USER MOD reduce.3.24.130724 H: found=0, std=0, add=876, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 875 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 86 LYS NZ :NH3+ -137:sc= -0.0217 (180deg=-0.182) USER MOD Set 1.2: A 87 ASN : amide:sc= 0 X(o=-0.022,f=-0.026) USER MOD Set 2.1: A 19 LYS NZ :NH3+ -120:sc= 0.489 (180deg=-0.173) USER MOD Set 2.2: A 84 MET CE :methyl -164:sc= -1.72 (180deg=-2.49) USER MOD Set 2.3: A 90 CYS SG : rot -125:sc= 0.636 USER MOD Set 3.1: A 67 HIS : no HD1:sc= -0.0533 X(o=-1.1,f=-1.1) USER MOD Set 3.2: A 70 GLN : amide:sc= -1.09 K(o=-1.1,f=-6.2!) USER MOD Set 4.1: A 42 HIS : no HE2:sc= -4.02 X(o=-3.5,f=-3.6) USER MOD Set 4.2: A 57 SER OG : rot 78:sc= 0.488 USER MOD Single : A 8 GLN : amide:sc= -0.308 X(o=-0.31,f=0) USER MOD Single : A 10 HIS : no HD1:sc= -2.81! C(o=-2.8!,f=-2.4!) USER MOD Single : A 12 THR OG1 : rot -119:sc= 0.0539 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.0931 USER MOD Single : A 24 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0397) USER MOD Single : A 31 ASN : amide:sc= -0.415 K(o=-0.42,f=-1) USER MOD Single : A 34 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.00802) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.21 X(o=-0.21,f=-0.077) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot -165:sc= 1.85 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= -0.514 USER MOD Single : A 52 LYS NZ :NH3+ -158:sc= -0.121 (180deg=-0.638) USER MOD Single : A 56 SER OG : rot 100:sc= -3.26! USER MOD Single : A 61 ASN : amide:sc= -0.0731 X(o=-0.073,f=-0.4) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 CYS SG : rot -18:sc= -3.19! USER MOD Single : A 83 SER OG : rot -36:sc= 0.685 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -151:sc= 0.629 (180deg=0.182) USER MOD Single : A 91 SER OG : rot 36:sc= -0.27 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 142:sc= -0.108 (180deg=-1.55!) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.0998 K(o=-0.1,f=-0.84) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 98 N GLU A 7 15.404 2.372 -5.377 1.00 0.00 N ATOM 99 CA GLU A 7 16.573 1.790 -4.729 1.00 0.00 C ATOM 100 C GLU A 7 17.414 1.003 -5.729 1.00 0.00 C ATOM 101 O GLU A 7 16.885 0.226 -6.524 1.00 0.00 O ATOM 102 CB GLU A 7 16.145 0.879 -3.577 1.00 0.00 C ATOM 103 CG GLU A 7 15.865 1.625 -2.283 1.00 0.00 C ATOM 104 CD GLU A 7 15.846 0.710 -1.074 1.00 0.00 C ATOM 105 OE1 GLU A 7 16.908 0.144 -0.742 1.00 0.00 O ATOM 106 OE2 GLU A 7 14.769 0.560 -0.460 1.00 0.00 O ATOM 0 HA GLU A 7 17.179 2.604 -4.332 1.00 0.00 H new ATOM 0 HB2 GLU A 7 15.250 0.331 -3.872 1.00 0.00 H new ATOM 0 HB3 GLU A 7 16.927 0.141 -3.399 1.00 0.00 H new ATOM 0 HG2 GLU A 7 16.624 2.394 -2.140 1.00 0.00 H new ATOM 0 HG3 GLU A 7 14.905 2.135 -2.363 1.00 0.00 H new ATOM 113 N GLN A 8 18.726 1.210 -5.684 1.00 0.00 N ATOM 114 CA GLN A 8 19.640 0.520 -6.587 1.00 0.00 C ATOM 115 C GLN A 8 20.355 -0.621 -5.871 1.00 0.00 C ATOM 116 O GLN A 8 20.825 -0.463 -4.744 1.00 0.00 O ATOM 117 CB GLN A 8 20.665 1.502 -7.157 1.00 0.00 C ATOM 118 CG GLN A 8 20.605 1.635 -8.670 1.00 0.00 C ATOM 119 CD GLN A 8 21.639 2.601 -9.213 1.00 0.00 C ATOM 120 OE1 GLN A 8 21.324 3.477 -10.019 1.00 0.00 O ATOM 121 NE2 GLN A 8 22.882 2.447 -8.773 1.00 0.00 N ATOM 0 H GLN A 8 19.180 1.850 -5.032 1.00 0.00 H new ATOM 0 HA GLN A 8 19.055 0.101 -7.405 1.00 0.00 H new ATOM 0 HB2 GLN A 8 20.505 2.482 -6.708 1.00 0.00 H new ATOM 0 HB3 GLN A 8 21.665 1.178 -6.869 1.00 0.00 H new ATOM 0 HG2 GLN A 8 20.756 0.655 -9.123 1.00 0.00 H new ATOM 0 HG3 GLN A 8 19.610 1.972 -8.962 1.00 0.00 H new ATOM 0 HE21 GLN A 8 23.099 1.707 -8.105 1.00 0.00 H new ATOM 0 HE22 GLN A 8 23.620 3.068 -9.103 1.00 0.00 H new ATOM 130 N VAL A 9 20.433 -1.771 -6.533 1.00 0.00 N ATOM 131 CA VAL A 9 21.091 -2.939 -5.960 1.00 0.00 C ATOM 132 C VAL A 9 22.033 -3.589 -6.968 1.00 0.00 C ATOM 133 O VAL A 9 21.623 -3.955 -8.070 1.00 0.00 O ATOM 134 CB VAL A 9 20.065 -3.985 -5.484 1.00 0.00 C ATOM 135 CG1 VAL A 9 20.772 -5.198 -4.898 1.00 0.00 C ATOM 136 CG2 VAL A 9 19.111 -3.372 -4.470 1.00 0.00 C ATOM 0 H VAL A 9 20.049 -1.919 -7.466 1.00 0.00 H new ATOM 0 HA VAL A 9 21.666 -2.589 -5.103 1.00 0.00 H new ATOM 0 HB VAL A 9 19.482 -4.315 -6.344 1.00 0.00 H new ATOM 0 HG11 VAL A 9 20.031 -5.926 -4.567 1.00 0.00 H new ATOM 0 HG12 VAL A 9 21.410 -5.649 -5.658 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.381 -4.889 -4.049 1.00 0.00 H new ATOM 0 HG21 VAL A 9 18.393 -4.125 -4.144 1.00 0.00 H new ATOM 0 HG22 VAL A 9 19.676 -3.013 -3.610 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.579 -2.538 -4.928 1.00 0.00 H new ATOM 146 N HIS A 10 23.297 -3.730 -6.583 1.00 0.00 N ATOM 147 CA HIS A 10 24.298 -4.337 -7.453 1.00 0.00 C ATOM 148 C HIS A 10 24.217 -5.860 -7.395 1.00 0.00 C ATOM 149 O HIS A 10 24.393 -6.461 -6.334 1.00 0.00 O ATOM 150 CB HIS A 10 25.699 -3.874 -7.055 1.00 0.00 C ATOM 151 CG HIS A 10 25.972 -2.439 -7.386 1.00 0.00 C ATOM 152 ND1 HIS A 10 27.164 -2.005 -7.926 1.00 0.00 N ATOM 153 CD2 HIS A 10 25.198 -1.337 -7.251 1.00 0.00 C ATOM 154 CE1 HIS A 10 27.112 -0.697 -8.108 1.00 0.00 C ATOM 155 NE2 HIS A 10 25.929 -0.267 -7.707 1.00 0.00 N ATOM 0 H HIS A 10 23.653 -3.432 -5.675 1.00 0.00 H new ATOM 0 HA HIS A 10 24.095 -4.019 -8.476 1.00 0.00 H new ATOM 0 HB2 HIS A 10 25.831 -4.023 -5.983 1.00 0.00 H new ATOM 0 HB3 HIS A 10 26.436 -4.501 -7.557 1.00 0.00 H new ATOM 0 HD2 HIS A 10 24.193 -1.305 -6.858 1.00 0.00 H new ATOM 0 HE1 HIS A 10 27.902 -0.084 -8.515 1.00 0.00 H new ATOM 0 HE2 HIS A 10 25.610 0.702 -7.732 1.00 0.00 H new ATOM 163 N LEU A 11 23.948 -6.478 -8.540 1.00 0.00 N ATOM 164 CA LEU A 11 23.842 -7.930 -8.619 1.00 0.00 C ATOM 165 C LEU A 11 25.204 -8.587 -8.415 1.00 0.00 C ATOM 166 O LEU A 11 25.293 -9.776 -8.106 1.00 0.00 O ATOM 167 CB LEU A 11 23.259 -8.346 -9.970 1.00 0.00 C ATOM 168 CG LEU A 11 21.739 -8.497 -10.028 1.00 0.00 C ATOM 169 CD1 LEU A 11 21.243 -8.365 -11.460 1.00 0.00 C ATOM 170 CD2 LEU A 11 21.312 -9.831 -9.434 1.00 0.00 C ATOM 0 H LEU A 11 23.799 -5.996 -9.426 1.00 0.00 H new ATOM 0 HA LEU A 11 23.175 -8.265 -7.825 1.00 0.00 H new ATOM 0 HB2 LEU A 11 23.559 -7.609 -10.715 1.00 0.00 H new ATOM 0 HB3 LEU A 11 23.710 -9.295 -10.261 1.00 0.00 H new ATOM 0 HG LEU A 11 21.291 -7.699 -9.436 1.00 0.00 H new ATOM 0 HD11 LEU A 11 20.159 -8.475 -11.481 1.00 0.00 H new ATOM 0 HD12 LEU A 11 21.516 -7.385 -11.851 1.00 0.00 H new ATOM 0 HD13 LEU A 11 21.699 -9.140 -12.076 1.00 0.00 H new ATOM 0 HD21 LEU A 11 20.227 -9.921 -9.484 1.00 0.00 H new ATOM 0 HD22 LEU A 11 21.770 -10.644 -9.998 1.00 0.00 H new ATOM 0 HD23 LEU A 11 21.633 -9.886 -8.394 1.00 0.00 H new ATOM 182 N THR A 12 26.265 -7.805 -8.589 1.00 0.00 N ATOM 183 CA THR A 12 27.622 -8.309 -8.424 1.00 0.00 C ATOM 184 C THR A 12 28.510 -7.281 -7.733 1.00 0.00 C ATOM 185 O THR A 12 28.238 -6.082 -7.779 1.00 0.00 O ATOM 186 CB THR A 12 28.250 -8.686 -9.779 1.00 0.00 C ATOM 187 OG1 THR A 12 29.460 -9.423 -9.570 1.00 0.00 O ATOM 188 CG2 THR A 12 28.544 -7.441 -10.604 1.00 0.00 C ATOM 0 H THR A 12 26.210 -6.819 -8.844 1.00 0.00 H new ATOM 0 HA THR A 12 27.554 -9.202 -7.803 1.00 0.00 H new ATOM 0 HB THR A 12 27.538 -9.305 -10.325 1.00 0.00 H new ATOM 0 HG1 THR A 12 30.212 -8.938 -9.970 1.00 0.00 H new ATOM 0 HG21 THR A 12 28.987 -7.732 -11.556 1.00 0.00 H new ATOM 0 HG22 THR A 12 27.617 -6.898 -10.786 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.239 -6.801 -10.061 1.00 0.00 H new ATOM 196 N GLU A 13 29.573 -7.759 -7.093 1.00 0.00 N ATOM 197 CA GLU A 13 30.501 -6.879 -6.393 1.00 0.00 C ATOM 198 C GLU A 13 31.342 -6.076 -7.381 1.00 0.00 C ATOM 199 O GLU A 13 31.823 -4.988 -7.063 1.00 0.00 O ATOM 200 CB GLU A 13 31.415 -7.693 -5.473 1.00 0.00 C ATOM 201 CG GLU A 13 30.719 -8.209 -4.225 1.00 0.00 C ATOM 202 CD GLU A 13 29.983 -9.513 -4.465 1.00 0.00 C ATOM 203 OE1 GLU A 13 30.613 -10.583 -4.333 1.00 0.00 O ATOM 204 OE2 GLU A 13 28.776 -9.463 -4.784 1.00 0.00 O ATOM 0 H GLU A 13 29.812 -8.749 -7.045 1.00 0.00 H new ATOM 0 HA GLU A 13 29.916 -6.183 -5.791 1.00 0.00 H new ATOM 0 HB2 GLU A 13 31.817 -8.539 -6.030 1.00 0.00 H new ATOM 0 HB3 GLU A 13 32.262 -7.075 -5.177 1.00 0.00 H new ATOM 0 HG2 GLU A 13 31.456 -8.352 -3.435 1.00 0.00 H new ATOM 0 HG3 GLU A 13 30.013 -7.458 -3.870 1.00 0.00 H new ATOM 211 N ASP A 14 31.514 -6.620 -8.581 1.00 0.00 N ATOM 212 CA ASP A 14 32.295 -5.955 -9.617 1.00 0.00 C ATOM 213 C ASP A 14 31.562 -4.726 -10.145 1.00 0.00 C ATOM 214 O ASP A 14 32.179 -3.804 -10.678 1.00 0.00 O ATOM 215 CB ASP A 14 32.587 -6.922 -10.765 1.00 0.00 C ATOM 216 CG ASP A 14 33.209 -8.219 -10.286 1.00 0.00 C ATOM 217 OD1 ASP A 14 34.440 -8.246 -10.080 1.00 0.00 O ATOM 218 OD2 ASP A 14 32.464 -9.208 -10.117 1.00 0.00 O ATOM 0 H ASP A 14 31.123 -7.520 -8.860 1.00 0.00 H new ATOM 0 HA ASP A 14 33.238 -5.632 -9.176 1.00 0.00 H new ATOM 0 HB2 ASP A 14 31.661 -7.141 -11.296 1.00 0.00 H new ATOM 0 HB3 ASP A 14 33.258 -6.443 -11.478 1.00 0.00 H new ATOM 223 N GLY A 15 30.241 -4.720 -9.995 1.00 0.00 N ATOM 224 CA GLY A 15 29.446 -3.600 -10.463 1.00 0.00 C ATOM 225 C GLY A 15 28.965 -3.786 -11.889 1.00 0.00 C ATOM 226 O GLY A 15 28.211 -2.965 -12.409 1.00 0.00 O ATOM 0 H GLY A 15 29.707 -5.471 -9.558 1.00 0.00 H new ATOM 0 HA2 GLY A 15 28.586 -3.470 -9.807 1.00 0.00 H new ATOM 0 HA3 GLY A 15 30.037 -2.687 -10.398 1.00 0.00 H new ATOM 230 N GLY A 16 29.404 -4.869 -12.524 1.00 0.00 N ATOM 231 CA GLY A 16 29.005 -5.139 -13.892 1.00 0.00 C ATOM 232 C GLY A 16 27.500 -5.125 -14.071 1.00 0.00 C ATOM 233 O GLY A 16 26.986 -4.550 -15.031 1.00 0.00 O ATOM 0 H GLY A 16 30.029 -5.564 -12.115 1.00 0.00 H new ATOM 0 HA2 GLY A 16 29.453 -4.395 -14.551 1.00 0.00 H new ATOM 0 HA3 GLY A 16 29.395 -6.111 -14.196 1.00 0.00 H new ATOM 237 N VAL A 17 26.790 -5.762 -13.145 1.00 0.00 N ATOM 238 CA VAL A 17 25.335 -5.822 -13.205 1.00 0.00 C ATOM 239 C VAL A 17 24.707 -5.177 -11.973 1.00 0.00 C ATOM 240 O VAL A 17 25.076 -5.488 -10.841 1.00 0.00 O ATOM 241 CB VAL A 17 24.836 -7.274 -13.320 1.00 0.00 C ATOM 242 CG1 VAL A 17 23.346 -7.306 -13.622 1.00 0.00 C ATOM 243 CG2 VAL A 17 25.621 -8.023 -14.388 1.00 0.00 C ATOM 0 H VAL A 17 27.199 -6.244 -12.344 1.00 0.00 H new ATOM 0 HA VAL A 17 25.033 -5.271 -14.095 1.00 0.00 H new ATOM 0 HB VAL A 17 24.998 -7.772 -12.364 1.00 0.00 H new ATOM 0 HG11 VAL A 17 23.013 -8.341 -13.699 1.00 0.00 H new ATOM 0 HG12 VAL A 17 22.801 -6.808 -12.820 1.00 0.00 H new ATOM 0 HG13 VAL A 17 23.155 -6.792 -14.564 1.00 0.00 H new ATOM 0 HG21 VAL A 17 25.256 -9.048 -14.456 1.00 0.00 H new ATOM 0 HG22 VAL A 17 25.492 -7.527 -15.350 1.00 0.00 H new ATOM 0 HG23 VAL A 17 26.678 -8.032 -14.123 1.00 0.00 H new ATOM 253 N VAL A 18 23.756 -4.278 -12.203 1.00 0.00 N ATOM 254 CA VAL A 18 23.076 -3.590 -11.112 1.00 0.00 C ATOM 255 C VAL A 18 21.607 -3.349 -11.445 1.00 0.00 C ATOM 256 O VAL A 18 21.283 -2.628 -12.389 1.00 0.00 O ATOM 257 CB VAL A 18 23.746 -2.240 -10.794 1.00 0.00 C ATOM 258 CG1 VAL A 18 23.056 -1.564 -9.620 1.00 0.00 C ATOM 259 CG2 VAL A 18 25.228 -2.436 -10.512 1.00 0.00 C ATOM 0 H VAL A 18 23.439 -4.009 -13.134 1.00 0.00 H new ATOM 0 HA VAL A 18 23.147 -4.237 -10.238 1.00 0.00 H new ATOM 0 HB VAL A 18 23.647 -1.591 -11.664 1.00 0.00 H new ATOM 0 HG11 VAL A 18 23.544 -0.612 -9.411 1.00 0.00 H new ATOM 0 HG12 VAL A 18 22.008 -1.389 -9.865 1.00 0.00 H new ATOM 0 HG13 VAL A 18 23.121 -2.206 -8.741 1.00 0.00 H new ATOM 0 HG21 VAL A 18 25.687 -1.473 -10.289 1.00 0.00 H new ATOM 0 HG22 VAL A 18 25.351 -3.102 -9.658 1.00 0.00 H new ATOM 0 HG23 VAL A 18 25.710 -2.874 -11.386 1.00 0.00 H new ATOM 269 N LYS A 19 20.722 -3.958 -10.663 1.00 0.00 N ATOM 270 CA LYS A 19 19.286 -3.810 -10.872 1.00 0.00 C ATOM 271 C LYS A 19 18.723 -2.688 -10.005 1.00 0.00 C ATOM 272 O LYS A 19 19.221 -2.426 -8.910 1.00 0.00 O ATOM 273 CB LYS A 19 18.566 -5.123 -10.558 1.00 0.00 C ATOM 274 CG LYS A 19 17.101 -5.123 -10.957 1.00 0.00 C ATOM 275 CD LYS A 19 16.208 -4.702 -9.801 1.00 0.00 C ATOM 276 CE LYS A 19 15.954 -5.856 -8.844 1.00 0.00 C ATOM 277 NZ LYS A 19 15.084 -6.900 -9.451 1.00 0.00 N ATOM 0 H LYS A 19 20.974 -4.559 -9.878 1.00 0.00 H new ATOM 0 HA LYS A 19 19.121 -3.554 -11.919 1.00 0.00 H new ATOM 0 HB2 LYS A 19 19.074 -5.938 -11.073 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.643 -5.323 -9.489 1.00 0.00 H new ATOM 0 HG2 LYS A 19 16.952 -4.446 -11.798 1.00 0.00 H new ATOM 0 HG3 LYS A 19 16.815 -6.119 -11.295 1.00 0.00 H new ATOM 0 HD2 LYS A 19 16.674 -3.877 -9.262 1.00 0.00 H new ATOM 0 HD3 LYS A 19 15.258 -4.334 -10.189 1.00 0.00 H new ATOM 0 HE2 LYS A 19 16.905 -6.301 -8.552 1.00 0.00 H new ATOM 0 HE3 LYS A 19 15.486 -5.477 -7.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 14.221 -7.007 -8.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 14.827 -6.618 -10.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 15.595 -7.805 -9.478 1.00 0.00 H new ATOM 291 N THR A 20 17.680 -2.030 -10.501 1.00 0.00 N ATOM 292 CA THR A 20 17.049 -0.938 -9.772 1.00 0.00 C ATOM 293 C THR A 20 15.552 -1.178 -9.608 1.00 0.00 C ATOM 294 O THR A 20 14.838 -1.392 -10.587 1.00 0.00 O ATOM 295 CB THR A 20 17.265 0.412 -10.483 1.00 0.00 C ATOM 296 OG1 THR A 20 18.654 0.589 -10.785 1.00 0.00 O ATOM 297 CG2 THR A 20 16.778 1.564 -9.617 1.00 0.00 C ATOM 0 H THR A 20 17.255 -2.235 -11.405 1.00 0.00 H new ATOM 0 HA THR A 20 17.519 -0.902 -8.789 1.00 0.00 H new ATOM 0 HB THR A 20 16.690 0.407 -11.409 1.00 0.00 H new ATOM 0 HG1 THR A 20 18.783 1.448 -11.238 1.00 0.00 H new ATOM 0 HG21 THR A 20 16.941 2.506 -10.140 1.00 0.00 H new ATOM 0 HG22 THR A 20 15.714 1.441 -9.413 1.00 0.00 H new ATOM 0 HG23 THR A 20 17.329 1.571 -8.677 1.00 0.00 H new ATOM 305 N ILE A 21 15.085 -1.141 -8.365 1.00 0.00 N ATOM 306 CA ILE A 21 13.672 -1.353 -8.074 1.00 0.00 C ATOM 307 C ILE A 21 12.818 -0.226 -8.644 1.00 0.00 C ATOM 308 O ILE A 21 12.705 0.845 -8.047 1.00 0.00 O ATOM 309 CB ILE A 21 13.419 -1.457 -6.558 1.00 0.00 C ATOM 310 CG1 ILE A 21 14.234 -2.607 -5.961 1.00 0.00 C ATOM 311 CG2 ILE A 21 11.936 -1.652 -6.281 1.00 0.00 C ATOM 312 CD1 ILE A 21 15.557 -2.169 -5.374 1.00 0.00 C ATOM 0 H ILE A 21 15.664 -0.966 -7.543 1.00 0.00 H new ATOM 0 HA ILE A 21 13.390 -2.294 -8.547 1.00 0.00 H new ATOM 0 HB ILE A 21 13.738 -0.527 -6.086 1.00 0.00 H new ATOM 0 HG12 ILE A 21 13.645 -3.094 -5.184 1.00 0.00 H new ATOM 0 HG13 ILE A 21 14.418 -3.351 -6.736 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.773 -1.724 -5.206 1.00 0.00 H new ATOM 0 HG22 ILE A 21 11.377 -0.804 -6.677 1.00 0.00 H new ATOM 0 HG23 ILE A 21 11.593 -2.568 -6.762 1.00 0.00 H new ATOM 0 HD11 ILE A 21 16.080 -3.035 -4.969 1.00 0.00 H new ATOM 0 HD12 ILE A 21 16.166 -1.708 -6.152 1.00 0.00 H new ATOM 0 HD13 ILE A 21 15.380 -1.447 -4.577 1.00 0.00 H new ATOM 324 N LEU A 22 12.217 -0.475 -9.802 1.00 0.00 N ATOM 325 CA LEU A 22 11.370 0.518 -10.453 1.00 0.00 C ATOM 326 C LEU A 22 9.895 0.238 -10.184 1.00 0.00 C ATOM 327 O LEU A 22 9.164 1.107 -9.709 1.00 0.00 O ATOM 328 CB LEU A 22 11.632 0.531 -11.960 1.00 0.00 C ATOM 329 CG LEU A 22 12.643 1.565 -12.458 1.00 0.00 C ATOM 330 CD1 LEU A 22 14.037 0.961 -12.520 1.00 0.00 C ATOM 331 CD2 LEU A 22 12.230 2.101 -13.821 1.00 0.00 C ATOM 0 H LEU A 22 12.300 -1.356 -10.309 1.00 0.00 H new ATOM 0 HA LEU A 22 11.616 1.496 -10.039 1.00 0.00 H new ATOM 0 HB2 LEU A 22 11.979 -0.459 -12.256 1.00 0.00 H new ATOM 0 HB3 LEU A 22 10.685 0.703 -12.471 1.00 0.00 H new ATOM 0 HG LEU A 22 12.661 2.397 -11.754 1.00 0.00 H new ATOM 0 HD11 LEU A 22 14.743 1.711 -12.876 1.00 0.00 H new ATOM 0 HD12 LEU A 22 14.333 0.627 -11.526 1.00 0.00 H new ATOM 0 HD13 LEU A 22 14.035 0.111 -13.203 1.00 0.00 H new ATOM 0 HD21 LEU A 22 12.961 2.835 -14.160 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.183 1.280 -14.536 1.00 0.00 H new ATOM 0 HD23 LEU A 22 11.250 2.572 -13.745 1.00 0.00 H new ATOM 343 N ARG A 23 9.465 -0.983 -10.488 1.00 0.00 N ATOM 344 CA ARG A 23 8.078 -1.378 -10.278 1.00 0.00 C ATOM 345 C ARG A 23 7.996 -2.796 -9.719 1.00 0.00 C ATOM 346 O ARG A 23 8.004 -3.772 -10.469 1.00 0.00 O ATOM 347 CB ARG A 23 7.296 -1.289 -11.589 1.00 0.00 C ATOM 348 CG ARG A 23 5.876 -0.774 -11.418 1.00 0.00 C ATOM 349 CD ARG A 23 5.861 0.654 -10.895 1.00 0.00 C ATOM 350 NE ARG A 23 4.693 1.396 -11.362 1.00 0.00 N ATOM 351 CZ ARG A 23 4.263 2.519 -10.799 1.00 0.00 C ATOM 352 NH1 ARG A 23 4.901 3.027 -9.753 1.00 0.00 N ATOM 353 NH2 ARG A 23 3.192 3.137 -11.281 1.00 0.00 N ATOM 0 H ARG A 23 10.057 -1.715 -10.880 1.00 0.00 H new ATOM 0 HA ARG A 23 7.637 -0.694 -9.553 1.00 0.00 H new ATOM 0 HB2 ARG A 23 7.830 -0.634 -12.277 1.00 0.00 H new ATOM 0 HB3 ARG A 23 7.262 -2.276 -12.050 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.354 -0.818 -12.374 1.00 0.00 H new ATOM 0 HG3 ARG A 23 5.334 -1.421 -10.729 1.00 0.00 H new ATOM 0 HD2 ARG A 23 5.870 0.641 -9.805 1.00 0.00 H new ATOM 0 HD3 ARG A 23 6.768 1.167 -11.215 1.00 0.00 H new ATOM 0 HE ARG A 23 4.180 1.032 -12.164 1.00 0.00 H new ATOM 0 HH11 ARG A 23 5.724 2.555 -9.379 1.00 0.00 H new ATOM 0 HH12 ARG A 23 4.568 3.890 -9.323 1.00 0.00 H new ATOM 0 HH21 ARG A 23 2.698 2.749 -12.085 1.00 0.00 H new ATOM 0 HH22 ARG A 23 2.863 4.000 -10.848 1.00 0.00 H new ATOM 367 N LYS A 24 7.917 -2.901 -8.397 1.00 0.00 N ATOM 368 CA LYS A 24 7.833 -4.198 -7.736 1.00 0.00 C ATOM 369 C LYS A 24 6.721 -5.048 -8.345 1.00 0.00 C ATOM 370 O LYS A 24 5.673 -4.532 -8.730 1.00 0.00 O ATOM 371 CB LYS A 24 7.586 -4.015 -6.237 1.00 0.00 C ATOM 372 CG LYS A 24 8.824 -3.596 -5.464 1.00 0.00 C ATOM 373 CD LYS A 24 9.763 -4.769 -5.235 1.00 0.00 C ATOM 374 CE LYS A 24 9.388 -5.546 -3.983 1.00 0.00 C ATOM 375 NZ LYS A 24 9.791 -4.827 -2.743 1.00 0.00 N ATOM 0 H LYS A 24 7.909 -2.103 -7.762 1.00 0.00 H new ATOM 0 HA LYS A 24 8.782 -4.714 -7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 24 6.808 -3.265 -6.094 1.00 0.00 H new ATOM 0 HB3 LYS A 24 7.208 -4.950 -5.823 1.00 0.00 H new ATOM 0 HG2 LYS A 24 9.347 -2.812 -6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 24 8.529 -3.173 -4.504 1.00 0.00 H new ATOM 0 HD2 LYS A 24 9.735 -5.433 -6.099 1.00 0.00 H new ATOM 0 HD3 LYS A 24 10.787 -4.405 -5.146 1.00 0.00 H new ATOM 0 HE2 LYS A 24 8.312 -5.717 -3.970 1.00 0.00 H new ATOM 0 HE3 LYS A 24 9.866 -6.525 -4.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 9.691 -5.462 -1.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 10.782 -4.522 -2.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 9.182 -3.994 -2.611 1.00 0.00 H new ATOM 389 N GLY A 25 6.958 -6.354 -8.427 1.00 0.00 N ATOM 390 CA GLY A 25 5.968 -7.253 -8.989 1.00 0.00 C ATOM 391 C GLY A 25 5.179 -7.986 -7.922 1.00 0.00 C ATOM 392 O GLY A 25 4.661 -7.369 -6.991 1.00 0.00 O ATOM 0 H GLY A 25 7.818 -6.805 -8.114 1.00 0.00 H new ATOM 0 HA2 GLY A 25 5.282 -6.686 -9.618 1.00 0.00 H new ATOM 0 HA3 GLY A 25 6.465 -7.979 -9.633 1.00 0.00 H new ATOM 396 N GLU A 26 5.085 -9.305 -8.057 1.00 0.00 N ATOM 397 CA GLU A 26 4.351 -10.121 -7.098 1.00 0.00 C ATOM 398 C GLU A 26 5.197 -10.394 -5.857 1.00 0.00 C ATOM 399 O GLU A 26 4.954 -9.831 -4.791 1.00 0.00 O ATOM 400 CB GLU A 26 3.924 -11.443 -7.739 1.00 0.00 C ATOM 401 CG GLU A 26 3.013 -11.269 -8.943 1.00 0.00 C ATOM 402 CD GLU A 26 1.949 -10.212 -8.721 1.00 0.00 C ATOM 403 OE1 GLU A 26 1.260 -10.272 -7.681 1.00 0.00 O ATOM 404 OE2 GLU A 26 1.805 -9.324 -9.588 1.00 0.00 O ATOM 0 H GLU A 26 5.508 -9.831 -8.822 1.00 0.00 H new ATOM 0 HA GLU A 26 3.461 -9.569 -6.796 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.814 -11.994 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.413 -12.051 -6.992 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.613 -10.998 -9.812 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.533 -12.221 -9.171 1.00 0.00 H new ATOM 411 N GLY A 27 6.191 -11.265 -6.006 1.00 0.00 N ATOM 412 CA GLY A 27 7.057 -11.599 -4.890 1.00 0.00 C ATOM 413 C GLY A 27 6.837 -13.013 -4.389 1.00 0.00 C ATOM 414 O GLY A 27 5.908 -13.271 -3.624 1.00 0.00 O ATOM 0 H GLY A 27 6.412 -11.745 -6.879 1.00 0.00 H new ATOM 0 HA2 GLY A 27 8.097 -11.482 -5.194 1.00 0.00 H new ATOM 0 HA3 GLY A 27 6.882 -10.897 -4.075 1.00 0.00 H new ATOM 418 N GLY A 28 7.694 -13.933 -4.822 1.00 0.00 N ATOM 419 CA GLY A 28 7.570 -15.317 -4.404 1.00 0.00 C ATOM 420 C GLY A 28 8.034 -16.289 -5.471 1.00 0.00 C ATOM 421 O GLY A 28 7.926 -16.008 -6.664 1.00 0.00 O ATOM 0 H GLY A 28 8.472 -13.744 -5.455 1.00 0.00 H new ATOM 0 HA2 GLY A 28 8.153 -15.473 -3.497 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.530 -15.526 -4.154 1.00 0.00 H new ATOM 425 N GLU A 29 8.554 -17.434 -5.040 1.00 0.00 N ATOM 426 CA GLU A 29 9.039 -18.449 -5.969 1.00 0.00 C ATOM 427 C GLU A 29 7.940 -18.865 -6.942 1.00 0.00 C ATOM 428 O GLU A 29 8.207 -19.153 -8.108 1.00 0.00 O ATOM 429 CB GLU A 29 9.546 -19.672 -5.202 1.00 0.00 C ATOM 430 CG GLU A 29 8.524 -20.257 -4.242 1.00 0.00 C ATOM 431 CD GLU A 29 9.151 -21.167 -3.205 1.00 0.00 C ATOM 432 OE1 GLU A 29 10.357 -21.466 -3.330 1.00 0.00 O ATOM 433 OE2 GLU A 29 8.437 -21.581 -2.268 1.00 0.00 O ATOM 0 H GLU A 29 8.650 -17.682 -4.055 1.00 0.00 H new ATOM 0 HA GLU A 29 9.862 -18.020 -6.540 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.842 -20.440 -5.916 1.00 0.00 H new ATOM 0 HB3 GLU A 29 10.440 -19.395 -4.643 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.999 -19.446 -3.738 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.779 -20.816 -4.807 1.00 0.00 H new ATOM 440 N GLU A 30 6.704 -18.894 -6.453 1.00 0.00 N ATOM 441 CA GLU A 30 5.565 -19.276 -7.279 1.00 0.00 C ATOM 442 C GLU A 30 5.440 -18.358 -8.492 1.00 0.00 C ATOM 443 O GLU A 30 4.895 -18.747 -9.524 1.00 0.00 O ATOM 444 CB GLU A 30 4.274 -19.234 -6.459 1.00 0.00 C ATOM 445 CG GLU A 30 4.377 -19.952 -5.124 1.00 0.00 C ATOM 446 CD GLU A 30 3.052 -20.531 -4.669 1.00 0.00 C ATOM 447 OE1 GLU A 30 2.179 -19.747 -4.241 1.00 0.00 O ATOM 448 OE2 GLU A 30 2.887 -21.767 -4.741 1.00 0.00 O ATOM 0 H GLU A 30 6.466 -18.658 -5.490 1.00 0.00 H new ATOM 0 HA GLU A 30 5.730 -20.294 -7.631 1.00 0.00 H new ATOM 0 HB2 GLU A 30 3.999 -18.194 -6.282 1.00 0.00 H new ATOM 0 HB3 GLU A 30 3.469 -19.682 -7.042 1.00 0.00 H new ATOM 0 HG2 GLU A 30 5.112 -20.753 -5.203 1.00 0.00 H new ATOM 0 HG3 GLU A 30 4.744 -19.256 -4.369 1.00 0.00 H new ATOM 455 N ASN A 31 5.949 -17.138 -8.358 1.00 0.00 N ATOM 456 CA ASN A 31 5.894 -16.163 -9.441 1.00 0.00 C ATOM 457 C ASN A 31 7.216 -16.119 -10.201 1.00 0.00 C ATOM 458 O ASN A 31 7.434 -15.243 -11.037 1.00 0.00 O ATOM 459 CB ASN A 31 5.563 -14.775 -8.890 1.00 0.00 C ATOM 460 CG ASN A 31 4.112 -14.651 -8.468 1.00 0.00 C ATOM 461 OD1 ASN A 31 3.216 -14.559 -9.306 1.00 0.00 O ATOM 462 ND2 ASN A 31 3.875 -14.647 -7.161 1.00 0.00 N ATOM 0 H ASN A 31 6.404 -16.801 -7.510 1.00 0.00 H new ATOM 0 HA ASN A 31 5.108 -16.469 -10.132 1.00 0.00 H new ATOM 0 HB2 ASN A 31 6.206 -14.563 -8.036 1.00 0.00 H new ATOM 0 HB3 ASN A 31 5.783 -14.024 -9.649 1.00 0.00 H new ATOM 0 HD21 ASN A 31 2.918 -14.565 -6.816 1.00 0.00 H new ATOM 0 HD22 ASN A 31 4.650 -14.726 -6.502 1.00 0.00 H new ATOM 469 N ALA A 32 8.095 -17.071 -9.904 1.00 0.00 N ATOM 470 CA ALA A 32 9.394 -17.143 -10.561 1.00 0.00 C ATOM 471 C ALA A 32 9.309 -17.935 -11.861 1.00 0.00 C ATOM 472 O ALA A 32 8.464 -18.815 -12.026 1.00 0.00 O ATOM 473 CB ALA A 32 10.423 -17.765 -9.628 1.00 0.00 C ATOM 0 H ALA A 32 7.931 -17.803 -9.213 1.00 0.00 H new ATOM 0 HA ALA A 32 9.707 -16.128 -10.805 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.389 -17.813 -10.131 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.513 -17.157 -8.728 1.00 0.00 H new ATOM 0 HB3 ALA A 32 10.106 -18.772 -9.356 1.00 0.00 H new ATOM 479 N PRO A 33 10.204 -17.617 -12.809 1.00 0.00 N ATOM 480 CA PRO A 33 10.249 -18.287 -14.112 1.00 0.00 C ATOM 481 C PRO A 33 10.730 -19.730 -14.004 1.00 0.00 C ATOM 482 O PRO A 33 11.353 -20.116 -13.015 1.00 0.00 O ATOM 483 CB PRO A 33 11.251 -17.447 -14.908 1.00 0.00 C ATOM 484 CG PRO A 33 12.121 -16.816 -13.876 1.00 0.00 C ATOM 485 CD PRO A 33 11.240 -16.578 -12.681 1.00 0.00 C ATOM 0 HA PRO A 33 9.263 -18.349 -14.573 1.00 0.00 H new ATOM 0 HB2 PRO A 33 11.832 -18.066 -15.591 1.00 0.00 H new ATOM 0 HB3 PRO A 33 10.745 -16.695 -15.513 1.00 0.00 H new ATOM 0 HG2 PRO A 33 12.958 -17.466 -13.621 1.00 0.00 H new ATOM 0 HG3 PRO A 33 12.544 -15.880 -14.241 1.00 0.00 H new ATOM 0 HD2 PRO A 33 11.794 -16.676 -11.747 1.00 0.00 H new ATOM 0 HD3 PRO A 33 10.809 -15.577 -12.693 1.00 0.00 H new ATOM 493 N LYS A 34 10.438 -20.524 -15.029 1.00 0.00 N ATOM 494 CA LYS A 34 10.842 -21.925 -15.052 1.00 0.00 C ATOM 495 C LYS A 34 11.913 -22.165 -16.111 1.00 0.00 C ATOM 496 O LYS A 34 11.635 -22.131 -17.310 1.00 0.00 O ATOM 497 CB LYS A 34 9.632 -22.821 -15.323 1.00 0.00 C ATOM 498 CG LYS A 34 9.100 -23.517 -14.082 1.00 0.00 C ATOM 499 CD LYS A 34 10.081 -24.554 -13.560 1.00 0.00 C ATOM 500 CE LYS A 34 9.942 -24.746 -12.058 1.00 0.00 C ATOM 501 NZ LYS A 34 10.576 -23.636 -11.295 1.00 0.00 N ATOM 0 H LYS A 34 9.923 -20.221 -15.855 1.00 0.00 H new ATOM 0 HA LYS A 34 11.259 -22.173 -14.076 1.00 0.00 H new ATOM 0 HB2 LYS A 34 8.836 -22.219 -15.761 1.00 0.00 H new ATOM 0 HB3 LYS A 34 9.906 -23.574 -16.062 1.00 0.00 H new ATOM 0 HG2 LYS A 34 8.903 -22.778 -13.305 1.00 0.00 H new ATOM 0 HG3 LYS A 34 8.149 -23.998 -14.313 1.00 0.00 H new ATOM 0 HD2 LYS A 34 9.912 -25.504 -14.067 1.00 0.00 H new ATOM 0 HD3 LYS A 34 11.099 -24.244 -13.796 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.886 -24.809 -11.796 1.00 0.00 H new ATOM 0 HE3 LYS A 34 10.399 -25.692 -11.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.565 -23.862 -10.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.559 -23.514 -11.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.048 -22.755 -11.460 1.00 0.00 H new ATOM 515 N LYS A 35 13.139 -22.409 -15.661 1.00 0.00 N ATOM 516 CA LYS A 35 14.253 -22.658 -16.569 1.00 0.00 C ATOM 517 C LYS A 35 13.912 -23.770 -17.556 1.00 0.00 C ATOM 518 O LYS A 35 13.348 -24.796 -17.179 1.00 0.00 O ATOM 519 CB LYS A 35 15.509 -23.031 -15.778 1.00 0.00 C ATOM 520 CG LYS A 35 15.525 -24.475 -15.307 1.00 0.00 C ATOM 521 CD LYS A 35 14.422 -24.744 -14.297 1.00 0.00 C ATOM 522 CE LYS A 35 14.577 -26.114 -13.655 1.00 0.00 C ATOM 523 NZ LYS A 35 13.552 -26.351 -12.600 1.00 0.00 N ATOM 0 H LYS A 35 13.387 -22.440 -14.672 1.00 0.00 H new ATOM 0 HA LYS A 35 14.443 -21.743 -17.131 1.00 0.00 H new ATOM 0 HB2 LYS A 35 16.386 -22.851 -16.399 1.00 0.00 H new ATOM 0 HB3 LYS A 35 15.591 -22.374 -14.912 1.00 0.00 H new ATOM 0 HG2 LYS A 35 15.406 -25.139 -16.163 1.00 0.00 H new ATOM 0 HG3 LYS A 35 16.493 -24.702 -14.860 1.00 0.00 H new ATOM 0 HD2 LYS A 35 14.439 -23.975 -13.525 1.00 0.00 H new ATOM 0 HD3 LYS A 35 13.452 -24.680 -14.790 1.00 0.00 H new ATOM 0 HE2 LYS A 35 14.495 -26.885 -14.421 1.00 0.00 H new ATOM 0 HE3 LYS A 35 15.573 -26.201 -13.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.691 -27.295 -12.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 13.646 -25.630 -11.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.602 -26.293 -13.020 1.00 0.00 H new ATOM 537 N GLY A 36 14.259 -23.559 -18.822 1.00 0.00 N ATOM 538 CA GLY A 36 13.983 -24.553 -19.842 1.00 0.00 C ATOM 539 C GLY A 36 12.654 -24.320 -20.534 1.00 0.00 C ATOM 540 O GLY A 36 12.539 -24.495 -21.747 1.00 0.00 O ATOM 0 H GLY A 36 14.726 -22.717 -19.159 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.782 -24.540 -20.583 1.00 0.00 H new ATOM 0 HA3 GLY A 36 13.984 -25.544 -19.389 1.00 0.00 H new ATOM 544 N ASN A 37 11.648 -23.924 -19.762 1.00 0.00 N ATOM 545 CA ASN A 37 10.320 -23.669 -20.308 1.00 0.00 C ATOM 546 C ASN A 37 10.240 -22.271 -20.913 1.00 0.00 C ATOM 547 O ASN A 37 10.877 -21.336 -20.427 1.00 0.00 O ATOM 548 CB ASN A 37 9.258 -23.826 -19.217 1.00 0.00 C ATOM 549 CG ASN A 37 9.024 -25.277 -18.843 1.00 0.00 C ATOM 550 OD1 ASN A 37 9.581 -25.775 -17.864 1.00 0.00 O ATOM 551 ND2 ASN A 37 8.196 -25.962 -19.623 1.00 0.00 N ATOM 0 H ASN A 37 11.727 -23.773 -18.756 1.00 0.00 H new ATOM 0 HA ASN A 37 10.132 -24.398 -21.096 1.00 0.00 H new ATOM 0 HB2 ASN A 37 9.566 -23.270 -18.331 1.00 0.00 H new ATOM 0 HB3 ASN A 37 8.321 -23.386 -19.559 1.00 0.00 H new ATOM 0 HD21 ASN A 37 7.999 -26.942 -19.421 1.00 0.00 H new ATOM 0 HD22 ASN A 37 7.757 -25.508 -20.424 1.00 0.00 H new ATOM 558 N GLU A 38 9.453 -22.136 -21.976 1.00 0.00 N ATOM 559 CA GLU A 38 9.291 -20.851 -22.647 1.00 0.00 C ATOM 560 C GLU A 38 8.918 -19.759 -21.649 1.00 0.00 C ATOM 561 O GLU A 38 8.094 -19.971 -20.759 1.00 0.00 O ATOM 562 CB GLU A 38 8.219 -20.951 -23.735 1.00 0.00 C ATOM 563 CG GLU A 38 8.264 -19.812 -24.740 1.00 0.00 C ATOM 564 CD GLU A 38 7.650 -20.188 -26.075 1.00 0.00 C ATOM 565 OE1 GLU A 38 8.273 -20.980 -26.813 1.00 0.00 O ATOM 566 OE2 GLU A 38 6.547 -19.690 -26.381 1.00 0.00 O ATOM 0 H GLU A 38 8.918 -22.899 -22.391 1.00 0.00 H new ATOM 0 HA GLU A 38 10.243 -20.588 -23.108 1.00 0.00 H new ATOM 0 HB2 GLU A 38 8.338 -21.896 -24.264 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.236 -20.970 -23.264 1.00 0.00 H new ATOM 0 HG2 GLU A 38 7.736 -18.950 -24.331 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.300 -19.508 -24.893 1.00 0.00 H new ATOM 573 N VAL A 39 9.531 -18.590 -21.804 1.00 0.00 N ATOM 574 CA VAL A 39 9.264 -17.463 -20.917 1.00 0.00 C ATOM 575 C VAL A 39 9.109 -16.168 -21.706 1.00 0.00 C ATOM 576 O VAL A 39 10.015 -15.758 -22.433 1.00 0.00 O ATOM 577 CB VAL A 39 10.388 -17.288 -19.879 1.00 0.00 C ATOM 578 CG1 VAL A 39 10.267 -18.333 -18.780 1.00 0.00 C ATOM 579 CG2 VAL A 39 11.750 -17.364 -20.551 1.00 0.00 C ATOM 0 H VAL A 39 10.216 -18.398 -22.535 1.00 0.00 H new ATOM 0 HA VAL A 39 8.331 -17.682 -20.398 1.00 0.00 H new ATOM 0 HB VAL A 39 10.288 -16.303 -19.423 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.070 -18.194 -18.056 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.304 -18.226 -18.280 1.00 0.00 H new ATOM 0 HG13 VAL A 39 10.340 -19.329 -19.216 1.00 0.00 H new ATOM 0 HG21 VAL A 39 12.532 -17.238 -19.803 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.863 -18.334 -21.035 1.00 0.00 H new ATOM 0 HG23 VAL A 39 11.832 -16.574 -21.298 1.00 0.00 H new ATOM 589 N THR A 40 7.955 -15.525 -21.558 1.00 0.00 N ATOM 590 CA THR A 40 7.680 -14.276 -22.256 1.00 0.00 C ATOM 591 C THR A 40 7.957 -13.074 -21.362 1.00 0.00 C ATOM 592 O THR A 40 7.403 -12.960 -20.268 1.00 0.00 O ATOM 593 CB THR A 40 6.220 -14.214 -22.743 1.00 0.00 C ATOM 594 OG1 THR A 40 5.947 -15.318 -23.614 1.00 0.00 O ATOM 595 CG2 THR A 40 5.948 -12.907 -23.472 1.00 0.00 C ATOM 0 H THR A 40 7.195 -15.850 -20.960 1.00 0.00 H new ATOM 0 HA THR A 40 8.345 -14.244 -23.119 1.00 0.00 H new ATOM 0 HB THR A 40 5.567 -14.269 -21.872 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.016 -15.273 -23.918 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.911 -12.886 -23.807 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.129 -12.070 -22.798 1.00 0.00 H new ATOM 0 HG23 THR A 40 6.609 -12.827 -24.335 1.00 0.00 H new ATOM 603 N VAL A 41 8.818 -12.177 -21.833 1.00 0.00 N ATOM 604 CA VAL A 41 9.167 -10.981 -21.076 1.00 0.00 C ATOM 605 C VAL A 41 9.365 -9.784 -21.999 1.00 0.00 C ATOM 606 O VAL A 41 9.329 -9.918 -23.223 1.00 0.00 O ATOM 607 CB VAL A 41 10.449 -11.195 -20.249 1.00 0.00 C ATOM 608 CG1 VAL A 41 10.314 -12.423 -19.362 1.00 0.00 C ATOM 609 CG2 VAL A 41 11.658 -11.318 -21.163 1.00 0.00 C ATOM 0 H VAL A 41 9.287 -12.256 -22.736 1.00 0.00 H new ATOM 0 HA VAL A 41 8.336 -10.781 -20.400 1.00 0.00 H new ATOM 0 HB VAL A 41 10.595 -10.327 -19.606 1.00 0.00 H new ATOM 0 HG11 VAL A 41 11.229 -12.558 -18.786 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.473 -12.290 -18.682 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.143 -13.303 -19.982 1.00 0.00 H new ATOM 0 HG21 VAL A 41 12.555 -11.469 -20.562 1.00 0.00 H new ATOM 0 HG22 VAL A 41 11.523 -12.167 -21.833 1.00 0.00 H new ATOM 0 HG23 VAL A 41 11.764 -10.406 -21.751 1.00 0.00 H new ATOM 619 N HIS A 42 9.575 -8.613 -21.405 1.00 0.00 N ATOM 620 CA HIS A 42 9.780 -7.392 -22.175 1.00 0.00 C ATOM 621 C HIS A 42 11.141 -6.776 -21.864 1.00 0.00 C ATOM 622 O HIS A 42 11.566 -6.736 -20.709 1.00 0.00 O ATOM 623 CB HIS A 42 8.671 -6.383 -21.876 1.00 0.00 C ATOM 624 CG HIS A 42 8.709 -5.172 -22.756 1.00 0.00 C ATOM 625 ND1 HIS A 42 7.717 -4.870 -23.665 1.00 0.00 N ATOM 626 CD2 HIS A 42 9.627 -4.183 -22.861 1.00 0.00 C ATOM 627 CE1 HIS A 42 8.024 -3.749 -24.293 1.00 0.00 C ATOM 628 NE2 HIS A 42 9.178 -3.311 -23.823 1.00 0.00 N ATOM 0 H HIS A 42 9.608 -8.485 -20.394 1.00 0.00 H new ATOM 0 HA HIS A 42 9.750 -7.650 -23.234 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.704 -6.874 -21.989 1.00 0.00 H new ATOM 0 HB3 HIS A 42 8.749 -6.068 -20.835 1.00 0.00 H new ATOM 0 HD1 HIS A 42 6.877 -5.426 -23.827 1.00 0.00 H new ATOM 0 HD2 HIS A 42 10.542 -4.096 -22.294 1.00 0.00 H new ATOM 0 HE1 HIS A 42 7.432 -3.272 -25.060 1.00 0.00 H new ATOM 636 N TYR A 43 11.819 -6.298 -22.901 1.00 0.00 N ATOM 637 CA TYR A 43 13.133 -5.687 -22.739 1.00 0.00 C ATOM 638 C TYR A 43 13.263 -4.436 -23.602 1.00 0.00 C ATOM 639 O TYR A 43 12.659 -4.339 -24.671 1.00 0.00 O ATOM 640 CB TYR A 43 14.232 -6.687 -23.103 1.00 0.00 C ATOM 641 CG TYR A 43 14.196 -7.127 -24.549 1.00 0.00 C ATOM 642 CD1 TYR A 43 14.811 -6.374 -25.541 1.00 0.00 C ATOM 643 CD2 TYR A 43 13.547 -8.298 -24.922 1.00 0.00 C ATOM 644 CE1 TYR A 43 14.779 -6.772 -26.863 1.00 0.00 C ATOM 645 CE2 TYR A 43 13.511 -8.705 -26.242 1.00 0.00 C ATOM 646 CZ TYR A 43 14.128 -7.938 -27.209 1.00 0.00 C ATOM 647 OH TYR A 43 14.096 -8.339 -28.525 1.00 0.00 O ATOM 0 H TYR A 43 11.481 -6.322 -23.863 1.00 0.00 H new ATOM 0 HA TYR A 43 13.244 -5.398 -21.694 1.00 0.00 H new ATOM 0 HB2 TYR A 43 15.203 -6.239 -22.892 1.00 0.00 H new ATOM 0 HB3 TYR A 43 14.140 -7.564 -22.463 1.00 0.00 H new ATOM 0 HD1 TYR A 43 15.323 -5.461 -25.274 1.00 0.00 H new ATOM 0 HD2 TYR A 43 13.063 -8.900 -24.167 1.00 0.00 H new ATOM 0 HE1 TYR A 43 15.261 -6.174 -27.622 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.003 -9.618 -26.515 1.00 0.00 H new ATOM 0 HH TYR A 43 13.418 -9.038 -28.638 1.00 0.00 H new ATOM 657 N VAL A 44 14.056 -3.479 -23.131 1.00 0.00 N ATOM 658 CA VAL A 44 14.268 -2.234 -23.859 1.00 0.00 C ATOM 659 C VAL A 44 15.666 -1.680 -23.606 1.00 0.00 C ATOM 660 O VAL A 44 16.047 -1.426 -22.464 1.00 0.00 O ATOM 661 CB VAL A 44 13.227 -1.169 -23.465 1.00 0.00 C ATOM 662 CG1 VAL A 44 13.502 0.140 -24.188 1.00 0.00 C ATOM 663 CG2 VAL A 44 11.820 -1.666 -23.762 1.00 0.00 C ATOM 0 H VAL A 44 14.562 -3.542 -22.248 1.00 0.00 H new ATOM 0 HA VAL A 44 14.158 -2.465 -24.919 1.00 0.00 H new ATOM 0 HB VAL A 44 13.306 -0.987 -22.393 1.00 0.00 H new ATOM 0 HG11 VAL A 44 12.756 0.880 -23.897 1.00 0.00 H new ATOM 0 HG12 VAL A 44 14.495 0.501 -23.921 1.00 0.00 H new ATOM 0 HG13 VAL A 44 13.452 -0.022 -25.265 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.097 -0.902 -23.478 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.726 -1.877 -24.827 1.00 0.00 H new ATOM 0 HG23 VAL A 44 11.628 -2.576 -23.194 1.00 0.00 H new ATOM 673 N GLY A 45 16.427 -1.494 -24.680 1.00 0.00 N ATOM 674 CA GLY A 45 17.774 -0.970 -24.553 1.00 0.00 C ATOM 675 C GLY A 45 17.814 0.544 -24.600 1.00 0.00 C ATOM 676 O GLY A 45 17.102 1.168 -25.386 1.00 0.00 O ATOM 0 H GLY A 45 16.135 -1.697 -25.636 1.00 0.00 H new ATOM 0 HA2 GLY A 45 18.207 -1.313 -23.613 1.00 0.00 H new ATOM 0 HA3 GLY A 45 18.394 -1.372 -25.355 1.00 0.00 H new ATOM 680 N LYS A 46 18.649 1.138 -23.754 1.00 0.00 N ATOM 681 CA LYS A 46 18.780 2.590 -23.700 1.00 0.00 C ATOM 682 C LYS A 46 20.128 2.993 -23.111 1.00 0.00 C ATOM 683 O LYS A 46 20.616 2.369 -22.167 1.00 0.00 O ATOM 684 CB LYS A 46 17.647 3.194 -22.868 1.00 0.00 C ATOM 685 CG LYS A 46 17.891 3.131 -21.371 1.00 0.00 C ATOM 686 CD LYS A 46 18.527 4.411 -20.855 1.00 0.00 C ATOM 687 CE LYS A 46 18.194 4.648 -19.390 1.00 0.00 C ATOM 688 NZ LYS A 46 18.375 6.075 -19.004 1.00 0.00 N ATOM 0 H LYS A 46 19.245 0.636 -23.096 1.00 0.00 H new ATOM 0 HA LYS A 46 18.719 2.974 -24.718 1.00 0.00 H new ATOM 0 HB2 LYS A 46 17.507 4.234 -23.161 1.00 0.00 H new ATOM 0 HB3 LYS A 46 16.719 2.670 -23.099 1.00 0.00 H new ATOM 0 HG2 LYS A 46 16.947 2.959 -20.855 1.00 0.00 H new ATOM 0 HG3 LYS A 46 18.538 2.284 -21.142 1.00 0.00 H new ATOM 0 HD2 LYS A 46 19.609 4.357 -20.979 1.00 0.00 H new ATOM 0 HD3 LYS A 46 18.180 5.256 -21.449 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.164 4.348 -19.199 1.00 0.00 H new ATOM 0 HE3 LYS A 46 18.830 4.020 -18.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 18.138 6.195 -17.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 19.364 6.355 -19.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 17.749 6.673 -19.581 1.00 0.00 H new ATOM 702 N LEU A 47 20.725 4.038 -23.672 1.00 0.00 N ATOM 703 CA LEU A 47 22.017 4.526 -23.201 1.00 0.00 C ATOM 704 C LEU A 47 21.841 5.721 -22.270 1.00 0.00 C ATOM 705 O LEU A 47 20.919 6.519 -22.436 1.00 0.00 O ATOM 706 CB LEU A 47 22.901 4.915 -24.387 1.00 0.00 C ATOM 707 CG LEU A 47 23.942 3.880 -24.816 1.00 0.00 C ATOM 708 CD1 LEU A 47 24.053 3.832 -26.332 1.00 0.00 C ATOM 709 CD2 LEU A 47 25.293 4.191 -24.190 1.00 0.00 C ATOM 0 H LEU A 47 20.335 4.564 -24.454 1.00 0.00 H new ATOM 0 HA LEU A 47 22.500 3.723 -22.644 1.00 0.00 H new ATOM 0 HB2 LEU A 47 22.257 5.128 -25.240 1.00 0.00 H new ATOM 0 HB3 LEU A 47 23.419 5.841 -24.140 1.00 0.00 H new ATOM 0 HG LEU A 47 23.619 2.900 -24.465 1.00 0.00 H new ATOM 0 HD11 LEU A 47 24.798 3.090 -26.619 1.00 0.00 H new ATOM 0 HD12 LEU A 47 23.088 3.560 -26.759 1.00 0.00 H new ATOM 0 HD13 LEU A 47 24.353 4.811 -26.706 1.00 0.00 H new ATOM 0 HD21 LEU A 47 26.021 3.444 -24.506 1.00 0.00 H new ATOM 0 HD22 LEU A 47 25.624 5.179 -24.511 1.00 0.00 H new ATOM 0 HD23 LEU A 47 25.203 4.173 -23.104 1.00 0.00 H new ATOM 721 N GLU A 48 22.733 5.839 -21.291 1.00 0.00 N ATOM 722 CA GLU A 48 22.676 6.938 -20.335 1.00 0.00 C ATOM 723 C GLU A 48 23.561 8.097 -20.785 1.00 0.00 C ATOM 724 O GLU A 48 23.245 9.263 -20.544 1.00 0.00 O ATOM 725 CB GLU A 48 23.111 6.460 -18.948 1.00 0.00 C ATOM 726 CG GLU A 48 24.547 5.965 -18.897 1.00 0.00 C ATOM 727 CD GLU A 48 25.541 7.086 -18.663 1.00 0.00 C ATOM 728 OE1 GLU A 48 25.133 8.139 -18.130 1.00 0.00 O ATOM 729 OE2 GLU A 48 26.727 6.910 -19.012 1.00 0.00 O ATOM 0 H GLU A 48 23.503 5.187 -21.140 1.00 0.00 H new ATOM 0 HA GLU A 48 21.645 7.288 -20.284 1.00 0.00 H new ATOM 0 HB2 GLU A 48 22.992 7.278 -18.237 1.00 0.00 H new ATOM 0 HB3 GLU A 48 22.447 5.658 -18.625 1.00 0.00 H new ATOM 0 HG2 GLU A 48 24.645 5.226 -18.102 1.00 0.00 H new ATOM 0 HG3 GLU A 48 24.787 5.461 -19.833 1.00 0.00 H new ATOM 736 N SER A 49 24.670 7.768 -21.439 1.00 0.00 N ATOM 737 CA SER A 49 25.603 8.781 -21.920 1.00 0.00 C ATOM 738 C SER A 49 24.946 9.669 -22.972 1.00 0.00 C ATOM 739 O SER A 49 25.310 10.834 -23.133 1.00 0.00 O ATOM 740 CB SER A 49 26.852 8.118 -22.504 1.00 0.00 C ATOM 741 OG SER A 49 27.820 9.086 -22.868 1.00 0.00 O ATOM 0 H SER A 49 24.945 6.808 -21.648 1.00 0.00 H new ATOM 0 HA SER A 49 25.893 9.404 -21.074 1.00 0.00 H new ATOM 0 HB2 SER A 49 27.278 7.430 -21.773 1.00 0.00 H new ATOM 0 HB3 SER A 49 26.579 7.526 -23.378 1.00 0.00 H new ATOM 0 HG SER A 49 28.609 8.637 -23.237 1.00 0.00 H new ATOM 747 N SER A 50 23.974 9.110 -23.687 1.00 0.00 N ATOM 748 CA SER A 50 23.268 9.848 -24.727 1.00 0.00 C ATOM 749 C SER A 50 21.791 10.001 -24.377 1.00 0.00 C ATOM 750 O SER A 50 21.117 10.908 -24.864 1.00 0.00 O ATOM 751 CB SER A 50 23.414 9.139 -26.075 1.00 0.00 C ATOM 752 OG SER A 50 22.951 9.957 -27.135 1.00 0.00 O ATOM 0 H SER A 50 23.658 8.148 -23.564 1.00 0.00 H new ATOM 0 HA SER A 50 23.712 10.841 -24.798 1.00 0.00 H new ATOM 0 HB2 SER A 50 24.460 8.880 -26.242 1.00 0.00 H new ATOM 0 HB3 SER A 50 22.853 8.205 -26.061 1.00 0.00 H new ATOM 0 HG SER A 50 23.057 9.481 -27.985 1.00 0.00 H new ATOM 758 N GLY A 51 21.294 9.106 -23.529 1.00 0.00 N ATOM 759 CA GLY A 51 19.901 9.158 -23.128 1.00 0.00 C ATOM 760 C GLY A 51 18.961 8.735 -24.239 1.00 0.00 C ATOM 761 O GLY A 51 17.780 9.083 -24.231 1.00 0.00 O ATOM 0 H GLY A 51 21.832 8.346 -23.113 1.00 0.00 H new ATOM 0 HA2 GLY A 51 19.751 8.511 -22.263 1.00 0.00 H new ATOM 0 HA3 GLY A 51 19.654 10.172 -22.814 1.00 0.00 H new ATOM 765 N LYS A 52 19.485 7.982 -25.201 1.00 0.00 N ATOM 766 CA LYS A 52 18.687 7.511 -26.326 1.00 0.00 C ATOM 767 C LYS A 52 18.313 6.042 -26.150 1.00 0.00 C ATOM 768 O LYS A 52 19.095 5.251 -25.623 1.00 0.00 O ATOM 769 CB LYS A 52 19.453 7.700 -27.637 1.00 0.00 C ATOM 770 CG LYS A 52 19.158 9.020 -28.329 1.00 0.00 C ATOM 771 CD LYS A 52 19.601 10.203 -27.484 1.00 0.00 C ATOM 772 CE LYS A 52 19.533 11.504 -28.269 1.00 0.00 C ATOM 773 NZ LYS A 52 20.387 11.463 -29.488 1.00 0.00 N ATOM 0 H LYS A 52 20.461 7.685 -25.223 1.00 0.00 H new ATOM 0 HA LYS A 52 17.770 8.100 -26.361 1.00 0.00 H new ATOM 0 HB2 LYS A 52 20.522 7.636 -27.436 1.00 0.00 H new ATOM 0 HB3 LYS A 52 19.206 6.882 -28.313 1.00 0.00 H new ATOM 0 HG2 LYS A 52 19.667 9.049 -29.292 1.00 0.00 H new ATOM 0 HG3 LYS A 52 18.089 9.095 -28.531 1.00 0.00 H new ATOM 0 HD2 LYS A 52 18.969 10.277 -26.599 1.00 0.00 H new ATOM 0 HD3 LYS A 52 20.621 10.040 -27.134 1.00 0.00 H new ATOM 0 HE2 LYS A 52 18.500 11.701 -28.556 1.00 0.00 H new ATOM 0 HE3 LYS A 52 19.850 12.329 -27.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 20.615 12.433 -29.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 21.266 10.949 -29.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 19.876 10.978 -30.253 1.00 0.00 H new ATOM 787 N VAL A 53 17.114 5.684 -26.598 1.00 0.00 N ATOM 788 CA VAL A 53 16.638 4.309 -26.493 1.00 0.00 C ATOM 789 C VAL A 53 16.746 3.587 -27.831 1.00 0.00 C ATOM 790 O VAL A 53 16.287 4.088 -28.858 1.00 0.00 O ATOM 791 CB VAL A 53 15.177 4.257 -26.009 1.00 0.00 C ATOM 792 CG1 VAL A 53 14.263 4.971 -26.993 1.00 0.00 C ATOM 793 CG2 VAL A 53 14.734 2.815 -25.808 1.00 0.00 C ATOM 0 H VAL A 53 16.454 6.326 -27.037 1.00 0.00 H new ATOM 0 HA VAL A 53 17.273 3.808 -25.762 1.00 0.00 H new ATOM 0 HB VAL A 53 15.111 4.771 -25.050 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.235 4.924 -26.634 1.00 0.00 H new ATOM 0 HG12 VAL A 53 14.569 6.013 -27.083 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.330 4.488 -27.968 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.699 2.797 -25.466 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.814 2.275 -26.751 1.00 0.00 H new ATOM 0 HG23 VAL A 53 15.371 2.339 -25.062 1.00 0.00 H new ATOM 803 N PHE A 54 17.354 2.406 -27.812 1.00 0.00 N ATOM 804 CA PHE A 54 17.523 1.613 -29.024 1.00 0.00 C ATOM 805 C PHE A 54 17.030 0.184 -28.812 1.00 0.00 C ATOM 806 O PHE A 54 17.180 -0.382 -27.729 1.00 0.00 O ATOM 807 CB PHE A 54 18.992 1.600 -29.450 1.00 0.00 C ATOM 808 CG PHE A 54 19.849 0.688 -28.620 1.00 0.00 C ATOM 809 CD1 PHE A 54 20.008 -0.643 -28.968 1.00 0.00 C ATOM 810 CD2 PHE A 54 20.497 1.163 -27.490 1.00 0.00 C ATOM 811 CE1 PHE A 54 20.795 -1.484 -28.205 1.00 0.00 C ATOM 812 CE2 PHE A 54 21.286 0.327 -26.723 1.00 0.00 C ATOM 813 CZ PHE A 54 21.436 -0.999 -27.082 1.00 0.00 C ATOM 0 H PHE A 54 17.738 1.977 -26.970 1.00 0.00 H new ATOM 0 HA PHE A 54 16.927 2.071 -29.814 1.00 0.00 H new ATOM 0 HB2 PHE A 54 19.056 1.295 -30.494 1.00 0.00 H new ATOM 0 HB3 PHE A 54 19.389 2.613 -29.389 1.00 0.00 H new ATOM 0 HD1 PHE A 54 19.511 -1.028 -29.846 1.00 0.00 H new ATOM 0 HD2 PHE A 54 20.384 2.199 -27.206 1.00 0.00 H new ATOM 0 HE1 PHE A 54 20.909 -2.520 -28.487 1.00 0.00 H new ATOM 0 HE2 PHE A 54 21.785 0.709 -25.845 1.00 0.00 H new ATOM 0 HZ PHE A 54 22.053 -1.655 -26.486 1.00 0.00 H new ATOM 823 N ASP A 55 16.442 -0.393 -29.854 1.00 0.00 N ATOM 824 CA ASP A 55 15.927 -1.755 -29.784 1.00 0.00 C ATOM 825 C ASP A 55 15.019 -1.932 -28.571 1.00 0.00 C ATOM 826 O ASP A 55 15.459 -2.386 -27.515 1.00 0.00 O ATOM 827 CB ASP A 55 17.082 -2.757 -29.723 1.00 0.00 C ATOM 828 CG ASP A 55 17.789 -2.907 -31.055 1.00 0.00 C ATOM 829 OD1 ASP A 55 17.122 -2.763 -32.100 1.00 0.00 O ATOM 830 OD2 ASP A 55 19.010 -3.170 -31.052 1.00 0.00 O ATOM 0 H ASP A 55 16.310 0.062 -30.758 1.00 0.00 H new ATOM 0 HA ASP A 55 15.341 -1.942 -30.684 1.00 0.00 H new ATOM 0 HB2 ASP A 55 17.799 -2.434 -28.968 1.00 0.00 H new ATOM 0 HB3 ASP A 55 16.701 -3.728 -29.406 1.00 0.00 H new ATOM 835 N SER A 56 13.751 -1.567 -28.729 1.00 0.00 N ATOM 836 CA SER A 56 12.782 -1.680 -27.645 1.00 0.00 C ATOM 837 C SER A 56 11.566 -2.490 -28.086 1.00 0.00 C ATOM 838 O SER A 56 11.087 -2.349 -29.211 1.00 0.00 O ATOM 839 CB SER A 56 12.342 -0.291 -27.179 1.00 0.00 C ATOM 840 OG SER A 56 13.438 0.606 -27.147 1.00 0.00 O ATOM 0 H SER A 56 13.370 -1.190 -29.597 1.00 0.00 H new ATOM 0 HA SER A 56 13.261 -2.199 -26.815 1.00 0.00 H new ATOM 0 HB2 SER A 56 11.572 0.094 -27.848 1.00 0.00 H new ATOM 0 HB3 SER A 56 11.896 -0.361 -26.187 1.00 0.00 H new ATOM 0 HG SER A 56 13.427 1.165 -27.952 1.00 0.00 H new ATOM 846 N SER A 57 11.073 -3.339 -27.190 1.00 0.00 N ATOM 847 CA SER A 57 9.915 -4.175 -27.486 1.00 0.00 C ATOM 848 C SER A 57 8.636 -3.345 -27.505 1.00 0.00 C ATOM 849 O SER A 57 7.631 -3.745 -28.094 1.00 0.00 O ATOM 850 CB SER A 57 9.793 -5.298 -26.454 1.00 0.00 C ATOM 851 OG SER A 57 8.456 -5.758 -26.356 1.00 0.00 O ATOM 0 H SER A 57 11.457 -3.466 -26.254 1.00 0.00 H new ATOM 0 HA SER A 57 10.057 -4.613 -28.474 1.00 0.00 H new ATOM 0 HB2 SER A 57 10.446 -6.125 -26.733 1.00 0.00 H new ATOM 0 HB3 SER A 57 10.130 -4.940 -25.481 1.00 0.00 H new ATOM 0 HG SER A 57 8.255 -6.343 -27.116 1.00 0.00 H new ATOM 857 N ARG A 58 8.680 -2.186 -26.856 1.00 0.00 N ATOM 858 CA ARG A 58 7.525 -1.299 -26.796 1.00 0.00 C ATOM 859 C ARG A 58 7.370 -0.519 -28.099 1.00 0.00 C ATOM 860 O ARG A 58 6.265 -0.127 -28.471 1.00 0.00 O ATOM 861 CB ARG A 58 7.661 -0.328 -25.622 1.00 0.00 C ATOM 862 CG ARG A 58 8.847 0.615 -25.744 1.00 0.00 C ATOM 863 CD ARG A 58 9.049 1.423 -24.473 1.00 0.00 C ATOM 864 NE ARG A 58 9.625 2.737 -24.746 1.00 0.00 N ATOM 865 CZ ARG A 58 9.938 3.614 -23.798 1.00 0.00 C ATOM 866 NH1 ARG A 58 9.732 3.318 -22.522 1.00 0.00 N ATOM 867 NH2 ARG A 58 10.459 4.790 -24.126 1.00 0.00 N ATOM 0 H ARG A 58 9.504 -1.839 -26.364 1.00 0.00 H new ATOM 0 HA ARG A 58 6.635 -1.912 -26.651 1.00 0.00 H new ATOM 0 HB2 ARG A 58 6.747 0.260 -25.541 1.00 0.00 H new ATOM 0 HB3 ARG A 58 7.756 -0.899 -24.698 1.00 0.00 H new ATOM 0 HG2 ARG A 58 9.749 0.041 -25.959 1.00 0.00 H new ATOM 0 HG3 ARG A 58 8.691 1.291 -26.585 1.00 0.00 H new ATOM 0 HD2 ARG A 58 8.092 1.545 -23.965 1.00 0.00 H new ATOM 0 HD3 ARG A 58 9.703 0.874 -23.795 1.00 0.00 H new ATOM 0 HE ARG A 58 9.796 2.996 -25.718 1.00 0.00 H new ATOM 0 HH11 ARG A 58 9.332 2.415 -22.266 1.00 0.00 H new ATOM 0 HH12 ARG A 58 9.973 3.993 -21.796 1.00 0.00 H new ATOM 0 HH21 ARG A 58 10.619 5.021 -25.106 1.00 0.00 H new ATOM 0 HH22 ARG A 58 10.699 5.463 -23.398 1.00 0.00 H new ATOM 881 N GLU A 59 8.486 -0.298 -28.786 1.00 0.00 N ATOM 882 CA GLU A 59 8.474 0.435 -30.046 1.00 0.00 C ATOM 883 C GLU A 59 7.538 -0.228 -31.053 1.00 0.00 C ATOM 884 O GLU A 59 7.037 0.421 -31.971 1.00 0.00 O ATOM 885 CB GLU A 59 9.887 0.521 -30.626 1.00 0.00 C ATOM 886 CG GLU A 59 10.274 1.917 -31.086 1.00 0.00 C ATOM 887 CD GLU A 59 9.402 2.420 -32.219 1.00 0.00 C ATOM 888 OE1 GLU A 59 9.752 2.171 -33.392 1.00 0.00 O ATOM 889 OE2 GLU A 59 8.370 3.062 -31.935 1.00 0.00 O ATOM 0 H GLU A 59 9.409 -0.616 -28.491 1.00 0.00 H new ATOM 0 HA GLU A 59 8.110 1.443 -29.846 1.00 0.00 H new ATOM 0 HB2 GLU A 59 10.600 0.185 -29.873 1.00 0.00 H new ATOM 0 HB3 GLU A 59 9.967 -0.165 -31.469 1.00 0.00 H new ATOM 0 HG2 GLU A 59 10.203 2.606 -30.244 1.00 0.00 H new ATOM 0 HG3 GLU A 59 11.315 1.914 -31.408 1.00 0.00 H new ATOM 896 N ARG A 60 7.309 -1.525 -30.874 1.00 0.00 N ATOM 897 CA ARG A 60 6.436 -2.277 -31.767 1.00 0.00 C ATOM 898 C ARG A 60 5.187 -2.753 -31.031 1.00 0.00 C ATOM 899 O ARG A 60 4.204 -3.154 -31.652 1.00 0.00 O ATOM 900 CB ARG A 60 7.183 -3.475 -32.355 1.00 0.00 C ATOM 901 CG ARG A 60 8.071 -4.192 -31.351 1.00 0.00 C ATOM 902 CD ARG A 60 8.839 -5.332 -32.001 1.00 0.00 C ATOM 903 NE ARG A 60 10.174 -4.921 -32.426 1.00 0.00 N ATOM 904 CZ ARG A 60 10.988 -5.691 -33.139 1.00 0.00 C ATOM 905 NH1 ARG A 60 10.606 -6.907 -33.504 1.00 0.00 N ATOM 906 NH2 ARG A 60 12.189 -5.246 -33.487 1.00 0.00 N ATOM 0 H ARG A 60 7.716 -2.077 -30.119 1.00 0.00 H new ATOM 0 HA ARG A 60 6.129 -1.616 -32.578 1.00 0.00 H new ATOM 0 HB2 ARG A 60 6.458 -4.183 -32.757 1.00 0.00 H new ATOM 0 HB3 ARG A 60 7.795 -3.136 -33.191 1.00 0.00 H new ATOM 0 HG2 ARG A 60 8.773 -3.483 -30.913 1.00 0.00 H new ATOM 0 HG3 ARG A 60 7.460 -4.581 -30.536 1.00 0.00 H new ATOM 0 HD2 ARG A 60 8.922 -6.161 -31.298 1.00 0.00 H new ATOM 0 HD3 ARG A 60 8.282 -5.700 -32.863 1.00 0.00 H new ATOM 0 HE ARG A 60 10.499 -3.991 -32.161 1.00 0.00 H new ATOM 0 HH11 ARG A 60 9.685 -7.254 -33.237 1.00 0.00 H new ATOM 0 HH12 ARG A 60 11.234 -7.496 -34.052 1.00 0.00 H new ATOM 0 HH21 ARG A 60 12.488 -4.312 -33.207 1.00 0.00 H new ATOM 0 HH22 ARG A 60 12.813 -5.838 -34.035 1.00 0.00 H new ATOM 920 N ASN A 61 5.234 -2.706 -29.704 1.00 0.00 N ATOM 921 CA ASN A 61 4.107 -3.134 -28.883 1.00 0.00 C ATOM 922 C ASN A 61 3.828 -4.622 -29.075 1.00 0.00 C ATOM 923 O ASN A 61 2.744 -5.011 -29.510 1.00 0.00 O ATOM 924 CB ASN A 61 2.858 -2.321 -29.231 1.00 0.00 C ATOM 925 CG ASN A 61 3.158 -0.844 -29.399 1.00 0.00 C ATOM 926 OD1 ASN A 61 3.495 -0.154 -28.437 1.00 0.00 O ATOM 927 ND2 ASN A 61 3.038 -0.352 -30.627 1.00 0.00 N ATOM 0 H ASN A 61 6.040 -2.376 -29.174 1.00 0.00 H new ATOM 0 HA ASN A 61 4.365 -2.962 -27.838 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.421 -2.707 -30.152 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.113 -2.451 -28.446 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.228 0.635 -30.802 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.756 -0.961 -31.395 1.00 0.00 H new ATOM 934 N VAL A 62 4.814 -5.450 -28.746 1.00 0.00 N ATOM 935 CA VAL A 62 4.676 -6.895 -28.880 1.00 0.00 C ATOM 936 C VAL A 62 5.580 -7.628 -27.895 1.00 0.00 C ATOM 937 O VAL A 62 6.762 -7.314 -27.748 1.00 0.00 O ATOM 938 CB VAL A 62 5.008 -7.361 -30.310 1.00 0.00 C ATOM 939 CG1 VAL A 62 6.428 -6.965 -30.684 1.00 0.00 C ATOM 940 CG2 VAL A 62 4.813 -8.864 -30.439 1.00 0.00 C ATOM 0 H VAL A 62 5.718 -5.145 -28.385 1.00 0.00 H new ATOM 0 HA VAL A 62 3.636 -7.135 -28.661 1.00 0.00 H new ATOM 0 HB VAL A 62 4.325 -6.869 -31.002 1.00 0.00 H new ATOM 0 HG11 VAL A 62 6.645 -7.302 -31.698 1.00 0.00 H new ATOM 0 HG12 VAL A 62 6.529 -5.881 -30.633 1.00 0.00 H new ATOM 0 HG13 VAL A 62 7.130 -7.428 -29.990 1.00 0.00 H new ATOM 0 HG21 VAL A 62 5.052 -9.176 -31.456 1.00 0.00 H new ATOM 0 HG22 VAL A 62 5.471 -9.378 -29.738 1.00 0.00 H new ATOM 0 HG23 VAL A 62 3.776 -9.117 -30.216 1.00 0.00 H new ATOM 950 N PRO A 63 5.015 -8.629 -27.204 1.00 0.00 N ATOM 951 CA PRO A 63 5.753 -9.428 -26.222 1.00 0.00 C ATOM 952 C PRO A 63 6.791 -10.335 -26.874 1.00 0.00 C ATOM 953 O PRO A 63 6.561 -10.883 -27.952 1.00 0.00 O ATOM 954 CB PRO A 63 4.660 -10.264 -25.551 1.00 0.00 C ATOM 955 CG PRO A 63 3.574 -10.354 -26.568 1.00 0.00 C ATOM 956 CD PRO A 63 3.612 -9.057 -27.329 1.00 0.00 C ATOM 0 HA PRO A 63 6.317 -8.803 -25.530 1.00 0.00 H new ATOM 0 HB2 PRO A 63 5.029 -11.252 -25.278 1.00 0.00 H new ATOM 0 HB3 PRO A 63 4.306 -9.791 -24.635 1.00 0.00 H new ATOM 0 HG2 PRO A 63 3.732 -11.202 -27.234 1.00 0.00 H new ATOM 0 HG3 PRO A 63 2.604 -10.499 -26.092 1.00 0.00 H new ATOM 0 HD2 PRO A 63 3.325 -9.194 -28.372 1.00 0.00 H new ATOM 0 HD3 PRO A 63 2.928 -8.322 -26.904 1.00 0.00 H new ATOM 964 N PHE A 64 7.934 -10.488 -26.214 1.00 0.00 N ATOM 965 CA PHE A 64 9.008 -11.328 -26.731 1.00 0.00 C ATOM 966 C PHE A 64 9.118 -12.624 -25.932 1.00 0.00 C ATOM 967 O PHE A 64 9.193 -12.605 -24.703 1.00 0.00 O ATOM 968 CB PHE A 64 10.340 -10.575 -26.687 1.00 0.00 C ATOM 969 CG PHE A 64 10.672 -9.870 -27.971 1.00 0.00 C ATOM 970 CD1 PHE A 64 10.000 -8.715 -28.336 1.00 0.00 C ATOM 971 CD2 PHE A 64 11.657 -10.362 -28.812 1.00 0.00 C ATOM 972 CE1 PHE A 64 10.304 -8.065 -29.518 1.00 0.00 C ATOM 973 CE2 PHE A 64 11.965 -9.716 -29.994 1.00 0.00 C ATOM 974 CZ PHE A 64 11.288 -8.565 -30.347 1.00 0.00 C ATOM 0 H PHE A 64 8.140 -10.042 -25.320 1.00 0.00 H new ATOM 0 HA PHE A 64 8.773 -11.578 -27.766 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.309 -9.845 -25.878 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.138 -11.278 -26.451 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.230 -8.318 -27.691 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.190 -11.261 -28.541 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.772 -7.166 -29.793 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.734 -10.111 -30.641 1.00 0.00 H new ATOM 0 HZ PHE A 64 11.528 -8.057 -31.270 1.00 0.00 H new ATOM 984 N LYS A 65 9.126 -13.749 -26.639 1.00 0.00 N ATOM 985 CA LYS A 65 9.226 -15.055 -25.999 1.00 0.00 C ATOM 986 C LYS A 65 10.621 -15.645 -26.183 1.00 0.00 C ATOM 987 O LYS A 65 11.195 -15.578 -27.270 1.00 0.00 O ATOM 988 CB LYS A 65 8.177 -16.009 -26.573 1.00 0.00 C ATOM 989 CG LYS A 65 8.389 -16.334 -28.041 1.00 0.00 C ATOM 990 CD LYS A 65 8.798 -17.784 -28.238 1.00 0.00 C ATOM 991 CE LYS A 65 9.648 -17.959 -29.488 1.00 0.00 C ATOM 992 NZ LYS A 65 8.818 -18.284 -30.681 1.00 0.00 N ATOM 0 H LYS A 65 9.064 -13.782 -27.657 1.00 0.00 H new ATOM 0 HA LYS A 65 9.044 -14.924 -24.932 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.188 -16.936 -25.999 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.189 -15.567 -26.446 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.471 -16.136 -28.595 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.157 -15.679 -28.452 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.356 -18.127 -27.367 1.00 0.00 H new ATOM 0 HD3 LYS A 65 7.907 -18.408 -28.312 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.211 -17.045 -29.675 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.376 -18.754 -29.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.433 -18.396 -31.512 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 8.300 -19.170 -30.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.140 -17.514 -30.853 1.00 0.00 H new ATOM 1006 N PHE A 66 11.159 -16.224 -25.114 1.00 0.00 N ATOM 1007 CA PHE A 66 12.486 -16.826 -25.159 1.00 0.00 C ATOM 1008 C PHE A 66 12.647 -17.868 -24.056 1.00 0.00 C ATOM 1009 O PHE A 66 11.756 -18.054 -23.227 1.00 0.00 O ATOM 1010 CB PHE A 66 13.564 -15.749 -25.020 1.00 0.00 C ATOM 1011 CG PHE A 66 13.781 -15.297 -23.604 1.00 0.00 C ATOM 1012 CD1 PHE A 66 12.748 -14.725 -22.879 1.00 0.00 C ATOM 1013 CD2 PHE A 66 15.018 -15.445 -22.997 1.00 0.00 C ATOM 1014 CE1 PHE A 66 12.944 -14.309 -21.576 1.00 0.00 C ATOM 1015 CE2 PHE A 66 15.220 -15.031 -21.694 1.00 0.00 C ATOM 1016 CZ PHE A 66 14.182 -14.461 -20.983 1.00 0.00 C ATOM 0 H PHE A 66 10.697 -16.289 -24.207 1.00 0.00 H new ATOM 0 HA PHE A 66 12.600 -17.321 -26.123 1.00 0.00 H new ATOM 0 HB2 PHE A 66 14.503 -16.133 -25.418 1.00 0.00 H new ATOM 0 HB3 PHE A 66 13.287 -14.889 -25.629 1.00 0.00 H new ATOM 0 HD1 PHE A 66 11.778 -14.603 -23.338 1.00 0.00 H new ATOM 0 HD2 PHE A 66 15.834 -15.889 -23.549 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.130 -13.865 -21.022 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.189 -15.153 -21.232 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.338 -14.135 -19.965 1.00 0.00 H new ATOM 1026 N HIS A 67 13.791 -18.546 -24.053 1.00 0.00 N ATOM 1027 CA HIS A 67 14.070 -19.570 -23.052 1.00 0.00 C ATOM 1028 C HIS A 67 15.051 -19.052 -22.004 1.00 0.00 C ATOM 1029 O HIS A 67 16.216 -18.789 -22.305 1.00 0.00 O ATOM 1030 CB HIS A 67 14.634 -20.825 -23.719 1.00 0.00 C ATOM 1031 CG HIS A 67 13.612 -21.607 -24.485 1.00 0.00 C ATOM 1032 ND1 HIS A 67 13.381 -22.950 -24.277 1.00 0.00 N ATOM 1033 CD2 HIS A 67 12.756 -21.226 -25.462 1.00 0.00 C ATOM 1034 CE1 HIS A 67 12.428 -23.363 -25.094 1.00 0.00 C ATOM 1035 NE2 HIS A 67 12.032 -22.336 -25.823 1.00 0.00 N ATOM 0 H HIS A 67 14.539 -18.405 -24.732 1.00 0.00 H new ATOM 0 HA HIS A 67 13.133 -19.822 -22.555 1.00 0.00 H new ATOM 0 HB2 HIS A 67 15.440 -20.537 -24.394 1.00 0.00 H new ATOM 0 HB3 HIS A 67 15.073 -21.467 -22.955 1.00 0.00 H new ATOM 0 HD2 HIS A 67 12.660 -20.235 -25.880 1.00 0.00 H new ATOM 0 HE1 HIS A 67 12.039 -24.369 -25.155 1.00 0.00 H new ATOM 0 HE2 HIS A 67 11.306 -22.363 -26.539 1.00 0.00 H new ATOM 1043 N LEU A 68 14.572 -18.907 -20.774 1.00 0.00 N ATOM 1044 CA LEU A 68 15.406 -18.420 -19.680 1.00 0.00 C ATOM 1045 C LEU A 68 16.514 -19.416 -19.355 1.00 0.00 C ATOM 1046 O LEU A 68 17.657 -19.032 -19.112 1.00 0.00 O ATOM 1047 CB LEU A 68 14.553 -18.163 -18.437 1.00 0.00 C ATOM 1048 CG LEU A 68 15.300 -18.144 -17.103 1.00 0.00 C ATOM 1049 CD1 LEU A 68 16.502 -17.215 -17.177 1.00 0.00 C ATOM 1050 CD2 LEU A 68 14.368 -17.724 -15.976 1.00 0.00 C ATOM 0 H LEU A 68 13.610 -19.120 -20.509 1.00 0.00 H new ATOM 0 HA LEU A 68 15.866 -17.484 -19.996 1.00 0.00 H new ATOM 0 HB2 LEU A 68 14.046 -17.206 -18.560 1.00 0.00 H new ATOM 0 HB3 LEU A 68 13.780 -18.929 -18.387 1.00 0.00 H new ATOM 0 HG LEU A 68 15.658 -19.152 -16.895 1.00 0.00 H new ATOM 0 HD11 LEU A 68 17.021 -17.215 -16.219 1.00 0.00 H new ATOM 0 HD12 LEU A 68 17.181 -17.560 -17.957 1.00 0.00 H new ATOM 0 HD13 LEU A 68 16.167 -16.204 -17.409 1.00 0.00 H new ATOM 0 HD21 LEU A 68 14.917 -17.716 -15.034 1.00 0.00 H new ATOM 0 HD22 LEU A 68 13.979 -16.726 -16.178 1.00 0.00 H new ATOM 0 HD23 LEU A 68 13.539 -18.429 -15.907 1.00 0.00 H new ATOM 1062 N GLY A 69 16.166 -20.700 -19.353 1.00 0.00 N ATOM 1063 CA GLY A 69 17.143 -21.732 -19.058 1.00 0.00 C ATOM 1064 C GLY A 69 18.002 -22.078 -20.258 1.00 0.00 C ATOM 1065 O GLY A 69 17.964 -23.205 -20.751 1.00 0.00 O ATOM 0 H GLY A 69 15.226 -21.043 -19.550 1.00 0.00 H new ATOM 0 HA2 GLY A 69 17.783 -21.399 -18.241 1.00 0.00 H new ATOM 0 HA3 GLY A 69 16.627 -22.628 -18.714 1.00 0.00 H new ATOM 1069 N GLN A 70 18.776 -21.106 -20.729 1.00 0.00 N ATOM 1070 CA GLN A 70 19.646 -21.314 -21.880 1.00 0.00 C ATOM 1071 C GLN A 70 20.831 -20.354 -21.847 1.00 0.00 C ATOM 1072 O GLN A 70 20.843 -19.393 -21.080 1.00 0.00 O ATOM 1073 CB GLN A 70 18.861 -21.128 -23.180 1.00 0.00 C ATOM 1074 CG GLN A 70 17.950 -22.299 -23.512 1.00 0.00 C ATOM 1075 CD GLN A 70 17.598 -22.365 -24.985 1.00 0.00 C ATOM 1076 OE1 GLN A 70 16.424 -22.422 -25.353 1.00 0.00 O ATOM 1077 NE2 GLN A 70 18.615 -22.356 -25.838 1.00 0.00 N ATOM 0 H GLN A 70 18.818 -20.168 -20.332 1.00 0.00 H new ATOM 0 HA GLN A 70 20.026 -22.335 -21.836 1.00 0.00 H new ATOM 0 HB2 GLN A 70 18.261 -20.221 -23.106 1.00 0.00 H new ATOM 0 HB3 GLN A 70 19.563 -20.980 -24.001 1.00 0.00 H new ATOM 0 HG2 GLN A 70 18.437 -23.228 -23.217 1.00 0.00 H new ATOM 0 HG3 GLN A 70 17.034 -22.219 -22.927 1.00 0.00 H new ATOM 0 HE21 GLN A 70 19.572 -22.308 -25.490 1.00 0.00 H new ATOM 0 HE22 GLN A 70 18.439 -22.397 -26.842 1.00 0.00 H new ATOM 1086 N GLY A 71 21.828 -20.622 -22.686 1.00 0.00 N ATOM 1087 CA GLY A 71 23.004 -19.773 -22.736 1.00 0.00 C ATOM 1088 C GLY A 71 23.052 -18.923 -23.990 1.00 0.00 C ATOM 1089 O GLY A 71 24.097 -18.807 -24.629 1.00 0.00 O ATOM 0 H GLY A 71 21.842 -21.412 -23.331 1.00 0.00 H new ATOM 0 HA2 GLY A 71 23.018 -19.124 -21.860 1.00 0.00 H new ATOM 0 HA3 GLY A 71 23.899 -20.394 -22.687 1.00 0.00 H new ATOM 1093 N GLU A 72 21.916 -18.329 -24.344 1.00 0.00 N ATOM 1094 CA GLU A 72 21.834 -17.487 -25.532 1.00 0.00 C ATOM 1095 C GLU A 72 21.869 -16.009 -25.155 1.00 0.00 C ATOM 1096 O GLU A 72 22.124 -15.147 -25.997 1.00 0.00 O ATOM 1097 CB GLU A 72 20.556 -17.795 -26.314 1.00 0.00 C ATOM 1098 CG GLU A 72 20.709 -18.937 -27.305 1.00 0.00 C ATOM 1099 CD GLU A 72 21.308 -18.488 -28.624 1.00 0.00 C ATOM 1100 OE1 GLU A 72 22.444 -17.970 -28.613 1.00 0.00 O ATOM 1101 OE2 GLU A 72 20.641 -18.654 -29.667 1.00 0.00 O ATOM 0 H GLU A 72 21.042 -18.415 -23.826 1.00 0.00 H new ATOM 0 HA GLU A 72 22.698 -17.704 -26.161 1.00 0.00 H new ATOM 0 HB2 GLU A 72 19.760 -18.040 -25.611 1.00 0.00 H new ATOM 0 HB3 GLU A 72 20.243 -16.899 -26.850 1.00 0.00 H new ATOM 0 HG2 GLU A 72 21.341 -19.710 -26.868 1.00 0.00 H new ATOM 0 HG3 GLU A 72 19.734 -19.388 -27.488 1.00 0.00 H new ATOM 1108 N VAL A 73 21.609 -15.722 -23.883 1.00 0.00 N ATOM 1109 CA VAL A 73 21.611 -14.349 -23.393 1.00 0.00 C ATOM 1110 C VAL A 73 22.802 -14.095 -22.475 1.00 0.00 C ATOM 1111 O VAL A 73 23.340 -15.022 -21.869 1.00 0.00 O ATOM 1112 CB VAL A 73 20.312 -14.023 -22.633 1.00 0.00 C ATOM 1113 CG1 VAL A 73 19.160 -13.822 -23.606 1.00 0.00 C ATOM 1114 CG2 VAL A 73 19.990 -15.122 -21.632 1.00 0.00 C ATOM 0 H VAL A 73 21.394 -16.423 -23.173 1.00 0.00 H new ATOM 0 HA VAL A 73 21.685 -13.701 -24.266 1.00 0.00 H new ATOM 0 HB VAL A 73 20.457 -13.093 -22.083 1.00 0.00 H new ATOM 0 HG11 VAL A 73 18.251 -13.593 -23.051 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.392 -12.997 -24.279 1.00 0.00 H new ATOM 0 HG13 VAL A 73 19.011 -14.733 -24.186 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.069 -14.875 -21.104 1.00 0.00 H new ATOM 0 HG22 VAL A 73 19.864 -16.068 -22.158 1.00 0.00 H new ATOM 0 HG23 VAL A 73 20.806 -15.212 -20.915 1.00 0.00 H new ATOM 1124 N ILE A 74 23.207 -12.833 -22.377 1.00 0.00 N ATOM 1125 CA ILE A 74 24.333 -12.457 -21.531 1.00 0.00 C ATOM 1126 C ILE A 74 23.979 -12.587 -20.054 1.00 0.00 C ATOM 1127 O ILE A 74 22.806 -12.678 -19.691 1.00 0.00 O ATOM 1128 CB ILE A 74 24.791 -11.013 -21.813 1.00 0.00 C ATOM 1129 CG1 ILE A 74 23.649 -10.032 -21.541 1.00 0.00 C ATOM 1130 CG2 ILE A 74 25.280 -10.883 -23.247 1.00 0.00 C ATOM 1131 CD1 ILE A 74 24.086 -8.583 -21.536 1.00 0.00 C ATOM 0 H ILE A 74 22.773 -12.054 -22.872 1.00 0.00 H new ATOM 0 HA ILE A 74 25.148 -13.141 -21.768 1.00 0.00 H new ATOM 0 HB ILE A 74 25.619 -10.772 -21.146 1.00 0.00 H new ATOM 0 HG12 ILE A 74 22.876 -10.168 -22.298 1.00 0.00 H new ATOM 0 HG13 ILE A 74 23.197 -10.270 -20.578 1.00 0.00 H new ATOM 0 HG21 ILE A 74 25.600 -9.857 -23.431 1.00 0.00 H new ATOM 0 HG22 ILE A 74 26.119 -11.559 -23.408 1.00 0.00 H new ATOM 0 HG23 ILE A 74 24.471 -11.139 -23.932 1.00 0.00 H new ATOM 0 HD11 ILE A 74 23.226 -7.944 -21.337 1.00 0.00 H new ATOM 0 HD12 ILE A 74 24.837 -8.432 -20.761 1.00 0.00 H new ATOM 0 HD13 ILE A 74 24.511 -8.328 -22.507 1.00 0.00 H new ATOM 1143 N LYS A 75 25.001 -12.595 -19.205 1.00 0.00 N ATOM 1144 CA LYS A 75 24.799 -12.711 -17.765 1.00 0.00 C ATOM 1145 C LYS A 75 23.833 -11.643 -17.264 1.00 0.00 C ATOM 1146 O LYS A 75 23.142 -11.836 -16.264 1.00 0.00 O ATOM 1147 CB LYS A 75 26.136 -12.590 -17.031 1.00 0.00 C ATOM 1148 CG LYS A 75 26.828 -13.923 -16.802 1.00 0.00 C ATOM 1149 CD LYS A 75 27.673 -14.324 -17.999 1.00 0.00 C ATOM 1150 CE LYS A 75 28.099 -15.782 -17.916 1.00 0.00 C ATOM 1151 NZ LYS A 75 29.194 -16.096 -18.876 1.00 0.00 N ATOM 0 H LYS A 75 25.978 -12.523 -19.489 1.00 0.00 H new ATOM 0 HA LYS A 75 24.367 -13.691 -17.561 1.00 0.00 H new ATOM 0 HB2 LYS A 75 26.798 -11.940 -17.604 1.00 0.00 H new ATOM 0 HB3 LYS A 75 25.970 -12.106 -16.068 1.00 0.00 H new ATOM 0 HG2 LYS A 75 27.458 -13.859 -15.915 1.00 0.00 H new ATOM 0 HG3 LYS A 75 26.082 -14.693 -16.608 1.00 0.00 H new ATOM 0 HD2 LYS A 75 27.107 -14.161 -18.916 1.00 0.00 H new ATOM 0 HD3 LYS A 75 28.557 -13.688 -18.052 1.00 0.00 H new ATOM 0 HE2 LYS A 75 28.430 -16.006 -16.902 1.00 0.00 H new ATOM 0 HE3 LYS A 75 27.242 -16.423 -18.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 29.456 -17.099 -18.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 28.870 -15.906 -19.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 30.022 -15.503 -18.665 1.00 0.00 H new ATOM 1165 N GLY A 76 23.788 -10.514 -17.966 1.00 0.00 N ATOM 1166 CA GLY A 76 22.902 -9.433 -17.576 1.00 0.00 C ATOM 1167 C GLY A 76 21.445 -9.850 -17.575 1.00 0.00 C ATOM 1168 O GLY A 76 20.734 -9.642 -16.592 1.00 0.00 O ATOM 0 H GLY A 76 24.349 -10.329 -18.797 1.00 0.00 H new ATOM 0 HA2 GLY A 76 23.177 -9.083 -16.581 1.00 0.00 H new ATOM 0 HA3 GLY A 76 23.036 -8.593 -18.258 1.00 0.00 H new ATOM 1172 N TRP A 77 20.998 -10.437 -18.679 1.00 0.00 N ATOM 1173 CA TRP A 77 19.615 -10.882 -18.802 1.00 0.00 C ATOM 1174 C TRP A 77 19.375 -12.145 -17.981 1.00 0.00 C ATOM 1175 O TRP A 77 18.335 -12.289 -17.338 1.00 0.00 O ATOM 1176 CB TRP A 77 19.269 -11.140 -20.269 1.00 0.00 C ATOM 1177 CG TRP A 77 19.855 -10.126 -21.205 1.00 0.00 C ATOM 1178 CD1 TRP A 77 20.320 -10.349 -22.469 1.00 0.00 C ATOM 1179 CD2 TRP A 77 20.040 -8.730 -20.948 1.00 0.00 C ATOM 1180 NE1 TRP A 77 20.783 -9.176 -23.014 1.00 0.00 N ATOM 1181 CE2 TRP A 77 20.622 -8.168 -22.101 1.00 0.00 C ATOM 1182 CE3 TRP A 77 19.770 -7.899 -19.857 1.00 0.00 C ATOM 1183 CZ2 TRP A 77 20.938 -6.815 -22.191 1.00 0.00 C ATOM 1184 CZ3 TRP A 77 20.085 -6.557 -19.948 1.00 0.00 C ATOM 1185 CH2 TRP A 77 20.662 -6.025 -21.108 1.00 0.00 C ATOM 0 H TRP A 77 21.573 -10.616 -19.502 1.00 0.00 H new ATOM 0 HA TRP A 77 18.970 -10.092 -18.417 1.00 0.00 H new ATOM 0 HB2 TRP A 77 19.625 -12.131 -20.550 1.00 0.00 H new ATOM 0 HB3 TRP A 77 18.185 -11.146 -20.384 1.00 0.00 H new ATOM 0 HD1 TRP A 77 20.323 -11.307 -22.967 1.00 0.00 H new ATOM 0 HE1 TRP A 77 21.182 -9.073 -23.947 1.00 0.00 H new ATOM 0 HE3 TRP A 77 19.323 -8.299 -18.959 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 21.385 -6.403 -23.084 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 19.883 -5.907 -19.110 1.00 0.00 H new ATOM 0 HH2 TRP A 77 20.894 -4.971 -21.149 1.00 0.00 H new ATOM 1196 N ASP A 78 20.342 -13.055 -18.007 1.00 0.00 N ATOM 1197 CA ASP A 78 20.235 -14.305 -17.263 1.00 0.00 C ATOM 1198 C ASP A 78 20.104 -14.038 -15.767 1.00 0.00 C ATOM 1199 O ASP A 78 19.218 -14.579 -15.106 1.00 0.00 O ATOM 1200 CB ASP A 78 21.454 -15.188 -17.532 1.00 0.00 C ATOM 1201 CG ASP A 78 21.431 -16.469 -16.721 1.00 0.00 C ATOM 1202 OD1 ASP A 78 21.943 -16.461 -15.582 1.00 0.00 O ATOM 1203 OD2 ASP A 78 20.900 -17.481 -17.226 1.00 0.00 O ATOM 0 H ASP A 78 21.209 -12.951 -18.535 1.00 0.00 H new ATOM 0 HA ASP A 78 19.338 -14.825 -17.600 1.00 0.00 H new ATOM 0 HB2 ASP A 78 21.494 -15.434 -18.593 1.00 0.00 H new ATOM 0 HB3 ASP A 78 22.361 -14.630 -17.300 1.00 0.00 H new ATOM 1208 N ILE A 79 20.993 -13.202 -15.241 1.00 0.00 N ATOM 1209 CA ILE A 79 20.976 -12.864 -13.823 1.00 0.00 C ATOM 1210 C ILE A 79 19.734 -12.054 -13.466 1.00 0.00 C ATOM 1211 O ILE A 79 19.071 -12.325 -12.464 1.00 0.00 O ATOM 1212 CB ILE A 79 22.230 -12.065 -13.420 1.00 0.00 C ATOM 1213 CG1 ILE A 79 23.487 -12.915 -13.614 1.00 0.00 C ATOM 1214 CG2 ILE A 79 22.118 -11.597 -11.977 1.00 0.00 C ATOM 1215 CD1 ILE A 79 24.753 -12.099 -13.748 1.00 0.00 C ATOM 0 H ILE A 79 21.733 -12.747 -15.775 1.00 0.00 H new ATOM 0 HA ILE A 79 20.963 -13.805 -13.274 1.00 0.00 H new ATOM 0 HB ILE A 79 22.305 -11.187 -14.062 1.00 0.00 H new ATOM 0 HG12 ILE A 79 23.590 -13.595 -12.768 1.00 0.00 H new ATOM 0 HG13 ILE A 79 23.365 -13.531 -14.505 1.00 0.00 H new ATOM 0 HG21 ILE A 79 23.011 -11.034 -11.707 1.00 0.00 H new ATOM 0 HG22 ILE A 79 21.241 -10.960 -11.868 1.00 0.00 H new ATOM 0 HG23 ILE A 79 22.022 -12.462 -11.320 1.00 0.00 H new ATOM 0 HD11 ILE A 79 25.604 -12.767 -13.883 1.00 0.00 H new ATOM 0 HD12 ILE A 79 24.670 -11.438 -14.611 1.00 0.00 H new ATOM 0 HD13 ILE A 79 24.899 -11.503 -12.847 1.00 0.00 H new ATOM 1227 N CYS A 80 19.424 -11.061 -14.292 1.00 0.00 N ATOM 1228 CA CYS A 80 18.261 -10.212 -14.064 1.00 0.00 C ATOM 1229 C CYS A 80 16.977 -11.035 -14.071 1.00 0.00 C ATOM 1230 O CYS A 80 16.191 -10.988 -13.124 1.00 0.00 O ATOM 1231 CB CYS A 80 18.185 -9.117 -15.129 1.00 0.00 C ATOM 1232 SG CYS A 80 16.753 -8.026 -14.967 1.00 0.00 S ATOM 0 H CYS A 80 19.962 -10.824 -15.126 1.00 0.00 H new ATOM 0 HA CYS A 80 18.368 -9.748 -13.084 1.00 0.00 H new ATOM 0 HB2 CYS A 80 19.093 -8.516 -15.082 1.00 0.00 H new ATOM 0 HB3 CYS A 80 18.163 -9.584 -16.114 1.00 0.00 H new ATOM 0 HG CYS A 80 15.859 -8.593 -14.213 1.00 0.00 H new ATOM 1238 N VAL A 81 16.769 -11.788 -15.147 1.00 0.00 N ATOM 1239 CA VAL A 81 15.580 -12.621 -15.278 1.00 0.00 C ATOM 1240 C VAL A 81 15.508 -13.656 -14.161 1.00 0.00 C ATOM 1241 O VAL A 81 14.428 -13.969 -13.659 1.00 0.00 O ATOM 1242 CB VAL A 81 15.550 -13.346 -16.637 1.00 0.00 C ATOM 1243 CG1 VAL A 81 14.377 -14.313 -16.701 1.00 0.00 C ATOM 1244 CG2 VAL A 81 15.485 -12.340 -17.776 1.00 0.00 C ATOM 0 H VAL A 81 17.409 -11.838 -15.940 1.00 0.00 H new ATOM 0 HA VAL A 81 14.719 -11.956 -15.210 1.00 0.00 H new ATOM 0 HB VAL A 81 16.470 -13.921 -16.743 1.00 0.00 H new ATOM 0 HG11 VAL A 81 14.372 -14.816 -17.668 1.00 0.00 H new ATOM 0 HG12 VAL A 81 14.473 -15.054 -15.907 1.00 0.00 H new ATOM 0 HG13 VAL A 81 13.445 -13.763 -16.573 1.00 0.00 H new ATOM 0 HG21 VAL A 81 15.465 -12.870 -18.728 1.00 0.00 H new ATOM 0 HG22 VAL A 81 14.583 -11.736 -17.677 1.00 0.00 H new ATOM 0 HG23 VAL A 81 16.361 -11.692 -17.740 1.00 0.00 H new ATOM 1254 N ALA A 82 16.665 -14.184 -13.775 1.00 0.00 N ATOM 1255 CA ALA A 82 16.734 -15.182 -12.715 1.00 0.00 C ATOM 1256 C ALA A 82 16.730 -14.523 -11.339 1.00 0.00 C ATOM 1257 O ALA A 82 16.853 -15.197 -10.317 1.00 0.00 O ATOM 1258 CB ALA A 82 17.974 -16.047 -12.884 1.00 0.00 C ATOM 0 H ALA A 82 17.568 -13.937 -14.181 1.00 0.00 H new ATOM 0 HA ALA A 82 15.850 -15.815 -12.788 1.00 0.00 H new ATOM 0 HB1 ALA A 82 18.012 -16.788 -12.085 1.00 0.00 H new ATOM 0 HB2 ALA A 82 17.935 -16.554 -13.848 1.00 0.00 H new ATOM 0 HB3 ALA A 82 18.864 -15.419 -12.840 1.00 0.00 H new ATOM 1264 N SER A 83 16.588 -13.201 -11.322 1.00 0.00 N ATOM 1265 CA SER A 83 16.572 -12.450 -10.072 1.00 0.00 C ATOM 1266 C SER A 83 15.326 -11.575 -9.979 1.00 0.00 C ATOM 1267 O SER A 83 15.230 -10.703 -9.116 1.00 0.00 O ATOM 1268 CB SER A 83 17.828 -11.584 -9.957 1.00 0.00 C ATOM 1269 OG SER A 83 17.911 -10.972 -8.682 1.00 0.00 O ATOM 0 H SER A 83 16.482 -12.628 -12.159 1.00 0.00 H new ATOM 0 HA SER A 83 16.555 -13.164 -9.248 1.00 0.00 H new ATOM 0 HB2 SER A 83 18.713 -12.197 -10.128 1.00 0.00 H new ATOM 0 HB3 SER A 83 17.817 -10.817 -10.732 1.00 0.00 H new ATOM 0 HG SER A 83 17.012 -10.731 -8.376 1.00 0.00 H new ATOM 1275 N MET A 84 14.375 -11.815 -10.875 1.00 0.00 N ATOM 1276 CA MET A 84 13.133 -11.049 -10.895 1.00 0.00 C ATOM 1277 C MET A 84 11.926 -11.968 -10.741 1.00 0.00 C ATOM 1278 O MET A 84 12.035 -13.186 -10.891 1.00 0.00 O ATOM 1279 CB MET A 84 13.021 -10.252 -12.196 1.00 0.00 C ATOM 1280 CG MET A 84 12.555 -11.084 -13.379 1.00 0.00 C ATOM 1281 SD MET A 84 12.607 -10.171 -14.933 1.00 0.00 S ATOM 1282 CE MET A 84 11.837 -8.629 -14.446 1.00 0.00 C ATOM 0 H MET A 84 14.440 -12.533 -11.597 1.00 0.00 H new ATOM 0 HA MET A 84 13.149 -10.356 -10.054 1.00 0.00 H new ATOM 0 HB2 MET A 84 12.326 -9.425 -12.047 1.00 0.00 H new ATOM 0 HB3 MET A 84 13.992 -9.815 -12.430 1.00 0.00 H new ATOM 0 HG2 MET A 84 13.181 -11.972 -13.463 1.00 0.00 H new ATOM 0 HG3 MET A 84 11.537 -11.428 -13.198 1.00 0.00 H new ATOM 0 HE1 MET A 84 11.538 -8.075 -15.336 1.00 0.00 H new ATOM 0 HE2 MET A 84 10.958 -8.838 -13.836 1.00 0.00 H new ATOM 0 HE3 MET A 84 12.546 -8.034 -13.870 1.00 0.00 H new ATOM 1292 N THR A 85 10.772 -11.378 -10.442 1.00 0.00 N ATOM 1293 CA THR A 85 9.545 -12.144 -10.267 1.00 0.00 C ATOM 1294 C THR A 85 8.513 -11.778 -11.327 1.00 0.00 C ATOM 1295 O THR A 85 8.712 -10.846 -12.107 1.00 0.00 O ATOM 1296 CB THR A 85 8.934 -11.915 -8.872 1.00 0.00 C ATOM 1297 OG1 THR A 85 9.063 -10.538 -8.500 1.00 0.00 O ATOM 1298 CG2 THR A 85 9.616 -12.792 -7.832 1.00 0.00 C ATOM 0 H THR A 85 10.662 -10.372 -10.316 1.00 0.00 H new ATOM 0 HA THR A 85 9.812 -13.196 -10.371 1.00 0.00 H new ATOM 0 HB THR A 85 7.878 -12.182 -8.914 1.00 0.00 H new ATOM 0 HG1 THR A 85 8.670 -10.401 -7.613 1.00 0.00 H new ATOM 0 HG21 THR A 85 9.168 -12.613 -6.855 1.00 0.00 H new ATOM 0 HG22 THR A 85 9.491 -13.841 -8.102 1.00 0.00 H new ATOM 0 HG23 THR A 85 10.678 -12.551 -7.793 1.00 0.00 H new ATOM 1306 N LYS A 86 7.408 -12.516 -11.351 1.00 0.00 N ATOM 1307 CA LYS A 86 6.342 -12.268 -12.315 1.00 0.00 C ATOM 1308 C LYS A 86 5.694 -10.909 -12.072 1.00 0.00 C ATOM 1309 O LYS A 86 5.633 -10.434 -10.939 1.00 0.00 O ATOM 1310 CB LYS A 86 5.285 -13.371 -12.231 1.00 0.00 C ATOM 1311 CG LYS A 86 4.204 -13.260 -13.293 1.00 0.00 C ATOM 1312 CD LYS A 86 3.571 -14.609 -13.587 1.00 0.00 C ATOM 1313 CE LYS A 86 2.123 -14.460 -14.031 1.00 0.00 C ATOM 1314 NZ LYS A 86 1.236 -14.060 -12.904 1.00 0.00 N ATOM 0 H LYS A 86 7.227 -13.291 -10.713 1.00 0.00 H new ATOM 0 HA LYS A 86 6.781 -12.268 -13.313 1.00 0.00 H new ATOM 0 HB2 LYS A 86 5.775 -14.340 -12.323 1.00 0.00 H new ATOM 0 HB3 LYS A 86 4.819 -13.342 -11.246 1.00 0.00 H new ATOM 0 HG2 LYS A 86 3.436 -12.562 -12.960 1.00 0.00 H new ATOM 0 HG3 LYS A 86 4.632 -12.851 -14.208 1.00 0.00 H new ATOM 0 HD2 LYS A 86 4.141 -15.118 -14.365 1.00 0.00 H new ATOM 0 HD3 LYS A 86 3.617 -15.236 -12.696 1.00 0.00 H new ATOM 0 HE2 LYS A 86 2.061 -13.715 -14.824 1.00 0.00 H new ATOM 0 HE3 LYS A 86 1.773 -15.403 -14.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 0.356 -14.612 -12.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 1.719 -14.241 -12.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 1.013 -13.047 -12.981 1.00 0.00 H new ATOM 1328 N ASN A 87 5.212 -10.289 -13.144 1.00 0.00 N ATOM 1329 CA ASN A 87 4.567 -8.984 -13.046 1.00 0.00 C ATOM 1330 C ASN A 87 5.526 -7.946 -12.471 1.00 0.00 C ATOM 1331 O ASN A 87 5.100 -6.913 -11.954 1.00 0.00 O ATOM 1332 CB ASN A 87 3.313 -9.075 -12.174 1.00 0.00 C ATOM 1333 CG ASN A 87 2.069 -9.389 -12.982 1.00 0.00 C ATOM 1334 OD1 ASN A 87 1.636 -8.588 -13.812 1.00 0.00 O ATOM 1335 ND2 ASN A 87 1.487 -10.558 -12.743 1.00 0.00 N ATOM 0 H ASN A 87 5.256 -10.668 -14.090 1.00 0.00 H new ATOM 0 HA ASN A 87 4.280 -8.672 -14.050 1.00 0.00 H new ATOM 0 HB2 ASN A 87 3.455 -9.846 -11.417 1.00 0.00 H new ATOM 0 HB3 ASN A 87 3.172 -8.132 -11.646 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.646 -10.824 -13.256 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.880 -11.191 -12.046 1.00 0.00 H new ATOM 1342 N GLU A 88 6.821 -8.227 -12.566 1.00 0.00 N ATOM 1343 CA GLU A 88 7.840 -7.318 -12.054 1.00 0.00 C ATOM 1344 C GLU A 88 8.503 -6.548 -13.193 1.00 0.00 C ATOM 1345 O GLU A 88 8.811 -7.112 -14.243 1.00 0.00 O ATOM 1346 CB GLU A 88 8.897 -8.092 -11.264 1.00 0.00 C ATOM 1347 CG GLU A 88 9.851 -7.200 -10.488 1.00 0.00 C ATOM 1348 CD GLU A 88 11.184 -7.023 -11.188 1.00 0.00 C ATOM 1349 OE1 GLU A 88 11.182 -6.689 -12.392 1.00 0.00 O ATOM 1350 OE2 GLU A 88 12.229 -7.219 -10.534 1.00 0.00 O ATOM 0 H GLU A 88 7.190 -9.077 -12.993 1.00 0.00 H new ATOM 0 HA GLU A 88 7.353 -6.604 -11.390 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.397 -8.767 -10.569 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.471 -8.712 -11.952 1.00 0.00 H new ATOM 0 HG2 GLU A 88 9.390 -6.223 -10.340 1.00 0.00 H new ATOM 0 HG3 GLU A 88 10.018 -7.627 -9.499 1.00 0.00 H new ATOM 1357 N LYS A 89 8.720 -5.255 -12.978 1.00 0.00 N ATOM 1358 CA LYS A 89 9.347 -4.406 -13.984 1.00 0.00 C ATOM 1359 C LYS A 89 10.472 -3.577 -13.372 1.00 0.00 C ATOM 1360 O LYS A 89 10.225 -2.664 -12.583 1.00 0.00 O ATOM 1361 CB LYS A 89 8.307 -3.481 -14.620 1.00 0.00 C ATOM 1362 CG LYS A 89 8.907 -2.437 -15.545 1.00 0.00 C ATOM 1363 CD LYS A 89 7.832 -1.563 -16.172 1.00 0.00 C ATOM 1364 CE LYS A 89 8.419 -0.612 -17.203 1.00 0.00 C ATOM 1365 NZ LYS A 89 8.492 -1.235 -18.554 1.00 0.00 N ATOM 0 H LYS A 89 8.471 -4.772 -12.115 1.00 0.00 H new ATOM 0 HA LYS A 89 9.771 -5.051 -14.754 1.00 0.00 H new ATOM 0 HB2 LYS A 89 7.592 -4.083 -15.181 1.00 0.00 H new ATOM 0 HB3 LYS A 89 7.750 -2.977 -13.830 1.00 0.00 H new ATOM 0 HG2 LYS A 89 9.605 -1.813 -14.987 1.00 0.00 H new ATOM 0 HG3 LYS A 89 9.479 -2.931 -16.330 1.00 0.00 H new ATOM 0 HD2 LYS A 89 7.079 -2.193 -16.644 1.00 0.00 H new ATOM 0 HD3 LYS A 89 7.327 -0.991 -15.394 1.00 0.00 H new ATOM 0 HE2 LYS A 89 7.811 0.291 -17.252 1.00 0.00 H new ATOM 0 HE3 LYS A 89 9.417 -0.307 -16.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 9.285 -0.821 -19.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 8.639 -2.260 -18.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 7.604 -1.060 -19.066 1.00 0.00 H new ATOM 1379 N CYS A 90 11.706 -3.901 -13.741 1.00 0.00 N ATOM 1380 CA CYS A 90 12.870 -3.185 -13.228 1.00 0.00 C ATOM 1381 C CYS A 90 13.928 -3.019 -14.314 1.00 0.00 C ATOM 1382 O CYS A 90 13.937 -3.752 -15.303 1.00 0.00 O ATOM 1383 CB CYS A 90 13.464 -3.927 -12.030 1.00 0.00 C ATOM 1384 SG CYS A 90 14.075 -5.584 -12.417 1.00 0.00 S ATOM 0 H CYS A 90 11.927 -4.654 -14.393 1.00 0.00 H new ATOM 0 HA CYS A 90 12.545 -2.195 -12.908 1.00 0.00 H new ATOM 0 HB2 CYS A 90 14.283 -3.336 -11.620 1.00 0.00 H new ATOM 0 HB3 CYS A 90 12.705 -4.004 -11.251 1.00 0.00 H new ATOM 0 HG CYS A 90 13.513 -6.449 -11.627 1.00 0.00 H new ATOM 1390 N SER A 91 14.816 -2.049 -14.124 1.00 0.00 N ATOM 1391 CA SER A 91 15.875 -1.783 -15.090 1.00 0.00 C ATOM 1392 C SER A 91 17.246 -2.082 -14.490 1.00 0.00 C ATOM 1393 O SER A 91 17.510 -1.770 -13.329 1.00 0.00 O ATOM 1394 CB SER A 91 15.816 -0.326 -15.554 1.00 0.00 C ATOM 1395 OG SER A 91 16.887 -0.027 -16.433 1.00 0.00 O ATOM 0 H SER A 91 14.823 -1.434 -13.310 1.00 0.00 H new ATOM 0 HA SER A 91 15.723 -2.437 -15.948 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.867 -0.139 -16.056 1.00 0.00 H new ATOM 0 HB3 SER A 91 15.855 0.336 -14.689 1.00 0.00 H new ATOM 0 HG SER A 91 17.077 -0.807 -16.994 1.00 0.00 H new ATOM 1401 N VAL A 92 18.116 -2.689 -15.291 1.00 0.00 N ATOM 1402 CA VAL A 92 19.460 -3.030 -14.841 1.00 0.00 C ATOM 1403 C VAL A 92 20.517 -2.356 -15.708 1.00 0.00 C ATOM 1404 O VAL A 92 20.372 -2.269 -16.927 1.00 0.00 O ATOM 1405 CB VAL A 92 19.689 -4.553 -14.862 1.00 0.00 C ATOM 1406 CG1 VAL A 92 18.560 -5.274 -14.141 1.00 0.00 C ATOM 1407 CG2 VAL A 92 19.823 -5.051 -16.294 1.00 0.00 C ATOM 0 H VAL A 92 17.914 -2.955 -16.255 1.00 0.00 H new ATOM 0 HA VAL A 92 19.552 -2.670 -13.816 1.00 0.00 H new ATOM 0 HB VAL A 92 20.619 -4.770 -14.337 1.00 0.00 H new ATOM 0 HG11 VAL A 92 18.740 -6.349 -14.167 1.00 0.00 H new ATOM 0 HG12 VAL A 92 18.517 -4.938 -13.105 1.00 0.00 H new ATOM 0 HG13 VAL A 92 17.613 -5.053 -14.634 1.00 0.00 H new ATOM 0 HG21 VAL A 92 19.984 -6.129 -16.291 1.00 0.00 H new ATOM 0 HG22 VAL A 92 18.911 -4.822 -16.846 1.00 0.00 H new ATOM 0 HG23 VAL A 92 20.670 -4.559 -16.773 1.00 0.00 H new ATOM 1417 N ARG A 93 21.581 -1.879 -15.070 1.00 0.00 N ATOM 1418 CA ARG A 93 22.664 -1.211 -15.783 1.00 0.00 C ATOM 1419 C ARG A 93 23.849 -2.153 -15.977 1.00 0.00 C ATOM 1420 O ARG A 93 24.435 -2.639 -15.009 1.00 0.00 O ATOM 1421 CB ARG A 93 23.110 0.037 -15.020 1.00 0.00 C ATOM 1422 CG ARG A 93 24.385 0.661 -15.566 1.00 0.00 C ATOM 1423 CD ARG A 93 24.743 1.938 -14.822 1.00 0.00 C ATOM 1424 NE ARG A 93 23.882 3.054 -15.204 1.00 0.00 N ATOM 1425 CZ ARG A 93 24.040 4.292 -14.750 1.00 0.00 C ATOM 1426 NH1 ARG A 93 25.021 4.571 -13.903 1.00 0.00 N ATOM 1427 NH2 ARG A 93 23.216 5.255 -15.144 1.00 0.00 N ATOM 0 H ARG A 93 21.716 -1.943 -14.061 1.00 0.00 H new ATOM 0 HA ARG A 93 22.293 -0.916 -16.764 1.00 0.00 H new ATOM 0 HB2 ARG A 93 22.311 0.777 -15.052 1.00 0.00 H new ATOM 0 HB3 ARG A 93 23.262 -0.223 -13.972 1.00 0.00 H new ATOM 0 HG2 ARG A 93 25.205 -0.052 -15.482 1.00 0.00 H new ATOM 0 HG3 ARG A 93 24.259 0.879 -16.626 1.00 0.00 H new ATOM 0 HD2 ARG A 93 24.660 1.767 -13.749 1.00 0.00 H new ATOM 0 HD3 ARG A 93 25.782 2.196 -15.025 1.00 0.00 H new ATOM 0 HE ARG A 93 23.118 2.873 -15.855 1.00 0.00 H new ATOM 0 HH11 ARG A 93 25.657 3.834 -13.598 1.00 0.00 H new ATOM 0 HH12 ARG A 93 25.140 5.523 -13.556 1.00 0.00 H new ATOM 0 HH21 ARG A 93 22.460 5.045 -15.796 1.00 0.00 H new ATOM 0 HH22 ARG A 93 23.338 6.205 -14.795 1.00 0.00 H new ATOM 1441 N LEU A 94 24.196 -2.406 -17.234 1.00 0.00 N ATOM 1442 CA LEU A 94 25.311 -3.289 -17.557 1.00 0.00 C ATOM 1443 C LEU A 94 26.553 -2.485 -17.928 1.00 0.00 C ATOM 1444 O LEU A 94 26.487 -1.559 -18.736 1.00 0.00 O ATOM 1445 CB LEU A 94 24.932 -4.223 -18.708 1.00 0.00 C ATOM 1446 CG LEU A 94 23.802 -5.213 -18.424 1.00 0.00 C ATOM 1447 CD1 LEU A 94 23.510 -6.057 -19.655 1.00 0.00 C ATOM 1448 CD2 LEU A 94 24.156 -6.100 -17.239 1.00 0.00 C ATOM 0 H LEU A 94 23.721 -2.012 -18.046 1.00 0.00 H new ATOM 0 HA LEU A 94 25.537 -3.885 -16.673 1.00 0.00 H new ATOM 0 HB2 LEU A 94 24.647 -3.613 -19.565 1.00 0.00 H new ATOM 0 HB3 LEU A 94 25.818 -4.787 -18.998 1.00 0.00 H new ATOM 0 HG LEU A 94 22.904 -4.648 -18.175 1.00 0.00 H new ATOM 0 HD11 LEU A 94 22.703 -6.756 -19.434 1.00 0.00 H new ATOM 0 HD12 LEU A 94 23.213 -5.408 -20.479 1.00 0.00 H new ATOM 0 HD13 LEU A 94 24.405 -6.613 -19.936 1.00 0.00 H new ATOM 0 HD21 LEU A 94 23.341 -6.798 -17.051 1.00 0.00 H new ATOM 0 HD22 LEU A 94 25.067 -6.656 -17.460 1.00 0.00 H new ATOM 0 HD23 LEU A 94 24.315 -5.481 -16.356 1.00 0.00 H new ATOM 1460 N ASP A 95 27.685 -2.847 -17.333 1.00 0.00 N ATOM 1461 CA ASP A 95 28.944 -2.161 -17.603 1.00 0.00 C ATOM 1462 C ASP A 95 29.538 -2.619 -18.932 1.00 0.00 C ATOM 1463 O ASP A 95 28.880 -3.306 -19.713 1.00 0.00 O ATOM 1464 CB ASP A 95 29.940 -2.414 -16.471 1.00 0.00 C ATOM 1465 CG ASP A 95 30.791 -1.197 -16.166 1.00 0.00 C ATOM 1466 OD1 ASP A 95 30.238 -0.198 -15.662 1.00 0.00 O ATOM 1467 OD2 ASP A 95 32.010 -1.243 -16.434 1.00 0.00 O ATOM 0 H ASP A 95 27.757 -3.611 -16.661 1.00 0.00 H new ATOM 0 HA ASP A 95 28.741 -1.092 -17.665 1.00 0.00 H new ATOM 0 HB2 ASP A 95 29.397 -2.709 -15.573 1.00 0.00 H new ATOM 0 HB3 ASP A 95 30.588 -3.248 -16.740 1.00 0.00 H new ATOM 1472 N SER A 96 30.785 -2.233 -19.181 1.00 0.00 N ATOM 1473 CA SER A 96 31.466 -2.600 -20.417 1.00 0.00 C ATOM 1474 C SER A 96 32.204 -3.925 -20.258 1.00 0.00 C ATOM 1475 O SER A 96 33.407 -4.014 -20.508 1.00 0.00 O ATOM 1476 CB SER A 96 32.448 -1.502 -20.828 1.00 0.00 C ATOM 1477 OG SER A 96 33.351 -1.205 -19.777 1.00 0.00 O ATOM 0 H SER A 96 31.344 -1.666 -18.543 1.00 0.00 H new ATOM 0 HA SER A 96 30.713 -2.715 -21.197 1.00 0.00 H new ATOM 0 HB2 SER A 96 33.004 -1.819 -21.710 1.00 0.00 H new ATOM 0 HB3 SER A 96 31.898 -0.602 -21.104 1.00 0.00 H new ATOM 0 HG SER A 96 33.969 -0.501 -20.066 1.00 0.00 H new ATOM 1483 N LYS A 97 31.476 -4.955 -19.839 1.00 0.00 N ATOM 1484 CA LYS A 97 32.059 -6.277 -19.646 1.00 0.00 C ATOM 1485 C LYS A 97 31.014 -7.368 -19.855 1.00 0.00 C ATOM 1486 O LYS A 97 31.070 -8.117 -20.830 1.00 0.00 O ATOM 1487 CB LYS A 97 32.660 -6.393 -18.243 1.00 0.00 C ATOM 1488 CG LYS A 97 33.334 -7.728 -17.979 1.00 0.00 C ATOM 1489 CD LYS A 97 33.548 -7.959 -16.492 1.00 0.00 C ATOM 1490 CE LYS A 97 34.800 -7.255 -15.993 1.00 0.00 C ATOM 1491 NZ LYS A 97 34.563 -5.805 -15.754 1.00 0.00 N ATOM 0 H LYS A 97 30.480 -4.899 -19.626 1.00 0.00 H new ATOM 0 HA LYS A 97 32.850 -6.409 -20.385 1.00 0.00 H new ATOM 0 HB2 LYS A 97 33.388 -5.594 -18.101 1.00 0.00 H new ATOM 0 HB3 LYS A 97 31.872 -6.241 -17.505 1.00 0.00 H new ATOM 0 HG2 LYS A 97 32.724 -8.532 -18.389 1.00 0.00 H new ATOM 0 HG3 LYS A 97 34.293 -7.761 -18.495 1.00 0.00 H new ATOM 0 HD2 LYS A 97 32.681 -7.598 -15.938 1.00 0.00 H new ATOM 0 HD3 LYS A 97 33.628 -9.028 -16.297 1.00 0.00 H new ATOM 0 HE2 LYS A 97 35.137 -7.725 -15.069 1.00 0.00 H new ATOM 0 HE3 LYS A 97 35.600 -7.377 -16.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 35.083 -5.504 -14.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 34.894 -5.259 -16.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 33.546 -5.638 -15.614 1.00 0.00 H new ATOM 1505 N TYR A 98 30.060 -7.451 -18.934 1.00 0.00 N ATOM 1506 CA TYR A 98 29.003 -8.451 -19.017 1.00 0.00 C ATOM 1507 C TYR A 98 28.097 -8.189 -20.216 1.00 0.00 C ATOM 1508 O TYR A 98 27.452 -9.100 -20.733 1.00 0.00 O ATOM 1509 CB TYR A 98 28.175 -8.457 -17.731 1.00 0.00 C ATOM 1510 CG TYR A 98 28.952 -8.899 -16.512 1.00 0.00 C ATOM 1511 CD1 TYR A 98 29.821 -8.030 -15.863 1.00 0.00 C ATOM 1512 CD2 TYR A 98 28.817 -10.187 -16.008 1.00 0.00 C ATOM 1513 CE1 TYR A 98 30.533 -8.431 -14.750 1.00 0.00 C ATOM 1514 CE2 TYR A 98 29.525 -10.596 -14.894 1.00 0.00 C ATOM 1515 CZ TYR A 98 30.382 -9.714 -14.269 1.00 0.00 C ATOM 1516 OH TYR A 98 31.089 -10.117 -13.159 1.00 0.00 O ATOM 0 H TYR A 98 29.997 -6.838 -18.121 1.00 0.00 H new ATOM 0 HA TYR A 98 29.472 -9.427 -19.145 1.00 0.00 H new ATOM 0 HB2 TYR A 98 27.782 -7.455 -17.557 1.00 0.00 H new ATOM 0 HB3 TYR A 98 27.318 -9.117 -17.864 1.00 0.00 H new ATOM 0 HD1 TYR A 98 29.941 -7.024 -16.236 1.00 0.00 H new ATOM 0 HD2 TYR A 98 28.147 -10.880 -16.495 1.00 0.00 H new ATOM 0 HE1 TYR A 98 31.205 -7.743 -14.259 1.00 0.00 H new ATOM 0 HE2 TYR A 98 29.408 -11.600 -14.515 1.00 0.00 H new ATOM 0 HH TYR A 98 30.867 -11.048 -12.950 1.00 0.00 H new ATOM 1526 N GLY A 99 28.056 -6.934 -20.655 1.00 0.00 N ATOM 1527 CA GLY A 99 27.228 -6.573 -21.791 1.00 0.00 C ATOM 1528 C GLY A 99 27.798 -7.067 -23.105 1.00 0.00 C ATOM 1529 O GLY A 99 27.804 -8.269 -23.374 1.00 0.00 O ATOM 0 H GLY A 99 28.581 -6.162 -20.244 1.00 0.00 H new ATOM 0 HA2 GLY A 99 26.229 -6.986 -21.654 1.00 0.00 H new ATOM 0 HA3 GLY A 99 27.122 -5.489 -21.829 1.00 0.00 H new ATOM 1533 N TYR A 100 28.278 -6.140 -23.926 1.00 0.00 N ATOM 1534 CA TYR A 100 28.850 -6.488 -25.222 1.00 0.00 C ATOM 1535 C TYR A 100 30.368 -6.611 -25.132 1.00 0.00 C ATOM 1536 O TYR A 100 30.987 -7.358 -25.888 1.00 0.00 O ATOM 1537 CB TYR A 100 28.473 -5.438 -26.268 1.00 0.00 C ATOM 1538 CG TYR A 100 26.982 -5.232 -26.410 1.00 0.00 C ATOM 1539 CD1 TYR A 100 26.137 -6.299 -26.691 1.00 0.00 C ATOM 1540 CD2 TYR A 100 26.418 -3.971 -26.264 1.00 0.00 C ATOM 1541 CE1 TYR A 100 24.774 -6.116 -26.822 1.00 0.00 C ATOM 1542 CE2 TYR A 100 25.056 -3.778 -26.392 1.00 0.00 C ATOM 1543 CZ TYR A 100 24.238 -4.854 -26.671 1.00 0.00 C ATOM 1544 OH TYR A 100 22.881 -4.666 -26.801 1.00 0.00 O ATOM 0 H TYR A 100 28.283 -5.142 -23.718 1.00 0.00 H new ATOM 0 HA TYR A 100 28.443 -7.453 -25.523 1.00 0.00 H new ATOM 0 HB2 TYR A 100 28.939 -4.489 -26.002 1.00 0.00 H new ATOM 0 HB3 TYR A 100 28.884 -5.735 -27.233 1.00 0.00 H new ATOM 0 HD1 TYR A 100 26.553 -7.289 -26.809 1.00 0.00 H new ATOM 0 HD2 TYR A 100 27.055 -3.127 -26.047 1.00 0.00 H new ATOM 0 HE1 TYR A 100 24.132 -6.956 -27.041 1.00 0.00 H new ATOM 0 HE2 TYR A 100 24.634 -2.791 -26.274 1.00 0.00 H new ATOM 0 HH TYR A 100 22.667 -3.719 -26.664 1.00 0.00 H new ATOM 1642 N ILE A 109 27.370 2.140 -29.856 1.00 0.00 N ATOM 1643 CA ILE A 109 27.701 1.647 -28.525 1.00 0.00 C ATOM 1644 C ILE A 109 29.157 1.200 -28.452 1.00 0.00 C ATOM 1645 O ILE A 109 29.494 0.048 -28.728 1.00 0.00 O ATOM 1646 CB ILE A 109 26.794 0.470 -28.119 1.00 0.00 C ATOM 1647 CG1 ILE A 109 25.325 0.822 -28.365 1.00 0.00 C ATOM 1648 CG2 ILE A 109 27.020 0.108 -26.659 1.00 0.00 C ATOM 1649 CD1 ILE A 109 24.378 -0.332 -28.119 1.00 0.00 C ATOM 0 HA ILE A 109 27.541 2.474 -27.833 1.00 0.00 H new ATOM 0 HB ILE A 109 27.048 -0.395 -28.732 1.00 0.00 H new ATOM 0 HG12 ILE A 109 25.046 1.654 -27.719 1.00 0.00 H new ATOM 0 HG13 ILE A 109 25.209 1.164 -29.393 1.00 0.00 H new ATOM 0 HG21 ILE A 109 26.372 -0.725 -26.386 1.00 0.00 H new ATOM 0 HG22 ILE A 109 28.061 -0.179 -26.512 1.00 0.00 H new ATOM 0 HG23 ILE A 109 26.788 0.968 -26.031 1.00 0.00 H new ATOM 0 HD11 ILE A 109 23.355 -0.011 -28.313 1.00 0.00 H new ATOM 0 HD12 ILE A 109 24.631 -1.158 -28.784 1.00 0.00 H new ATOM 0 HD13 ILE A 109 24.465 -0.660 -27.083 1.00 0.00 H new ATOM 1661 N PRO A 110 30.043 2.131 -28.068 1.00 0.00 N ATOM 1662 CA PRO A 110 31.478 1.856 -27.947 1.00 0.00 C ATOM 1663 C PRO A 110 31.794 0.932 -26.775 1.00 0.00 C ATOM 1664 O PRO A 110 31.052 0.880 -25.795 1.00 0.00 O ATOM 1665 CB PRO A 110 32.086 3.241 -27.714 1.00 0.00 C ATOM 1666 CG PRO A 110 30.984 4.043 -27.112 1.00 0.00 C ATOM 1667 CD PRO A 110 29.712 3.524 -27.723 1.00 0.00 C ATOM 0 HA PRO A 110 31.871 1.345 -28.826 1.00 0.00 H new ATOM 0 HB2 PRO A 110 32.947 3.188 -27.047 1.00 0.00 H new ATOM 0 HB3 PRO A 110 32.433 3.683 -28.648 1.00 0.00 H new ATOM 0 HG2 PRO A 110 30.969 3.933 -26.028 1.00 0.00 H new ATOM 0 HG3 PRO A 110 31.114 5.104 -27.323 1.00 0.00 H new ATOM 0 HD2 PRO A 110 28.879 3.577 -27.022 1.00 0.00 H new ATOM 0 HD3 PRO A 110 29.425 4.099 -28.604 1.00 0.00 H new ATOM 1675 N GLY A 111 32.901 0.204 -26.884 1.00 0.00 N ATOM 1676 CA GLY A 111 33.296 -0.708 -25.826 1.00 0.00 C ATOM 1677 C GLY A 111 33.256 -0.059 -24.456 1.00 0.00 C ATOM 1678 O GLY A 111 32.574 -0.542 -23.553 1.00 0.00 O ATOM 0 H GLY A 111 33.531 0.229 -27.686 1.00 0.00 H new ATOM 0 HA2 GLY A 111 32.636 -1.575 -25.833 1.00 0.00 H new ATOM 0 HA3 GLY A 111 34.304 -1.073 -26.023 1.00 0.00 H new ATOM 1682 N ASN A 112 33.990 1.038 -24.301 1.00 0.00 N ATOM 1683 CA ASN A 112 34.038 1.753 -23.031 1.00 0.00 C ATOM 1684 C ASN A 112 32.819 2.655 -22.868 1.00 0.00 C ATOM 1685 O ASN A 112 32.917 3.876 -22.988 1.00 0.00 O ATOM 1686 CB ASN A 112 35.319 2.585 -22.938 1.00 0.00 C ATOM 1687 CG ASN A 112 36.554 1.789 -23.312 1.00 0.00 C ATOM 1688 OD1 ASN A 112 36.547 0.558 -23.280 1.00 0.00 O ATOM 1689 ND2 ASN A 112 37.623 2.490 -23.671 1.00 0.00 N ATOM 0 H ASN A 112 34.560 1.451 -25.039 1.00 0.00 H new ATOM 0 HA ASN A 112 34.032 1.016 -22.228 1.00 0.00 H new ATOM 0 HB2 ASN A 112 35.235 3.451 -23.595 1.00 0.00 H new ATOM 0 HB3 ASN A 112 35.429 2.965 -21.922 1.00 0.00 H new ATOM 0 HD21 ASN A 112 38.483 2.009 -23.935 1.00 0.00 H new ATOM 0 HD22 ASN A 112 37.584 3.509 -23.683 1.00 0.00 H new ATOM 1696 N SER A 113 31.670 2.045 -22.595 1.00 0.00 N ATOM 1697 CA SER A 113 30.430 2.793 -22.419 1.00 0.00 C ATOM 1698 C SER A 113 29.381 1.944 -21.707 1.00 0.00 C ATOM 1699 O SER A 113 29.080 0.827 -22.126 1.00 0.00 O ATOM 1700 CB SER A 113 29.893 3.257 -23.774 1.00 0.00 C ATOM 1701 OG SER A 113 28.528 3.626 -23.683 1.00 0.00 O ATOM 0 H SER A 113 31.572 1.035 -22.491 1.00 0.00 H new ATOM 0 HA SER A 113 30.645 3.666 -21.803 1.00 0.00 H new ATOM 0 HB2 SER A 113 30.479 4.104 -24.130 1.00 0.00 H new ATOM 0 HB3 SER A 113 30.009 2.459 -24.507 1.00 0.00 H new ATOM 0 HG SER A 113 28.209 3.920 -24.562 1.00 0.00 H new ATOM 1707 N VAL A 114 28.826 2.485 -20.626 1.00 0.00 N ATOM 1708 CA VAL A 114 27.809 1.779 -19.856 1.00 0.00 C ATOM 1709 C VAL A 114 26.451 1.850 -20.544 1.00 0.00 C ATOM 1710 O VAL A 114 26.102 2.863 -21.151 1.00 0.00 O ATOM 1711 CB VAL A 114 27.682 2.357 -18.433 1.00 0.00 C ATOM 1712 CG1 VAL A 114 26.579 1.646 -17.665 1.00 0.00 C ATOM 1713 CG2 VAL A 114 29.009 2.252 -17.696 1.00 0.00 C ATOM 0 H VAL A 114 29.064 3.409 -20.265 1.00 0.00 H new ATOM 0 HA VAL A 114 28.126 0.738 -19.791 1.00 0.00 H new ATOM 0 HB VAL A 114 27.417 3.412 -18.509 1.00 0.00 H new ATOM 0 HG11 VAL A 114 26.504 2.067 -16.663 1.00 0.00 H new ATOM 0 HG12 VAL A 114 25.630 1.777 -18.186 1.00 0.00 H new ATOM 0 HG13 VAL A 114 26.811 0.583 -17.595 1.00 0.00 H new ATOM 0 HG21 VAL A 114 28.902 2.665 -16.693 1.00 0.00 H new ATOM 0 HG22 VAL A 114 29.306 1.205 -17.628 1.00 0.00 H new ATOM 0 HG23 VAL A 114 29.772 2.811 -18.238 1.00 0.00 H new ATOM 1723 N LEU A 115 25.687 0.767 -20.445 1.00 0.00 N ATOM 1724 CA LEU A 115 24.365 0.706 -21.058 1.00 0.00 C ATOM 1725 C LEU A 115 23.317 0.248 -20.048 1.00 0.00 C ATOM 1726 O LEU A 115 23.627 -0.480 -19.104 1.00 0.00 O ATOM 1727 CB LEU A 115 24.381 -0.243 -22.258 1.00 0.00 C ATOM 1728 CG LEU A 115 25.682 -0.289 -23.060 1.00 0.00 C ATOM 1729 CD1 LEU A 115 25.668 -1.457 -24.034 1.00 0.00 C ATOM 1730 CD2 LEU A 115 25.899 1.023 -23.800 1.00 0.00 C ATOM 0 H LEU A 115 25.960 -0.080 -19.946 1.00 0.00 H new ATOM 0 HA LEU A 115 24.103 1.708 -21.398 1.00 0.00 H new ATOM 0 HB2 LEU A 115 24.161 -1.250 -21.903 1.00 0.00 H new ATOM 0 HB3 LEU A 115 23.572 0.041 -22.931 1.00 0.00 H new ATOM 0 HG LEU A 115 26.510 -0.432 -22.365 1.00 0.00 H new ATOM 0 HD11 LEU A 115 26.602 -1.473 -24.596 1.00 0.00 H new ATOM 0 HD12 LEU A 115 25.560 -2.390 -23.481 1.00 0.00 H new ATOM 0 HD13 LEU A 115 24.832 -1.345 -24.724 1.00 0.00 H new ATOM 0 HD21 LEU A 115 26.830 0.972 -24.365 1.00 0.00 H new ATOM 0 HD22 LEU A 115 25.068 1.197 -24.484 1.00 0.00 H new ATOM 0 HD23 LEU A 115 25.955 1.841 -23.082 1.00 0.00 H new ATOM 1742 N ILE A 116 22.077 0.678 -20.253 1.00 0.00 N ATOM 1743 CA ILE A 116 20.984 0.310 -19.363 1.00 0.00 C ATOM 1744 C ILE A 116 19.840 -0.340 -20.135 1.00 0.00 C ATOM 1745 O ILE A 116 19.471 0.115 -21.217 1.00 0.00 O ATOM 1746 CB ILE A 116 20.443 1.533 -18.599 1.00 0.00 C ATOM 1747 CG1 ILE A 116 21.536 2.132 -17.712 1.00 0.00 C ATOM 1748 CG2 ILE A 116 19.230 1.144 -17.767 1.00 0.00 C ATOM 1749 CD1 ILE A 116 22.453 3.086 -18.444 1.00 0.00 C ATOM 0 H ILE A 116 21.804 1.282 -21.028 1.00 0.00 H new ATOM 0 HA ILE A 116 21.389 -0.406 -18.647 1.00 0.00 H new ATOM 0 HB ILE A 116 20.135 2.288 -19.322 1.00 0.00 H new ATOM 0 HG12 ILE A 116 21.069 2.657 -16.879 1.00 0.00 H new ATOM 0 HG13 ILE A 116 22.131 1.324 -17.286 1.00 0.00 H new ATOM 0 HG21 ILE A 116 18.859 2.019 -17.233 1.00 0.00 H new ATOM 0 HG22 ILE A 116 18.448 0.760 -18.422 1.00 0.00 H new ATOM 0 HG23 ILE A 116 19.513 0.374 -17.049 1.00 0.00 H new ATOM 0 HD11 ILE A 116 23.203 3.472 -17.753 1.00 0.00 H new ATOM 0 HD12 ILE A 116 22.948 2.560 -19.261 1.00 0.00 H new ATOM 0 HD13 ILE A 116 21.870 3.914 -18.846 1.00 0.00 H new ATOM 1761 N PHE A 117 19.282 -1.406 -19.570 1.00 0.00 N ATOM 1762 CA PHE A 117 18.180 -2.118 -20.205 1.00 0.00 C ATOM 1763 C PHE A 117 17.048 -2.364 -19.211 1.00 0.00 C ATOM 1764 O PHE A 117 17.276 -2.846 -18.102 1.00 0.00 O ATOM 1765 CB PHE A 117 18.668 -3.449 -20.779 1.00 0.00 C ATOM 1766 CG PHE A 117 19.192 -3.341 -22.183 1.00 0.00 C ATOM 1767 CD1 PHE A 117 20.320 -2.585 -22.458 1.00 0.00 C ATOM 1768 CD2 PHE A 117 18.556 -3.995 -23.226 1.00 0.00 C ATOM 1769 CE1 PHE A 117 20.803 -2.483 -23.749 1.00 0.00 C ATOM 1770 CE2 PHE A 117 19.035 -3.896 -24.519 1.00 0.00 C ATOM 1771 CZ PHE A 117 20.161 -3.140 -24.780 1.00 0.00 C ATOM 0 H PHE A 117 19.575 -1.795 -18.674 1.00 0.00 H new ATOM 0 HA PHE A 117 17.799 -1.498 -21.017 1.00 0.00 H new ATOM 0 HB2 PHE A 117 19.453 -3.846 -20.136 1.00 0.00 H new ATOM 0 HB3 PHE A 117 17.847 -4.166 -20.760 1.00 0.00 H new ATOM 0 HD1 PHE A 117 20.827 -2.070 -21.655 1.00 0.00 H new ATOM 0 HD2 PHE A 117 17.676 -4.589 -23.027 1.00 0.00 H new ATOM 0 HE1 PHE A 117 21.682 -1.890 -23.951 1.00 0.00 H new ATOM 0 HE2 PHE A 117 18.530 -4.409 -25.324 1.00 0.00 H new ATOM 0 HZ PHE A 117 20.539 -3.063 -25.789 1.00 0.00 H new ATOM 1781 N GLU A 118 15.827 -2.030 -19.618 1.00 0.00 N ATOM 1782 CA GLU A 118 14.660 -2.213 -18.764 1.00 0.00 C ATOM 1783 C GLU A 118 13.983 -3.551 -19.047 1.00 0.00 C ATOM 1784 O GLU A 118 13.433 -3.763 -20.128 1.00 0.00 O ATOM 1785 CB GLU A 118 13.664 -1.071 -18.971 1.00 0.00 C ATOM 1786 CG GLU A 118 12.447 -1.152 -18.065 1.00 0.00 C ATOM 1787 CD GLU A 118 11.526 0.043 -18.216 1.00 0.00 C ATOM 1788 OE1 GLU A 118 10.930 0.200 -19.302 1.00 0.00 O ATOM 1789 OE2 GLU A 118 11.402 0.821 -17.247 1.00 0.00 O ATOM 0 H GLU A 118 15.621 -1.631 -20.534 1.00 0.00 H new ATOM 0 HA GLU A 118 14.996 -2.208 -17.727 1.00 0.00 H new ATOM 0 HB2 GLU A 118 14.172 -0.122 -18.799 1.00 0.00 H new ATOM 0 HB3 GLU A 118 13.334 -1.072 -20.010 1.00 0.00 H new ATOM 0 HG2 GLU A 118 11.893 -2.064 -18.288 1.00 0.00 H new ATOM 0 HG3 GLU A 118 12.775 -1.224 -17.028 1.00 0.00 H new ATOM 1796 N ILE A 119 14.029 -4.449 -18.069 1.00 0.00 N ATOM 1797 CA ILE A 119 13.420 -5.766 -18.213 1.00 0.00 C ATOM 1798 C ILE A 119 12.183 -5.899 -17.331 1.00 0.00 C ATOM 1799 O ILE A 119 12.144 -5.374 -16.218 1.00 0.00 O ATOM 1800 CB ILE A 119 14.414 -6.888 -17.857 1.00 0.00 C ATOM 1801 CG1 ILE A 119 15.647 -6.812 -18.760 1.00 0.00 C ATOM 1802 CG2 ILE A 119 13.743 -8.248 -17.981 1.00 0.00 C ATOM 1803 CD1 ILE A 119 16.766 -7.736 -18.333 1.00 0.00 C ATOM 0 H ILE A 119 14.481 -4.289 -17.169 1.00 0.00 H new ATOM 0 HA ILE A 119 13.130 -5.867 -19.259 1.00 0.00 H new ATOM 0 HB ILE A 119 14.735 -6.755 -16.824 1.00 0.00 H new ATOM 0 HG12 ILE A 119 15.355 -7.056 -19.781 1.00 0.00 H new ATOM 0 HG13 ILE A 119 16.017 -5.787 -18.771 1.00 0.00 H new ATOM 0 HG21 ILE A 119 14.458 -9.031 -17.726 1.00 0.00 H new ATOM 0 HG22 ILE A 119 12.893 -8.298 -17.301 1.00 0.00 H new ATOM 0 HG23 ILE A 119 13.397 -8.391 -19.005 1.00 0.00 H new ATOM 0 HD11 ILE A 119 17.607 -7.629 -19.018 1.00 0.00 H new ATOM 0 HD12 ILE A 119 17.085 -7.478 -17.323 1.00 0.00 H new ATOM 0 HD13 ILE A 119 16.413 -8.767 -18.350 1.00 0.00 H new ATOM 1815 N GLU A 120 11.176 -6.605 -17.835 1.00 0.00 N ATOM 1816 CA GLU A 120 9.939 -6.808 -17.092 1.00 0.00 C ATOM 1817 C GLU A 120 9.359 -8.193 -17.366 1.00 0.00 C ATOM 1818 O GLU A 120 9.123 -8.562 -18.517 1.00 0.00 O ATOM 1819 CB GLU A 120 8.915 -5.732 -17.460 1.00 0.00 C ATOM 1820 CG GLU A 120 7.523 -6.003 -16.912 1.00 0.00 C ATOM 1821 CD GLU A 120 6.518 -4.946 -17.324 1.00 0.00 C ATOM 1822 OE1 GLU A 120 6.807 -4.192 -18.277 1.00 0.00 O ATOM 1823 OE2 GLU A 120 5.443 -4.871 -16.694 1.00 0.00 O ATOM 0 H GLU A 120 11.193 -7.046 -18.755 1.00 0.00 H new ATOM 0 HA GLU A 120 10.168 -6.734 -16.029 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.262 -4.769 -17.086 1.00 0.00 H new ATOM 0 HB3 GLU A 120 8.860 -5.651 -18.546 1.00 0.00 H new ATOM 0 HG2 GLU A 120 7.183 -6.978 -17.261 1.00 0.00 H new ATOM 0 HG3 GLU A 120 7.568 -6.052 -15.824 1.00 0.00 H new ATOM 1830 N LEU A 121 9.133 -8.954 -16.302 1.00 0.00 N ATOM 1831 CA LEU A 121 8.582 -10.299 -16.427 1.00 0.00 C ATOM 1832 C LEU A 121 7.075 -10.251 -16.656 1.00 0.00 C ATOM 1833 O LEU A 121 6.310 -9.907 -15.754 1.00 0.00 O ATOM 1834 CB LEU A 121 8.892 -11.118 -15.172 1.00 0.00 C ATOM 1835 CG LEU A 121 8.551 -12.606 -15.240 1.00 0.00 C ATOM 1836 CD1 LEU A 121 9.147 -13.234 -16.491 1.00 0.00 C ATOM 1837 CD2 LEU A 121 9.045 -13.325 -13.993 1.00 0.00 C ATOM 0 H LEU A 121 9.323 -8.663 -15.343 1.00 0.00 H new ATOM 0 HA LEU A 121 9.047 -10.776 -17.289 1.00 0.00 H new ATOM 0 HB2 LEU A 121 9.955 -11.019 -14.952 1.00 0.00 H new ATOM 0 HB3 LEU A 121 8.350 -10.680 -14.334 1.00 0.00 H new ATOM 0 HG LEU A 121 7.467 -12.708 -15.288 1.00 0.00 H new ATOM 0 HD11 LEU A 121 8.894 -14.294 -16.522 1.00 0.00 H new ATOM 0 HD12 LEU A 121 8.744 -12.738 -17.374 1.00 0.00 H new ATOM 0 HD13 LEU A 121 10.231 -13.120 -16.474 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.793 -14.383 -14.059 1.00 0.00 H new ATOM 0 HD22 LEU A 121 10.126 -13.214 -13.913 1.00 0.00 H new ATOM 0 HD23 LEU A 121 8.570 -12.894 -13.112 1.00 0.00 H new ATOM 1849 N ILE A 122 6.655 -10.599 -17.868 1.00 0.00 N ATOM 1850 CA ILE A 122 5.239 -10.598 -18.214 1.00 0.00 C ATOM 1851 C ILE A 122 4.573 -11.910 -17.811 1.00 0.00 C ATOM 1852 O ILE A 122 3.610 -11.919 -17.045 1.00 0.00 O ATOM 1853 CB ILE A 122 5.029 -10.372 -19.723 1.00 0.00 C ATOM 1854 CG1 ILE A 122 5.733 -9.090 -20.172 1.00 0.00 C ATOM 1855 CG2 ILE A 122 3.543 -10.307 -20.047 1.00 0.00 C ATOM 1856 CD1 ILE A 122 5.719 -8.885 -21.670 1.00 0.00 C ATOM 0 H ILE A 122 7.275 -10.885 -18.626 1.00 0.00 H new ATOM 0 HA ILE A 122 4.780 -9.776 -17.664 1.00 0.00 H new ATOM 0 HB ILE A 122 5.464 -11.212 -20.265 1.00 0.00 H new ATOM 0 HG12 ILE A 122 5.255 -8.236 -19.692 1.00 0.00 H new ATOM 0 HG13 ILE A 122 6.766 -9.113 -19.826 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.411 -10.147 -21.117 1.00 0.00 H new ATOM 0 HG22 ILE A 122 3.066 -11.244 -19.759 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.087 -9.484 -19.498 1.00 0.00 H new ATOM 0 HD11 ILE A 122 6.236 -7.957 -21.915 1.00 0.00 H new ATOM 0 HD12 ILE A 122 6.223 -9.720 -22.156 1.00 0.00 H new ATOM 0 HD13 ILE A 122 4.688 -8.830 -22.020 1.00 0.00 H new ATOM 1868 N SER A 123 5.095 -13.016 -18.331 1.00 0.00 N ATOM 1869 CA SER A 123 4.551 -14.334 -18.027 1.00 0.00 C ATOM 1870 C SER A 123 5.417 -15.433 -18.634 1.00 0.00 C ATOM 1871 O SER A 123 6.409 -15.156 -19.309 1.00 0.00 O ATOM 1872 CB SER A 123 3.118 -14.451 -18.551 1.00 0.00 C ATOM 1873 OG SER A 123 3.094 -14.485 -19.967 1.00 0.00 O ATOM 0 H SER A 123 5.894 -13.026 -18.965 1.00 0.00 H new ATOM 0 HA SER A 123 4.546 -14.456 -16.944 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.655 -15.355 -18.155 1.00 0.00 H new ATOM 0 HB3 SER A 123 2.527 -13.607 -18.194 1.00 0.00 H new ATOM 0 HG SER A 123 2.167 -14.562 -20.277 1.00 0.00 H new ATOM 1879 N PHE A 124 5.035 -16.682 -18.389 1.00 0.00 N ATOM 1880 CA PHE A 124 5.777 -17.825 -18.910 1.00 0.00 C ATOM 1881 C PHE A 124 4.857 -19.026 -19.108 1.00 0.00 C ATOM 1882 O PHE A 124 3.736 -19.053 -18.600 1.00 0.00 O ATOM 1883 CB PHE A 124 6.919 -18.194 -17.961 1.00 0.00 C ATOM 1884 CG PHE A 124 6.474 -18.411 -16.543 1.00 0.00 C ATOM 1885 CD1 PHE A 124 6.404 -17.351 -15.655 1.00 0.00 C ATOM 1886 CD2 PHE A 124 6.125 -19.677 -16.098 1.00 0.00 C ATOM 1887 CE1 PHE A 124 5.994 -17.547 -14.349 1.00 0.00 C ATOM 1888 CE2 PHE A 124 5.714 -19.879 -14.794 1.00 0.00 C ATOM 1889 CZ PHE A 124 5.650 -18.813 -13.918 1.00 0.00 C ATOM 0 H PHE A 124 4.216 -16.929 -17.833 1.00 0.00 H new ATOM 0 HA PHE A 124 6.194 -17.545 -19.878 1.00 0.00 H new ATOM 0 HB2 PHE A 124 7.404 -19.100 -18.324 1.00 0.00 H new ATOM 0 HB3 PHE A 124 7.668 -17.402 -17.981 1.00 0.00 H new ATOM 0 HD1 PHE A 124 6.673 -16.359 -15.986 1.00 0.00 H new ATOM 0 HD2 PHE A 124 6.175 -20.515 -16.778 1.00 0.00 H new ATOM 0 HE1 PHE A 124 5.943 -16.711 -13.667 1.00 0.00 H new ATOM 0 HE2 PHE A 124 5.443 -20.870 -14.460 1.00 0.00 H new ATOM 0 HZ PHE A 124 5.332 -18.969 -12.898 1.00 0.00 H new ATOM 1899 N ARG A 125 5.339 -20.016 -19.852 1.00 0.00 N ATOM 1900 CA ARG A 125 4.560 -21.219 -20.120 1.00 0.00 C ATOM 1901 C ARG A 125 5.392 -22.248 -20.881 1.00 0.00 C ATOM 1902 O ARG A 125 6.547 -21.995 -21.223 1.00 0.00 O ATOM 1903 CB ARG A 125 3.303 -20.872 -20.920 1.00 0.00 C ATOM 1904 CG ARG A 125 3.550 -20.737 -22.413 1.00 0.00 C ATOM 1905 CD ARG A 125 4.538 -19.621 -22.716 1.00 0.00 C ATOM 1906 NE ARG A 125 4.398 -19.121 -24.081 1.00 0.00 N ATOM 1907 CZ ARG A 125 3.380 -18.370 -24.487 1.00 0.00 C ATOM 1908 NH1 ARG A 125 2.419 -18.034 -23.637 1.00 0.00 N ATOM 1909 NH2 ARG A 125 3.322 -17.953 -25.745 1.00 0.00 N ATOM 0 H ARG A 125 6.265 -20.009 -20.280 1.00 0.00 H new ATOM 0 HA ARG A 125 4.266 -21.651 -19.163 1.00 0.00 H new ATOM 0 HB2 ARG A 125 2.552 -21.644 -20.753 1.00 0.00 H new ATOM 0 HB3 ARG A 125 2.889 -19.937 -20.543 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.932 -21.679 -22.806 1.00 0.00 H new ATOM 0 HG3 ARG A 125 2.607 -20.538 -22.922 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.387 -18.802 -22.013 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.554 -19.986 -22.566 1.00 0.00 H new ATOM 0 HE ARG A 125 5.121 -19.361 -24.759 1.00 0.00 H new ATOM 0 HH11 ARG A 125 2.460 -18.352 -22.669 1.00 0.00 H new ATOM 0 HH12 ARG A 125 1.639 -17.457 -23.951 1.00 0.00 H new ATOM 0 HH21 ARG A 125 4.059 -18.209 -26.402 1.00 0.00 H new ATOM 0 HH22 ARG A 125 2.540 -17.376 -26.056 1.00 0.00 H new ATOM 1923 N GLU A 126 4.797 -23.407 -21.141 1.00 0.00 N ATOM 1924 CA GLU A 126 5.484 -24.474 -21.860 1.00 0.00 C ATOM 1925 C GLU A 126 5.044 -24.517 -23.320 1.00 0.00 C ATOM 1926 O GLU A 126 3.960 -24.049 -23.666 1.00 0.00 O ATOM 1927 CB GLU A 126 5.214 -25.824 -21.194 1.00 0.00 C ATOM 1928 CG GLU A 126 3.736 -26.139 -21.033 1.00 0.00 C ATOM 1929 CD GLU A 126 3.478 -27.610 -20.769 1.00 0.00 C ATOM 1930 OE1 GLU A 126 3.431 -28.388 -21.744 1.00 0.00 O ATOM 1931 OE2 GLU A 126 3.324 -27.982 -19.587 1.00 0.00 O ATOM 0 H GLU A 126 3.841 -23.632 -20.865 1.00 0.00 H new ATOM 0 HA GLU A 126 6.554 -24.269 -21.827 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.682 -26.611 -21.785 1.00 0.00 H new ATOM 0 HB3 GLU A 126 5.689 -25.837 -20.213 1.00 0.00 H new ATOM 0 HG2 GLU A 126 3.330 -25.550 -20.211 1.00 0.00 H new ATOM 0 HG3 GLU A 126 3.204 -25.837 -21.935 1.00 0.00 H new