 6.282 0.053 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.772 7.461 1.323 1.00 0.00 H new ATOM 625 N ALA A 41 4.856 3.645 1.224 1.00 0.00 N ATOM 626 CA ALA A 41 5.438 2.644 2.105 1.00 0.00 C ATOM 627 C ALA A 41 6.943 2.543 1.897 1.00 0.00 C ATOM 628 O ALA A 41 7.701 2.462 2.859 1.00 0.00 O ATOM 629 CB ALA A 41 4.780 1.292 1.882 1.00 0.00 C ATOM 0 H ALA A 41 4.137 3.286 0.596 1.00 0.00 H new ATOM 0 HA ALA A 41 5.258 2.954 3.134 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.227 0.555 2.549 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.713 1.368 2.089 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.928 0.982 0.848 1.00 0.00 H new ATOM 635 N THR A 42 7.366 2.571 0.638 1.00 0.00 N ATOM 636 CA THR A 42 8.781 2.497 0.301 1.00 0.00 C ATOM 637 C THR A 42 9.556 3.645 0.949 1.00 0.00 C ATOM 638 O THR A 42 10.596 3.426 1.563 1.00 0.00 O ATOM 639 CB THR A 42 8.991 2.517 -1.228 1.00 0.00 C ATOM 640 OG1 THR A 42 8.288 1.420 -1.830 1.00 0.00 O ATOM 641 CG2 THR A 42 10.466 2.420 -1.584 1.00 0.00 C ATOM 0 H THR A 42 6.746 2.645 -0.168 1.00 0.00 H new ATOM 0 HA THR A 42 9.162 1.553 0.690 1.00 0.00 H new ATOM 0 HB THR A 42 8.604 3.463 -1.607 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.325 1.527 -1.680 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.581 2.437 -2.668 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.001 3.264 -1.150 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.875 1.490 -1.190 1.00 0.00 H new ATOM 649 N ASN A 43 9.029 4.861 0.837 1.00 0.00 N ATOM 650 CA ASN A 43 9.658 6.029 1.452 1.00 0.00 C ATOM 651 C ASN A 43 9.749 5.855 2.968 1.00 0.00 C ATOM 652 O ASN A 43 10.754 6.214 3.589 1.00 0.00 O ATOM 653 CB ASN A 43 8.872 7.298 1.111 1.00 0.00 C ATOM 654 CG ASN A 43 9.438 8.542 1.776 1.00 0.00 C ATOM 655 OD1 ASN A 43 10.647 8.659 1.997 1.00 0.00 O ATOM 656 ND2 ASN A 43 8.564 9.478 2.106 1.00 0.00 N ATOM 0 H ASN A 43 8.169 5.065 0.327 1.00 0.00 H new ATOM 0 HA ASN A 43 10.668 6.125 1.054 1.00 0.00 H new ATOM 0 HB2 ASN A 43 8.871 7.439 0.030 1.00 0.00 H new ATOM 0 HB3 ASN A 43 7.834 7.169 1.417 1.00 0.00 H new ATOM 0 HD21 ASN A 43 8.881 10.334 2.560 1.00 0.00 H new ATOM 0 HD22 ASN A 43 7.573 9.343 1.906 1.00 0.00 H new ATOM 663 N VAL A 44 8.703 5.287 3.559 1.00 0.00 N ATOM 664 CA VAL A 44 8.709 4.984 4.984 1.00 0.00 C ATOM 665 C VAL A 44 9.806 3.966 5.294 1.00 0.00 C ATOM 666 O VAL A 44 10.561 4.121 6.250 1.00 0.00 O ATOM 667 CB VAL A 44 7.346 4.435 5.465 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.368 4.169 6.965 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.223 5.400 5.112 1.00 0.00 C ATOM 0 H VAL A 44 7.843 5.028 3.075 1.00 0.00 H new ATOM 0 HA VAL A 44 8.901 5.916 5.516 1.00 0.00 H new ATOM 0 HB VAL A 44 7.162 3.490 4.953 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.398 3.783 7.280 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.142 3.436 7.193 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.580 5.097 7.496 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.273 4.995 5.459 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.405 6.361 5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.186 5.536 4.031 1.00 0.00 H new ATOM 679 N LEU A 45 9.905 2.947 4.449 1.00 0.00 N ATOM 680 CA LEU A 45 10.923 1.911 4.597 1.00 0.00 C ATOM 681 C LEU A 45 12.324 2.479 4.372 1.00 0.00 C ATOM 682 O LEU A 45 13.321 1.902 4.811 1.00 0.00 O ATOM 683 CB LEU A 45 10.661 0.767 3.615 1.00 0.00 C ATOM 684 CG LEU A 45 9.295 0.088 3.754 1.00 0.00 C ATOM 685 CD1 LEU A 45 9.055 -0.873 2.599 1.00 0.00 C ATOM 686 CD2 LEU A 45 9.197 -0.642 5.086 1.00 0.00 C ATOM 0 H LEU A 45 9.288 2.815 3.648 1.00 0.00 H new ATOM 0 HA LEU A 45 10.868 1.529 5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.756 1.152 2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.438 0.014 3.744 1.00 0.00 H new ATOM 0 HG LEU A 45 8.524 0.857 3.725 1.00 0.00 H new ATOM 0 HD11 LEU A 45 8.080 -1.346 2.716 1.00 0.00 H new ATOM 0 HD12 LEU A 45 9.082 -0.324 1.658 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.831 -1.639 2.595 1.00 0.00 H new ATOM 0 HD21 LEU A 45 8.220 -1.119 5.169 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.977 -1.401 5.143 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.323 0.070 5.901 1.00 0.00 H new ATOM 698 N ASN A 46 12.393 3.610 3.681 1.00 0.00 N ATOM 699 CA ASN A 46 13.666 4.258 3.389 1.00 0.00 C ATOM 700 C ASN A 46 14.143 5.114 4.556 1.00 0.00 C ATOM 701 O ASN A 46 15.265 4.955 5.034 1.00 0.00 O ATOM 702 CB ASN A 46 13.563 5.147 2.139 1.00 0.00 C ATOM 703 CG ASN A 46 13.374 4.377 0.842 1.00 0.00 C ATOM 704 OD1 ASN A 46 13.912 3.170 0.770 1.00 0.00 O flip ATOM 705 ND2 ASN A 46 12.757 4.876 -0.099 1.00 0.00 N flip ATOM 0 H ASN A 46 11.578 4.100 3.311 1.00 0.00 H new ATOM 0 HA ASN A 46 14.386 3.459 3.213 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.728 5.836 2.265 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.466 5.752 2.061 1.00 0.00 H new ATOM 0 HD21 ASN A 46 12.355 5.809 -0.008 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.647 4.356 -0.970 1.00 0.00 H new ATOM 712 N GLN A 47 13.297 6.033 5.010 1.00 0.00 N ATOM 713 CA GLN A 47 13.742 7.060 5.947 1.00 0.00 C ATOM 714 C GLN A 47 12.958 7.067 7.258 1.00 0.00 C ATOM 715 O GLN A 47 13.320 7.789 8.183 1.00 0.00 O ATOM 716 CB GLN A 47 13.615 8.441 5.298 1.00 0.00 C ATOM 717 CG GLN A 47 14.378 8.586 3.993 1.00 0.00 C ATOM 718 CD GLN A 47 14.179 9.944 3.352 1.00 0.00 C ATOM 719 OE1 GLN A 47 14.930 10.885 3.614 1.00 0.00 O ATOM 720 NE2 GLN A 47 13.161 10.064 2.513 1.00 0.00 N ATOM 0 H GLN A 47 12.312 6.089 4.749 1.00 0.00 H new ATOM 0 HA GLN A 47 14.779 6.826 6.186 1.00 0.00 H new ATOM 0 HB2 GLN A 47 12.561 8.649 5.115 1.00 0.00 H new ATOM 0 HB3 GLN A 47 13.971 9.195 6.000 1.00 0.00 H new ATOM 0 HG2 GLN A 47 15.440 8.427 4.178 1.00 0.00 H new ATOM 0 HG3 GLN A 47 14.056 7.810 3.299 1.00 0.00 H new ATOM 0 HE21 GLN A 47 12.561 9.262 2.321 1.00 0.00 H new ATOM 0 HE22 GLN A 47 12.977 10.959 2.059 1.00 0.00 H new ATOM 729 N ARG A 48 11.891 6.288 7.356 1.00 0.00 N ATOM 730 CA ARG A 48 10.988 6.426 8.495 1.00 0.00 C ATOM 731 C ARG A 48 10.747 5.099 9.218 1.00 0.00 C ATOM 732 O ARG A 48 9.708 4.921 9.857 1.00 0.00 O ATOM 733 CB ARG A 48 9.654 7.029 8.032 1.00 0.00 C ATOM 734 CG ARG A 48 9.812 8.355 7.302 1.00 0.00 C ATOM 735 CD ARG A 48 8.474 8.946 6.880 1.00 0.00 C ATOM 736 NE ARG A 48 7.748 9.558 7.998 1.00 0.00 N ATOM 737 CZ ARG A 48 6.463 9.914 7.946 1.00 0.00 C ATOM 738 NH1 ARG A 48 5.775 9.750 6.828 1.00 0.00 N ATOM 739 NH2 ARG A 48 5.880 10.474 9.000 1.00 0.00 N ATOM 0 H ARG A 48 11.631 5.570 6.680 1.00 0.00 H new ATOM 0 HA ARG A 48 11.467 7.094 9.211 1.00 0.00 H new ATOM 0 HB2 ARG A 48 9.151 6.319 7.376 1.00 0.00 H new ATOM 0 HB3 ARG A 48 9.009 7.174 8.899 1.00 0.00 H new ATOM 0 HG2 ARG A 48 10.332 9.063 7.948 1.00 0.00 H new ATOM 0 HG3 ARG A 48 10.437 8.210 6.421 1.00 0.00 H new ATOM 0 HD2 ARG A 48 8.640 9.696 6.106 1.00 0.00 H new ATOM 0 HD3 ARG A 48 7.859 8.163 6.438 1.00 0.00 H new ATOM 0 HE ARG A 48 8.256 9.721 8.867 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.227 9.351 6.005 1.00 0.00 H new ATOM 0 HH12 ARG A 48 4.793 10.022 6.789 1.00 0.00 H new ATOM 0 HH21 ARG A 48 6.415 10.634 9.854 1.00 0.00 H new ATOM 0 HH22 ARG A 48 4.898 10.744 8.956 1.00 0.00 H new ATOM 753 N VAL A 49 11.714 4.188 9.155 1.00 0.00 N ATOM 754 CA VAL A 49 11.596 2.914 9.856 1.00 0.00 C ATOM 755 C VAL A 49 12.988 2.357 10.181 1.00 0.00 C ATOM 756 O VAL A 49 13.994 2.856 9.672 1.00 0.00 O ATOM 757 CB VAL A 49 10.789 1.890 9.018 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.634 1.319 7.898 1.00 0.00 C ATOM 759 CG2 VAL A 49 10.221 0.777 9.888 1.00 0.00 C ATOM 0 H VAL A 49 12.581 4.307 8.630 1.00 0.00 H new ATOM 0 HA VAL A 49 11.058 3.087 10.788 1.00 0.00 H new ATOM 0 HB VAL A 49 9.948 2.423 8.574 1.00 0.00 H new ATOM 0 HG11 VAL A 49 11.044 0.603 7.326 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.962 2.126 7.242 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.505 0.817 8.319 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.662 0.078 9.266 1.00 0.00 H new ATOM 0 HG22 VAL A 49 11.037 0.250 10.383 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.557 1.205 10.639 1.00 0.00 H new ATOM 769 N ALA A 50 13.042 1.342 11.040 1.00 0.00 N ATOM 770 CA ALA A 50 14.305 0.722 11.424 1.00 0.00 C ATOM 771 C ALA A 50 14.655 -0.428 10.480 1.00 0.00 C ATOM 772 O ALA A 50 13.771 -1.012 9.855 1.00 0.00 O ATOM 773 CB ALA A 50 14.232 0.224 12.861 1.00 0.00 C ATOM 0 H ALA A 50 12.221 0.931 11.484 1.00 0.00 H new ATOM 0 HA ALA A 50 15.091 1.473 11.352 1.00 0.00 H new ATOM 0 HB1 ALA A 50 15.181 -0.237 13.135 1.00 0.00 H new ATOM 0 HB2 ALA A 50 14.030 1.063 13.527 1.00 0.00 H new ATOM 0 HB3 ALA A 50 13.432 -0.511 12.951 1.00 0.00 H new ATOM 779 N ALA A 51 15.942 -0.756 10.401 1.00 0.00 N ATOM 780 CA ALA A 51 16.432 -1.793 9.495 1.00 0.00 C ATOM 781 C ALA A 51 15.775 -3.138 9.770 1.00 0.00 C ATOM 782 O ALA A 51 15.216 -3.762 8.865 1.00 0.00 O ATOM 783 CB ALA A 51 17.944 -1.916 9.606 1.00 0.00 C ATOM 0 H ALA A 51 16.672 -0.314 10.960 1.00 0.00 H new ATOM 0 HA ALA A 51 16.168 -1.497 8.480 1.00 0.00 H new ATOM 0 HB1 ALA A 51 18.297 -2.692 8.926 1.00 0.00 H new ATOM 0 HB2 ALA A 51 18.407 -0.965 9.343 1.00 0.00 H new ATOM 0 HB3 ALA A 51 18.213 -2.180 10.629 1.00 0.00 H new ATOM 789 N SER A 52 15.839 -3.573 11.020 1.00 0.00 N ATOM 790 CA SER A 52 15.257 -4.844 11.423 1.00 0.00 C ATOM 791 C SER A 52 13.738 -4.817 11.272 1.00 0.00 C ATOM 792 O SER A 52 13.104 -5.845 11.032 1.00 0.00 O ATOM 793 CB SER A 52 15.622 -5.145 12.877 1.00 0.00 C ATOM 794 OG SER A 52 17.022 -5.032 13.087 1.00 0.00 O ATOM 0 H SER A 52 16.291 -3.060 11.777 1.00 0.00 H new ATOM 0 HA SER A 52 15.657 -5.625 10.776 1.00 0.00 H new ATOM 0 HB2 SER A 52 15.095 -4.456 13.537 1.00 0.00 H new ATOM 0 HB3 SER A 52 15.292 -6.151 13.137 1.00 0.00 H new ATOM 0 HG SER A 52 17.229 -5.228 14.025 1.00 0.00 H new ATOM 800 N GLN A 53 13.163 -3.626 11.386 1.00 0.00 N ATOM 801 CA GLN A 53 11.720 -3.483 11.379 1.00 0.00 C ATOM 802 C GLN A 53 11.171 -3.468 9.962 1.00 0.00 C ATOM 803 O GLN A 53 9.979 -3.645 9.764 1.00 0.00 O ATOM 804 CB GLN A 53 11.293 -2.205 12.105 1.00 0.00 C ATOM 805 CG GLN A 53 10.107 -2.417 13.027 1.00 0.00 C ATOM 806 CD GLN A 53 10.430 -3.387 14.149 1.00 0.00 C ATOM 807 OE1 GLN A 53 11.567 -3.467 14.608 1.00 0.00 O ATOM 808 NE2 GLN A 53 9.438 -4.140 14.591 1.00 0.00 N ATOM 0 H GLN A 53 13.676 -2.750 11.484 1.00 0.00 H new ATOM 0 HA GLN A 53 11.310 -4.346 11.903 1.00 0.00 H new ATOM 0 HB2 GLN A 53 12.134 -1.825 12.685 1.00 0.00 H new ATOM 0 HB3 GLN A 53 11.042 -1.442 11.369 1.00 0.00 H new ATOM 0 HG2 GLN A 53 9.801 -1.461 13.451 1.00 0.00 H new ATOM 0 HG3 GLN A 53 9.262 -2.796 12.451 1.00 0.00 H new ATOM 0 HE21 GLN A 53 8.507 -4.046 14.186 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.604 -4.815 15.337 1.00 0.00 H new ATOM 817 N ARG A 54 12.041 -3.264 8.979 1.00 0.00 N ATOM 818 CA ARG A 54 11.602 -3.144 7.592 1.00 0.00 C ATOM 819 C ARG A 54 10.840 -4.379 7.120 1.00 0.00 C ATOM 820 O ARG A 54 9.692 -4.271 6.696 1.00 0.00 O ATOM 821 CB ARG A 54 12.783 -2.846 6.665 1.00 0.00 C ATOM 822 CG ARG A 54 13.162 -1.376 6.665 1.00 0.00 C ATOM 823 CD ARG A 54 14.245 -1.055 5.652 1.00 0.00 C ATOM 824 NE ARG A 54 15.584 -1.382 6.137 1.00 0.00 N ATOM 825 CZ ARG A 54 16.602 -0.518 6.120 1.00 0.00 C ATOM 826 NH1 ARG A 54 16.395 0.747 5.769 1.00 0.00 N ATOM 827 NH2 ARG A 54 17.818 -0.913 6.484 1.00 0.00 N ATOM 0 H ARG A 54 13.048 -3.179 9.114 1.00 0.00 H new ATOM 0 HA ARG A 54 10.910 -2.303 7.549 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.643 -3.440 6.974 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.531 -3.154 5.650 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.278 -0.776 6.449 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.504 -1.092 7.660 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.051 -1.606 4.732 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.202 0.005 5.403 1.00 0.00 H new ATOM 0 HE ARG A 54 15.750 -2.318 6.507 1.00 0.00 H new ATOM 0 HH11 ARG A 54 15.458 1.058 5.512 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.173 1.407 5.756 1.00 0.00 H new ATOM 0 HH21 ARG A 54 17.975 -1.877 6.777 1.00 0.00 H new ATOM 0 HH22 ARG A 54 18.594 -0.252 6.470 1.00 0.00 H new ATOM 841 N LYS A 55 11.460 -5.551 7.206 1.00 0.00 N ATOM 842 CA LYS A 55 10.798 -6.777 6.767 1.00 0.00 C ATOM 843 C LYS A 55 9.596 -7.089 7.651 1.00 0.00 C ATOM 844 O LYS A 55 8.550 -7.513 7.164 1.00 0.00 O ATOM 845 CB LYS A 55 11.768 -7.967 6.761 1.00 0.00 C ATOM 846 CG LYS A 55 11.102 -9.289 6.381 1.00 0.00 C ATOM 847 CD LYS A 55 10.470 -9.228 4.995 1.00 0.00 C ATOM 848 CE LYS A 55 9.467 -10.354 4.776 1.00 0.00 C ATOM 849 NZ LYS A 55 10.105 -11.695 4.799 1.00 0.00 N ATOM 0 H LYS A 55 12.404 -5.679 7.569 1.00 0.00 H new ATOM 0 HA LYS A 55 10.453 -6.613 5.746 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.578 -7.762 6.061 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.217 -8.065 7.749 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.842 -10.089 6.408 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.338 -9.536 7.118 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.971 -8.268 4.866 1.00 0.00 H new ATOM 0 HD3 LYS A 55 11.251 -9.286 4.237 1.00 0.00 H new ATOM 0 HE2 LYS A 55 8.699 -10.307 5.548 1.00 0.00 H new ATOM 0 HE3 LYS A 55 8.966 -10.210 3.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 9.382 -12.426 4.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.820 -11.752 4.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 10.561 -11.847 5.721 1.00 0.00 H new ATOM 863 N LEU A 56 9.744 -6.848 8.944 1.00 0.00 N ATOM 864 CA LEU A 56 8.706 -7.176 9.912 1.00 0.00 C ATOM 865 C LEU A 56 7.464 -6.312 9.684 1.00 0.00 C ATOM 866 O LEU A 56 6.349 -6.823 9.596 1.00 0.00 O ATOM 867 CB LEU A 56 9.252 -6.985 11.336 1.00 0.00 C ATOM 868 CG LEU A 56 8.529 -7.760 12.450 1.00 0.00 C ATOM 869 CD1 LEU A 56 9.365 -7.759 13.719 1.00 0.00 C ATOM 870 CD2 LEU A 56 7.158 -7.166 12.738 1.00 0.00 C ATOM 0 H LEU A 56 10.578 -6.424 9.351 1.00 0.00 H new ATOM 0 HA LEU A 56 8.414 -8.218 9.783 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.302 -7.276 11.342 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.214 -5.923 11.578 1.00 0.00 H new ATOM 0 HG LEU A 56 8.392 -8.785 12.106 1.00 0.00 H new ATOM 0 HD11 LEU A 56 8.842 -8.311 14.500 1.00 0.00 H new ATOM 0 HD12 LEU A 56 10.326 -8.233 13.522 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.527 -6.732 14.047 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.673 -7.737 13.530 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.270 -6.129 13.054 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.547 -7.206 11.836 1.00 0.00 H new ATOM 882 N ILE A 57 7.664 -5.007 9.563 1.00 0.00 N ATOM 883 CA ILE A 57 6.555 -4.072 9.445 1.00 0.00 C ATOM 884 C ILE A 57 5.910 -4.160 8.062 1.00 0.00 C ATOM 885 O ILE A 57 4.702 -3.970 7.918 1.00 0.00 O ATOM 886 CB ILE A 57 7.009 -2.622 9.756 1.00 0.00 C ATOM 887 CG1 ILE A 57 5.823 -1.775 10.219 1.00 0.00 C ATOM 888 CG2 ILE A 57 7.680 -1.975 8.549 1.00 0.00 C ATOM 889 CD1 ILE A 57 6.239 -0.461 10.843 1.00 0.00 C ATOM 0 H ILE A 57 8.586 -4.572 9.544 1.00 0.00 H new ATOM 0 HA ILE A 57 5.804 -4.351 10.184 1.00 0.00 H new ATOM 0 HB ILE A 57 7.743 -2.672 10.561 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.172 -1.576 9.368 1.00 0.00 H new ATOM 0 HG13 ILE A 57 5.238 -2.344 10.941 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.985 -0.960 8.803 1.00 0.00 H new ATOM 0 HG22 ILE A 57 8.557 -2.557 8.265 1.00 0.00 H new ATOM 0 HG23 ILE A 57 6.978 -1.945 7.715 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.352 0.093 11.150 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.866 -0.654 11.713 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.799 0.126 10.115 1.00 0.00 H new ATOM 901 N ALA A 58 6.711 -4.484 7.052 1.00 0.00 N ATOM 902 CA ALA A 58 6.195 -4.659 5.702 1.00 0.00 C ATOM 903 C ALA A 58 5.409 -5.957 5.603 1.00 0.00 C ATOM 904 O ALA A 58 4.448 -6.062 4.841 1.00 0.00 O ATOM 905 CB ALA A 58 7.325 -4.643 4.685 1.00 0.00 C ATOM 0 H ALA A 58 7.716 -4.630 7.144 1.00 0.00 H new ATOM 0 HA ALA A 58 5.527 -3.827 5.480 1.00 0.00 H new ATOM 0 HB1 ALA A 58 6.915 -4.775 3.684 1.00 0.00 H new ATOM 0 HB2 ALA A 58 7.850 -3.689 4.739 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.021 -5.453 4.902 1.00 0.00 H new ATOM 911 N GLU A 59 5.822 -6.944 6.389 1.00 0.00 N ATOM 912 CA GLU A 59 5.116 -8.212 6.456 1.00 0.00 C ATOM 913 C GLU A 59 3.774 -8.020 7.153 1.00 0.00 C ATOM 914 O GLU A 59 2.768 -8.602 6.750 1.00 0.00 O ATOM 915 CB GLU A 59 5.966 -9.254 7.183 1.00 0.00 C ATOM 916 CG GLU A 59 5.350 -10.640 7.212 1.00 0.00 C ATOM 917 CD GLU A 59 6.331 -11.687 7.686 1.00 0.00 C ATOM 918 OE1 GLU A 59 6.466 -11.871 8.912 1.00 0.00 O ATOM 919 OE2 GLU A 59 6.977 -12.329 6.832 1.00 0.00 O ATOM 0 H GLU A 59 6.645 -6.888 6.989 1.00 0.00 H new ATOM 0 HA GLU A 59 4.932 -8.574 5.444 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.942 -9.311 6.702 1.00 0.00 H new ATOM 0 HB3 GLU A 59 6.134 -8.921 8.207 1.00 0.00 H new ATOM 0 HG2 GLU A 59 4.479 -10.636 7.868 1.00 0.00 H new ATOM 0 HG3 GLU A 59 4.996 -10.900 6.214 1.00 0.00 H new ATOM 926 N LYS A 60 3.763 -7.192 8.195 1.00 0.00 N ATOM 927 CA LYS A 60 2.515 -6.811 8.850 1.00 0.00 C ATOM 928 C LYS A 60 1.595 -6.122 7.852 1.00 0.00 C ATOM 929 O LYS A 60 0.397 -6.399 7.798 1.00 0.00 O ATOM 930 CB LYS A 60 2.775 -5.872 10.031 1.00 0.00 C ATOM 931 CG LYS A 60 3.479 -6.531 11.206 1.00 0.00 C ATOM 932 CD LYS A 60 3.610 -5.576 12.386 1.00 0.00 C ATOM 933 CE LYS A 60 2.250 -5.069 12.849 1.00 0.00 C ATOM 934 NZ LYS A 60 2.352 -4.229 14.070 1.00 0.00 N ATOM 0 H LYS A 60 4.600 -6.774 8.602 1.00 0.00 H new ATOM 0 HA LYS A 60 2.041 -7.718 9.225 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.376 -5.031 9.687 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.824 -5.465 10.373 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.924 -7.417 11.514 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.469 -6.867 10.897 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.111 -6.082 13.211 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.237 -4.731 12.103 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.788 -4.490 12.049 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.596 -5.918 13.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.404 -3.906 14.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.769 -4.788 14.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.955 -3.404 13.875 1.00 0.00 H new ATOM 948 N PHE A 61 2.178 -5.227 7.065 1.00 0.00 N ATOM 949 CA PHE A 61 1.458 -4.521 6.017 1.00 0.00 C ATOM 950 C PHE A 61 0.825 -5.508 5.041 1.00 0.00 C ATOM 951 O PHE A 61 -0.379 -5.463 4.792 1.00 0.00 O ATOM 952 CB PHE A 61 2.420 -3.586 5.279 1.00 0.00 C ATOM 953 CG PHE A 61 1.792 -2.818 4.153 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.215 -1.582 4.380 1.00 0.00 C ATOM 955 CD2 PHE A 61 1.789 -3.328 2.866 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.646 -0.870 3.346 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.220 -2.621 1.829 1.00 0.00 C ATOM 958 CZ PHE A 61 0.648 -1.389 2.068 1.00 0.00 C ATOM 0 H PHE A 61 3.163 -4.971 7.136 1.00 0.00 H new ATOM 0 HA PHE A 61 0.659 -3.933 6.469 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.842 -2.880 5.994 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.249 -4.174 4.885 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.210 -1.170 5.378 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.238 -4.291 2.672 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.199 0.094 3.536 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.222 -3.031 0.830 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.203 -0.832 1.257 1.00 0.00 H new ATOM 968 N ALA A 62 1.643 -6.404 4.501 1.00 0.00 N ATOM 969 CA ALA A 62 1.167 -7.407 3.556 1.00 0.00 C ATOM 970 C ALA A 62 0.093 -8.285 4.188 1.00 0.00 C ATOM 971 O ALA A 62 -0.926 -8.573 3.567 1.00 0.00 O ATOM 972 CB ALA A 62 2.325 -8.258 3.062 1.00 0.00 C ATOM 0 H ALA A 62 2.642 -6.456 4.702 1.00 0.00 H new ATOM 0 HA ALA A 62 0.724 -6.890 2.705 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.955 -9.003 2.357 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.058 -7.622 2.566 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.794 -8.761 3.908 1.00 0.00 H new ATOM 978 N GLN A 63 0.324 -8.687 5.432 1.00 0.00 N ATOM 979 CA GLN A 63 -0.623 -9.520 6.165 1.00 0.00 C ATOM 980 C GLN A 63 -1.965 -8.809 6.309 1.00 0.00 C ATOM 981 O GLN A 63 -3.023 -9.394 6.068 1.00 0.00 O ATOM 982 CB GLN A 63 -0.062 -9.849 7.551 1.00 0.00 C ATOM 983 CG GLN A 63 -0.915 -10.811 8.361 1.00 0.00 C ATOM 984 CD GLN A 63 -0.926 -12.213 7.789 1.00 0.00 C ATOM 985 OE1 GLN A 63 -1.778 -12.560 6.971 1.00 0.00 O ATOM 986 NE2 GLN A 63 0.022 -13.031 8.218 1.00 0.00 N ATOM 0 H GLN A 63 1.165 -8.448 5.958 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.776 -10.444 5.607 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.934 -10.276 7.434 1.00 0.00 H new ATOM 0 HB3 GLN A 63 0.052 -8.922 8.113 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.543 -10.845 9.385 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.937 -10.434 8.405 1.00 0.00 H new ATOM 0 HE21 GLN A 63 0.709 -12.704 8.897 1.00 0.00 H new ATOM 0 HE22 GLN A 63 0.065 -13.989 7.870 1.00 0.00 H new ATOM 995 N ALA A 64 -1.916 -7.543 6.701 1.00 0.00 N ATOM 996 CA ALA A 64 -3.123 -6.749 6.863 1.00 0.00 C ATOM 997 C ALA A 64 -3.823 -6.549 5.524 1.00 0.00 C ATOM 998 O ALA A 64 -5.050 -6.603 5.438 1.00 0.00 O ATOM 999 CB ALA A 64 -2.793 -5.407 7.497 1.00 0.00 C ATOM 0 H ALA A 64 -1.051 -7.045 6.913 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.801 -7.289 7.524 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.707 -4.824 7.612 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.340 -5.568 8.475 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.095 -4.865 6.859 1.00 0.00 H new ATOM 1005 N LEU A 65 -3.032 -6.345 4.479 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.566 -6.158 3.142 1.00 0.00 C ATOM 1007 C LEU A 65 -4.216 -7.445 2.641 1.00 0.00 C ATOM 1008 O LEU A 65 -5.259 -7.408 1.995 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.461 -5.709 2.183 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.945 -5.258 0.806 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.895 -4.081 0.950 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.769 -4.883 -0.085 1.00 0.00 C ATOM 0 H LEU A 65 -2.014 -6.305 4.535 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.328 -5.379 3.181 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.911 -4.889 2.645 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.757 -6.531 2.053 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.475 -6.087 0.337 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.235 -3.765 -0.036 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.753 -4.378 1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.378 -3.254 1.437 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.138 -4.565 -1.060 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.210 -4.068 0.375 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.116 -5.747 -0.208 1.00 0.00 H new ATOM 1024 N MET A 66 -3.602 -8.585 2.957 1.00 0.00 N ATOM 1025 CA MET A 66 -4.170 -9.882 2.596 1.00 0.00 C ATOM 1026 C MET A 66 -5.455 -10.127 3.378 1.00 0.00 C ATOM 1027 O MET A 66 -6.351 -10.837 2.922 1.00 0.00 O ATOM 1028 CB MET A 66 -3.183 -11.025 2.869 1.00 0.00 C ATOM 1029 CG MET A 66 -1.909 -10.995 2.032 1.00 0.00 C ATOM 1030 SD MET A 66 -2.212 -10.985 0.252 1.00 0.00 S ATOM 1031 CE MET A 66 -2.246 -9.223 -0.077 1.00 0.00 C ATOM 0 H MET A 66 -2.716 -8.636 3.460 1.00 0.00 H new ATOM 0 HA MET A 66 -4.385 -9.862 1.528 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.907 -11.001 3.923 1.00 0.00 H new ATOM 0 HB3 MET A 66 -3.692 -11.973 2.694 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.330 -10.111 2.298 1.00 0.00 H new ATOM 0 HG3 MET A 66 -1.299 -11.863 2.283 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.243 -8.934 -0.408 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.993 -8.678 0.833 1.00 0.00 H new ATOM 0 HE3 MET A 66 -1.522 -8.984 -0.856 1.00 0.00 H new ATOM 1041 N SER A 67 -5.532 -9.536 4.562 1.00 0.00 N ATOM 1042 CA SER A 67 -6.711 -9.643 5.407 1.00 0.00 C ATOM 1043 C SER A 67 -7.875 -8.853 4.812 1.00 0.00 C ATOM 1044 O SER A 67 -8.997 -9.356 4.707 1.00 0.00 O ATOM 1045 CB SER A 67 -6.381 -9.133 6.815 1.00 0.00 C ATOM 1046 OG SER A 67 -7.514 -9.180 7.668 1.00 0.00 O ATOM 0 H SER A 67 -4.782 -8.972 4.962 1.00 0.00 H new ATOM 0 HA SER A 67 -7.010 -10.690 5.466 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.579 -9.735 7.242 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.013 -8.109 6.754 1.00 0.00 H new ATOM 0 HG SER A 67 -7.268 -8.850 8.557 1.00 0.00 H new ATOM 1052 N SER A 68 -7.599 -7.622 4.410 1.00 0.00 N ATOM 1053 CA SER A 68 -8.626 -6.746 3.866 1.00 0.00 C ATOM 1054 C SER A 68 -8.850 -7.005 2.376 1.00 0.00 C ATOM 1055 O SER A 68 -9.735 -6.408 1.762 1.00 0.00 O ATOM 1056 CB SER A 68 -8.239 -5.289 4.115 1.00 0.00 C ATOM 1057 OG SER A 68 -8.097 -5.041 5.506 1.00 0.00 O ATOM 0 H SER A 68 -6.669 -7.205 4.450 1.00 0.00 H new ATOM 0 HA SER A 68 -9.567 -6.957 4.373 1.00 0.00 H new ATOM 0 HB2 SER A 68 -7.304 -5.063 3.602 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.999 -4.629 3.698 1.00 0.00 H new ATOM 0 HG SER A 68 -7.847 -4.104 5.647 1.00 0.00 H new ATOM 1063 N LEU A 69 -8.045 -7.898 1.804 1.00 0.00 N ATOM 1064 CA LEU A 69 -8.234 -8.327 0.426 1.00 0.00 C ATOM 1065 C LEU A 69 -9.578 -9.024 0.271 1.00 0.00 C ATOM 1066 O LEU A 69 -9.749 -10.162 0.718 1.00 0.00 O ATOM 1067 CB LEU A 69 -7.121 -9.285 -0.002 1.00 0.00 C ATOM 1068 CG LEU A 69 -7.318 -9.933 -1.376 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -6.979 -8.958 -2.490 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -6.496 -11.204 -1.490 1.00 0.00 C ATOM 0 H LEU A 69 -7.255 -8.337 2.277 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.205 -7.441 -0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.176 -8.742 -0.005 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.033 -10.073 0.746 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.369 -10.201 -1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.127 -9.442 -3.455 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.627 -8.085 -2.419 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.939 -8.646 -2.396 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.649 -11.650 -2.473 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.440 -10.967 -1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.808 -11.909 -0.719 1.00 0.00 H new ATOM 1440 N THR B 8 3.544 8.445 -16.649 1.00 0.00 N ATOM 1441 CA THR B 8 4.196 9.724 -16.822 1.00 0.00 C ATOM 1442 C THR B 8 4.828 10.140 -15.494 1.00 0.00 C ATOM 1443 O THR B 8 4.125 10.545 -14.563 1.00 0.00 O ATOM 1444 CB THR B 8 3.196 10.790 -17.312 1.00 0.00 C ATOM 1445 OG1 THR B 8 2.571 10.331 -18.519 1.00 0.00 O ATOM 1446 CG2 THR B 8 3.886 12.121 -17.573 1.00 0.00 C ATOM 0 HA THR B 8 4.973 9.634 -17.581 1.00 0.00 H new ATOM 0 HB THR B 8 2.449 10.943 -16.533 1.00 0.00 H new ATOM 0 HG1 THR B 8 2.582 9.351 -18.541 1.00 0.00 H new ATOM 0 HG21 THR B 8 3.152 12.850 -17.917 1.00 0.00 H new ATOM 0 HG22 THR B 8 4.348 12.478 -16.653 1.00 0.00 H new ATOM 0 HG23 THR B 8 4.653 11.990 -18.337 1.00 0.00 H new ATOM 1454 N ASP B 9 6.150 9.997 -15.407 1.00 0.00 N ATOM 1455 CA ASP B 9 6.898 10.262 -14.173 1.00 0.00 C ATOM 1456 C ASP B 9 6.600 11.654 -13.631 1.00 0.00 C ATOM 1457 O ASP B 9 6.511 11.852 -12.419 1.00 0.00 O ATOM 1458 CB ASP B 9 8.401 10.107 -14.427 1.00 0.00 C ATOM 1459 CG ASP B 9 9.251 10.396 -13.203 1.00 0.00 C ATOM 1460 OD1 ASP B 9 9.247 9.575 -12.263 1.00 0.00 O ATOM 1461 OD2 ASP B 9 9.946 11.435 -13.190 1.00 0.00 O ATOM 0 H ASP B 9 6.734 9.695 -16.187 1.00 0.00 H new ATOM 0 HA ASP B 9 6.581 9.535 -13.425 1.00 0.00 H new ATOM 0 HB2 ASP B 9 8.602 9.091 -14.768 1.00 0.00 H new ATOM 0 HB3 ASP B 9 8.697 10.778 -15.233 1.00 0.00 H new ATOM 1466 N GLU B 10 6.431 12.605 -14.542 1.00 0.00 N ATOM 1467 CA GLU B 10 6.071 13.972 -14.186 1.00 0.00 C ATOM 1468 C GLU B 10 4.810 13.978 -13.326 1.00 0.00 C ATOM 1469 O GLU B 10 4.775 14.564 -12.249 1.00 0.00 O ATOM 1470 CB GLU B 10 5.826 14.807 -15.451 1.00 0.00 C ATOM 1471 CG GLU B 10 7.063 15.055 -16.311 1.00 0.00 C ATOM 1472 CD GLU B 10 7.715 13.783 -16.814 1.00 0.00 C ATOM 1473 OE1 GLU B 10 6.992 12.891 -17.301 1.00 0.00 O ATOM 1474 OE2 GLU B 10 8.950 13.658 -16.696 1.00 0.00 O ATOM 0 H GLU B 10 6.539 12.451 -15.545 1.00 0.00 H new ATOM 0 HA GLU B 10 6.896 14.408 -13.622 1.00 0.00 H new ATOM 0 HB2 GLU B 10 5.074 14.305 -16.059 1.00 0.00 H new ATOM 0 HB3 GLU B 10 5.407 15.770 -15.157 1.00 0.00 H new ATOM 0 HG2 GLU B 10 6.784 15.673 -17.165 1.00 0.00 H new ATOM 0 HG3 GLU B 10 7.791 15.622 -15.731 1.00 0.00 H new ATOM 1481 N GLN B 11 3.781 13.302 -13.820 1.00 0.00 N ATOM 1482 CA GLN B 11 2.509 13.223 -13.126 1.00 0.00 C ATOM 1483 C GLN B 11 2.681 12.506 -11.791 1.00 0.00 C ATOM 1484 O GLN B 11 2.168 12.962 -10.769 1.00 0.00 O ATOM 1485 CB GLN B 11 1.477 12.500 -13.995 1.00 0.00 C ATOM 1486 CG GLN B 11 0.093 12.434 -13.377 1.00 0.00 C ATOM 1487 CD GLN B 11 -0.912 11.758 -14.286 1.00 0.00 C ATOM 1488 OE1 GLN B 11 -1.570 12.408 -15.096 1.00 0.00 O ATOM 1489 NE2 GLN B 11 -1.034 10.447 -14.161 1.00 0.00 N ATOM 0 H GLN B 11 3.807 12.798 -14.706 1.00 0.00 H new ATOM 0 HA GLN B 11 2.150 14.234 -12.932 1.00 0.00 H new ATOM 0 HB2 GLN B 11 1.410 13.005 -14.959 1.00 0.00 H new ATOM 0 HB3 GLN B 11 1.826 11.486 -14.189 1.00 0.00 H new ATOM 0 HG2 GLN B 11 0.145 11.894 -12.432 1.00 0.00 H new ATOM 0 HG3 GLN B 11 -0.249 13.444 -13.149 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -0.469 9.945 -13.476 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -1.693 9.938 -14.750 1.00 0.00 H new ATOM 1498 N VAL B 12 3.424 11.400 -11.807 1.00 0.00 N ATOM 1499 CA VAL B 12 3.689 10.633 -10.594 1.00 0.00 C ATOM 1500 C VAL B 12 4.303 11.524 -9.517 1.00 0.00 C ATOM 1501 O VAL B 12 3.808 11.565 -8.388 1.00 0.00 O ATOM 1502 CB VAL B 12 4.625 9.431 -10.864 1.00 0.00 C ATOM 1503 CG1 VAL B 12 4.962 8.707 -9.572 1.00 0.00 C ATOM 1504 CG2 VAL B 12 3.989 8.463 -11.848 1.00 0.00 C ATOM 0 H VAL B 12 3.853 11.016 -12.649 1.00 0.00 H new ATOM 0 HA VAL B 12 2.731 10.247 -10.246 1.00 0.00 H new ATOM 0 HB VAL B 12 5.547 9.818 -11.298 1.00 0.00 H new ATOM 0 HG11 VAL B 12 5.621 7.866 -9.787 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.462 9.394 -8.890 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.045 8.340 -9.110 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.665 7.626 -12.023 1.00 0.00 H new ATOM 0 HG22 VAL B 12 3.050 8.092 -11.438 1.00 0.00 H new ATOM 0 HG23 VAL B 12 3.796 8.976 -12.790 1.00 0.00 H new ATOM 1514 N GLU B 13 5.360 12.251 -9.883 1.00 0.00 N ATOM 1515 CA GLU B 13 6.024 13.167 -8.959 1.00 0.00 C ATOM 1516 C GLU B 13 5.038 14.116 -8.311 1.00 0.00 C ATOM 1517 O GLU B 13 4.974 14.218 -7.087 1.00 0.00 O ATOM 1518 CB GLU B 13 7.080 14.014 -9.661 1.00 0.00 C ATOM 1519 CG GLU B 13 8.399 13.314 -9.889 1.00 0.00 C ATOM 1520 CD GLU B 13 9.505 14.293 -10.212 1.00 0.00 C ATOM 1521 OE1 GLU B 13 9.209 15.370 -10.772 1.00 0.00 O ATOM 1522 OE2 GLU B 13 10.672 14.010 -9.871 1.00 0.00 O ATOM 0 H GLU B 13 5.774 12.222 -10.815 1.00 0.00 H new ATOM 0 HA GLU B 13 6.493 12.537 -8.204 1.00 0.00 H new ATOM 0 HB2 GLU B 13 6.685 14.339 -10.624 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.258 14.912 -9.070 1.00 0.00 H new ATOM 0 HG2 GLU B 13 8.667 12.744 -8.999 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.295 12.600 -10.706 1.00 0.00 H new ATOM 1529 N LYS B 14 4.270 14.803 -9.140 1.00 0.00 N ATOM 1530 CA LYS B 14 3.424 15.885 -8.655 1.00 0.00 C ATOM 1531 C LYS B 14 2.283 15.371 -7.781 1.00 0.00 C ATOM 1532 O LYS B 14 1.879 16.043 -6.831 1.00 0.00 O ATOM 1533 CB LYS B 14 2.908 16.734 -9.822 1.00 0.00 C ATOM 1534 CG LYS B 14 3.932 17.756 -10.313 1.00 0.00 C ATOM 1535 CD LYS B 14 5.196 17.091 -10.847 1.00 0.00 C ATOM 1536 CE LYS B 14 6.390 18.028 -10.815 1.00 0.00 C ATOM 1537 NZ LYS B 14 7.616 17.399 -11.373 1.00 0.00 N ATOM 0 H LYS B 14 4.213 14.634 -10.144 1.00 0.00 H new ATOM 0 HA LYS B 14 4.037 16.525 -8.020 1.00 0.00 H new ATOM 0 HB2 LYS B 14 2.632 16.078 -10.648 1.00 0.00 H new ATOM 0 HB3 LYS B 14 2.002 17.255 -9.513 1.00 0.00 H new ATOM 0 HG2 LYS B 14 3.486 18.368 -11.097 1.00 0.00 H new ATOM 0 HG3 LYS B 14 4.194 18.428 -9.495 1.00 0.00 H new ATOM 0 HD2 LYS B 14 5.416 16.203 -10.254 1.00 0.00 H new ATOM 0 HD3 LYS B 14 5.025 16.757 -11.870 1.00 0.00 H new ATOM 0 HE2 LYS B 14 6.157 18.930 -11.382 1.00 0.00 H new ATOM 0 HE3 LYS B 14 6.579 18.337 -9.787 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 8.400 18.082 -11.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 7.865 16.563 -10.807 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 7.442 17.112 -12.357 1.00 0.00 H new ATOM 1551 N ILE B 15 1.783 14.174 -8.077 1.00 0.00 N ATOM 1552 CA ILE B 15 0.775 13.556 -7.223 1.00 0.00 C ATOM 1553 C ILE B 15 1.388 13.232 -5.866 1.00 0.00 C ATOM 1554 O ILE B 15 0.874 13.644 -4.826 1.00 0.00 O ATOM 1555 CB ILE B 15 0.191 12.260 -7.826 1.00 0.00 C ATOM 1556 CG1 ILE B 15 -0.345 12.510 -9.234 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.920 11.728 -6.932 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -0.884 11.265 -9.906 1.00 0.00 C ATOM 0 H ILE B 15 2.055 13.620 -8.889 1.00 0.00 H new ATOM 0 HA ILE B 15 -0.041 14.272 -7.125 1.00 0.00 H new ATOM 0 HB ILE B 15 0.988 11.519 -7.889 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -1.136 13.258 -9.185 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.452 12.929 -9.848 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -1.328 10.814 -7.363 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.519 11.515 -5.941 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.710 12.474 -6.850 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -1.248 11.518 -10.902 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -0.090 10.523 -9.987 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -1.703 10.857 -9.313 1.00 0.00 H new ATOM 1570 N LEU B 16 2.509 12.514 -5.895 1.00 0.00 N ATOM 1571 CA LEU B 16 3.228 12.138 -4.679 1.00 0.00 C ATOM 1572 C LEU B 16 3.602 13.368 -3.863 1.00 0.00 C ATOM 1573 O LEU B 16 3.489 13.372 -2.637 1.00 0.00 O ATOM 1574 CB LEU B 16 4.502 11.368 -5.029 1.00 0.00 C ATOM 1575 CG LEU B 16 4.300 10.010 -5.692 1.00 0.00 C ATOM 1576 CD1 LEU B 16 5.631 9.467 -6.177 1.00 0.00 C ATOM 1577 CD2 LEU B 16 3.654 9.038 -4.721 1.00 0.00 C ATOM 0 H LEU B 16 2.942 12.178 -6.755 1.00 0.00 H new ATOM 0 HA LEU B 16 2.566 11.505 -4.087 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.107 11.987 -5.691 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.078 11.222 -4.115 1.00 0.00 H new ATOM 0 HG LEU B 16 3.637 10.132 -6.548 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.478 8.497 -6.649 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.064 10.158 -6.900 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.309 9.356 -5.331 1.00 0.00 H new ATOM 0 HD21 LEU B 16 3.516 8.073 -5.209 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.296 8.915 -3.848 1.00 0.00 H new ATOM 0 HD23 LEU B 16 2.685 9.427 -4.407 1.00 0.00 H new ATOM 1589 N ALA B 17 4.045 14.406 -4.558 1.00 0.00 N ATOM 1590 CA ALA B 17 4.465 15.645 -3.923 1.00 0.00 C ATOM 1591 C ALA B 17 3.336 16.248 -3.096 1.00 0.00 C ATOM 1592 O ALA B 17 3.555 16.715 -1.977 1.00 0.00 O ATOM 1593 CB ALA B 17 4.944 16.635 -4.975 1.00 0.00 C ATOM 0 H ALA B 17 4.123 14.412 -5.575 1.00 0.00 H new ATOM 0 HA ALA B 17 5.290 15.421 -3.247 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.256 17.559 -4.489 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.787 16.208 -5.519 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.133 16.847 -5.671 1.00 0.00 H new ATOM 1599 N GLU B 18 2.126 16.224 -3.642 1.00 0.00 N ATOM 1600 CA GLU B 18 0.970 16.765 -2.938 1.00 0.00 C ATOM 1601 C GLU B 18 0.493 15.808 -1.847 1.00 0.00 C ATOM 1602 O GLU B 18 0.048 16.244 -0.788 1.00 0.00 O ATOM 1603 CB GLU B 18 -0.161 17.073 -3.916 1.00 0.00 C ATOM 1604 CG GLU B 18 0.232 18.082 -4.982 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.951 18.586 -5.778 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -1.562 17.789 -6.514 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -1.267 19.791 -5.680 1.00 0.00 O ATOM 0 H GLU B 18 1.920 15.838 -4.564 1.00 0.00 H new ATOM 0 HA GLU B 18 1.274 17.696 -2.459 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.478 16.148 -4.398 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.019 17.454 -3.362 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.732 18.927 -4.509 1.00 0.00 H new ATOM 0 HG3 GLU B 18 0.952 17.625 -5.661 1.00 0.00 H new ATOM 1614 N VAL B 19 0.597 14.506 -2.099 1.00 0.00 N ATOM 1615 CA VAL B 19 0.248 13.506 -1.092 1.00 0.00 C ATOM 1616 C VAL B 19 1.157 13.643 0.130 1.00 0.00 C ATOM 1617 O VAL B 19 0.691 13.633 1.270 1.00 0.00 O ATOM 1618 CB VAL B 19 0.341 12.065 -1.650 1.00 0.00 C ATOM 1619 CG1 VAL B 19 0.093 11.038 -0.554 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -0.650 11.871 -2.787 1.00 0.00 C ATOM 0 H VAL B 19 0.918 14.119 -2.987 1.00 0.00 H new ATOM 0 HA VAL B 19 -0.787 13.688 -0.802 1.00 0.00 H new ATOM 0 HB VAL B 19 1.350 11.917 -2.034 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.164 10.034 -0.973 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.839 11.157 0.232 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -0.902 11.186 -0.135 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -0.572 10.853 -3.168 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -1.662 12.045 -2.421 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.428 12.576 -3.588 1.00 0.00 H new ATOM 1630 N ALA B 20 2.454 13.792 -0.118 1.00 0.00 N ATOM 1631 CA ALA B 20 3.423 13.997 0.951 1.00 0.00 C ATOM 1632 C ALA B 20 3.137 15.298 1.690 1.00 0.00 C ATOM 1633 O ALA B 20 3.364 15.405 2.895 1.00 0.00 O ATOM 1634 CB ALA B 20 4.838 14.003 0.395 1.00 0.00 C ATOM 0 H ALA B 20 2.859 13.774 -1.054 1.00 0.00 H new ATOM 0 HA ALA B 20 3.333 13.172 1.657 1.00 0.00 H new ATOM 0 HB1 ALA B 20 5.548 14.157 1.208 1.00 0.00 H new ATOM 0 HB2 ALA B 20 5.043 13.048 -0.089 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.939 14.808 -0.333 1.00 0.00 H new ATOM 1640 N LEU B 21 2.630 16.283 0.959 1.00 0.00 N ATOM 1641 CA LEU B 21 2.237 17.551 1.554 1.00 0.00 C ATOM 1642 C LEU B 21 1.054 17.334 2.499 1.00 0.00 C ATOM 1643 O LEU B 21 1.023 17.877 3.603 1.00 0.00 O ATOM 1644 CB LEU B 21 1.898 18.565 0.449 1.00 0.00 C ATOM 1645 CG LEU B 21 1.606 19.997 0.912 1.00 0.00 C ATOM 1646 CD1 LEU B 21 2.004 20.990 -0.167 1.00 0.00 C ATOM 1647 CD2 LEU B 21 0.132 20.168 1.249 1.00 0.00 C ATOM 0 H LEU B 21 2.482 16.226 -0.049 1.00 0.00 H new ATOM 0 HA LEU B 21 3.064 17.956 2.137 1.00 0.00 H new ATOM 0 HB2 LEU B 21 2.729 18.595 -0.255 1.00 0.00 H new ATOM 0 HB3 LEU B 21 1.030 18.198 -0.098 1.00 0.00 H new ATOM 0 HG LEU B 21 2.193 20.188 1.811 1.00 0.00 H new ATOM 0 HD11 LEU B 21 1.791 22.003 0.175 1.00 0.00 H new ATOM 0 HD12 LEU B 21 3.070 20.893 -0.375 1.00 0.00 H new ATOM 0 HD13 LEU B 21 1.437 20.787 -1.075 1.00 0.00 H new ATOM 0 HD21 LEU B 21 -0.050 21.192 1.575 1.00 0.00 H new ATOM 0 HD22 LEU B 21 -0.470 19.956 0.366 1.00 0.00 H new ATOM 0 HD23 LEU B 21 -0.141 19.479 2.048 1.00 0.00 H new ATOM 1659 N VAL B 22 0.100 16.511 2.069 1.00 0.00 N ATOM 1660 CA VAL B 22 -1.057 16.169 2.892 1.00 0.00 C ATOM 1661 C VAL B 22 -0.621 15.470 4.176 1.00 0.00 C ATOM 1662 O VAL B 22 -1.122 15.772 5.265 1.00 0.00 O ATOM 1663 CB VAL B 22 -2.046 15.258 2.130 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.156 14.775 3.052 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -2.635 15.988 0.931 1.00 0.00 C ATOM 0 H VAL B 22 0.106 16.067 1.151 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.560 17.104 3.139 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.495 14.389 1.770 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -3.840 14.136 2.494 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -2.723 14.210 3.878 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.701 15.633 3.446 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.328 15.329 0.408 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.166 16.877 1.271 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.833 16.281 0.254 1.00 0.00 H new ATOM 1675 N LEU B 23 0.319 14.541 4.042 1.00 0.00 N ATOM 1676 CA LEU B 23 0.836 13.797 5.182 1.00 0.00 C ATOM 1677 C LEU B 23 1.493 14.746 6.178 1.00 0.00 C ATOM 1678 O LEU B 23 1.374 14.574 7.392 1.00 0.00 O ATOM 1679 CB LEU B 23 1.847 12.743 4.718 1.00 0.00 C ATOM 1680 CG LEU B 23 1.330 11.758 3.667 1.00 0.00 C ATOM 1681 CD1 LEU B 23 2.417 10.767 3.286 1.00 0.00 C ATOM 1682 CD2 LEU B 23 0.095 11.030 4.173 1.00 0.00 C ATOM 0 H LEU B 23 0.740 14.285 3.149 1.00 0.00 H new ATOM 0 HA LEU B 23 0.003 13.292 5.672 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.720 13.255 4.314 1.00 0.00 H new ATOM 0 HB3 LEU B 23 2.183 12.178 5.588 1.00 0.00 H new ATOM 0 HG LEU B 23 1.051 12.322 2.777 1.00 0.00 H new ATOM 0 HD11 LEU B 23 2.032 10.074 2.538 1.00 0.00 H new ATOM 0 HD12 LEU B 23 3.272 11.305 2.877 1.00 0.00 H new ATOM 0 HD13 LEU B 23 2.728 10.210 4.170 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -0.256 10.335 3.410 1.00 0.00 H new ATOM 0 HD22 LEU B 23 0.344 10.478 5.080 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -0.690 11.754 4.393 1.00 0.00 H new ATOM 1694 N GLU B 24 2.181 15.751 5.652 1.00 0.00 N ATOM 1695 CA GLU B 24 2.818 16.768 6.476 1.00 0.00 C ATOM 1696 C GLU B 24 1.769 17.646 7.158 1.00 0.00 C ATOM 1697 O GLU B 24 1.856 17.916 8.356 1.00 0.00 O ATOM 1698 CB GLU B 24 3.737 17.628 5.610 1.00 0.00 C ATOM 1699 CG GLU B 24 4.487 18.697 6.382 1.00 0.00 C ATOM 1700 CD GLU B 24 5.321 19.574 5.477 1.00 0.00 C ATOM 1701 OE1 GLU B 24 6.433 19.157 5.099 1.00 0.00 O ATOM 1702 OE2 GLU B 24 4.867 20.684 5.131 1.00 0.00 O ATOM 0 H GLU B 24 2.312 15.883 4.649 1.00 0.00 H new ATOM 0 HA GLU B 24 3.406 16.274 7.249 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.458 16.982 5.110 1.00 0.00 H new ATOM 0 HB3 GLU B 24 3.143 18.106 4.831 1.00 0.00 H new ATOM 0 HG2 GLU B 24 3.775 19.315 6.929 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.132 18.223 7.122 1.00 0.00 H new ATOM 1709 N LYS B 25 0.780 18.080 6.382 1.00 0.00 N ATOM 1710 CA LYS B 25 -0.290 18.941 6.887 1.00 0.00 C ATOM 1711 C LYS B 25 -1.008 18.309 8.070 1.00 0.00 C ATOM 1712 O LYS B 25 -1.254 18.963 9.081 1.00 0.00 O ATOM 1713 CB LYS B 25 -1.304 19.244 5.779 1.00 0.00 C ATOM 1714 CG LYS B 25 -0.807 20.235 4.741 1.00 0.00 C ATOM 1715 CD LYS B 25 -0.597 21.612 5.347 1.00 0.00 C ATOM 1716 CE LYS B 25 -1.904 22.208 5.848 1.00 0.00 C ATOM 1717 NZ LYS B 25 -1.698 23.530 6.493 1.00 0.00 N ATOM 0 H LYS B 25 0.696 17.848 5.392 1.00 0.00 H new ATOM 0 HA LYS B 25 0.173 19.869 7.222 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -1.570 18.313 5.279 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -2.216 19.634 6.232 1.00 0.00 H new ATOM 0 HG2 LYS B 25 0.129 19.877 4.313 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -1.526 20.301 3.925 1.00 0.00 H new ATOM 0 HD2 LYS B 25 0.112 21.543 6.172 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -0.156 22.275 4.602 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -2.598 22.315 5.014 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -2.365 21.524 6.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -2.612 23.903 6.821 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -1.056 23.424 7.304 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -1.281 24.190 5.806 1.00 0.00 H new ATOM 1731 N HIS B 26 -1.333 17.032 7.946 1.00 0.00 N ATOM 1732 CA HIS B 26 -2.107 16.348 8.976 1.00 0.00 C ATOM 1733 C HIS B 26 -1.203 15.687 10.015 1.00 0.00 C ATOM 1734 O HIS B 26 -1.684 14.958 10.885 1.00 0.00 O ATOM 1735 CB HIS B 26 -3.049 15.317 8.348 1.00 0.00 C ATOM 1736 CG HIS B 26 -4.239 15.923 7.666 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -5.482 16.017 8.257 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -4.373 16.461 6.430 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -6.327 16.583 7.414 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -5.680 16.860 6.300 1.00 0.00 N ATOM 0 H HIS B 26 -1.076 16.449 7.149 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.705 17.100 9.491 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.491 14.722 7.625 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -3.395 14.634 9.124 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.596 16.558 5.686 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.371 16.784 7.605 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -6.085 17.300 5.474 1.00 0.00 H new ATOM 1749 N ALA B 27 0.101 15.965 9.925 1.00 0.00 N ATOM 1750 CA ALA B 27 1.082 15.461 10.888 1.00 0.00 C ATOM 1751 C ALA B 27 1.007 13.942 11.025 1.00 0.00 C ATOM 1752 O ALA B 27 0.979 13.401 12.136 1.00 0.00 O ATOM 1753 CB ALA B 27 0.882 16.135 12.238 1.00 0.00 C ATOM 0 H ALA B 27 0.504 16.542 9.187 1.00 0.00 H new ATOM 0 HA ALA B 27 2.077 15.704 10.515 1.00 0.00 H new ATOM 0 HB1 ALA B 27 1.616 15.754 12.947 1.00 0.00 H new ATOM 0 HB2 ALA B 27 1.008 17.212 12.129 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -0.122 15.923 12.606 1.00 0.00 H new ATOM 1759 N ALA B 28 0.978 13.260 9.889 1.00 0.00 N ATOM 1760 CA ALA B 28 0.903 11.808 9.872 1.00 0.00 C ATOM 1761 C ALA B 28 2.233 11.177 10.276 1.00 0.00 C ATOM 1762 O ALA B 28 3.255 11.370 9.611 1.00 0.00 O ATOM 1763 CB ALA B 28 0.481 11.317 8.495 1.00 0.00 C ATOM 0 H ALA B 28 1.005 13.691 8.965 1.00 0.00 H new ATOM 0 HA ALA B 28 0.153 11.503 10.602 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.429 10.228 8.497 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.498 11.727 8.247 1.00 0.00 H new ATOM 0 HB3 ALA B 28 1.209 11.644 7.753 1.00 0.00 H new ATOM 1769 N SER B 29 2.208 10.428 11.373 1.00 0.00 N ATOM 1770 CA SER B 29 3.381 9.706 11.852 1.00 0.00 C ATOM 1771 C SER B 29 3.765 8.592 10.872 1.00 0.00 C ATOM 1772 O SER B 29 2.963 8.221 10.016 1.00 0.00 O ATOM 1773 CB SER B 29 3.089 9.129 13.239 1.00 0.00 C ATOM 1774 OG SER B 29 2.761 10.164 14.155 1.00 0.00 O ATOM 0 H SER B 29 1.378 10.305 11.953 1.00 0.00 H new ATOM 0 HA SER B 29 4.223 10.395 11.922 1.00 0.00 H new ATOM 0 HB2 SER B 29 2.265 8.418 13.176 1.00 0.00 H new ATOM 0 HB3 SER B 29 3.958 8.579 13.600 1.00 0.00 H new ATOM 0 HG SER B 29 2.576 9.775 15.035 1.00 0.00 H new ATOM 1780 N PRO B 30 4.998 8.056 10.970 1.00 0.00 N ATOM 1781 CA PRO B 30 5.500 7.029 10.043 1.00 0.00 C ATOM 1782 C PRO B 30 4.571 5.822 9.903 1.00 0.00 C ATOM 1783 O PRO B 30 4.191 5.456 8.790 1.00 0.00 O ATOM 1784 CB PRO B 30 6.830 6.605 10.660 1.00 0.00 C ATOM 1785 CG PRO B 30 7.267 7.784 11.456 1.00 0.00 C ATOM 1786 CD PRO B 30 6.010 8.416 11.981 1.00 0.00 C ATOM 0 HA PRO B 30 5.583 7.425 9.031 1.00 0.00 H new ATOM 0 HB2 PRO B 30 6.712 5.723 11.290 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.561 6.352 9.892 1.00 0.00 H new ATOM 0 HG2 PRO B 30 7.923 7.482 12.273 1.00 0.00 H new ATOM 0 HG3 PRO B 30 7.828 8.485 10.839 1.00 0.00 H new ATOM 0 HD2 PRO B 30 5.748 8.031 12.966 1.00 0.00 H new ATOM 0 HD3 PRO B 30 6.114 9.497 12.078 1.00 0.00 H new ATOM 1794 N GLU B 31 4.194 5.215 11.024 1.00 0.00 N ATOM 1795 CA GLU B 31 3.348 4.028 10.995 1.00 0.00 C ATOM 1796 C GLU B 31 1.940 4.379 10.522 1.00 0.00 C ATOM 1797 O GLU B 31 1.295 3.589 9.836 1.00 0.00 O ATOM 1798 CB GLU B 31 3.303 3.325 12.363 1.00 0.00 C ATOM 1799 CG GLU B 31 2.907 4.220 13.529 1.00 0.00 C ATOM 1800 CD GLU B 31 4.079 4.975 14.124 1.00 0.00 C ATOM 1801 OE1 GLU B 31 4.526 5.969 13.518 1.00 0.00 O ATOM 1802 OE2 GLU B 31 4.566 4.568 15.202 1.00 0.00 O ATOM 0 H GLU B 31 4.460 5.524 11.959 1.00 0.00 H new ATOM 0 HA GLU B 31 3.789 3.330 10.283 1.00 0.00 H new ATOM 0 HB2 GLU B 31 2.599 2.494 12.306 1.00 0.00 H new ATOM 0 HB3 GLU B 31 4.284 2.898 12.568 1.00 0.00 H new ATOM 0 HG2 GLU B 31 2.156 4.934 13.192 1.00 0.00 H new ATOM 0 HG3 GLU B 31 2.443 3.611 14.305 1.00 0.00 H new ATOM 1809 N LEU B 32 1.474 5.574 10.879 1.00 0.00 N ATOM 1810 CA LEU B 32 0.190 6.070 10.393 1.00 0.00 C ATOM 1811 C LEU B 32 0.246 6.248 8.880 1.00 0.00 C ATOM 1812 O LEU B 32 -0.679 5.878 8.160 1.00 0.00 O ATOM 1813 CB LEU B 32 -0.155 7.402 11.070 1.00 0.00 C ATOM 1814 CG LEU B 32 -1.455 8.059 10.599 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -2.643 7.147 10.853 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -1.656 9.398 11.289 1.00 0.00 C ATOM 0 H LEU B 32 1.966 6.215 11.502 1.00 0.00 H new ATOM 0 HA LEU B 32 -0.586 5.345 10.638 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -0.219 7.238 12.146 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.666 8.099 10.903 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.380 8.231 9.525 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -3.556 7.635 10.510 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -2.506 6.211 10.311 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -2.721 6.940 11.920 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -2.585 9.850 10.942 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -1.706 9.248 12.367 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -0.821 10.058 11.053 1.00 0.00 H new ATOM 1828 N THR B 33 1.357 6.801 8.417 1.00 0.00 N ATOM 1829 CA THR B 33 1.609 6.996 7.000 1.00 0.00 C ATOM 1830 C THR B 33 1.544 5.667 6.248 1.00 0.00 C ATOM 1831 O THR B 33 0.892 5.554 5.208 1.00 0.00 O ATOM 1832 CB THR B 33 2.997 7.635 6.794 1.00 0.00 C ATOM 1833 OG1 THR B 33 3.021 8.955 7.356 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.374 7.686 5.326 1.00 0.00 C ATOM 0 H THR B 33 2.113 7.129 9.019 1.00 0.00 H new ATOM 0 HA THR B 33 0.839 7.659 6.606 1.00 0.00 H new ATOM 0 HB THR B 33 3.731 7.012 7.306 1.00 0.00 H new ATOM 0 HG1 THR B 33 3.003 8.895 8.334 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.358 8.142 5.219 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.397 6.674 4.921 1.00 0.00 H new ATOM 0 HG23 THR B 33 2.638 8.278 4.782 1.00 0.00 H new ATOM 1842 N LEU B 34 2.209 4.661 6.796 1.00 0.00 N ATOM 1843 CA LEU B 34 2.279 3.358 6.160 1.00 0.00 C ATOM 1844 C LEU B 34 0.924 2.646 6.233 1.00 0.00 C ATOM 1845 O LEU B 34 0.543 1.922 5.313 1.00 0.00 O ATOM 1846 CB LEU B 34 3.391 2.526 6.809 1.00 0.00 C ATOM 1847 CG LEU B 34 3.786 1.261 6.048 1.00 0.00 C ATOM 1848 CD1 LEU B 34 5.290 1.058 6.095 1.00 0.00 C ATOM 1849 CD2 LEU B 34 3.079 0.046 6.627 1.00 0.00 C ATOM 0 H LEU B 34 2.709 4.725 7.683 1.00 0.00 H new ATOM 0 HA LEU B 34 2.519 3.485 5.105 1.00 0.00 H new ATOM 0 HB2 LEU B 34 4.275 3.154 6.921 1.00 0.00 H new ATOM 0 HB3 LEU B 34 3.072 2.243 7.812 1.00 0.00 H new ATOM 0 HG LEU B 34 3.481 1.381 5.008 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.552 0.152 5.548 1.00 0.00 H new ATOM 0 HD12 LEU B 34 5.787 1.914 5.639 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.612 0.961 7.132 1.00 0.00 H new ATOM 0 HD21 LEU B 34 3.373 -0.845 6.072 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.356 -0.071 7.675 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.000 0.182 6.550 1.00 0.00 H new ATOM 1861 N MET B 35 0.193 2.872 7.323 1.00 0.00 N ATOM 1862 CA MET B 35 -1.153 2.325 7.471 1.00 0.00 C ATOM 1863 C MET B 35 -2.062 2.881 6.383 1.00 0.00 C ATOM 1864 O MET B 35 -2.814 2.145 5.745 1.00 0.00 O ATOM 1865 CB MET B 35 -1.739 2.682 8.838 1.00 0.00 C ATOM 1866 CG MET B 35 -3.093 2.038 9.100 1.00 0.00 C ATOM 1867 SD MET B 35 -4.140 3.021 10.192 1.00 0.00 S ATOM 1868 CE MET B 35 -3.009 3.364 11.531 1.00 0.00 C ATOM 0 H MET B 35 0.510 3.430 8.116 1.00 0.00 H new ATOM 0 HA MET B 35 -1.088 1.240 7.384 1.00 0.00 H new ATOM 0 HB2 MET B 35 -1.041 2.374 9.616 1.00 0.00 H new ATOM 0 HB3 MET B 35 -1.839 3.765 8.911 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.607 1.887 8.151 1.00 0.00 H new ATOM 0 HG3 MET B 35 -2.942 1.053 9.541 1.00 0.00 H new ATOM 0 HE1 MET B 35 -3.555 3.378 12.474 1.00 0.00 H new ATOM 0 HE2 MET B 35 -2.243 2.590 11.567 1.00 0.00 H new ATOM 0 HE3 MET B 35 -2.538 4.334 11.370 1.00 0.00 H new ATOM 1878 N ILE B 36 -1.967 4.191 6.182 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.749 4.891 5.171 1.00 0.00 C ATOM 1880 C ILE B 36 -2.495 4.322 3.780 1.00 0.00 C ATOM 1881 O ILE B 36 -3.428 4.142 2.997 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.446 6.408 5.208 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -3.171 7.030 6.406 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.834 7.099 3.902 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -2.890 8.499 6.601 1.00 0.00 C ATOM 0 H ILE B 36 -1.345 4.797 6.716 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.804 4.742 5.400 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.371 6.550 5.321 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -4.245 6.890 6.280 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.883 6.493 7.310 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.605 8.162 3.971 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.273 6.659 3.077 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.902 6.969 3.725 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -3.440 8.863 7.469 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -1.822 8.647 6.761 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -3.204 9.050 5.715 1.00 0.00 H new ATOM 1897 N ALA B 37 -1.241 4.011 3.485 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.892 3.382 2.217 1.00 0.00 C ATOM 1899 C ALA B 37 -1.603 2.037 2.076 1.00 0.00 C ATOM 1900 O ALA B 37 -2.036 1.659 0.986 1.00 0.00 O ATOM 1901 CB ALA B 37 0.613 3.209 2.110 1.00 0.00 C ATOM 0 H ALA B 37 -0.449 4.183 4.104 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.221 4.029 1.404 1.00 0.00 H new ATOM 0 HB1 ALA B 37 0.858 2.738 1.158 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.096 4.184 2.168 1.00 0.00 H new ATOM 0 HB3 ALA B 37 0.966 2.580 2.927 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.733 1.330 3.193 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.469 0.081 3.205 1.00 0.00 C ATOM 1909 C GLY B 38 -3.939 0.296 2.931 1.00 0.00 C ATOM 1910 O GLY B 38 -4.567 -0.483 2.211 1.00 0.00 O ATOM 0 H GLY B 38 -1.340 1.602 4.094 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.054 -0.593 2.456 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.346 -0.404 4.173 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.486 1.363 3.503 1.00 0.00 N ATOM 1915 CA ASN B 39 -5.874 1.744 3.264 1.00 0.00 C ATOM 1916 C ASN B 39 -6.089 2.012 1.779 1.00 0.00 C ATOM 1917 O ASN B 39 -7.101 1.607 1.206 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.250 2.997 4.065 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.116 2.833 5.572 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -5.778 3.780 6.271 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -6.397 1.647 6.089 1.00 0.00 N ATOM 0 H ASN B 39 -3.986 1.983 4.140 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.510 0.921 3.589 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.618 3.825 3.743 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.279 3.271 3.830 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -6.335 1.502 7.097 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -6.676 0.878 5.480 1.00 0.00 H new ATOM 1928 N ILE B 40 -5.118 2.687 1.166 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.166 2.986 -0.262 1.00 0.00 C ATOM 1930 C ILE B 40 -5.242 1.698 -1.073 1.00 0.00 C ATOM 1931 O ILE B 40 -6.173 1.500 -1.854 1.00 0.00 O ATOM 1932 CB ILE B 40 -3.925 3.784 -0.722 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -3.741 5.055 0.114 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -4.028 4.133 -2.201 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -4.918 6.004 0.067 1.00 0.00 C ATOM 0 H ILE B 40 -4.286 3.038 1.640 1.00 0.00 H new ATOM 0 HA ILE B 40 -6.057 3.591 -0.430 1.00 0.00 H new ATOM 0 HB ILE B 40 -3.050 3.152 -0.573 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -3.559 4.771 1.151 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -2.851 5.580 -0.234 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -3.145 4.695 -2.505 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -4.095 3.217 -2.787 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -4.919 4.738 -2.371 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -4.706 6.877 0.685 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -5.089 6.320 -0.962 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -5.807 5.499 0.444 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.260 0.820 -0.869 1.00 0.00 N ATOM 1948 CA ALA B 41 -4.200 -0.448 -1.583 1.00 0.00 C ATOM 1949 C ALA B 41 -5.470 -1.263 -1.363 1.00 0.00 C ATOM 1950 O ALA B 41 -5.977 -1.896 -2.287 1.00 0.00 O ATOM 1951 CB ALA B 41 -2.974 -1.235 -1.148 1.00 0.00 C ATOM 0 H ALA B 41 -3.494 0.968 -0.212 1.00 0.00 H new ATOM 0 HA ALA B 41 -4.122 -0.238 -2.650 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.939 -2.181 -1.688 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.075 -0.659 -1.367 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -3.028 -1.430 -0.077 1.00 0.00 H new ATOM 1957 N THR B 42 -5.987 -1.234 -0.139 1.00 0.00 N ATOM 1958 CA THR B 42 -7.221 -1.932 0.183 1.00 0.00 C ATOM 1959 C THR B 42 -8.382 -1.389 -0.649 1.00 0.00 C ATOM 1960 O THR B 42 -9.125 -2.155 -1.255 1.00 0.00 O ATOM 1961 CB THR B 42 -7.566 -1.819 1.684 1.00 0.00 C ATOM 1962 OG1 THR B 42 -6.487 -2.332 2.477 1.00 0.00 O ATOM 1963 CG2 THR B 42 -8.838 -2.585 2.011 1.00 0.00 C ATOM 0 H THR B 42 -5.568 -0.734 0.645 1.00 0.00 H new ATOM 0 HA THR B 42 -7.065 -2.984 -0.056 1.00 0.00 H new ATOM 0 HB THR B 42 -7.723 -0.765 1.914 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.808 -1.635 2.595 1.00 0.00 H new ATOM 0 HG21 THR B 42 -9.058 -2.489 3.074 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.667 -2.179 1.431 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.703 -3.638 1.762 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.509 -0.066 -0.702 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.605 0.570 -1.429 1.00 0.00 C ATOM 1973 C ASN B 43 -9.524 0.250 -2.920 1.00 0.00 C ATOM 1974 O ASN B 43 -10.548 0.059 -3.585 1.00 0.00 O ATOM 1975 CB ASN B 43 -9.593 2.083 -1.205 1.00 0.00 C ATOM 1976 CG ASN B 43 -10.821 2.764 -1.779 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -10.818 3.229 -2.920 1.00 0.00 O ATOM 1978 ND2 ASN B 43 -11.890 2.803 -0.997 1.00 0.00 N ATOM 0 H ASN B 43 -7.868 0.586 -0.251 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.544 0.171 -1.044 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.534 2.289 -0.136 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -8.699 2.508 -1.662 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -12.753 3.230 -1.334 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -11.850 2.406 -0.058 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.303 0.181 -3.437 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.084 -0.224 -4.819 1.00 0.00 C ATOM 1987 C VAL B 44 -8.605 -1.641 -5.032 1.00 0.00 C ATOM 1988 O VAL B 44 -9.336 -1.905 -5.983 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.590 -0.168 -5.206 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.389 -0.606 -6.650 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.033 1.230 -4.997 1.00 0.00 C ATOM 0 H VAL B 44 -7.451 0.400 -2.921 1.00 0.00 H new ATOM 0 HA VAL B 44 -8.625 0.476 -5.455 1.00 0.00 H new ATOM 0 HB VAL B 44 -6.048 -0.857 -4.558 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.329 -0.559 -6.900 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -6.746 -1.629 -6.773 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -6.948 0.055 -7.312 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -4.979 1.247 -5.276 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -6.584 1.938 -5.617 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.136 1.510 -3.948 1.00 0.00 H new ATOM 2001 N LEU B 45 -8.251 -2.536 -4.116 1.00 0.00 N ATOM 2002 CA LEU B 45 -8.680 -3.928 -4.192 1.00 0.00 C ATOM 2003 C LEU B 45 -10.194 -4.053 -4.025 1.00 0.00 C ATOM 2004 O LEU B 45 -10.813 -4.971 -4.561 1.00 0.00 O ATOM 2005 CB LEU B 45 -7.966 -4.763 -3.126 1.00 0.00 C ATOM 2006 CG LEU B 45 -6.440 -4.806 -3.248 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -5.833 -5.566 -2.080 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -6.029 -5.438 -4.570 1.00 0.00 C ATOM 0 H LEU B 45 -7.666 -2.321 -3.309 1.00 0.00 H new ATOM 0 HA LEU B 45 -8.415 -4.305 -5.180 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -8.225 -4.368 -2.144 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -8.347 -5.783 -3.170 1.00 0.00 H new ATOM 0 HG LEU B 45 -6.063 -3.783 -3.224 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -4.748 -5.586 -2.184 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -6.099 -5.071 -1.146 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -6.216 -6.587 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -4.941 -5.460 -4.640 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -6.417 -6.455 -4.623 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -6.434 -4.852 -5.395 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.779 -3.128 -3.276 1.00 0.00 N ATOM 2021 CA ASN B 46 -12.218 -3.127 -3.034 1.00 0.00 C ATOM 2022 C ASN B 46 -12.996 -2.765 -4.293 1.00 0.00 C ATOM 2023 O ASN B 46 -13.925 -3.475 -4.686 1.00 0.00 O ATOM 2024 CB ASN B 46 -12.589 -2.136 -1.921 1.00 0.00 C ATOM 2025 CG ASN B 46 -12.052 -2.527 -0.557 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -11.735 -1.667 0.265 1.00 0.00 O ATOM 2027 ND2 ASN B 46 -11.976 -3.819 -0.287 1.00 0.00 N ATOM 0 H ASN B 46 -10.277 -2.364 -2.823 1.00 0.00 H new ATOM 0 HA ASN B 46 -12.486 -4.138 -2.727 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -12.208 -1.149 -2.183 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.675 -2.054 -1.865 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -11.646 -4.131 0.627 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -12.247 -4.504 -0.992 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.617 -1.661 -4.927 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.420 -1.098 -6.008 1.00 0.00 C ATOM 2036 C GLN B 47 -12.642 -0.982 -7.319 1.00 0.00 C ATOM 2037 O GLN B 47 -13.142 -1.356 -8.380 1.00 0.00 O ATOM 2038 CB GLN B 47 -13.930 0.290 -5.606 1.00 0.00 C ATOM 2039 CG GLN B 47 -14.701 0.308 -4.296 1.00 0.00 C ATOM 2040 CD GLN B 47 -15.034 1.714 -3.836 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -16.085 2.263 -4.169 1.00 0.00 O ATOM 2042 NE2 GLN B 47 -14.132 2.310 -3.074 1.00 0.00 N ATOM 0 H GLN B 47 -11.766 -1.141 -4.714 1.00 0.00 H new ATOM 0 HA GLN B 47 -14.253 -1.781 -6.175 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -13.081 0.969 -5.526 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -14.572 0.674 -6.399 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -15.624 -0.260 -4.414 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -14.114 -0.193 -3.526 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -13.274 1.820 -2.821 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -14.294 3.260 -2.739 1.00 0.00 H new ATOM 2051 N ARG B 48 -11.417 -0.480 -7.244 1.00 0.00 N ATOM 2052 CA ARG B 48 -10.683 -0.065 -8.439 1.00 0.00 C ATOM 2053 C ARG B 48 -9.781 -1.168 -8.994 1.00 0.00 C ATOM 2054 O ARG B 48 -8.648 -0.901 -9.395 1.00 0.00 O ATOM 2055 CB ARG B 48 -9.845 1.179 -8.127 1.00 0.00 C ATOM 2056 CG ARG B 48 -10.673 2.385 -7.722 1.00 0.00 C ATOM 2057 CD ARG B 48 -9.803 3.612 -7.521 1.00 0.00 C ATOM 2058 NE ARG B 48 -10.596 4.792 -7.177 1.00 0.00 N ATOM 2059 CZ ARG B 48 -10.475 5.975 -7.784 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -9.577 6.142 -8.748 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -11.246 6.993 -7.421 1.00 0.00 N ATOM 0 H ARG B 48 -10.908 -0.349 -6.370 1.00 0.00 H new ATOM 0 HA ARG B 48 -11.424 0.160 -9.206 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.145 0.943 -7.325 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.250 1.435 -9.004 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.421 2.589 -8.489 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.213 2.165 -6.801 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -9.079 3.418 -6.730 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -9.236 3.808 -8.431 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.283 4.706 -6.428 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -8.977 5.365 -9.027 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -9.487 7.047 -9.210 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.933 6.872 -6.677 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -11.151 7.896 -7.886 1.00 0.00 H new ATOM 2075 N VAL B 49 -10.287 -2.394 -9.047 1.00 0.00 N ATOM 2076 CA VAL B 49 -9.529 -3.497 -9.627 1.00 0.00 C ATOM 2077 C VAL B 49 -10.455 -4.641 -10.043 1.00 0.00 C ATOM 2078 O VAL B 49 -11.520 -4.843 -9.451 1.00 0.00 O ATOM 2079 CB VAL B 49 -8.444 -4.021 -8.653 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -9.060 -4.790 -7.499 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -7.417 -4.875 -9.383 1.00 0.00 C ATOM 0 H VAL B 49 -11.211 -2.649 -8.699 1.00 0.00 H new ATOM 0 HA VAL B 49 -9.029 -3.109 -10.514 1.00 0.00 H new ATOM 0 HB VAL B 49 -7.931 -3.153 -8.239 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -8.271 -5.143 -6.835 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -9.735 -4.137 -6.946 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -9.617 -5.643 -7.886 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -6.668 -5.229 -8.674 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -7.914 -5.729 -9.842 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -6.932 -4.279 -10.156 1.00 0.00 H new ATOM 2091 N ALA B 50 -10.052 -5.374 -11.075 1.00 0.00 N ATOM 2092 CA ALA B 50 -10.824 -6.507 -11.565 1.00 0.00 C ATOM 2093 C ALA B 50 -10.632 -7.721 -10.665 1.00 0.00 C ATOM 2094 O ALA B 50 -9.600 -7.851 -10.014 1.00 0.00 O ATOM 2095 CB ALA B 50 -10.421 -6.840 -12.990 1.00 0.00 C ATOM 0 H ALA B 50 -9.189 -5.201 -11.591 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.879 -6.234 -11.552 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.006 -7.689 -13.345 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.607 -5.978 -13.631 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.361 -7.092 -13.019 1.00 0.00 H new ATOM 2101 N ALA B 51 -11.626 -8.603 -10.631 1.00 0.00 N ATOM 2102 CA ALA B 51 -11.563 -9.813 -9.812 1.00 0.00 C ATOM 2103 C ALA B 51 -10.336 -10.658 -10.147 1.00 0.00 C ATOM 2104 O ALA B 51 -9.565 -11.025 -9.261 1.00 0.00 O ATOM 2105 CB ALA B 51 -12.829 -10.638 -9.983 1.00 0.00 C ATOM 0 H ALA B 51 -12.490 -8.503 -11.164 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.479 -9.500 -8.771 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -12.765 -11.535 -9.367 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -13.692 -10.048 -9.676 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -12.938 -10.924 -11.029 1.00 0.00 H new ATOM 2111 N SER B 52 -10.149 -10.946 -11.429 1.00 0.00 N ATOM 2112 CA SER B 52 -9.025 -11.765 -11.877 1.00 0.00 C ATOM 2113 C SER B 52 -7.690 -11.060 -11.628 1.00 0.00 C ATOM 2114 O SER B 52 -6.654 -11.704 -11.454 1.00 0.00 O ATOM 2115 CB SER B 52 -9.176 -12.074 -13.366 1.00 0.00 C ATOM 2116 OG SER B 52 -10.473 -12.573 -13.653 1.00 0.00 O ATOM 0 H SER B 52 -10.761 -10.625 -12.179 1.00 0.00 H new ATOM 0 HA SER B 52 -9.030 -12.693 -11.305 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.993 -11.171 -13.949 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.426 -12.806 -13.667 1.00 0.00 H new ATOM 0 HG SER B 52 -10.546 -12.762 -14.612 1.00 0.00 H new ATOM 2122 N GLN B 53 -7.726 -9.735 -11.598 1.00 0.00 N ATOM 2123 CA GLN B 53 -6.519 -8.943 -11.431 1.00 0.00 C ATOM 2124 C GLN B 53 -6.227 -8.728 -9.950 1.00 0.00 C ATOM 2125 O GLN B 53 -5.109 -8.406 -9.576 1.00 0.00 O ATOM 2126 CB GLN B 53 -6.685 -7.581 -12.116 1.00 0.00 C ATOM 2127 CG GLN B 53 -5.373 -6.928 -12.520 1.00 0.00 C ATOM 2128 CD GLN B 53 -4.616 -7.732 -13.558 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -4.820 -7.561 -14.761 1.00 0.00 O ATOM 2130 NE2 GLN B 53 -3.735 -8.609 -13.104 1.00 0.00 N ATOM 0 H GLN B 53 -8.581 -9.186 -11.688 1.00 0.00 H new ATOM 0 HA GLN B 53 -5.688 -9.481 -11.887 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -7.305 -7.705 -13.003 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.221 -6.911 -11.444 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -5.574 -5.931 -12.913 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -4.747 -6.802 -11.636 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -3.597 -8.720 -12.099 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.194 -9.174 -13.759 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.241 -8.943 -9.126 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.217 -8.550 -7.720 1.00 0.00 C ATOM 2141 C ARG B 54 -6.072 -9.212 -6.949 1.00 0.00 C ATOM 2142 O ARG B 54 -5.208 -8.527 -6.406 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.571 -8.892 -7.094 1.00 0.00 C ATOM 2144 CG ARG B 54 -8.878 -8.150 -5.804 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.380 -8.096 -5.557 1.00 0.00 C ATOM 2146 NE ARG B 54 -11.074 -7.319 -6.591 1.00 0.00 N ATOM 2147 CZ ARG B 54 -12.253 -7.646 -7.121 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -12.866 -8.762 -6.759 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -12.816 -6.857 -8.028 1.00 0.00 N ATOM 0 H ARG B 54 -8.109 -9.397 -9.412 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.039 -7.476 -7.662 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.356 -8.675 -7.818 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.605 -9.964 -6.898 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -8.385 -8.645 -4.968 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.477 -7.138 -5.857 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.781 -9.109 -5.533 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.572 -7.654 -4.579 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.622 -6.469 -6.928 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.437 -9.379 -6.070 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.768 -9.005 -7.169 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.347 -6.000 -8.320 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.718 -7.108 -8.433 1.00 0.00 H new ATOM 2163 N LYS B 55 -6.060 -10.539 -6.910 1.00 0.00 N ATOM 2164 CA LYS B 55 -5.036 -11.260 -6.160 1.00 0.00 C ATOM 2165 C LYS B 55 -3.669 -11.147 -6.830 1.00 0.00 C ATOM 2166 O LYS B 55 -2.638 -11.148 -6.155 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.413 -12.734 -5.991 1.00 0.00 C ATOM 2168 CG LYS B 55 -6.608 -12.959 -5.077 1.00 0.00 C ATOM 2169 CD LYS B 55 -6.768 -14.427 -4.713 1.00 0.00 C ATOM 2170 CE LYS B 55 -5.527 -14.962 -4.013 1.00 0.00 C ATOM 2171 NZ LYS B 55 -5.703 -16.360 -3.542 1.00 0.00 N ATOM 0 H LYS B 55 -6.740 -11.134 -7.383 1.00 0.00 H new ATOM 0 HA LYS B 55 -4.975 -10.798 -5.175 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -5.631 -13.159 -6.971 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -4.555 -13.276 -5.593 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -6.487 -12.370 -4.168 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -7.514 -12.605 -5.569 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -7.635 -14.551 -4.065 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -6.959 -15.009 -5.615 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -4.679 -14.915 -4.696 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -5.288 -14.322 -3.164 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -4.832 -16.680 -3.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -6.495 -16.403 -2.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -5.905 -16.977 -4.354 1.00 0.00 H new ATOM 2185 N LEU B 56 -3.659 -11.039 -8.152 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.410 -10.944 -8.895 1.00 0.00 C ATOM 2187 C LEU B 56 -1.749 -9.589 -8.687 1.00 0.00 C ATOM 2188 O LEU B 56 -0.544 -9.508 -8.451 1.00 0.00 O ATOM 2189 CB LEU B 56 -2.645 -11.186 -10.387 1.00 0.00 C ATOM 2190 CG LEU B 56 -3.010 -12.621 -10.763 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -3.194 -12.745 -12.266 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -1.941 -13.585 -10.272 1.00 0.00 C ATOM 0 H LEU B 56 -4.499 -11.015 -8.730 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.742 -11.716 -8.514 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.443 -10.525 -10.725 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -1.744 -10.903 -10.931 1.00 0.00 H new ATOM 0 HG LEU B 56 -3.953 -12.878 -10.280 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -3.454 -13.773 -12.517 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -3.994 -12.079 -12.591 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -2.267 -12.471 -12.770 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -2.215 -14.603 -10.547 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -0.984 -13.331 -10.728 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.856 -13.513 -9.188 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.546 -8.529 -8.756 1.00 0.00 N ATOM 2205 CA ILE B 57 -2.029 -7.175 -8.619 1.00 0.00 C ATOM 2206 C ILE B 57 -1.557 -6.938 -7.186 1.00 0.00 C ATOM 2207 O ILE B 57 -0.624 -6.171 -6.951 1.00 0.00 O ATOM 2208 CB ILE B 57 -3.089 -6.119 -9.033 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -2.423 -4.786 -9.372 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -4.128 -5.919 -7.936 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -3.380 -3.775 -9.968 1.00 0.00 C ATOM 0 H ILE B 57 -3.553 -8.582 -8.906 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.179 -7.065 -9.292 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.597 -6.495 -9.921 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -1.980 -4.368 -8.468 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -1.608 -4.963 -10.074 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.856 -5.174 -8.256 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.637 -6.863 -7.740 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.635 -5.577 -7.026 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -2.844 -2.851 -10.186 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.804 -4.174 -10.889 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -4.182 -3.571 -9.258 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.186 -7.633 -6.238 1.00 0.00 N ATOM 2224 CA ALA B 58 -1.778 -7.564 -4.841 1.00 0.00 C ATOM 2225 C ALA B 58 -0.404 -8.202 -4.647 1.00 0.00 C ATOM 2226 O ALA B 58 0.449 -7.663 -3.938 1.00 0.00 O ATOM 2227 CB ALA B 58 -2.813 -8.239 -3.953 1.00 0.00 C ATOM 0 H ALA B 58 -2.979 -8.249 -6.415 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.708 -6.515 -4.554 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.494 -8.179 -2.912 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.774 -7.737 -4.067 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -2.914 -9.285 -4.242 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.186 -9.345 -5.293 1.00 0.00 N ATOM 2234 CA GLU B 59 1.091 -10.041 -5.191 1.00 0.00 C ATOM 2235 C GLU B 59 2.174 -9.289 -5.963 1.00 0.00 C ATOM 2236 O GLU B 59 3.330 -9.238 -5.533 1.00 0.00 O ATOM 2237 CB GLU B 59 0.972 -11.480 -5.697 1.00 0.00 C ATOM 2238 CG GLU B 59 2.236 -12.295 -5.480 1.00 0.00 C ATOM 2239 CD GLU B 59 2.096 -13.728 -5.932 1.00 0.00 C ATOM 2240 OE1 GLU B 59 2.227 -13.988 -7.146 1.00 0.00 O ATOM 2241 OE2 GLU B 59 1.867 -14.605 -5.076 1.00 0.00 O ATOM 0 H GLU B 59 -0.874 -9.806 -5.889 1.00 0.00 H new ATOM 0 HA GLU B 59 1.375 -10.075 -4.139 1.00 0.00 H new ATOM 0 HB2 GLU B 59 0.140 -11.969 -5.190 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.734 -11.466 -6.761 1.00 0.00 H new ATOM 0 HG2 GLU B 59 3.060 -11.828 -6.019 1.00 0.00 H new ATOM 0 HG3 GLU B 59 2.497 -12.277 -4.422 1.00 0.00 H new ATOM 2248 N LYS B 60 1.796 -8.716 -7.105 1.00 0.00 N ATOM 2249 CA LYS B 60 2.686 -7.833 -7.861 1.00 0.00 C ATOM 2250 C LYS B 60 3.229 -6.740 -6.953 1.00 0.00 C ATOM 2251 O LYS B 60 4.436 -6.494 -6.896 1.00 0.00 O ATOM 2252 CB LYS B 60 1.935 -7.181 -9.028 1.00 0.00 C ATOM 2253 CG LYS B 60 1.693 -8.098 -10.215 1.00 0.00 C ATOM 2254 CD LYS B 60 0.668 -7.500 -11.174 1.00 0.00 C ATOM 2255 CE LYS B 60 1.044 -6.094 -11.624 1.00 0.00 C ATOM 2256 NZ LYS B 60 -0.012 -5.485 -12.482 1.00 0.00 N ATOM 0 H LYS B 60 0.877 -8.847 -7.528 1.00 0.00 H new ATOM 0 HA LYS B 60 3.508 -8.433 -8.252 1.00 0.00 H new ATOM 0 HB2 LYS B 60 0.974 -6.816 -8.666 1.00 0.00 H new ATOM 0 HB3 LYS B 60 2.499 -6.312 -9.366 1.00 0.00 H new ATOM 0 HG2 LYS B 60 2.631 -8.270 -10.742 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.343 -9.068 -9.863 1.00 0.00 H new ATOM 0 HD2 LYS B 60 0.573 -8.145 -12.048 1.00 0.00 H new ATOM 0 HD3 LYS B 60 -0.308 -7.474 -10.689 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.209 -5.465 -10.749 1.00 0.00 H new ATOM 0 HE3 LYS B 60 1.984 -6.128 -12.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 -0.053 -4.461 -12.307 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 0.212 -5.657 -13.483 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 -0.933 -5.912 -12.255 1.00 0.00 H new ATOM 2270 N PHE B 61 2.313 -6.106 -6.239 1.00 0.00 N ATOM 2271 CA PHE B 61 2.642 -5.032 -5.320 1.00 0.00 C ATOM 2272 C PHE B 61 3.569 -5.509 -4.203 1.00 0.00 C ATOM 2273 O PHE B 61 4.620 -4.910 -3.963 1.00 0.00 O ATOM 2274 CB PHE B 61 1.352 -4.457 -4.737 1.00 0.00 C ATOM 2275 CG PHE B 61 1.563 -3.520 -3.588 1.00 0.00 C ATOM 2276 CD1 PHE B 61 2.533 -2.535 -3.643 1.00 0.00 C ATOM 2277 CD2 PHE B 61 0.792 -3.633 -2.446 1.00 0.00 C ATOM 2278 CE1 PHE B 61 2.729 -1.681 -2.581 1.00 0.00 C ATOM 2279 CE2 PHE B 61 0.983 -2.779 -1.381 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.954 -1.802 -1.447 1.00 0.00 C ATOM 0 H PHE B 61 1.317 -6.324 -6.282 1.00 0.00 H new ATOM 0 HA PHE B 61 3.175 -4.256 -5.870 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.812 -3.932 -5.525 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.716 -5.279 -4.409 1.00 0.00 H new ATOM 0 HD1 PHE B 61 3.143 -2.435 -4.529 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.032 -4.398 -2.388 1.00 0.00 H new ATOM 0 HE1 PHE B 61 3.490 -0.916 -2.636 1.00 0.00 H new ATOM 0 HE2 PHE B 61 0.372 -2.875 -0.495 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.107 -1.133 -0.613 1.00 0.00 H new ATOM 2290 N ALA B 62 3.182 -6.582 -3.523 1.00 0.00 N ATOM 2291 CA ALA B 62 3.963 -7.092 -2.403 1.00 0.00 C ATOM 2292 C ALA B 62 5.389 -7.426 -2.821 1.00 0.00 C ATOM 2293 O ALA B 62 6.329 -7.142 -2.086 1.00 0.00 O ATOM 2294 CB ALA B 62 3.301 -8.316 -1.793 1.00 0.00 C ATOM 0 H ALA B 62 2.336 -7.114 -3.727 1.00 0.00 H new ATOM 0 HA ALA B 62 4.004 -6.302 -1.653 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.903 -8.678 -0.959 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.306 -8.051 -1.434 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.218 -9.099 -2.547 1.00 0.00 H new ATOM 2300 N GLN B 63 5.551 -8.020 -4.001 1.00 0.00 N ATOM 2301 CA GLN B 63 6.880 -8.368 -4.491 1.00 0.00 C ATOM 2302 C GLN B 63 7.708 -7.110 -4.680 1.00 0.00 C ATOM 2303 O GLN B 63 8.862 -7.052 -4.266 1.00 0.00 O ATOM 2304 CB GLN B 63 6.806 -9.114 -5.820 1.00 0.00 C ATOM 2305 CG GLN B 63 8.114 -9.786 -6.214 1.00 0.00 C ATOM 2306 CD GLN B 63 8.578 -10.803 -5.190 1.00 0.00 C ATOM 2307 OE1 GLN B 63 7.768 -11.435 -4.512 1.00 0.00 O ATOM 2308 NE2 GLN B 63 9.885 -10.965 -5.065 1.00 0.00 N ATOM 0 H GLN B 63 4.787 -8.268 -4.629 1.00 0.00 H new ATOM 0 HA GLN B 63 7.345 -9.018 -3.750 1.00 0.00 H new ATOM 0 HB2 GLN B 63 6.022 -9.869 -5.760 1.00 0.00 H new ATOM 0 HB3 GLN B 63 6.516 -8.415 -6.604 1.00 0.00 H new ATOM 0 HG2 GLN B 63 7.989 -10.278 -7.179 1.00 0.00 H new ATOM 0 HG3 GLN B 63 8.885 -9.026 -6.341 1.00 0.00 H new ATOM 0 HE21 GLN B 63 10.524 -10.422 -5.646 1.00 0.00 H new ATOM 0 HE22 GLN B 63 10.254 -11.633 -4.388 1.00 0.00 H new ATOM 2317 N ALA B 64 7.109 -6.110 -5.314 1.00 0.00 N ATOM 2318 CA ALA B 64 7.780 -4.840 -5.545 1.00 0.00 C ATOM 2319 C ALA B 64 8.194 -4.210 -4.222 1.00 0.00 C ATOM 2320 O ALA B 64 9.343 -3.812 -4.049 1.00 0.00 O ATOM 2321 CB ALA B 64 6.877 -3.901 -6.328 1.00 0.00 C ATOM 0 H ALA B 64 6.157 -6.156 -5.678 1.00 0.00 H new ATOM 0 HA ALA B 64 8.679 -5.022 -6.133 1.00 0.00 H new ATOM 0 HB1 ALA B 64 7.392 -2.955 -6.493 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.629 -4.352 -7.289 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.962 -3.722 -5.764 1.00 0.00 H new ATOM 2327 N LEU B 65 7.258 -4.169 -3.282 1.00 0.00 N ATOM 2328 CA LEU B 65 7.502 -3.585 -1.967 1.00 0.00 C ATOM 2329 C LEU B 65 8.571 -4.377 -1.215 1.00 0.00 C ATOM 2330 O LEU B 65 9.413 -3.812 -0.517 1.00 0.00 O ATOM 2331 CB LEU B 65 6.205 -3.565 -1.155 1.00 0.00 C ATOM 2332 CG LEU B 65 6.197 -2.589 0.020 1.00 0.00 C ATOM 2333 CD1 LEU B 65 6.316 -1.168 -0.496 1.00 0.00 C ATOM 2334 CD2 LEU B 65 4.933 -2.747 0.848 1.00 0.00 C ATOM 0 H LEU B 65 6.315 -4.536 -3.407 1.00 0.00 H new ATOM 0 HA LEU B 65 7.858 -2.564 -2.104 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.380 -3.315 -1.822 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.015 -4.569 -0.776 1.00 0.00 H new ATOM 0 HG LEU B 65 7.049 -2.810 0.663 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.310 -0.474 0.344 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.248 -1.059 -1.050 1.00 0.00 H new ATOM 0 HD13 LEU B 65 5.475 -0.948 -1.154 1.00 0.00 H new ATOM 0 HD21 LEU B 65 4.951 -2.041 1.678 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.062 -2.550 0.223 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.878 -3.764 1.237 1.00 0.00 H new ATOM 2346 N MET B 66 8.531 -5.694 -1.376 1.00 0.00 N ATOM 2347 CA MET B 66 9.483 -6.591 -0.731 1.00 0.00 C ATOM 2348 C MET B 66 10.852 -6.472 -1.394 1.00 0.00 C ATOM 2349 O MET B 66 11.875 -6.844 -0.821 1.00 0.00 O ATOM 2350 CB MET B 66 8.979 -8.038 -0.829 1.00 0.00 C ATOM 2351 CG MET B 66 9.348 -8.920 0.355 1.00 0.00 C ATOM 2352 SD MET B 66 8.113 -8.894 1.678 1.00 0.00 S ATOM 2353 CE MET B 66 7.931 -7.138 1.977 1.00 0.00 C ATOM 0 H MET B 66 7.840 -6.170 -1.956 1.00 0.00 H new ATOM 0 HA MET B 66 9.576 -6.313 0.319 1.00 0.00 H new ATOM 0 HB2 MET B 66 7.894 -8.025 -0.931 1.00 0.00 H new ATOM 0 HB3 MET B 66 9.379 -8.487 -1.738 1.00 0.00 H new ATOM 0 HG2 MET B 66 9.478 -9.945 0.009 1.00 0.00 H new ATOM 0 HG3 MET B 66 10.308 -8.595 0.757 1.00 0.00 H new ATOM 0 HE1 MET B 66 7.296 -6.981 2.849 1.00 0.00 H new ATOM 0 HE2 MET B 66 8.911 -6.696 2.157 1.00 0.00 H new ATOM 0 HE3 MET B 66 7.475 -6.666 1.107 1.00 0.00 H new ATOM 2363 N SER B 67 10.859 -5.945 -2.609 1.00 0.00 N ATOM 2364 CA SER B 67 12.080 -5.798 -3.378 1.00 0.00 C ATOM 2365 C SER B 67 12.697 -4.410 -3.177 1.00 0.00 C ATOM 2366 O SER B 67 13.919 -4.256 -3.208 1.00 0.00 O ATOM 2367 CB SER B 67 11.784 -6.072 -4.855 1.00 0.00 C ATOM 2368 OG SER B 67 11.379 -7.419 -5.039 1.00 0.00 O ATOM 0 H SER B 67 10.022 -5.610 -3.086 1.00 0.00 H new ATOM 0 HA SER B 67 12.813 -6.524 -3.026 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.001 -5.400 -5.206 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.672 -5.868 -5.454 1.00 0.00 H new ATOM 0 HG SER B 67 10.458 -7.530 -4.723 1.00 0.00 H new ATOM 2374 N SER B 68 11.854 -3.407 -2.940 1.00 0.00 N ATOM 2375 CA SER B 68 12.325 -2.056 -2.651 1.00 0.00 C ATOM 2376 C SER B 68 12.531 -1.877 -1.148 1.00 0.00 C ATOM 2377 O SER B 68 12.725 -0.764 -0.655 1.00 0.00 O ATOM 2378 CB SER B 68 11.323 -1.022 -3.175 1.00 0.00 C ATOM 2379 OG SER B 68 10.017 -1.280 -2.686 1.00 0.00 O ATOM 0 H SER B 68 10.839 -3.506 -2.943 1.00 0.00 H new ATOM 0 HA SER B 68 13.280 -1.905 -3.155 1.00 0.00 H new ATOM 0 HB2 SER B 68 11.636 -0.023 -2.873 1.00 0.00 H new ATOM 0 HB3 SER B 68 11.316 -1.038 -4.265 1.00 0.00 H new ATOM 0 HG SER B 68 9.624 -2.029 -3.182 1.00 0.00 H new ATOM 2385 N LEU B 69 12.523 -2.999 -0.440 1.00 0.00 N ATOM 2386 CA LEU B 69 12.624 -3.031 1.017 1.00 0.00 C ATOM 2387 C LEU B 69 14.071 -2.817 1.485 1.00 0.00 C ATOM 2388 O LEU B 69 14.455 -3.277 2.564 1.00 0.00 O ATOM 2389 CB LEU B 69 12.100 -4.393 1.498 1.00 0.00 C ATOM 2390 CG LEU B 69 11.949 -4.574 3.008 1.00 0.00 C ATOM 2391 CD1 LEU B 69 10.904 -3.622 3.560 1.00 0.00 C ATOM 2392 CD2 LEU B 69 11.585 -6.014 3.330 1.00 0.00 C ATOM 0 H LEU B 69 12.445 -3.924 -0.864 1.00 0.00 H new ATOM 0 HA LEU B 69 12.030 -2.221 1.441 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.129 -4.567 1.035 1.00 0.00 H new ATOM 0 HB3 LEU B 69 12.773 -5.167 1.128 1.00 0.00 H new ATOM 0 HG LEU B 69 12.903 -4.342 3.482 1.00 0.00 H new ATOM 0 HD11 LEU B 69 10.812 -3.767 4.636 1.00 0.00 H new ATOM 0 HD12 LEU B 69 11.205 -2.594 3.357 1.00 0.00 H new ATOM 0 HD13 LEU B 69 9.944 -3.820 3.084 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.480 -6.130 4.409 1.00 0.00 H new ATOM 0 HD22 LEU B 69 10.643 -6.268 2.844 1.00 0.00 H new ATOM 0 HD23 LEU B 69 12.370 -6.677 2.968 1.00 0.00 H new