USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 666 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: B 82 SER OG : rot -43:sc= 1.23 USER MOD Set 1.2: B 83 ASN : amide:sc= 0.99 K(o=2.2,f=0.29) USER MOD Set 2.1: B 78 ASN : amide:sc= 0.901 K(o=3.2,f=-4.8) USER MOD Set 2.2: B 81 LYS NZ :NH3+ 138:sc= 2.34 (180deg=-0.123) USER MOD Set 3.1: B 73 GLN : amide:sc= 2.61 K(o=3,f=-6.2!) USER MOD Set 3.2: B 75 GLN : amide:sc= 0.393 K(o=3,f=-9.8!) USER MOD Set 4.1: B 66 SER OG : rot -77:sc= 1.16 USER MOD Set 4.2: B 71 GLN : amide:sc= 1.11 K(o=2.3,f=1) USER MOD Set 5.1: A 18 SER OG : rot -55:sc= 2.05 USER MOD Set 5.2: B 93 GLN : amide:sc= 0.966 K(o=3,f=1) USER MOD Single : A 12 GLN :FLIP amide:sc=-0.00872 F(o=-2.1!,f=-0.0087) USER MOD Single : A 14 HIS : no HD1:sc= -1.01 K(o=-1,f=-6!) USER MOD Single : A 15 THR OG1 : rot 90:sc= 1.24 USER MOD Single : A 19 ASN : amide:sc= 1.18 K(o=1.2,f=-2.6) USER MOD Single : A 20 THR OG1 : rot -55:sc= 1.13 USER MOD Single : A 23 THR OG1 : rot 99:sc= 1.22 USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot 180:sc= -0.1 USER MOD Single : B 55 SER OG : rot 180:sc= 0.0462 USER MOD Single : B 58 GLN : amide:sc= 1.07 K(o=1.1,f=-0.096) USER MOD Single : B 63 THR OG1 : rot 77:sc= 1.29 USER MOD Single : B 65 LYS NZ :NH3+ 172:sc= 0.788 (180deg=0.704) USER MOD Single : B 68 SER OG : rot 136:sc= 1.2 USER MOD Single : B 69 SER OG : rot 37:sc= 0.893 USER MOD Single : B 72 GLN : amide:sc= 1.2 K(o=1.2,f=-0.14) USER MOD Single : B 74 GLN : amide:sc= 0.202 K(o=0.2,f=-3.3!) USER MOD Single : B 85 GLN : amide:sc= 1.07 K(o=1.1,f=-0.26) USER MOD Single : B 87 MET CE :methyl -111:sc= -0.999 (180deg=-2.61) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 THR OG1 : rot 60:sc= 0.428 USER MOD Single : B 97 LYS NZ :NH3+ 179:sc= 1.2 (180deg=1.19) USER MOD Single : B 98 TYR OH : rot 105:sc= 1.09 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 6 12.626 -10.314 -3.232 1.00 10.00 N ATOM 66 CA GLU A 6 11.267 -9.963 -3.661 1.00 10.00 C ATOM 67 C GLU A 6 10.291 -9.951 -2.494 1.00 10.00 C ATOM 68 O GLU A 6 9.610 -8.944 -2.312 1.00 10.00 O ATOM 69 CB GLU A 6 10.752 -10.912 -4.756 1.00 10.00 C ATOM 70 CG GLU A 6 9.355 -10.548 -5.308 1.00 10.00 C ATOM 71 CD GLU A 6 8.687 -11.683 -6.102 1.00 10.00 C ATOM 72 OE1 GLU A 6 9.363 -12.550 -6.710 1.00 10.00 O ATOM 73 OE2 GLU A 6 7.438 -11.717 -6.139 1.00 10.00 O ATOM 0 HA GLU A 6 11.327 -8.956 -4.073 1.00 10.00 H new ATOM 0 HB2 GLU A 6 11.465 -10.918 -5.580 1.00 10.00 H new ATOM 0 HB3 GLU A 6 10.719 -11.925 -4.356 1.00 10.00 H new ATOM 0 HG2 GLU A 6 8.708 -10.269 -4.477 1.00 10.00 H new ATOM 0 HG3 GLU A 6 9.445 -9.672 -5.950 1.00 10.00 H new ATOM 80 N ARG A 7 10.197 -11.050 -1.735 1.00 10.00 N ATOM 81 CA ARG A 7 9.130 -11.132 -0.739 1.00 10.00 C ATOM 82 C ARG A 7 9.356 -10.107 0.365 1.00 10.00 C ATOM 83 O ARG A 7 8.432 -9.365 0.711 1.00 10.00 O ATOM 84 CB ARG A 7 8.936 -12.570 -0.216 1.00 10.00 C ATOM 85 CG ARG A 7 7.932 -12.643 0.938 1.00 10.00 C ATOM 86 CD ARG A 7 6.551 -12.186 0.447 1.00 10.00 C ATOM 87 NE ARG A 7 5.632 -11.916 1.549 1.00 10.00 N ATOM 88 CZ ARG A 7 4.323 -12.011 1.490 1.00 10.00 C ATOM 89 NH1 ARG A 7 3.769 -12.847 0.637 1.00 10.00 N ATOM 90 NH2 ARG A 7 3.581 -11.242 2.242 1.00 10.00 N ATOM 0 H ARG A 7 10.817 -11.858 -1.787 1.00 10.00 H new ATOM 0 HA ARG A 7 8.185 -10.877 -1.219 1.00 10.00 H new ATOM 0 HB2 ARG A 7 8.594 -13.207 -1.032 1.00 10.00 H new ATOM 0 HB3 ARG A 7 9.896 -12.965 0.116 1.00 10.00 H new ATOM 0 HG2 ARG A 7 7.875 -13.662 1.320 1.00 10.00 H new ATOM 0 HG3 ARG A 7 8.263 -12.012 1.763 1.00 10.00 H new ATOM 0 HD2 ARG A 7 6.663 -11.287 -0.159 1.00 10.00 H new ATOM 0 HD3 ARG A 7 6.125 -12.954 -0.198 1.00 10.00 H new ATOM 0 HE ARG A 7 6.040 -11.630 2.439 1.00 10.00 H new ATOM 0 HH11 ARG A 7 4.356 -13.416 0.027 1.00 10.00 H new ATOM 0 HH12 ARG A 7 2.753 -12.925 0.586 1.00 10.00 H new ATOM 0 HH21 ARG A 7 4.018 -10.570 2.873 1.00 10.00 H new ATOM 0 HH22 ARG A 7 2.564 -11.314 2.198 1.00 10.00 H new ATOM 104 N ALA A 8 10.572 -10.045 0.894 1.00 10.00 N ATOM 105 CA ALA A 8 10.939 -9.078 1.909 1.00 10.00 C ATOM 106 C ALA A 8 10.809 -7.629 1.423 1.00 10.00 C ATOM 107 O ALA A 8 10.308 -6.795 2.185 1.00 10.00 O ATOM 108 CB ALA A 8 12.363 -9.398 2.390 1.00 10.00 C ATOM 0 H ALA A 8 11.332 -10.670 0.626 1.00 10.00 H new ATOM 0 HA ALA A 8 10.242 -9.160 2.743 1.00 10.00 H new ATOM 0 HB1 ALA A 8 12.658 -8.680 3.155 1.00 10.00 H new ATOM 0 HB2 ALA A 8 12.388 -10.405 2.807 1.00 10.00 H new ATOM 0 HB3 ALA A 8 13.054 -9.336 1.549 1.00 10.00 H new ATOM 114 N LEU A 9 11.202 -7.302 0.170 1.00 10.00 N ATOM 115 CA LEU A 9 11.091 -5.920 -0.295 1.00 10.00 C ATOM 116 C LEU A 9 9.640 -5.585 -0.656 1.00 10.00 C ATOM 117 O LEU A 9 9.204 -4.479 -0.361 1.00 10.00 O ATOM 118 CB LEU A 9 12.218 -5.519 -1.274 1.00 10.00 C ATOM 119 CG LEU A 9 11.978 -5.145 -2.748 1.00 10.00 C ATOM 120 CD1 LEU A 9 11.639 -6.360 -3.610 1.00 10.00 C ATOM 121 CD2 LEU A 9 11.005 -3.995 -2.978 1.00 10.00 C ATOM 0 H LEU A 9 11.585 -7.959 -0.510 1.00 10.00 H new ATOM 0 HA LEU A 9 11.301 -5.228 0.521 1.00 10.00 H new ATOM 0 HB2 LEU A 9 12.727 -4.668 -0.822 1.00 10.00 H new ATOM 0 HB3 LEU A 9 12.926 -6.347 -1.280 1.00 10.00 H new ATOM 0 HG LEU A 9 12.941 -4.757 -3.079 1.00 10.00 H new ATOM 0 HD11 LEU A 9 11.479 -6.042 -4.640 1.00 10.00 H new ATOM 0 HD12 LEU A 9 12.463 -7.073 -3.574 1.00 10.00 H new ATOM 0 HD13 LEU A 9 10.733 -6.833 -3.232 1.00 10.00 H new ATOM 0 HD21 LEU A 9 10.906 -3.811 -4.048 1.00 10.00 H new ATOM 0 HD22 LEU A 9 10.031 -4.254 -2.562 1.00 10.00 H new ATOM 0 HD23 LEU A 9 11.381 -3.097 -2.489 1.00 10.00 H new ATOM 133 N LEU A 10 8.846 -6.539 -1.154 1.00 10.00 N ATOM 134 CA LEU A 10 7.398 -6.366 -1.318 1.00 10.00 C ATOM 135 C LEU A 10 6.716 -6.121 0.034 1.00 10.00 C ATOM 136 O LEU A 10 5.937 -5.175 0.149 1.00 10.00 O ATOM 137 CB LEU A 10 6.847 -7.606 -2.052 1.00 10.00 C ATOM 138 CG LEU A 10 5.314 -7.677 -2.217 1.00 10.00 C ATOM 139 CD1 LEU A 10 4.742 -6.479 -2.975 1.00 10.00 C ATOM 140 CD2 LEU A 10 4.968 -8.956 -2.996 1.00 10.00 C ATOM 0 H LEU A 10 9.188 -7.452 -1.454 1.00 10.00 H new ATOM 0 HA LEU A 10 7.183 -5.482 -1.918 1.00 10.00 H new ATOM 0 HB2 LEU A 10 7.300 -7.647 -3.043 1.00 10.00 H new ATOM 0 HB3 LEU A 10 7.175 -8.496 -1.515 1.00 10.00 H new ATOM 0 HG LEU A 10 4.875 -7.674 -1.219 1.00 10.00 H new ATOM 0 HD11 LEU A 10 3.660 -6.585 -3.060 1.00 10.00 H new ATOM 0 HD12 LEU A 10 4.976 -5.561 -2.435 1.00 10.00 H new ATOM 0 HD13 LEU A 10 5.181 -6.435 -3.972 1.00 10.00 H new ATOM 0 HD21 LEU A 10 3.888 -9.024 -3.123 1.00 10.00 H new ATOM 0 HD22 LEU A 10 5.447 -8.927 -3.975 1.00 10.00 H new ATOM 0 HD23 LEU A 10 5.324 -9.826 -2.444 1.00 10.00 H new ATOM 152 N ASP A 11 7.030 -6.936 1.048 1.00 10.00 N ATOM 153 CA ASP A 11 6.546 -6.711 2.405 1.00 10.00 C ATOM 154 C ASP A 11 6.946 -5.336 2.962 1.00 10.00 C ATOM 155 O ASP A 11 6.071 -4.577 3.406 1.00 10.00 O ATOM 156 CB ASP A 11 6.927 -7.874 3.335 1.00 10.00 C ATOM 157 CG ASP A 11 6.010 -9.101 3.209 1.00 10.00 C ATOM 158 OD1 ASP A 11 4.794 -8.960 2.949 1.00 10.00 O ATOM 159 OD2 ASP A 11 6.507 -10.232 3.416 1.00 10.00 O ATOM 0 H ASP A 11 7.621 -7.761 0.948 1.00 10.00 H new ATOM 0 HA ASP A 11 5.457 -6.690 2.357 1.00 10.00 H new ATOM 0 HB2 ASP A 11 7.952 -8.176 3.121 1.00 10.00 H new ATOM 0 HB3 ASP A 11 6.907 -7.522 4.367 1.00 10.00 H new ATOM 164 N GLN A 12 8.232 -4.971 2.923 1.00 10.00 N ATOM 165 CA GLN A 12 8.644 -3.673 3.457 1.00 10.00 C ATOM 166 C GLN A 12 8.121 -2.493 2.635 1.00 10.00 C ATOM 167 O GLN A 12 7.907 -1.419 3.208 1.00 10.00 O ATOM 168 CB GLN A 12 10.158 -3.627 3.715 1.00 10.00 C ATOM 169 CG GLN A 12 11.047 -3.207 2.524 1.00 10.00 C ATOM 170 CD GLN A 12 11.501 -1.741 2.561 1.00 10.00 C ATOM 171 OE1 GLN A 12 10.652 -0.767 2.850 1.00 10.00 O flip ATOM 172 NE2 GLN A 12 12.648 -1.425 2.302 1.00 10.00 N flip ATOM 0 H GLN A 12 8.986 -5.540 2.538 1.00 10.00 H new ATOM 0 HA GLN A 12 8.165 -3.559 4.429 1.00 10.00 H new ATOM 0 HB2 GLN A 12 10.343 -2.938 4.539 1.00 10.00 H new ATOM 0 HB3 GLN A 12 10.478 -4.614 4.048 1.00 10.00 H new ATOM 0 HG2 GLN A 12 11.929 -3.848 2.500 1.00 10.00 H new ATOM 0 HG3 GLN A 12 10.500 -3.383 1.598 1.00 10.00 H new ATOM 0 HE21 GLN A 12 13.336 -2.143 2.074 1.00 10.00 H new ATOM 0 HE22 GLN A 12 12.921 -0.442 2.313 1.00 10.00 H new ATOM 181 N LEU A 13 7.903 -2.645 1.322 1.00 10.00 N ATOM 182 CA LEU A 13 7.291 -1.596 0.513 1.00 10.00 C ATOM 183 C LEU A 13 5.799 -1.498 0.788 1.00 10.00 C ATOM 184 O LEU A 13 5.338 -0.374 0.976 1.00 10.00 O ATOM 185 CB LEU A 13 7.588 -1.764 -0.991 1.00 10.00 C ATOM 186 CG LEU A 13 8.834 -1.001 -1.510 1.00 10.00 C ATOM 187 CD1 LEU A 13 8.565 0.509 -1.608 1.00 10.00 C ATOM 188 CD2 LEU A 13 10.077 -1.176 -0.639 1.00 10.00 C ATOM 0 H LEU A 13 8.144 -3.488 0.801 1.00 10.00 H new ATOM 0 HA LEU A 13 7.748 -0.652 0.810 1.00 10.00 H new ATOM 0 HB2 LEU A 13 7.718 -2.825 -1.202 1.00 10.00 H new ATOM 0 HB3 LEU A 13 6.717 -1.431 -1.556 1.00 10.00 H new ATOM 0 HG LEU A 13 9.026 -1.439 -2.490 1.00 10.00 H new ATOM 0 HD11 LEU A 13 9.458 1.015 -1.975 1.00 10.00 H new ATOM 0 HD12 LEU A 13 7.739 0.687 -2.296 1.00 10.00 H new ATOM 0 HD13 LEU A 13 8.307 0.897 -0.623 1.00 10.00 H new ATOM 0 HD21 LEU A 13 10.905 -0.612 -1.069 1.00 10.00 H new ATOM 0 HD22 LEU A 13 9.871 -0.809 0.367 1.00 10.00 H new ATOM 0 HD23 LEU A 13 10.343 -2.232 -0.593 1.00 10.00 H new ATOM 200 N HIS A 14 5.020 -2.595 0.837 1.00 10.00 N ATOM 201 CA HIS A 14 3.580 -2.460 1.138 1.00 10.00 C ATOM 202 C HIS A 14 3.352 -1.991 2.580 1.00 10.00 C ATOM 203 O HIS A 14 2.412 -1.228 2.821 1.00 10.00 O ATOM 204 CB HIS A 14 2.744 -3.688 0.741 1.00 10.00 C ATOM 205 CG HIS A 14 2.746 -4.859 1.690 1.00 10.00 C ATOM 206 ND1 HIS A 14 2.231 -4.842 2.988 1.00 10.00 N ATOM 207 CD2 HIS A 14 3.213 -6.108 1.412 1.00 10.00 C ATOM 208 CE1 HIS A 14 2.459 -6.068 3.480 1.00 10.00 C ATOM 209 NE2 HIS A 14 3.052 -6.851 2.558 1.00 10.00 N ATOM 0 H HIS A 14 5.345 -3.549 0.679 1.00 10.00 H new ATOM 0 HA HIS A 14 3.198 -1.670 0.491 1.00 10.00 H new ATOM 0 HB2 HIS A 14 1.712 -3.365 0.606 1.00 10.00 H new ATOM 0 HB3 HIS A 14 3.098 -4.038 -0.229 1.00 10.00 H new ATOM 0 HD2 HIS A 14 3.628 -6.448 0.475 1.00 10.00 H new ATOM 0 HE1 HIS A 14 2.202 -6.385 4.480 1.00 10.00 H new ATOM 0 HE2 HIS A 14 3.332 -7.823 2.687 1.00 10.00 H new ATOM 217 N THR A 15 4.276 -2.316 3.500 1.00 10.00 N ATOM 218 CA THR A 15 4.315 -1.754 4.861 1.00 10.00 C ATOM 219 C THR A 15 4.482 -0.243 4.786 1.00 10.00 C ATOM 220 O THR A 15 3.610 0.465 5.276 1.00 10.00 O ATOM 221 CB THR A 15 5.451 -2.337 5.722 1.00 10.00 C ATOM 222 OG1 THR A 15 5.394 -3.745 5.740 1.00 10.00 O ATOM 223 CG2 THR A 15 5.348 -1.889 7.183 1.00 10.00 C ATOM 0 H THR A 15 5.025 -2.984 3.318 1.00 10.00 H new ATOM 0 HA THR A 15 3.372 -2.021 5.337 1.00 10.00 H new ATOM 0 HB THR A 15 6.378 -1.977 5.275 1.00 10.00 H new ATOM 0 HG1 THR A 15 5.933 -4.104 5.004 1.00 10.00 H new ATOM 0 HG21 THR A 15 6.168 -2.323 7.755 1.00 10.00 H new ATOM 0 HG22 THR A 15 5.404 -0.802 7.235 1.00 10.00 H new ATOM 0 HG23 THR A 15 4.398 -2.223 7.600 1.00 10.00 H new ATOM 231 N LEU A 16 5.543 0.253 4.142 1.00 10.00 N ATOM 232 CA LEU A 16 5.725 1.680 3.899 1.00 10.00 C ATOM 233 C LEU A 16 4.479 2.306 3.280 1.00 10.00 C ATOM 234 O LEU A 16 3.954 3.289 3.801 1.00 10.00 O ATOM 235 CB LEU A 16 6.959 1.883 3.009 1.00 10.00 C ATOM 236 CG LEU A 16 7.187 3.366 2.647 1.00 10.00 C ATOM 237 CD1 LEU A 16 8.205 4.010 3.578 1.00 10.00 C ATOM 238 CD2 LEU A 16 7.578 3.523 1.174 1.00 10.00 C ATOM 0 H LEU A 16 6.298 -0.327 3.776 1.00 10.00 H new ATOM 0 HA LEU A 16 5.885 2.186 4.851 1.00 10.00 H new ATOM 0 HB2 LEU A 16 7.840 1.497 3.521 1.00 10.00 H new ATOM 0 HB3 LEU A 16 6.843 1.302 2.094 1.00 10.00 H new ATOM 0 HG LEU A 16 6.244 3.895 2.787 1.00 10.00 H new ATOM 0 HD11 LEU A 16 8.344 5.054 3.298 1.00 10.00 H new ATOM 0 HD12 LEU A 16 7.845 3.955 4.605 1.00 10.00 H new ATOM 0 HD13 LEU A 16 9.156 3.483 3.498 1.00 10.00 H new ATOM 0 HD21 LEU A 16 7.732 4.578 0.949 1.00 10.00 H new ATOM 0 HD22 LEU A 16 8.499 2.973 0.981 1.00 10.00 H new ATOM 0 HD23 LEU A 16 6.782 3.130 0.542 1.00 10.00 H new ATOM 250 N LEU A 17 4.007 1.772 2.158 1.00 10.00 N ATOM 251 CA LEU A 17 2.931 2.325 1.354 1.00 10.00 C ATOM 252 C LEU A 17 1.568 2.271 2.064 1.00 10.00 C ATOM 253 O LEU A 17 0.637 2.921 1.608 1.00 10.00 O ATOM 254 CB LEU A 17 2.981 1.597 -0.015 1.00 10.00 C ATOM 255 CG LEU A 17 2.776 2.439 -1.290 1.00 10.00 C ATOM 256 CD1 LEU A 17 3.560 3.738 -1.313 1.00 10.00 C ATOM 257 CD2 LEU A 17 3.200 1.648 -2.520 1.00 10.00 C ATOM 0 H LEU A 17 4.382 0.906 1.771 1.00 10.00 H new ATOM 0 HA LEU A 17 3.068 3.394 1.194 1.00 10.00 H new ATOM 0 HB2 LEU A 17 3.948 1.101 -0.094 1.00 10.00 H new ATOM 0 HB3 LEU A 17 2.222 0.815 -0.005 1.00 10.00 H new ATOM 0 HG LEU A 17 1.713 2.679 -1.295 1.00 10.00 H new ATOM 0 HD11 LEU A 17 3.358 4.268 -2.244 1.00 10.00 H new ATOM 0 HD12 LEU A 17 3.260 4.359 -0.469 1.00 10.00 H new ATOM 0 HD13 LEU A 17 4.626 3.521 -1.243 1.00 10.00 H new ATOM 0 HD21 LEU A 17 3.050 2.255 -3.413 1.00 10.00 H new ATOM 0 HD22 LEU A 17 4.254 1.381 -2.436 1.00 10.00 H new ATOM 0 HD23 LEU A 17 2.601 0.740 -2.593 1.00 10.00 H new ATOM 269 N SER A 18 1.436 1.565 3.198 1.00 10.00 N ATOM 270 CA SER A 18 0.158 1.409 3.915 1.00 10.00 C ATOM 271 C SER A 18 0.206 1.624 5.439 1.00 10.00 C ATOM 272 O SER A 18 -0.839 1.488 6.079 1.00 10.00 O ATOM 273 CB SER A 18 -0.460 0.049 3.577 1.00 10.00 C ATOM 274 OG SER A 18 0.300 -0.979 4.176 1.00 10.00 O ATOM 0 H SER A 18 2.216 1.084 3.646 1.00 10.00 H new ATOM 0 HA SER A 18 -0.470 2.224 3.556 1.00 10.00 H new ATOM 0 HB2 SER A 18 -1.490 0.008 3.932 1.00 10.00 H new ATOM 0 HB3 SER A 18 -0.490 -0.090 2.496 1.00 10.00 H new ATOM 0 HG SER A 18 1.236 -0.900 3.896 1.00 10.00 H new ATOM 280 N ASN A 19 1.350 2.060 5.963 1.00 10.00 N ATOM 281 CA ASN A 19 1.903 2.201 7.329 1.00 10.00 C ATOM 282 C ASN A 19 1.019 2.682 8.508 1.00 10.00 C ATOM 283 O ASN A 19 1.546 2.794 9.615 1.00 10.00 O ATOM 284 CB ASN A 19 3.085 3.182 7.171 1.00 10.00 C ATOM 285 CG ASN A 19 2.596 4.587 6.788 1.00 10.00 C ATOM 286 OD1 ASN A 19 1.930 5.286 7.534 1.00 10.00 O ATOM 287 ND2 ASN A 19 2.854 5.006 5.571 1.00 10.00 N ATOM 0 H ASN A 19 2.057 2.391 5.307 1.00 10.00 H new ATOM 0 HA ASN A 19 2.117 1.180 7.646 1.00 10.00 H new ATOM 0 HB2 ASN A 19 3.646 3.232 8.104 1.00 10.00 H new ATOM 0 HB3 ASN A 19 3.768 2.811 6.407 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.499 5.909 5.256 1.00 10.00 H new ATOM 0 HD22 ASN A 19 3.410 4.429 4.940 1.00 10.00 H new ATOM 294 N THR A 20 -0.269 2.956 8.288 1.00 10.00 N ATOM 295 CA THR A 20 -1.380 3.359 9.187 1.00 10.00 C ATOM 296 C THR A 20 -1.921 4.752 8.856 1.00 10.00 C ATOM 297 O THR A 20 -3.104 5.001 9.104 1.00 10.00 O ATOM 298 CB THR A 20 -1.161 3.259 10.717 1.00 10.00 C ATOM 299 OG1 THR A 20 -0.058 4.007 11.152 1.00 10.00 O ATOM 300 CG2 THR A 20 -1.036 1.807 11.212 1.00 10.00 C ATOM 0 H THR A 20 -0.619 2.893 7.332 1.00 10.00 H new ATOM 0 HA THR A 20 -2.108 2.580 8.961 1.00 10.00 H new ATOM 0 HB THR A 20 -2.061 3.687 11.158 1.00 10.00 H new ATOM 0 HG1 THR A 20 0.740 3.733 10.654 1.00 10.00 H new ATOM 0 HG21 THR A 20 -0.884 1.802 12.291 1.00 10.00 H new ATOM 0 HG22 THR A 20 -1.948 1.261 10.972 1.00 10.00 H new ATOM 0 HG23 THR A 20 -0.187 1.328 10.724 1.00 10.00 H new ATOM 308 N ASP A 21 -1.137 5.655 8.252 1.00 10.00 N ATOM 309 CA ASP A 21 -1.653 6.975 7.869 1.00 10.00 C ATOM 310 C ASP A 21 -2.791 6.899 6.831 1.00 10.00 C ATOM 311 O ASP A 21 -3.006 5.910 6.123 1.00 10.00 O ATOM 312 CB ASP A 21 -0.494 7.889 7.394 1.00 10.00 C ATOM 313 CG ASP A 21 -0.987 9.283 6.958 1.00 10.00 C ATOM 314 OD1 ASP A 21 -1.761 9.907 7.723 1.00 10.00 O ATOM 315 OD2 ASP A 21 -0.733 9.676 5.794 1.00 10.00 O ATOM 0 H ASP A 21 -0.156 5.499 8.021 1.00 10.00 H new ATOM 0 HA ASP A 21 -2.100 7.419 8.758 1.00 10.00 H new ATOM 0 HB2 ASP A 21 0.232 7.999 8.199 1.00 10.00 H new ATOM 0 HB3 ASP A 21 0.023 7.412 6.561 1.00 10.00 H new ATOM 320 N ALA A 22 -3.541 7.991 6.748 1.00 10.00 N ATOM 321 CA ALA A 22 -4.538 8.299 5.726 1.00 10.00 C ATOM 322 C ALA A 22 -4.514 9.786 5.295 1.00 10.00 C ATOM 323 O ALA A 22 -5.126 10.121 4.292 1.00 10.00 O ATOM 324 CB ALA A 22 -5.922 7.880 6.227 1.00 10.00 C ATOM 0 H ALA A 22 -3.465 8.737 7.440 1.00 10.00 H new ATOM 0 HA ALA A 22 -4.291 7.730 4.830 1.00 10.00 H new ATOM 0 HB1 ALA A 22 -6.669 8.108 5.467 1.00 10.00 H new ATOM 0 HB2 ALA A 22 -5.927 6.809 6.430 1.00 10.00 H new ATOM 0 HB3 ALA A 22 -6.158 8.424 7.142 1.00 10.00 H new ATOM 330 N THR A 23 -3.779 10.668 5.980 1.00 10.00 N ATOM 331 CA THR A 23 -3.823 12.123 5.838 1.00 10.00 C ATOM 332 C THR A 23 -3.686 12.644 4.411 1.00 10.00 C ATOM 333 O THR A 23 -4.422 13.551 4.020 1.00 10.00 O ATOM 334 CB THR A 23 -2.728 12.751 6.729 1.00 10.00 C ATOM 335 OG1 THR A 23 -2.757 12.205 8.031 1.00 10.00 O ATOM 336 CG2 THR A 23 -2.866 14.265 6.877 1.00 10.00 C ATOM 0 H THR A 23 -3.104 10.369 6.684 1.00 10.00 H new ATOM 0 HA THR A 23 -4.823 12.421 6.154 1.00 10.00 H new ATOM 0 HB THR A 23 -1.790 12.524 6.223 1.00 10.00 H new ATOM 0 HG1 THR A 23 -2.065 11.516 8.112 1.00 10.00 H new ATOM 0 HG21 THR A 23 -2.066 14.643 7.514 1.00 10.00 H new ATOM 0 HG22 THR A 23 -2.800 14.734 5.895 1.00 10.00 H new ATOM 0 HG23 THR A 23 -3.830 14.500 7.327 1.00 10.00 H new ATOM 344 N GLY A 24 -2.752 12.069 3.652 1.00 10.00 N ATOM 345 CA GLY A 24 -2.626 12.285 2.210 1.00 10.00 C ATOM 346 C GLY A 24 -2.746 10.991 1.392 1.00 10.00 C ATOM 347 O GLY A 24 -3.073 11.056 0.215 1.00 10.00 O ATOM 0 H GLY A 24 -2.051 11.430 4.028 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -3.396 12.985 1.885 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -1.663 12.751 2.002 1.00 10.00 H new ATOM 351 N LEU A 25 -2.564 9.821 2.023 1.00 10.00 N ATOM 352 CA LEU A 25 -2.864 8.537 1.396 1.00 10.00 C ATOM 353 C LEU A 25 -4.337 8.402 0.997 1.00 10.00 C ATOM 354 O LEU A 25 -4.606 7.729 0.008 1.00 10.00 O ATOM 355 CB LEU A 25 -2.437 7.406 2.344 1.00 10.00 C ATOM 356 CG LEU A 25 -0.924 7.139 2.286 1.00 10.00 C ATOM 357 CD1 LEU A 25 -0.444 6.515 3.596 1.00 10.00 C ATOM 358 CD2 LEU A 25 -0.597 6.151 1.168 1.00 10.00 C ATOM 0 H LEU A 25 -2.207 9.744 2.975 1.00 10.00 H new ATOM 0 HA LEU A 25 -2.299 8.472 0.466 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -2.720 7.664 3.365 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -2.975 6.494 2.085 1.00 10.00 H new ATOM 0 HG LEU A 25 -0.430 8.094 2.109 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.629 6.332 3.540 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -0.653 7.196 4.421 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -0.965 5.572 3.762 1.00 10.00 H new ATOM 0 HD21 LEU A 25 0.478 5.974 1.142 1.00 10.00 H new ATOM 0 HD22 LEU A 25 -1.115 5.210 1.351 1.00 10.00 H new ATOM 0 HD23 LEU A 25 -0.920 6.563 0.212 1.00 10.00 H new ATOM 370 N GLU A 26 -5.252 9.098 1.684 1.00 10.00 N ATOM 371 CA GLU A 26 -6.670 9.242 1.337 1.00 10.00 C ATOM 372 C GLU A 26 -6.920 9.436 -0.157 1.00 10.00 C ATOM 373 O GLU A 26 -7.690 8.712 -0.775 1.00 10.00 O ATOM 374 CB GLU A 26 -7.231 10.427 2.146 1.00 10.00 C ATOM 375 CG GLU A 26 -8.638 10.879 1.748 1.00 10.00 C ATOM 376 CD GLU A 26 -8.762 12.108 0.825 1.00 10.00 C ATOM 377 OE1 GLU A 26 -7.765 12.762 0.440 1.00 10.00 O ATOM 378 OE2 GLU A 26 -9.913 12.388 0.422 1.00 10.00 O ATOM 0 H GLU A 26 -5.011 9.600 2.538 1.00 10.00 H new ATOM 0 HA GLU A 26 -7.181 8.313 1.589 1.00 10.00 H new ATOM 0 HB2 GLU A 26 -7.239 10.154 3.201 1.00 10.00 H new ATOM 0 HB3 GLU A 26 -6.551 11.273 2.040 1.00 10.00 H new ATOM 0 HG2 GLU A 26 -9.134 10.041 1.258 1.00 10.00 H new ATOM 0 HG3 GLU A 26 -9.194 11.088 2.662 1.00 10.00 H new ATOM 385 N GLU A 27 -6.258 10.436 -0.726 1.00 10.00 N ATOM 386 CA GLU A 27 -6.336 10.832 -2.123 1.00 10.00 C ATOM 387 C GLU A 27 -5.850 9.735 -3.075 1.00 10.00 C ATOM 388 O GLU A 27 -6.533 9.452 -4.071 1.00 10.00 O ATOM 389 CB GLU A 27 -5.570 12.147 -2.201 1.00 10.00 C ATOM 390 CG GLU A 27 -5.387 12.721 -3.614 1.00 10.00 C ATOM 391 CD GLU A 27 -5.485 14.252 -3.580 1.00 10.00 C ATOM 392 OE1 GLU A 27 -4.457 14.918 -3.323 1.00 10.00 O ATOM 393 OE2 GLU A 27 -6.635 14.734 -3.745 1.00 10.00 O ATOM 0 H GLU A 27 -5.617 11.024 -0.193 1.00 10.00 H new ATOM 0 HA GLU A 27 -7.362 10.979 -2.461 1.00 10.00 H new ATOM 0 HB2 GLU A 27 -6.089 12.887 -1.591 1.00 10.00 H new ATOM 0 HB3 GLU A 27 -4.586 12.001 -1.756 1.00 10.00 H new ATOM 0 HG2 GLU A 27 -4.419 12.420 -4.014 1.00 10.00 H new ATOM 0 HG3 GLU A 27 -6.148 12.315 -4.281 1.00 10.00 H new ATOM 400 N ILE A 28 -4.742 9.054 -2.742 1.00 10.00 N ATOM 401 CA ILE A 28 -4.302 7.851 -3.469 1.00 10.00 C ATOM 402 C ILE A 28 -5.327 6.717 -3.324 1.00 10.00 C ATOM 403 O ILE A 28 -5.631 6.030 -4.300 1.00 10.00 O ATOM 404 CB ILE A 28 -2.905 7.365 -2.998 1.00 10.00 C ATOM 405 CG1 ILE A 28 -1.869 8.488 -2.776 1.00 10.00 C ATOM 406 CG2 ILE A 28 -2.332 6.326 -3.974 1.00 10.00 C ATOM 407 CD1 ILE A 28 -1.477 9.236 -4.051 1.00 10.00 C ATOM 0 H ILE A 28 -4.131 9.318 -1.969 1.00 10.00 H new ATOM 0 HA ILE A 28 -4.224 8.128 -4.520 1.00 10.00 H new ATOM 0 HB ILE A 28 -3.082 6.917 -2.020 1.00 10.00 H new ATOM 0 HG12 ILE A 28 -2.271 9.202 -2.058 1.00 10.00 H new ATOM 0 HG13 ILE A 28 -0.972 8.058 -2.330 1.00 10.00 H new ATOM 0 HG21 ILE A 28 -1.353 5.999 -3.624 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -3.003 5.468 -4.028 1.00 10.00 H new ATOM 0 HG23 ILE A 28 -2.234 6.772 -4.964 1.00 10.00 H new ATOM 0 HD11 ILE A 28 -0.746 10.008 -3.810 1.00 10.00 H new ATOM 0 HD12 ILE A 28 -1.043 8.536 -4.765 1.00 10.00 H new ATOM 0 HD13 ILE A 28 -2.362 9.698 -4.488 1.00 10.00 H new ATOM 419 N ASP A 29 -5.881 6.534 -2.122 1.00 10.00 N ATOM 420 CA ASP A 29 -6.856 5.497 -1.823 1.00 10.00 C ATOM 421 C ASP A 29 -8.154 5.719 -2.616 1.00 10.00 C ATOM 422 O ASP A 29 -8.619 4.786 -3.274 1.00 10.00 O ATOM 423 CB ASP A 29 -7.140 5.446 -0.309 1.00 10.00 C ATOM 424 CG ASP A 29 -5.965 5.036 0.593 1.00 10.00 C ATOM 425 OD1 ASP A 29 -5.156 4.156 0.232 1.00 10.00 O ATOM 426 OD2 ASP A 29 -5.950 5.502 1.752 1.00 10.00 O ATOM 0 H ASP A 29 -5.655 7.118 -1.317 1.00 10.00 H new ATOM 0 HA ASP A 29 -6.439 4.537 -2.127 1.00 10.00 H new ATOM 0 HB2 ASP A 29 -7.486 6.430 0.007 1.00 10.00 H new ATOM 0 HB3 ASP A 29 -7.961 4.749 -0.139 1.00 10.00 H new ATOM 431 N ARG A 30 -8.722 6.938 -2.616 1.00 10.00 N ATOM 432 CA ARG A 30 -9.918 7.270 -3.409 1.00 10.00 C ATOM 433 C ARG A 30 -9.667 7.218 -4.914 1.00 10.00 C ATOM 434 O ARG A 30 -10.549 6.749 -5.629 1.00 10.00 O ATOM 435 CB ARG A 30 -10.610 8.579 -2.965 1.00 10.00 C ATOM 436 CG ARG A 30 -9.818 9.875 -3.173 1.00 10.00 C ATOM 437 CD ARG A 30 -10.683 11.111 -2.870 1.00 10.00 C ATOM 438 NE ARG A 30 -9.923 12.198 -2.236 1.00 10.00 N ATOM 439 CZ ARG A 30 -9.104 13.120 -2.718 1.00 10.00 C ATOM 440 NH1 ARG A 30 -8.864 13.277 -3.992 1.00 10.00 N ATOM 441 NH2 ARG A 30 -8.425 13.897 -1.922 1.00 10.00 N ATOM 0 H ARG A 30 -8.365 7.720 -2.067 1.00 10.00 H new ATOM 0 HA ARG A 30 -10.633 6.476 -3.192 1.00 10.00 H new ATOM 0 HB2 ARG A 30 -11.554 8.666 -3.503 1.00 10.00 H new ATOM 0 HB3 ARG A 30 -10.854 8.494 -1.906 1.00 10.00 H new ATOM 0 HG2 ARG A 30 -8.940 9.875 -2.527 1.00 10.00 H new ATOM 0 HG3 ARG A 30 -9.458 9.923 -4.201 1.00 10.00 H new ATOM 0 HD2 ARG A 30 -11.125 11.476 -3.797 1.00 10.00 H new ATOM 0 HD3 ARG A 30 -11.506 10.821 -2.217 1.00 10.00 H new ATOM 0 HE ARG A 30 -10.052 12.253 -1.226 1.00 10.00 H new ATOM 0 HH11 ARG A 30 -9.318 12.671 -4.675 1.00 10.00 H new ATOM 0 HH12 ARG A 30 -8.222 14.006 -4.304 1.00 10.00 H new ATOM 0 HH21 ARG A 30 -8.520 13.800 -0.911 1.00 10.00 H new ATOM 0 HH22 ARG A 30 -7.798 14.602 -2.310 1.00 10.00 H new ATOM 455 N ALA A 31 -8.469 7.587 -5.399 1.00 10.00 N ATOM 456 CA ALA A 31 -8.057 7.383 -6.788 1.00 10.00 C ATOM 457 C ALA A 31 -8.089 5.901 -7.213 1.00 10.00 C ATOM 458 O ALA A 31 -8.161 5.609 -8.405 1.00 10.00 O ATOM 459 CB ALA A 31 -6.673 8.004 -7.019 1.00 10.00 C ATOM 0 H ALA A 31 -7.756 8.040 -4.827 1.00 10.00 H new ATOM 0 HA ALA A 31 -8.785 7.889 -7.423 1.00 10.00 H new ATOM 0 HB1 ALA A 31 -6.373 7.848 -8.055 1.00 10.00 H new ATOM 0 HB2 ALA A 31 -6.714 9.073 -6.810 1.00 10.00 H new ATOM 0 HB3 ALA A 31 -5.947 7.532 -6.356 1.00 10.00 H new ATOM 465 N LEU A 32 -8.069 4.967 -6.249 1.00 10.00 N ATOM 466 CA LEU A 32 -8.140 3.518 -6.446 1.00 10.00 C ATOM 467 C LEU A 32 -9.400 2.908 -5.803 1.00 10.00 C ATOM 468 O LEU A 32 -9.500 1.689 -5.675 1.00 10.00 O ATOM 469 CB LEU A 32 -6.804 2.936 -5.943 1.00 10.00 C ATOM 470 CG LEU A 32 -5.644 3.334 -6.880 1.00 10.00 C ATOM 471 CD1 LEU A 32 -4.317 3.265 -6.142 1.00 10.00 C ATOM 472 CD2 LEU A 32 -5.604 2.439 -8.126 1.00 10.00 C ATOM 0 H LEU A 32 -7.999 5.219 -5.263 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.256 3.259 -7.498 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -6.602 3.296 -4.934 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -6.874 1.850 -5.885 1.00 10.00 H new ATOM 0 HG LEU A 32 -5.815 4.360 -7.205 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -3.510 3.549 -6.817 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.337 3.948 -5.293 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -4.151 2.248 -5.786 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -4.776 2.744 -8.767 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -5.466 1.401 -7.824 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.541 2.536 -8.674 1.00 10.00 H new ATOM 484 N GLY A 33 -10.386 3.741 -5.425 1.00 10.00 N ATOM 485 CA GLY A 33 -11.664 3.310 -4.859 1.00 10.00 C ATOM 486 C GLY A 33 -11.585 2.558 -3.523 1.00 10.00 C ATOM 487 O GLY A 33 -12.577 1.962 -3.114 1.00 10.00 O ATOM 0 H GLY A 33 -10.308 4.755 -5.509 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -12.294 4.189 -4.723 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -12.164 2.669 -5.586 1.00 10.00 H new ATOM 491 N ILE A 34 -10.443 2.575 -2.831 1.00 10.00 N ATOM 492 CA ILE A 34 -10.179 1.717 -1.661 1.00 10.00 C ATOM 493 C ILE A 34 -11.193 1.910 -0.514 1.00 10.00 C ATOM 494 O ILE A 34 -11.658 0.892 0.009 1.00 10.00 O ATOM 495 CB ILE A 34 -8.699 1.810 -1.226 1.00 10.00 C ATOM 496 CG1 ILE A 34 -7.764 1.546 -2.427 1.00 10.00 C ATOM 497 CG2 ILE A 34 -8.404 0.836 -0.080 1.00 10.00 C ATOM 498 CD1 ILE A 34 -6.267 1.604 -2.109 1.00 10.00 C ATOM 0 H ILE A 34 -9.664 3.190 -3.066 1.00 10.00 H new ATOM 0 HA ILE A 34 -10.342 0.685 -1.972 1.00 10.00 H new ATOM 0 HB ILE A 34 -8.512 2.821 -0.863 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -7.995 0.563 -2.838 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -7.983 2.277 -3.206 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -7.356 0.920 0.208 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -9.036 1.077 0.775 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -8.610 -0.183 -0.407 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.695 1.406 -3.015 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -6.014 2.594 -1.729 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -6.026 0.854 -1.356 1.00 10.00 H new ATOM 510 N PRO A 35 -11.646 3.127 -0.148 1.00 10.00 N ATOM 511 CA PRO A 35 -12.771 3.305 0.782 1.00 10.00 C ATOM 512 C PRO A 35 -14.094 2.657 0.327 1.00 10.00 C ATOM 513 O PRO A 35 -14.890 2.237 1.165 1.00 10.00 O ATOM 514 CB PRO A 35 -12.912 4.822 0.955 1.00 10.00 C ATOM 515 CG PRO A 35 -11.507 5.337 0.656 1.00 10.00 C ATOM 516 CD PRO A 35 -11.067 4.419 -0.483 1.00 10.00 C ATOM 0 HA PRO A 35 -12.558 2.790 1.719 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -13.649 5.239 0.268 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -13.231 5.085 1.964 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -11.512 6.385 0.356 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -10.850 5.256 1.522 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -11.428 4.779 -1.446 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -9.981 4.362 -0.551 1.00 10.00 H new ATOM 524 N GLU A 36 -14.320 2.491 -0.986 1.00 10.00 N ATOM 525 CA GLU A 36 -15.432 1.698 -1.519 1.00 10.00 C ATOM 526 C GLU A 36 -15.129 0.194 -1.404 1.00 10.00 C ATOM 527 O GLU A 36 -15.982 -0.561 -0.939 1.00 10.00 O ATOM 528 CB GLU A 36 -15.771 2.099 -2.968 1.00 10.00 C ATOM 529 CG GLU A 36 -17.282 2.090 -3.243 1.00 10.00 C ATOM 530 CD GLU A 36 -17.945 0.744 -2.927 1.00 10.00 C ATOM 531 OE1 GLU A 36 -17.593 -0.238 -3.619 1.00 10.00 O ATOM 532 OE2 GLU A 36 -18.763 0.703 -1.979 1.00 10.00 O ATOM 0 H GLU A 36 -13.732 2.906 -1.709 1.00 10.00 H new ATOM 0 HA GLU A 36 -16.315 1.910 -0.916 1.00 10.00 H new ATOM 0 HB2 GLU A 36 -15.375 3.094 -3.168 1.00 10.00 H new ATOM 0 HB3 GLU A 36 -15.276 1.414 -3.656 1.00 10.00 H new ATOM 0 HG2 GLU A 36 -17.758 2.870 -2.649 1.00 10.00 H new ATOM 0 HG3 GLU A 36 -17.456 2.336 -4.291 1.00 10.00 H new ATOM 539 N LEU A 37 -13.906 -0.247 -1.748 1.00 10.00 N ATOM 540 CA LEU A 37 -13.445 -1.624 -1.497 1.00 10.00 C ATOM 541 C LEU A 37 -13.658 -2.051 -0.027 1.00 10.00 C ATOM 542 O LEU A 37 -13.963 -3.214 0.218 1.00 10.00 O ATOM 543 CB LEU A 37 -11.976 -1.809 -1.912 1.00 10.00 C ATOM 544 CG LEU A 37 -11.674 -1.558 -3.407 1.00 10.00 C ATOM 545 CD1 LEU A 37 -10.190 -1.816 -3.665 1.00 10.00 C ATOM 546 CD2 LEU A 37 -12.470 -2.465 -4.349 1.00 10.00 C ATOM 0 H LEU A 37 -13.210 0.340 -2.207 1.00 10.00 H new ATOM 0 HA LEU A 37 -14.058 -2.277 -2.118 1.00 10.00 H new ATOM 0 HB2 LEU A 37 -11.360 -1.136 -1.316 1.00 10.00 H new ATOM 0 HB3 LEU A 37 -11.671 -2.825 -1.662 1.00 10.00 H new ATOM 0 HG LEU A 37 -11.960 -0.526 -3.611 1.00 10.00 H new ATOM 0 HD11 LEU A 37 -9.968 -1.641 -4.718 1.00 10.00 H new ATOM 0 HD12 LEU A 37 -9.592 -1.143 -3.051 1.00 10.00 H new ATOM 0 HD13 LEU A 37 -9.951 -2.848 -3.410 1.00 10.00 H new ATOM 0 HD21 LEU A 37 -12.209 -2.235 -5.382 1.00 10.00 H new ATOM 0 HD22 LEU A 37 -12.232 -3.507 -4.138 1.00 10.00 H new ATOM 0 HD23 LEU A 37 -13.537 -2.299 -4.199 1.00 10.00 H new ATOM 558 N VAL A 38 -13.539 -1.123 0.928 1.00 10.00 N ATOM 559 CA VAL A 38 -13.940 -1.340 2.324 1.00 10.00 C ATOM 560 C VAL A 38 -15.472 -1.501 2.427 1.00 10.00 C ATOM 561 O VAL A 38 -15.961 -2.544 2.844 1.00 10.00 O ATOM 562 CB VAL A 38 -13.446 -0.178 3.208 1.00 10.00 C ATOM 563 CG1 VAL A 38 -14.001 -0.257 4.625 1.00 10.00 C ATOM 564 CG2 VAL A 38 -11.919 -0.103 3.298 1.00 10.00 C ATOM 0 H VAL A 38 -13.159 -0.193 0.754 1.00 10.00 H new ATOM 0 HA VAL A 38 -13.480 -2.261 2.682 1.00 10.00 H new ATOM 0 HB VAL A 38 -13.817 0.721 2.715 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -13.625 0.582 5.210 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -15.090 -0.218 4.592 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -13.685 -1.192 5.088 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -11.633 0.735 3.934 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -11.534 -1.030 3.723 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -11.502 0.039 2.301 1.00 10.00 H new ATOM 765 N SER B 51 11.583 -9.834 -8.998 1.00 10.00 N ATOM 766 CA SER B 51 11.624 -8.693 -8.089 1.00 10.00 C ATOM 767 C SER B 51 11.192 -7.501 -8.947 1.00 10.00 C ATOM 768 O SER B 51 12.027 -6.880 -9.608 1.00 10.00 O ATOM 769 CB SER B 51 13.024 -8.482 -7.519 1.00 10.00 C ATOM 770 OG SER B 51 13.400 -9.517 -6.647 1.00 10.00 O ATOM 0 HA SER B 51 10.976 -8.837 -7.224 1.00 10.00 H new ATOM 0 HB2 SER B 51 13.742 -8.418 -8.336 1.00 10.00 H new ATOM 0 HB3 SER B 51 13.060 -7.530 -6.989 1.00 10.00 H new ATOM 0 HG SER B 51 14.302 -9.345 -6.305 1.00 10.00 H new ATOM 776 N ILE B 52 9.888 -7.178 -8.990 1.00 10.00 N ATOM 777 CA ILE B 52 9.325 -6.148 -9.888 1.00 10.00 C ATOM 778 C ILE B 52 9.319 -4.745 -9.235 1.00 10.00 C ATOM 779 O ILE B 52 8.744 -3.802 -9.780 1.00 10.00 O ATOM 780 CB ILE B 52 7.925 -6.515 -10.441 1.00 10.00 C ATOM 781 CG1 ILE B 52 7.556 -8.019 -10.436 1.00 10.00 C ATOM 782 CG2 ILE B 52 7.815 -6.017 -11.894 1.00 10.00 C ATOM 783 CD1 ILE B 52 6.867 -8.431 -9.130 1.00 10.00 C ATOM 0 H ILE B 52 9.188 -7.626 -8.399 1.00 10.00 H new ATOM 0 HA ILE B 52 9.997 -6.113 -10.746 1.00 10.00 H new ATOM 0 HB ILE B 52 7.228 -6.033 -9.756 1.00 10.00 H new ATOM 0 HG12 ILE B 52 6.898 -8.235 -11.278 1.00 10.00 H new ATOM 0 HG13 ILE B 52 8.458 -8.615 -10.575 1.00 10.00 H new ATOM 0 HG21 ILE B 52 6.833 -6.271 -12.292 1.00 10.00 H new ATOM 0 HG22 ILE B 52 7.948 -4.935 -11.919 1.00 10.00 H new ATOM 0 HG23 ILE B 52 8.586 -6.492 -12.501 1.00 10.00 H new ATOM 0 HD11 ILE B 52 6.624 -9.493 -9.166 1.00 10.00 H new ATOM 0 HD12 ILE B 52 7.535 -8.240 -8.290 1.00 10.00 H new ATOM 0 HD13 ILE B 52 5.951 -7.854 -9.004 1.00 10.00 H new ATOM 795 N SER B 53 9.954 -4.612 -8.063 1.00 10.00 N ATOM 796 CA SER B 53 10.007 -3.411 -7.229 1.00 10.00 C ATOM 797 C SER B 53 11.397 -2.951 -6.708 1.00 10.00 C ATOM 798 O SER B 53 11.404 -1.964 -5.972 1.00 10.00 O ATOM 799 CB SER B 53 9.035 -3.618 -6.058 1.00 10.00 C ATOM 800 OG SER B 53 9.217 -4.895 -5.473 1.00 10.00 O ATOM 0 H SER B 53 10.474 -5.387 -7.650 1.00 10.00 H new ATOM 0 HA SER B 53 9.726 -2.589 -7.887 1.00 10.00 H new ATOM 0 HB2 SER B 53 9.193 -2.843 -5.307 1.00 10.00 H new ATOM 0 HB3 SER B 53 8.008 -3.517 -6.410 1.00 10.00 H new ATOM 0 HG SER B 53 8.590 -5.006 -4.728 1.00 10.00 H new ATOM 806 N PRO B 54 12.586 -3.504 -7.050 1.00 10.00 N ATOM 807 CA PRO B 54 13.880 -3.022 -6.536 1.00 10.00 C ATOM 808 C PRO B 54 14.221 -1.594 -7.003 1.00 10.00 C ATOM 809 O PRO B 54 15.101 -0.944 -6.433 1.00 10.00 O ATOM 810 CB PRO B 54 14.928 -4.037 -6.988 1.00 10.00 C ATOM 811 CG PRO B 54 14.338 -4.538 -8.303 1.00 10.00 C ATOM 812 CD PRO B 54 12.840 -4.554 -8.028 1.00 10.00 C ATOM 0 HA PRO B 54 13.846 -2.948 -5.449 1.00 10.00 H new ATOM 0 HB2 PRO B 54 15.907 -3.578 -7.129 1.00 10.00 H new ATOM 0 HB3 PRO B 54 15.055 -4.842 -6.265 1.00 10.00 H new ATOM 0 HG2 PRO B 54 14.588 -3.878 -9.134 1.00 10.00 H new ATOM 0 HG3 PRO B 54 14.711 -5.529 -8.560 1.00 10.00 H new ATOM 0 HD2 PRO B 54 12.276 -4.376 -8.943 1.00 10.00 H new ATOM 0 HD3 PRO B 54 12.527 -5.525 -7.645 1.00 10.00 H new ATOM 820 N SER B 55 13.561 -1.113 -8.054 1.00 10.00 N ATOM 821 CA SER B 55 13.574 0.271 -8.517 1.00 10.00 C ATOM 822 C SER B 55 12.679 1.153 -7.646 1.00 10.00 C ATOM 823 O SER B 55 13.107 2.183 -7.130 1.00 10.00 O ATOM 824 CB SER B 55 13.075 0.308 -9.968 1.00 10.00 C ATOM 825 OG SER B 55 11.862 -0.434 -10.081 1.00 10.00 O ATOM 0 H SER B 55 12.972 -1.710 -8.635 1.00 10.00 H new ATOM 0 HA SER B 55 14.592 0.656 -8.452 1.00 10.00 H new ATOM 0 HB2 SER B 55 12.911 1.340 -10.280 1.00 10.00 H new ATOM 0 HB3 SER B 55 13.831 -0.110 -10.633 1.00 10.00 H new ATOM 0 HG SER B 55 11.547 -0.406 -11.008 1.00 10.00 H new ATOM 831 N ALA B 56 11.436 0.724 -7.399 1.00 10.00 N ATOM 832 CA ALA B 56 10.509 1.339 -6.447 1.00 10.00 C ATOM 833 C ALA B 56 11.072 1.361 -5.009 1.00 10.00 C ATOM 834 O ALA B 56 10.835 2.300 -4.254 1.00 10.00 O ATOM 835 CB ALA B 56 9.194 0.581 -6.530 1.00 10.00 C ATOM 0 H ALA B 56 11.037 -0.087 -7.872 1.00 10.00 H new ATOM 0 HA ALA B 56 10.356 2.386 -6.709 1.00 10.00 H new ATOM 0 HB1 ALA B 56 8.479 1.015 -5.831 1.00 10.00 H new ATOM 0 HB2 ALA B 56 8.798 0.649 -7.543 1.00 10.00 H new ATOM 0 HB3 ALA B 56 9.361 -0.466 -6.275 1.00 10.00 H new ATOM 841 N LEU B 57 11.899 0.387 -4.652 1.00 10.00 N ATOM 842 CA LEU B 57 12.692 0.372 -3.420 1.00 10.00 C ATOM 843 C LEU B 57 13.605 1.602 -3.312 1.00 10.00 C ATOM 844 O LEU B 57 13.981 1.973 -2.209 1.00 10.00 O ATOM 845 CB LEU B 57 13.467 -0.951 -3.408 1.00 10.00 C ATOM 846 CG LEU B 57 14.526 -1.173 -2.312 1.00 10.00 C ATOM 847 CD1 LEU B 57 13.907 -1.400 -0.937 1.00 10.00 C ATOM 848 CD2 LEU B 57 15.344 -2.401 -2.725 1.00 10.00 C ATOM 0 H LEU B 57 12.044 -0.443 -5.227 1.00 10.00 H new ATOM 0 HA LEU B 57 12.049 0.431 -2.542 1.00 10.00 H new ATOM 0 HB2 LEU B 57 12.740 -1.760 -3.335 1.00 10.00 H new ATOM 0 HB3 LEU B 57 13.963 -1.053 -4.373 1.00 10.00 H new ATOM 0 HG LEU B 57 15.146 -0.281 -2.224 1.00 10.00 H new ATOM 0 HD11 LEU B 57 14.698 -1.551 -0.202 1.00 10.00 H new ATOM 0 HD12 LEU B 57 13.313 -0.530 -0.657 1.00 10.00 H new ATOM 0 HD13 LEU B 57 13.267 -2.282 -0.967 1.00 10.00 H new ATOM 0 HD21 LEU B 57 16.110 -2.597 -1.975 1.00 10.00 H new ATOM 0 HD22 LEU B 57 14.686 -3.266 -2.806 1.00 10.00 H new ATOM 0 HD23 LEU B 57 15.819 -2.215 -3.688 1.00 10.00 H new ATOM 860 N GLN B 58 13.947 2.253 -4.424 1.00 10.00 N ATOM 861 CA GLN B 58 14.618 3.547 -4.423 1.00 10.00 C ATOM 862 C GLN B 58 13.559 4.672 -4.464 1.00 10.00 C ATOM 863 O GLN B 58 13.468 5.497 -3.547 1.00 10.00 O ATOM 864 CB GLN B 58 15.604 3.651 -5.617 1.00 10.00 C ATOM 865 CG GLN B 58 16.380 2.376 -5.999 1.00 10.00 C ATOM 866 CD GLN B 58 17.015 1.644 -4.821 1.00 10.00 C ATOM 867 OE1 GLN B 58 17.728 2.211 -4.020 1.00 10.00 O ATOM 868 NE2 GLN B 58 16.813 0.341 -4.702 1.00 10.00 N ATOM 0 H GLN B 58 13.763 1.890 -5.359 1.00 10.00 H new ATOM 0 HA GLN B 58 15.203 3.653 -3.510 1.00 10.00 H new ATOM 0 HB2 GLN B 58 15.043 3.980 -6.492 1.00 10.00 H new ATOM 0 HB3 GLN B 58 16.329 4.433 -5.390 1.00 10.00 H new ATOM 0 HG2 GLN B 58 15.702 1.693 -6.512 1.00 10.00 H new ATOM 0 HG3 GLN B 58 17.163 2.642 -6.710 1.00 10.00 H new ATOM 0 HE21 GLN B 58 16.215 -0.146 -5.370 1.00 10.00 H new ATOM 0 HE22 GLN B 58 17.255 -0.176 -3.942 1.00 10.00 H new ATOM 877 N ASP B 59 12.740 4.685 -5.522 1.00 10.00 N ATOM 878 CA ASP B 59 11.840 5.795 -5.860 1.00 10.00 C ATOM 879 C ASP B 59 10.474 5.845 -5.165 1.00 10.00 C ATOM 880 O ASP B 59 10.016 6.930 -4.794 1.00 10.00 O ATOM 881 CB ASP B 59 11.696 5.841 -7.388 1.00 10.00 C ATOM 882 CG ASP B 59 11.979 7.253 -7.898 1.00 10.00 C ATOM 883 OD1 ASP B 59 13.084 7.769 -7.612 1.00 10.00 O ATOM 884 OD2 ASP B 59 11.053 7.918 -8.403 1.00 10.00 O ATOM 0 H ASP B 59 12.683 3.909 -6.181 1.00 10.00 H new ATOM 0 HA ASP B 59 12.319 6.688 -5.458 1.00 10.00 H new ATOM 0 HB2 ASP B 59 12.387 5.134 -7.848 1.00 10.00 H new ATOM 0 HB3 ASP B 59 10.690 5.536 -7.676 1.00 10.00 H new ATOM 889 N LEU B 60 9.811 4.701 -4.968 1.00 10.00 N ATOM 890 CA LEU B 60 8.550 4.637 -4.222 1.00 10.00 C ATOM 891 C LEU B 60 8.820 4.732 -2.710 1.00 10.00 C ATOM 892 O LEU B 60 8.063 5.363 -1.964 1.00 10.00 O ATOM 893 CB LEU B 60 7.816 3.348 -4.610 1.00 10.00 C ATOM 894 CG LEU B 60 6.321 3.246 -4.260 1.00 10.00 C ATOM 895 CD1 LEU B 60 5.562 4.558 -4.385 1.00 10.00 C ATOM 896 CD2 LEU B 60 5.688 2.232 -5.221 1.00 10.00 C ATOM 0 H LEU B 60 10.131 3.798 -5.319 1.00 10.00 H new ATOM 0 HA LEU B 60 7.910 5.482 -4.476 1.00 10.00 H new ATOM 0 HB2 LEU B 60 7.919 3.214 -5.687 1.00 10.00 H new ATOM 0 HB3 LEU B 60 8.330 2.513 -4.135 1.00 10.00 H new ATOM 0 HG LEU B 60 6.254 2.947 -3.214 1.00 10.00 H new ATOM 0 HD11 LEU B 60 4.516 4.400 -4.121 1.00 10.00 H new ATOM 0 HD12 LEU B 60 5.999 5.296 -3.712 1.00 10.00 H new ATOM 0 HD13 LEU B 60 5.626 4.919 -5.411 1.00 10.00 H new ATOM 0 HD21 LEU B 60 4.625 2.135 -5.000 1.00 10.00 H new ATOM 0 HD22 LEU B 60 5.815 2.575 -6.248 1.00 10.00 H new ATOM 0 HD23 LEU B 60 6.173 1.264 -5.100 1.00 10.00 H new ATOM 908 N LEU B 61 9.961 4.179 -2.273 1.00 10.00 N ATOM 909 CA LEU B 61 10.481 4.310 -0.928 1.00 10.00 C ATOM 910 C LEU B 61 10.688 5.790 -0.564 1.00 10.00 C ATOM 911 O LEU B 61 10.012 6.245 0.352 1.00 10.00 O ATOM 912 CB LEU B 61 11.749 3.457 -0.749 1.00 10.00 C ATOM 913 CG LEU B 61 12.119 3.234 0.731 1.00 10.00 C ATOM 914 CD1 LEU B 61 11.479 1.959 1.321 1.00 10.00 C ATOM 915 CD2 LEU B 61 13.630 3.113 0.899 1.00 10.00 C ATOM 0 H LEU B 61 10.558 3.612 -2.876 1.00 10.00 H new ATOM 0 HA LEU B 61 9.747 3.921 -0.223 1.00 10.00 H new ATOM 0 HB2 LEU B 61 11.601 2.490 -1.231 1.00 10.00 H new ATOM 0 HB3 LEU B 61 12.582 3.943 -1.257 1.00 10.00 H new ATOM 0 HG LEU B 61 11.735 4.103 1.265 1.00 10.00 H new ATOM 0 HD11 LEU B 61 11.774 1.853 2.365 1.00 10.00 H new ATOM 0 HD12 LEU B 61 10.393 2.034 1.257 1.00 10.00 H new ATOM 0 HD13 LEU B 61 11.817 1.089 0.759 1.00 10.00 H new ATOM 0 HD21 LEU B 61 13.868 2.956 1.951 1.00 10.00 H new ATOM 0 HD22 LEU B 61 13.995 2.268 0.315 1.00 10.00 H new ATOM 0 HD23 LEU B 61 14.109 4.028 0.551 1.00 10.00 H new ATOM 927 N ARG B 62 11.523 6.570 -1.282 1.00 10.00 N ATOM 928 CA ARG B 62 11.683 8.016 -0.997 1.00 10.00 C ATOM 929 C ARG B 62 10.345 8.776 -1.037 1.00 10.00 C ATOM 930 O ARG B 62 10.125 9.693 -0.233 1.00 10.00 O ATOM 931 CB ARG B 62 12.746 8.660 -1.912 1.00 10.00 C ATOM 932 CG ARG B 62 12.287 8.819 -3.372 1.00 10.00 C ATOM 933 CD ARG B 62 13.340 9.455 -4.291 1.00 10.00 C ATOM 934 NE ARG B 62 12.782 9.593 -5.654 1.00 10.00 N ATOM 935 CZ ARG B 62 11.934 10.496 -6.123 1.00 10.00 C ATOM 936 NH1 ARG B 62 11.594 11.551 -5.418 1.00 10.00 N ATOM 937 NH2 ARG B 62 11.391 10.354 -7.302 1.00 10.00 N ATOM 0 H ARG B 62 12.093 6.229 -2.056 1.00 10.00 H new ATOM 0 HA ARG B 62 12.047 8.097 0.027 1.00 10.00 H new ATOM 0 HB2 ARG B 62 13.010 9.640 -1.514 1.00 10.00 H new ATOM 0 HB3 ARG B 62 13.650 8.052 -1.888 1.00 10.00 H new ATOM 0 HG2 ARG B 62 12.019 7.839 -3.767 1.00 10.00 H new ATOM 0 HG3 ARG B 62 11.384 9.429 -3.394 1.00 10.00 H new ATOM 0 HD2 ARG B 62 13.633 10.431 -3.905 1.00 10.00 H new ATOM 0 HD3 ARG B 62 14.239 8.838 -4.314 1.00 10.00 H new ATOM 0 HE ARG B 62 13.094 8.894 -6.328 1.00 10.00 H new ATOM 0 HH11 ARG B 62 11.985 11.689 -4.486 1.00 10.00 H new ATOM 0 HH12 ARG B 62 10.939 12.232 -5.802 1.00 10.00 H new ATOM 0 HH21 ARG B 62 11.618 9.540 -7.874 1.00 10.00 H new ATOM 0 HH22 ARG B 62 10.739 11.057 -7.651 1.00 10.00 H new ATOM 951 N THR B 63 9.446 8.363 -1.944 1.00 10.00 N ATOM 952 CA THR B 63 8.134 8.973 -2.234 1.00 10.00 C ATOM 953 C THR B 63 7.137 8.871 -1.083 1.00 10.00 C ATOM 954 O THR B 63 6.267 9.738 -0.964 1.00 10.00 O ATOM 955 CB THR B 63 7.573 8.332 -3.515 1.00 10.00 C ATOM 956 OG1 THR B 63 8.305 8.844 -4.602 1.00 10.00 O ATOM 957 CG2 THR B 63 6.087 8.532 -3.781 1.00 10.00 C ATOM 0 H THR B 63 9.623 7.547 -2.530 1.00 10.00 H new ATOM 0 HA THR B 63 8.288 10.043 -2.375 1.00 10.00 H new ATOM 0 HB THR B 63 7.680 7.256 -3.380 1.00 10.00 H new ATOM 0 HG1 THR B 63 9.177 8.399 -4.648 1.00 10.00 H new ATOM 0 HG21 THR B 63 5.814 8.034 -4.711 1.00 10.00 H new ATOM 0 HG22 THR B 63 5.510 8.108 -2.959 1.00 10.00 H new ATOM 0 HG23 THR B 63 5.872 9.597 -3.863 1.00 10.00 H new ATOM 965 N LEU B 64 7.287 7.879 -0.201 1.00 10.00 N ATOM 966 CA LEU B 64 6.486 7.703 1.007 1.00 10.00 C ATOM 967 C LEU B 64 7.318 7.894 2.290 1.00 10.00 C ATOM 968 O LEU B 64 6.749 8.199 3.340 1.00 10.00 O ATOM 969 CB LEU B 64 5.779 6.341 0.962 1.00 10.00 C ATOM 970 CG LEU B 64 4.240 6.340 0.919 1.00 10.00 C ATOM 971 CD1 LEU B 64 3.540 6.892 2.153 1.00 10.00 C ATOM 972 CD2 LEU B 64 3.649 6.974 -0.347 1.00 10.00 C ATOM 0 H LEU B 64 7.994 7.153 -0.315 1.00 10.00 H new ATOM 0 HA LEU B 64 5.724 8.482 1.036 1.00 10.00 H new ATOM 0 HB2 LEU B 64 6.140 5.803 0.085 1.00 10.00 H new ATOM 0 HB3 LEU B 64 6.091 5.771 1.837 1.00 10.00 H new ATOM 0 HG LEU B 64 4.027 5.271 0.901 1.00 10.00 H new ATOM 0 HD11 LEU B 64 2.460 6.842 2.012 1.00 10.00 H new ATOM 0 HD12 LEU B 64 3.819 6.301 3.025 1.00 10.00 H new ATOM 0 HD13 LEU B 64 3.838 7.929 2.307 1.00 10.00 H new ATOM 0 HD21 LEU B 64 2.561 6.934 -0.300 1.00 10.00 H new ATOM 0 HD22 LEU B 64 3.971 8.013 -0.418 1.00 10.00 H new ATOM 0 HD23 LEU B 64 3.995 6.426 -1.224 1.00 10.00 H new ATOM 984 N LYS B 65 8.663 7.757 2.232 1.00 10.00 N ATOM 985 CA LYS B 65 9.560 8.164 3.325 1.00 10.00 C ATOM 986 C LYS B 65 9.460 9.660 3.574 1.00 10.00 C ATOM 987 O LYS B 65 9.727 10.075 4.702 1.00 10.00 O ATOM 988 CB LYS B 65 11.006 7.768 3.022 1.00 10.00 C ATOM 989 CG LYS B 65 11.227 6.327 3.460 1.00 10.00 C ATOM 990 CD LYS B 65 11.229 6.078 4.983 1.00 10.00 C ATOM 991 CE LYS B 65 12.022 7.109 5.824 1.00 10.00 C ATOM 992 NZ LYS B 65 11.198 8.246 6.304 1.00 10.00 N ATOM 0 H LYS B 65 9.150 7.362 1.427 1.00 10.00 H new ATOM 0 HA LYS B 65 9.246 7.642 4.229 1.00 10.00 H new ATOM 0 HB2 LYS B 65 11.210 7.873 1.956 1.00 10.00 H new ATOM 0 HB3 LYS B 65 11.695 8.431 3.545 1.00 10.00 H new ATOM 0 HG2 LYS B 65 10.450 5.708 3.011 1.00 10.00 H new ATOM 0 HG3 LYS B 65 12.180 5.986 3.054 1.00 10.00 H new ATOM 0 HD2 LYS B 65 10.197 6.066 5.333 1.00 10.00 H new ATOM 0 HD3 LYS B 65 11.641 5.087 5.171 1.00 10.00 H new ATOM 0 HE2 LYS B 65 12.462 6.603 6.683 1.00 10.00 H new ATOM 0 HE3 LYS B 65 12.846 7.496 5.225 1.00 10.00 H new ATOM 0 HZ1 LYS B 65 11.754 8.822 6.968 1.00 10.00 H new ATOM 0 HZ2 LYS B 65 10.910 8.832 5.495 1.00 10.00 H new ATOM 0 HZ3 LYS B 65 10.352 7.882 6.787 1.00 10.00 H new ATOM 1006 N SER B 66 9.154 10.425 2.520 1.00 10.00 N ATOM 1007 CA SER B 66 8.748 11.820 2.580 1.00 10.00 C ATOM 1008 C SER B 66 7.237 11.718 2.853 1.00 10.00 C ATOM 1009 O SER B 66 6.525 11.142 2.026 1.00 10.00 O ATOM 1010 CB SER B 66 9.101 12.565 1.279 1.00 10.00 C ATOM 1011 OG SER B 66 8.780 11.850 0.097 1.00 10.00 O ATOM 0 H SER B 66 9.186 10.067 1.565 1.00 10.00 H new ATOM 0 HA SER B 66 9.259 12.405 3.345 1.00 10.00 H new ATOM 0 HB2 SER B 66 8.577 13.521 1.266 1.00 10.00 H new ATOM 0 HB3 SER B 66 10.168 12.787 1.278 1.00 10.00 H new ATOM 0 HG SER B 66 9.454 11.156 -0.059 1.00 10.00 H new ATOM 1017 N PRO B 67 6.734 12.099 4.046 1.00 10.00 N ATOM 1018 CA PRO B 67 5.348 11.800 4.413 1.00 10.00 C ATOM 1019 C PRO B 67 4.277 12.499 3.578 1.00 10.00 C ATOM 1020 O PRO B 67 4.539 13.428 2.832 1.00 10.00 O ATOM 1021 CB PRO B 67 5.211 12.173 5.893 1.00 10.00 C ATOM 1022 CG PRO B 67 6.646 12.223 6.406 1.00 10.00 C ATOM 1023 CD PRO B 67 7.423 12.689 5.186 1.00 10.00 C ATOM 0 HA PRO B 67 5.166 10.743 4.216 1.00 10.00 H new ATOM 0 HB2 PRO B 67 4.711 13.134 6.016 1.00 10.00 H new ATOM 0 HB3 PRO B 67 4.620 11.435 6.436 1.00 10.00 H new ATOM 0 HG2 PRO B 67 6.753 12.914 7.242 1.00 10.00 H new ATOM 0 HG3 PRO B 67 6.986 11.247 6.754 1.00 10.00 H new ATOM 0 HD2 PRO B 67 7.435 13.777 5.119 1.00 10.00 H new ATOM 0 HD3 PRO B 67 8.461 12.361 5.231 1.00 10.00 H new ATOM 1031 N SER B 68 3.038 12.062 3.804 1.00 10.00 N ATOM 1032 CA SER B 68 1.820 12.366 3.056 1.00 10.00 C ATOM 1033 C SER B 68 1.553 13.856 2.813 1.00 10.00 C ATOM 1034 O SER B 68 0.819 14.193 1.891 1.00 10.00 O ATOM 1035 CB SER B 68 0.648 11.699 3.777 1.00 10.00 C ATOM 1036 OG SER B 68 0.983 10.389 4.213 1.00 10.00 O ATOM 0 H SER B 68 2.845 11.432 4.583 1.00 10.00 H new ATOM 0 HA SER B 68 1.951 11.967 2.050 1.00 10.00 H new ATOM 0 HB2 SER B 68 0.354 12.305 4.634 1.00 10.00 H new ATOM 0 HB3 SER B 68 -0.212 11.653 3.110 1.00 10.00 H new ATOM 0 HG SER B 68 0.657 10.255 5.128 1.00 10.00 H new ATOM 1042 N SER B 69 2.186 14.744 3.584 1.00 10.00 N ATOM 1043 CA SER B 69 2.259 16.186 3.384 1.00 10.00 C ATOM 1044 C SER B 69 2.663 16.453 1.934 1.00 10.00 C ATOM 1045 O SER B 69 3.793 16.123 1.576 1.00 10.00 O ATOM 1046 CB SER B 69 3.306 16.767 4.341 1.00 10.00 C ATOM 1047 OG SER B 69 4.550 16.123 4.164 1.00 10.00 O ATOM 0 H SER B 69 2.693 14.451 4.419 1.00 10.00 H new ATOM 0 HA SER B 69 1.295 16.654 3.585 1.00 10.00 H new ATOM 0 HB2 SER B 69 3.415 17.837 4.164 1.00 10.00 H new ATOM 0 HB3 SER B 69 2.971 16.647 5.371 1.00 10.00 H new ATOM 0 HG SER B 69 4.680 15.918 3.214 1.00 10.00 H new ATOM 1053 N PRO B 70 1.780 17.058 1.126 1.00 10.00 N ATOM 1054 CA PRO B 70 1.889 17.169 -0.333 1.00 10.00 C ATOM 1055 C PRO B 70 2.356 15.972 -1.190 1.00 10.00 C ATOM 1056 O PRO B 70 2.129 16.002 -2.396 1.00 10.00 O ATOM 1057 CB PRO B 70 2.607 18.488 -0.566 1.00 10.00 C ATOM 1058 CG PRO B 70 1.969 19.356 0.532 1.00 10.00 C ATOM 1059 CD PRO B 70 1.285 18.367 1.499 1.00 10.00 C ATOM 0 HA PRO B 70 0.880 17.144 -0.745 1.00 10.00 H new ATOM 0 HB2 PRO B 70 3.687 18.398 -0.448 1.00 10.00 H new ATOM 0 HB3 PRO B 70 2.428 18.886 -1.565 1.00 10.00 H new ATOM 0 HG2 PRO B 70 2.722 19.951 1.048 1.00 10.00 H new ATOM 0 HG3 PRO B 70 1.246 20.054 0.109 1.00 10.00 H new ATOM 0 HD2 PRO B 70 1.530 18.599 2.536 1.00 10.00 H new ATOM 0 HD3 PRO B 70 0.200 18.417 1.409 1.00 10.00 H new ATOM 1067 N GLN B 71 2.866 14.875 -0.605 1.00 10.00 N ATOM 1068 CA GLN B 71 3.141 13.589 -1.266 1.00 10.00 C ATOM 1069 C GLN B 71 1.849 12.814 -1.598 1.00 10.00 C ATOM 1070 O GLN B 71 1.876 11.835 -2.348 1.00 10.00 O ATOM 1071 CB GLN B 71 4.112 12.735 -0.413 1.00 10.00 C ATOM 1072 CG GLN B 71 5.498 13.394 -0.319 1.00 10.00 C ATOM 1073 CD GLN B 71 6.251 13.395 -1.642 1.00 10.00 C ATOM 1074 OE1 GLN B 71 6.552 14.430 -2.214 1.00 10.00 O ATOM 1075 NE2 GLN B 71 6.574 12.237 -2.182 1.00 10.00 N ATOM 0 H GLN B 71 3.108 14.860 0.386 1.00 10.00 H new ATOM 0 HA GLN B 71 3.624 13.807 -2.219 1.00 10.00 H new ATOM 0 HB2 GLN B 71 3.701 12.603 0.588 1.00 10.00 H new ATOM 0 HB3 GLN B 71 4.208 11.742 -0.852 1.00 10.00 H new ATOM 0 HG2 GLN B 71 5.382 14.421 0.027 1.00 10.00 H new ATOM 0 HG3 GLN B 71 6.092 12.870 0.430 1.00 10.00 H new ATOM 0 HE21 GLN B 71 6.326 11.367 -1.710 1.00 10.00 H new ATOM 0 HE22 GLN B 71 7.072 12.210 -3.072 1.00 10.00 H new ATOM 1084 N GLN B 72 0.713 13.289 -1.064 1.00 10.00 N ATOM 1085 CA GLN B 72 -0.678 12.854 -1.233 1.00 10.00 C ATOM 1086 C GLN B 72 -1.185 12.519 -2.644 1.00 10.00 C ATOM 1087 O GLN B 72 -2.264 11.947 -2.759 1.00 10.00 O ATOM 1088 CB GLN B 72 -1.584 13.969 -0.661 1.00 10.00 C ATOM 1089 CG GLN B 72 -1.532 15.271 -1.493 1.00 10.00 C ATOM 1090 CD GLN B 72 -2.387 16.376 -0.891 1.00 10.00 C ATOM 1091 OE1 GLN B 72 -1.963 17.091 0.005 1.00 10.00 O ATOM 1092 NE2 GLN B 72 -3.606 16.536 -1.363 1.00 10.00 N ATOM 0 H GLN B 72 0.756 14.084 -0.426 1.00 10.00 H new ATOM 0 HA GLN B 72 -0.717 11.896 -0.714 1.00 10.00 H new ATOM 0 HB2 GLN B 72 -2.612 13.610 -0.621 1.00 10.00 H new ATOM 0 HB3 GLN B 72 -1.282 14.186 0.364 1.00 10.00 H new ATOM 0 HG2 GLN B 72 -0.499 15.612 -1.565 1.00 10.00 H new ATOM 0 HG3 GLN B 72 -1.871 15.065 -2.508 1.00 10.00 H new ATOM 0 HE21 GLN B 72 -3.947 15.932 -2.111 1.00 10.00 H new ATOM 0 HE22 GLN B 72 -4.209 17.264 -0.981 1.00 10.00 H new ATOM 1101 N GLN B 73 -0.452 12.865 -3.712 1.00 10.00 N ATOM 1102 CA GLN B 73 -0.946 12.799 -5.086 1.00 10.00 C ATOM 1103 C GLN B 73 -0.187 11.811 -5.992 1.00 10.00 C ATOM 1104 O GLN B 73 0.672 11.038 -5.555 1.00 10.00 O ATOM 1105 CB GLN B 73 -1.109 14.226 -5.667 1.00 10.00 C ATOM 1106 CG GLN B 73 0.071 15.204 -5.489 1.00 10.00 C ATOM 1107 CD GLN B 73 1.433 14.572 -5.746 1.00 10.00 C ATOM 1108 OE1 GLN B 73 1.674 13.909 -6.748 1.00 10.00 O ATOM 1109 NE2 GLN B 73 2.335 14.746 -4.813 1.00 10.00 N ATOM 0 H GLN B 73 0.508 13.201 -3.641 1.00 10.00 H new ATOM 0 HA GLN B 73 -1.940 12.354 -5.054 1.00 10.00 H new ATOM 0 HB2 GLN B 73 -1.312 14.134 -6.734 1.00 10.00 H new ATOM 0 HB3 GLN B 73 -1.991 14.676 -5.212 1.00 10.00 H new ATOM 0 HG2 GLN B 73 -0.062 16.047 -6.166 1.00 10.00 H new ATOM 0 HG3 GLN B 73 0.051 15.603 -4.475 1.00 10.00 H new ATOM 0 HE21 GLN B 73 2.114 15.302 -3.987 1.00 10.00 H new ATOM 0 HE22 GLN B 73 3.259 14.326 -4.912 1.00 10.00 H new ATOM 1118 N GLN B 74 -0.547 11.820 -7.275 1.00 10.00 N ATOM 1119 CA GLN B 74 -0.177 10.884 -8.327 1.00 10.00 C ATOM 1120 C GLN B 74 1.316 10.537 -8.458 1.00 10.00 C ATOM 1121 O GLN B 74 1.575 9.511 -9.083 1.00 10.00 O ATOM 1122 CB GLN B 74 -0.758 11.380 -9.672 1.00 10.00 C ATOM 1123 CG GLN B 74 -2.252 11.055 -9.850 1.00 10.00 C ATOM 1124 CD GLN B 74 -3.152 11.684 -8.793 1.00 10.00 C ATOM 1125 OE1 GLN B 74 -2.929 12.795 -8.338 1.00 10.00 O ATOM 1126 NE2 GLN B 74 -4.186 11.000 -8.336 1.00 10.00 N ATOM 0 H GLN B 74 -1.161 12.551 -7.633 1.00 10.00 H new ATOM 0 HA GLN B 74 -0.616 9.932 -8.028 1.00 10.00 H new ATOM 0 HB2 GLN B 74 -0.617 12.458 -9.744 1.00 10.00 H new ATOM 0 HB3 GLN B 74 -0.196 10.930 -10.490 1.00 10.00 H new ATOM 0 HG2 GLN B 74 -2.573 11.395 -10.835 1.00 10.00 H new ATOM 0 HG3 GLN B 74 -2.383 9.973 -9.828 1.00 10.00 H new ATOM 0 HE21 GLN B 74 -4.386 10.071 -8.705 1.00 10.00 H new ATOM 0 HE22 GLN B 74 -4.784 11.401 -7.614 1.00 10.00 H new ATOM 1135 N GLN B 75 2.295 11.249 -7.869 1.00 10.00 N ATOM 1136 CA GLN B 75 3.671 10.720 -7.851 1.00 10.00 C ATOM 1137 C GLN B 75 3.795 9.381 -7.125 1.00 10.00 C ATOM 1138 O GLN B 75 4.693 8.615 -7.461 1.00 10.00 O ATOM 1139 CB GLN B 75 4.704 11.775 -7.407 1.00 10.00 C ATOM 1140 CG GLN B 75 5.384 11.595 -6.031 1.00 10.00 C ATOM 1141 CD GLN B 75 4.496 11.977 -4.851 1.00 10.00 C ATOM 1142 OE1 GLN B 75 4.439 13.132 -4.482 1.00 10.00 O ATOM 1143 NE2 GLN B 75 3.818 11.046 -4.210 1.00 10.00 N ATOM 0 H GLN B 75 2.169 12.155 -7.417 1.00 10.00 H new ATOM 0 HA GLN B 75 3.922 10.490 -8.886 1.00 10.00 H new ATOM 0 HB2 GLN B 75 5.488 11.813 -8.164 1.00 10.00 H new ATOM 0 HB3 GLN B 75 4.210 12.747 -7.410 1.00 10.00 H new ATOM 0 HG2 GLN B 75 5.691 10.555 -5.921 1.00 10.00 H new ATOM 0 HG3 GLN B 75 6.291 12.200 -6.002 1.00 10.00 H new ATOM 0 HE21 GLN B 75 3.866 10.075 -4.520 1.00 10.00 H new ATOM 0 HE22 GLN B 75 3.245 11.296 -3.404 1.00 10.00 H new ATOM 1152 N VAL B 76 2.898 9.029 -6.182 1.00 10.00 N ATOM 1153 CA VAL B 76 2.891 7.657 -5.651 1.00 10.00 C ATOM 1154 C VAL B 76 2.376 6.737 -6.750 1.00 10.00 C ATOM 1155 O VAL B 76 3.039 5.770 -7.122 1.00 10.00 O ATOM 1156 CB VAL B 76 2.022 7.445 -4.393 1.00 10.00 C ATOM 1157 CG1 VAL B 76 2.498 6.173 -3.695 1.00 10.00 C ATOM 1158 CG2 VAL B 76 2.071 8.537 -3.339 1.00 10.00 C ATOM 0 H VAL B 76 2.194 9.652 -5.786 1.00 10.00 H new ATOM 0 HA VAL B 76 3.914 7.439 -5.346 1.00 10.00 H new ATOM 0 HB VAL B 76 1.000 7.419 -4.772 1.00 10.00 H new ATOM 0 HG11 VAL B 76 1.898 6.002 -2.801 1.00 10.00 H new ATOM 0 HG12 VAL B 76 2.391 5.325 -4.372 1.00 10.00 H new ATOM 0 HG13 VAL B 76 3.545 6.283 -3.413 1.00 10.00 H new ATOM 0 HG21 VAL B 76 1.419 8.270 -2.508 1.00 10.00 H new ATOM 0 HG22 VAL B 76 3.093 8.648 -2.977 1.00 10.00 H new ATOM 0 HG23 VAL B 76 1.736 9.478 -3.775 1.00 10.00 H new ATOM 1168 N LEU B 77 1.190 7.059 -7.276 1.00 10.00 N ATOM 1169 CA LEU B 77 0.438 6.242 -8.220 1.00 10.00 C ATOM 1170 C LEU B 77 1.229 5.969 -9.514 1.00 10.00 C ATOM 1171 O LEU B 77 1.200 4.860 -10.054 1.00 10.00 O ATOM 1172 CB LEU B 77 -0.936 6.908 -8.479 1.00 10.00 C ATOM 1173 CG LEU B 77 -2.100 5.929 -8.248 1.00 10.00 C ATOM 1174 CD1 LEU B 77 -3.425 6.691 -8.293 1.00 10.00 C ATOM 1175 CD2 LEU B 77 -2.115 4.814 -9.301 1.00 10.00 C ATOM 0 H LEU B 77 0.713 7.930 -7.044 1.00 10.00 H new ATOM 0 HA LEU B 77 0.266 5.257 -7.785 1.00 10.00 H new ATOM 0 HB2 LEU B 77 -1.051 7.770 -7.822 1.00 10.00 H new ATOM 0 HB3 LEU B 77 -0.972 7.280 -9.503 1.00 10.00 H new ATOM 0 HG LEU B 77 -1.965 5.468 -7.269 1.00 10.00 H new ATOM 0 HD11 LEU B 77 -4.250 5.997 -8.129 1.00 10.00 H new ATOM 0 HD12 LEU B 77 -3.433 7.454 -7.514 1.00 10.00 H new ATOM 0 HD13 LEU B 77 -3.539 7.166 -9.267 1.00 10.00 H new ATOM 0 HD21 LEU B 77 -2.950 4.141 -9.107 1.00 10.00 H new ATOM 0 HD22 LEU B 77 -2.225 5.252 -10.293 1.00 10.00 H new ATOM 0 HD23 LEU B 77 -1.180 4.255 -9.253 1.00 10.00 H new ATOM 1187 N ASN B 78 2.004 6.962 -9.951 1.00 10.00 N ATOM 1188 CA ASN B 78 2.884 6.896 -11.093 1.00 10.00 C ATOM 1189 C ASN B 78 4.027 5.901 -10.903 1.00 10.00 C ATOM 1190 O ASN B 78 4.408 5.275 -11.894 1.00 10.00 O ATOM 1191 CB ASN B 78 3.414 8.307 -11.392 1.00 10.00 C ATOM 1192 CG ASN B 78 4.236 8.326 -12.666 1.00 10.00 C ATOM 1193 OD1 ASN B 78 3.753 7.948 -13.728 1.00 10.00 O ATOM 1194 ND2 ASN B 78 5.492 8.712 -12.607 1.00 10.00 N ATOM 0 H ASN B 78 2.028 7.871 -9.490 1.00 10.00 H new ATOM 0 HA ASN B 78 2.313 6.527 -11.945 1.00 10.00 H new ATOM 0 HB2 ASN B 78 2.578 9.000 -11.485 1.00 10.00 H new ATOM 0 HB3 ASN B 78 4.024 8.654 -10.558 1.00 10.00 H new ATOM 0 HD21 ASN B 78 6.070 8.698 -13.447 1.00 10.00 H new ATOM 0 HD22 ASN B 78 5.888 9.025 -11.721 1.00 10.00 H new ATOM 1201 N ILE B 79 4.550 5.712 -9.679 1.00 10.00 N ATOM 1202 CA ILE B 79 5.575 4.693 -9.439 1.00 10.00 C ATOM 1203 C ILE B 79 4.893 3.347 -9.153 1.00 10.00 C ATOM 1204 O ILE B 79 5.245 2.360 -9.798 1.00 10.00 O ATOM 1205 CB ILE B 79 6.573 5.124 -8.348 1.00 10.00 C ATOM 1206 CG1 ILE B 79 7.196 6.517 -8.633 1.00 10.00 C ATOM 1207 CG2 ILE B 79 7.709 4.075 -8.290 1.00 10.00 C ATOM 1208 CD1 ILE B 79 7.798 7.161 -7.380 1.00 10.00 C ATOM 0 H ILE B 79 4.281 6.246 -8.853 1.00 10.00 H new ATOM 0 HA ILE B 79 6.183 4.572 -10.335 1.00 10.00 H new ATOM 0 HB ILE B 79 6.034 5.191 -7.403 1.00 10.00 H new ATOM 0 HG12 ILE B 79 7.971 6.416 -9.393 1.00 10.00 H new ATOM 0 HG13 ILE B 79 6.431 7.176 -9.044 1.00 10.00 H new ATOM 0 HG21 ILE B 79 8.429 4.360 -7.523 1.00 10.00 H new ATOM 0 HG22 ILE B 79 7.290 3.098 -8.049 1.00 10.00 H new ATOM 0 HG23 ILE B 79 8.209 4.027 -9.257 1.00 10.00 H new ATOM 0 HD11 ILE B 79 8.219 8.133 -7.637 1.00 10.00 H new ATOM 0 HD12 ILE B 79 7.020 7.290 -6.628 1.00 10.00 H new ATOM 0 HD13 ILE B 79 8.584 6.519 -6.982 1.00 10.00 H new ATOM 1220 N LEU B 80 3.849 3.342 -8.290 1.00 10.00 N ATOM 1221 CA LEU B 80 2.981 2.215 -7.931 1.00 10.00 C ATOM 1222 C LEU B 80 2.645 1.332 -9.135 1.00 10.00 C ATOM 1223 O LEU B 80 2.857 0.112 -9.100 1.00 10.00 O ATOM 1224 CB LEU B 80 1.661 2.776 -7.351 1.00 10.00 C ATOM 1225 CG LEU B 80 1.516 2.886 -5.822 1.00 10.00 C ATOM 1226 CD1 LEU B 80 0.365 3.822 -5.418 1.00 10.00 C ATOM 1227 CD2 LEU B 80 1.127 1.518 -5.257 1.00 10.00 C ATOM 0 H LEU B 80 3.579 4.192 -7.795 1.00 10.00 H new ATOM 0 HA LEU B 80 3.514 1.602 -7.204 1.00 10.00 H new ATOM 0 HB2 LEU B 80 1.512 3.771 -7.770 1.00 10.00 H new ATOM 0 HB3 LEU B 80 0.847 2.151 -7.717 1.00 10.00 H new ATOM 0 HG LEU B 80 2.468 3.259 -5.444 1.00 10.00 H new ATOM 0 HD11 LEU B 80 0.299 3.870 -4.331 1.00 10.00 H new ATOM 0 HD12 LEU B 80 0.551 4.820 -5.814 1.00 10.00 H new ATOM 0 HD13 LEU B 80 -0.573 3.441 -5.822 1.00 10.00 H new ATOM 0 HD21 LEU B 80 1.022 1.588 -4.174 1.00 10.00 H new ATOM 0 HD22 LEU B 80 0.180 1.200 -5.693 1.00 10.00 H new ATOM 0 HD23 LEU B 80 1.901 0.790 -5.501 1.00 10.00 H new ATOM 1239 N LYS B 81 2.120 1.933 -10.212 1.00 10.00 N ATOM 1240 CA LYS B 81 1.680 1.206 -11.409 1.00 10.00 C ATOM 1241 C LYS B 81 2.780 0.381 -12.103 1.00 10.00 C ATOM 1242 O LYS B 81 2.458 -0.550 -12.839 1.00 10.00 O ATOM 1243 CB LYS B 81 1.002 2.181 -12.384 1.00 10.00 C ATOM 1244 CG LYS B 81 2.016 3.096 -13.101 1.00 10.00 C ATOM 1245 CD LYS B 81 1.324 4.181 -13.932 1.00 10.00 C ATOM 1246 CE LYS B 81 2.271 4.718 -15.023 1.00 10.00 C ATOM 1247 NZ LYS B 81 3.493 5.369 -14.481 1.00 10.00 N ATOM 0 H LYS B 81 1.988 2.942 -10.277 1.00 10.00 H new ATOM 0 HA LYS B 81 0.961 0.460 -11.070 1.00 10.00 H new ATOM 0 HB2 LYS B 81 0.439 1.615 -13.126 1.00 10.00 H new ATOM 0 HB3 LYS B 81 0.285 2.795 -11.840 1.00 10.00 H new ATOM 0 HG2 LYS B 81 2.666 3.565 -12.362 1.00 10.00 H new ATOM 0 HG3 LYS B 81 2.652 2.494 -13.749 1.00 10.00 H new ATOM 0 HD2 LYS B 81 0.424 3.774 -14.393 1.00 10.00 H new ATOM 0 HD3 LYS B 81 1.009 4.998 -13.283 1.00 10.00 H new ATOM 0 HE2 LYS B 81 2.566 3.895 -15.674 1.00 10.00 H new ATOM 0 HE3 LYS B 81 1.731 5.435 -15.641 1.00 10.00 H new ATOM 0 HZ1 LYS B 81 4.318 5.082 -15.045 1.00 10.00 H new ATOM 0 HZ2 LYS B 81 3.385 6.402 -14.526 1.00 10.00 H new ATOM 0 HZ3 LYS B 81 3.632 5.078 -13.492 1.00 10.00 H new ATOM 1261 N SER B 82 4.056 0.691 -11.849 1.00 10.00 N ATOM 1262 CA SER B 82 5.200 -0.049 -12.383 1.00 10.00 C ATOM 1263 C SER B 82 5.485 -1.360 -11.653 1.00 10.00 C ATOM 1264 O SER B 82 6.297 -2.148 -12.131 1.00 10.00 O ATOM 1265 CB SER B 82 6.471 0.818 -12.380 1.00 10.00 C ATOM 1266 OG SER B 82 7.006 1.064 -11.086 1.00 10.00 O ATOM 0 H SER B 82 4.325 1.476 -11.257 1.00 10.00 H new ATOM 0 HA SER B 82 4.921 -0.304 -13.405 1.00 10.00 H new ATOM 0 HB2 SER B 82 7.232 0.329 -12.989 1.00 10.00 H new ATOM 0 HB3 SER B 82 6.247 1.773 -12.856 1.00 10.00 H new ATOM 0 HG SER B 82 6.277 1.268 -10.464 1.00 10.00 H new ATOM 1272 N ASN B 83 4.828 -1.628 -10.518 1.00 10.00 N ATOM 1273 CA ASN B 83 5.156 -2.760 -9.644 1.00 10.00 C ATOM 1274 C ASN B 83 3.890 -3.566 -9.308 1.00 10.00 C ATOM 1275 O ASN B 83 3.374 -3.471 -8.199 1.00 10.00 O ATOM 1276 CB ASN B 83 5.875 -2.233 -8.390 1.00 10.00 C ATOM 1277 CG ASN B 83 6.784 -1.053 -8.662 1.00 10.00 C ATOM 1278 OD1 ASN B 83 6.515 0.051 -8.218 1.00 10.00 O ATOM 1279 ND2 ASN B 83 7.822 -1.217 -9.439 1.00 10.00 N ATOM 0 H ASN B 83 4.050 -1.062 -10.179 1.00 10.00 H new ATOM 0 HA ASN B 83 5.831 -3.447 -10.154 1.00 10.00 H new ATOM 0 HB2 ASN B 83 5.130 -1.943 -7.649 1.00 10.00 H new ATOM 0 HB3 ASN B 83 6.463 -3.040 -7.952 1.00 10.00 H new ATOM 0 HD21 ASN B 83 8.412 -0.420 -9.677 1.00 10.00 H new ATOM 0 HD22 ASN B 83 8.042 -2.142 -9.807 1.00 10.00 H new ATOM 1286 N PRO B 84 3.375 -4.373 -10.262 1.00 10.00 N ATOM 1287 CA PRO B 84 2.070 -5.042 -10.190 1.00 10.00 C ATOM 1288 C PRO B 84 1.703 -5.646 -8.822 1.00 10.00 C ATOM 1289 O PRO B 84 0.679 -5.288 -8.229 1.00 10.00 O ATOM 1290 CB PRO B 84 2.094 -6.065 -11.318 1.00 10.00 C ATOM 1291 CG PRO B 84 2.987 -5.420 -12.374 1.00 10.00 C ATOM 1292 CD PRO B 84 4.002 -4.649 -11.546 1.00 10.00 C ATOM 0 HA PRO B 84 1.270 -4.311 -10.309 1.00 10.00 H new ATOM 0 HB2 PRO B 84 2.497 -7.021 -10.983 1.00 10.00 H new ATOM 0 HB3 PRO B 84 1.093 -6.259 -11.704 1.00 10.00 H new ATOM 0 HG2 PRO B 84 3.467 -6.167 -13.006 1.00 10.00 H new ATOM 0 HG3 PRO B 84 2.421 -4.761 -13.033 1.00 10.00 H new ATOM 0 HD2 PRO B 84 4.914 -5.230 -11.414 1.00 10.00 H new ATOM 0 HD3 PRO B 84 4.284 -3.722 -12.045 1.00 10.00 H new ATOM 1300 N GLN B 85 2.547 -6.537 -8.290 1.00 10.00 N ATOM 1301 CA GLN B 85 2.338 -7.163 -6.977 1.00 10.00 C ATOM 1302 C GLN B 85 2.314 -6.156 -5.817 1.00 10.00 C ATOM 1303 O GLN B 85 1.462 -6.259 -4.938 1.00 10.00 O ATOM 1304 CB GLN B 85 3.423 -8.214 -6.722 1.00 10.00 C ATOM 1305 CG GLN B 85 3.221 -9.453 -7.601 1.00 10.00 C ATOM 1306 CD GLN B 85 4.366 -10.455 -7.533 1.00 10.00 C ATOM 1307 OE1 GLN B 85 4.679 -11.120 -8.514 1.00 10.00 O ATOM 1308 NE2 GLN B 85 5.016 -10.606 -6.386 1.00 10.00 N ATOM 0 H GLN B 85 3.398 -6.846 -8.759 1.00 10.00 H new ATOM 0 HA GLN B 85 1.353 -7.629 -7.010 1.00 10.00 H new ATOM 0 HB2 GLN B 85 4.404 -7.782 -6.920 1.00 10.00 H new ATOM 0 HB3 GLN B 85 3.409 -8.505 -5.672 1.00 10.00 H new ATOM 0 HG2 GLN B 85 2.298 -9.951 -7.303 1.00 10.00 H new ATOM 0 HG3 GLN B 85 3.092 -9.135 -8.635 1.00 10.00 H new ATOM 0 HE21 GLN B 85 4.751 -10.050 -5.573 1.00 10.00 H new ATOM 0 HE22 GLN B 85 5.780 -11.278 -6.318 1.00 10.00 H new ATOM 1317 N LEU B 86 3.226 -5.172 -5.822 1.00 10.00 N ATOM 1318 CA LEU B 86 3.244 -4.054 -4.871 1.00 10.00 C ATOM 1319 C LEU B 86 1.976 -3.214 -4.995 1.00 10.00 C ATOM 1320 O LEU B 86 1.400 -2.838 -3.985 1.00 10.00 O ATOM 1321 CB LEU B 86 4.498 -3.196 -5.122 1.00 10.00 C ATOM 1322 CG LEU B 86 5.093 -2.439 -3.917 1.00 10.00 C ATOM 1323 CD1 LEU B 86 6.120 -1.450 -4.462 1.00 10.00 C ATOM 1324 CD2 LEU B 86 4.074 -1.644 -3.099 1.00 10.00 C ATOM 0 H LEU B 86 3.986 -5.132 -6.501 1.00 10.00 H new ATOM 0 HA LEU B 86 3.277 -4.448 -3.855 1.00 10.00 H new ATOM 0 HB2 LEU B 86 5.274 -3.845 -5.529 1.00 10.00 H new ATOM 0 HB3 LEU B 86 4.257 -2.465 -5.893 1.00 10.00 H new ATOM 0 HG LEU B 86 5.513 -3.190 -3.248 1.00 10.00 H new ATOM 0 HD11 LEU B 86 6.564 -0.894 -3.636 1.00 10.00 H new ATOM 0 HD12 LEU B 86 6.901 -1.993 -4.995 1.00 10.00 H new ATOM 0 HD13 LEU B 86 5.630 -0.756 -5.145 1.00 10.00 H new ATOM 0 HD21 LEU B 86 4.580 -1.145 -2.273 1.00 10.00 H new ATOM 0 HD22 LEU B 86 3.598 -0.899 -3.736 1.00 10.00 H new ATOM 0 HD23 LEU B 86 3.317 -2.321 -2.704 1.00 10.00 H new ATOM 1336 N MET B 87 1.511 -2.953 -6.220 1.00 10.00 N ATOM 1337 CA MET B 87 0.257 -2.251 -6.469 1.00 10.00 C ATOM 1338 C MET B 87 -0.933 -2.992 -5.822 1.00 10.00 C ATOM 1339 O MET B 87 -1.677 -2.392 -5.040 1.00 10.00 O ATOM 1340 CB MET B 87 0.063 -2.045 -7.984 1.00 10.00 C ATOM 1341 CG MET B 87 -0.361 -0.608 -8.293 1.00 10.00 C ATOM 1342 SD MET B 87 -1.970 -0.154 -7.627 1.00 10.00 S ATOM 1343 CE MET B 87 -2.062 1.516 -8.293 1.00 10.00 C ATOM 0 H MET B 87 2.001 -3.227 -7.071 1.00 10.00 H new ATOM 0 HA MET B 87 0.301 -1.267 -6.002 1.00 10.00 H new ATOM 0 HB2 MET B 87 0.991 -2.274 -8.507 1.00 10.00 H new ATOM 0 HB3 MET B 87 -0.692 -2.738 -8.355 1.00 10.00 H new ATOM 0 HG2 MET B 87 0.390 0.074 -7.895 1.00 10.00 H new ATOM 0 HG3 MET B 87 -0.376 -0.470 -9.374 1.00 10.00 H new ATOM 0 HE1 MET B 87 -1.987 2.237 -7.479 1.00 10.00 H new ATOM 0 HE2 MET B 87 -1.242 1.674 -8.994 1.00 10.00 H new ATOM 0 HE3 MET B 87 -3.012 1.650 -8.810 1.00 10.00 H new ATOM 1353 N ALA B 88 -1.096 -4.290 -6.125 1.00 10.00 N ATOM 1354 CA ALA B 88 -2.134 -5.111 -5.490 1.00 10.00 C ATOM 1355 C ALA B 88 -1.962 -5.180 -3.967 1.00 10.00 C ATOM 1356 O ALA B 88 -2.941 -5.063 -3.240 1.00 10.00 O ATOM 1357 CB ALA B 88 -2.175 -6.513 -6.103 1.00 10.00 C ATOM 0 H ALA B 88 -0.523 -4.790 -6.804 1.00 10.00 H new ATOM 0 HA ALA B 88 -3.091 -4.626 -5.683 1.00 10.00 H new ATOM 0 HB1 ALA B 88 -2.952 -7.101 -5.615 1.00 10.00 H new ATOM 0 HB2 ALA B 88 -2.392 -6.438 -7.169 1.00 10.00 H new ATOM 0 HB3 ALA B 88 -1.210 -7.000 -5.963 1.00 10.00 H new ATOM 1363 N ALA B 89 -0.728 -5.349 -3.471 1.00 10.00 N ATOM 1364 CA ALA B 89 -0.430 -5.343 -2.043 1.00 10.00 C ATOM 1365 C ALA B 89 -0.756 -3.994 -1.368 1.00 10.00 C ATOM 1366 O ALA B 89 -1.348 -4.005 -0.295 1.00 10.00 O ATOM 1367 CB ALA B 89 1.036 -5.741 -1.831 1.00 10.00 C ATOM 0 H ALA B 89 0.093 -5.494 -4.059 1.00 10.00 H new ATOM 0 HA ALA B 89 -1.077 -6.075 -1.560 1.00 10.00 H new ATOM 0 HB1 ALA B 89 1.263 -5.738 -0.765 1.00 10.00 H new ATOM 0 HB2 ALA B 89 1.204 -6.739 -2.235 1.00 10.00 H new ATOM 0 HB3 ALA B 89 1.684 -5.029 -2.342 1.00 10.00 H new ATOM 1373 N PHE B 90 -0.454 -2.850 -2.001 1.00 10.00 N ATOM 1374 CA PHE B 90 -0.912 -1.536 -1.560 1.00 10.00 C ATOM 1375 C PHE B 90 -2.433 -1.546 -1.491 1.00 10.00 C ATOM 1376 O PHE B 90 -2.944 -1.365 -0.394 1.00 10.00 O ATOM 1377 CB PHE B 90 -0.391 -0.416 -2.475 1.00 10.00 C ATOM 1378 CG PHE B 90 -1.015 0.965 -2.225 1.00 10.00 C ATOM 1379 CD1 PHE B 90 -0.560 1.794 -1.171 1.00 10.00 C ATOM 1380 CD2 PHE B 90 -2.025 1.461 -3.078 1.00 10.00 C ATOM 1381 CE1 PHE B 90 -1.007 3.116 -1.043 1.00 10.00 C ATOM 1382 CE2 PHE B 90 -2.541 2.748 -2.891 1.00 10.00 C ATOM 1383 CZ PHE B 90 -2.002 3.584 -1.897 1.00 10.00 C ATOM 0 H PHE B 90 0.122 -2.818 -2.842 1.00 10.00 H new ATOM 0 HA PHE B 90 -0.509 -1.329 -0.569 1.00 10.00 H new ATOM 0 HB2 PHE B 90 0.689 -0.338 -2.351 1.00 10.00 H new ATOM 0 HB3 PHE B 90 -0.574 -0.699 -3.512 1.00 10.00 H new ATOM 0 HD1 PHE B 90 0.144 1.400 -0.453 1.00 10.00 H new ATOM 0 HD2 PHE B 90 -2.402 0.843 -3.880 1.00 10.00 H new ATOM 0 HE1 PHE B 90 -0.584 3.765 -0.290 1.00 10.00 H new ATOM 0 HE2 PHE B 90 -3.353 3.099 -3.510 1.00 10.00 H new ATOM 0 HZ PHE B 90 -2.363 4.597 -1.795 1.00 10.00 H new ATOM 1393 N ILE B 91 -3.146 -1.822 -2.592 1.00 10.00 N ATOM 1394 CA ILE B 91 -4.617 -1.877 -2.583 1.00 10.00 C ATOM 1395 C ILE B 91 -5.112 -2.749 -1.412 1.00 10.00 C ATOM 1396 O ILE B 91 -5.795 -2.239 -0.528 1.00 10.00 O ATOM 1397 CB ILE B 91 -5.183 -2.283 -3.969 1.00 10.00 C ATOM 1398 CG1 ILE B 91 -4.889 -1.165 -4.988 1.00 10.00 C ATOM 1399 CG2 ILE B 91 -6.703 -2.525 -3.871 1.00 10.00 C ATOM 1400 CD1 ILE B 91 -5.317 -1.475 -6.429 1.00 10.00 C ATOM 0 H ILE B 91 -2.728 -2.011 -3.503 1.00 10.00 H new ATOM 0 HA ILE B 91 -5.013 -0.877 -2.406 1.00 10.00 H new ATOM 0 HB ILE B 91 -4.705 -3.206 -4.298 1.00 10.00 H new ATOM 0 HG12 ILE B 91 -5.393 -0.255 -4.663 1.00 10.00 H new ATOM 0 HG13 ILE B 91 -3.819 -0.957 -4.979 1.00 10.00 H new ATOM 0 HG21 ILE B 91 -7.090 -2.809 -4.849 1.00 10.00 H new ATOM 0 HG22 ILE B 91 -6.899 -3.325 -3.157 1.00 10.00 H new ATOM 0 HG23 ILE B 91 -7.196 -1.612 -3.537 1.00 10.00 H new ATOM 0 HD11 ILE B 91 -5.069 -0.630 -7.072 1.00 10.00 H new ATOM 0 HD12 ILE B 91 -4.794 -2.364 -6.781 1.00 10.00 H new ATOM 0 HD13 ILE B 91 -6.392 -1.651 -6.459 1.00 10.00 H new ATOM 1412 N LYS B 92 -4.698 -4.024 -1.367 1.00 10.00 N ATOM 1413 CA LYS B 92 -5.087 -4.990 -0.337 1.00 10.00 C ATOM 1414 C LYS B 92 -4.786 -4.478 1.081 1.00 10.00 C ATOM 1415 O LYS B 92 -5.699 -4.421 1.912 1.00 10.00 O ATOM 1416 CB LYS B 92 -4.426 -6.343 -0.643 1.00 10.00 C ATOM 1417 CG LYS B 92 -4.735 -7.474 0.337 1.00 10.00 C ATOM 1418 CD LYS B 92 -6.218 -7.883 0.405 1.00 10.00 C ATOM 1419 CE LYS B 92 -7.016 -7.012 1.378 1.00 10.00 C ATOM 1420 NZ LYS B 92 -8.378 -7.523 1.573 1.00 10.00 N ATOM 0 H LYS B 92 -4.068 -4.419 -2.065 1.00 10.00 H new ATOM 0 HA LYS B 92 -6.168 -5.126 -0.361 1.00 10.00 H new ATOM 0 HB2 LYS B 92 -4.733 -6.658 -1.640 1.00 10.00 H new ATOM 0 HB3 LYS B 92 -3.346 -6.199 -0.673 1.00 10.00 H new ATOM 0 HG2 LYS B 92 -4.144 -8.347 0.060 1.00 10.00 H new ATOM 0 HG3 LYS B 92 -4.410 -7.172 1.333 1.00 10.00 H new ATOM 0 HD2 LYS B 92 -6.659 -7.811 -0.589 1.00 10.00 H new ATOM 0 HD3 LYS B 92 -6.291 -8.927 0.711 1.00 10.00 H new ATOM 0 HE2 LYS B 92 -6.501 -6.973 2.338 1.00 10.00 H new ATOM 0 HE3 LYS B 92 -7.061 -5.991 0.999 1.00 10.00 H new ATOM 0 HZ1 LYS B 92 -8.888 -6.907 2.238 1.00 10.00 H new ATOM 0 HZ2 LYS B 92 -8.878 -7.536 0.661 1.00 10.00 H new ATOM 0 HZ3 LYS B 92 -8.335 -8.488 1.958 1.00 10.00 H new ATOM 1434 N GLN B 93 -3.532 -4.134 1.387 1.00 10.00 N ATOM 1435 CA GLN B 93 -3.132 -3.711 2.723 1.00 10.00 C ATOM 1436 C GLN B 93 -3.761 -2.360 3.098 1.00 10.00 C ATOM 1437 O GLN B 93 -4.168 -2.210 4.241 1.00 10.00 O ATOM 1438 CB GLN B 93 -1.596 -3.689 2.887 1.00 10.00 C ATOM 1439 CG GLN B 93 -1.122 -4.175 4.270 1.00 10.00 C ATOM 1440 CD GLN B 93 -1.796 -3.533 5.485 1.00 10.00 C ATOM 1441 OE1 GLN B 93 -2.635 -4.133 6.135 1.00 10.00 O ATOM 1442 NE2 GLN B 93 -1.460 -2.315 5.852 1.00 10.00 N ATOM 0 H GLN B 93 -2.768 -4.142 0.711 1.00 10.00 H new ATOM 0 HA GLN B 93 -3.515 -4.455 3.422 1.00 10.00 H new ATOM 0 HB2 GLN B 93 -1.147 -4.315 2.116 1.00 10.00 H new ATOM 0 HB3 GLN B 93 -1.235 -2.674 2.723 1.00 10.00 H new ATOM 0 HG2 GLN B 93 -1.275 -5.253 4.324 1.00 10.00 H new ATOM 0 HG3 GLN B 93 -0.048 -4.002 4.344 1.00 10.00 H new ATOM 0 HE21 GLN B 93 -0.760 -1.797 5.321 1.00 10.00 H new ATOM 0 HE22 GLN B 93 -1.900 -1.889 6.668 1.00 10.00 H new ATOM 1451 N ARG B 94 -3.921 -1.396 2.171 1.00 10.00 N ATOM 1452 CA ARG B 94 -4.706 -0.172 2.413 1.00 10.00 C ATOM 1453 C ARG B 94 -6.129 -0.524 2.862 1.00 10.00 C ATOM 1454 O ARG B 94 -6.569 -0.028 3.896 1.00 10.00 O ATOM 1455 CB ARG B 94 -4.726 0.763 1.192 1.00 10.00 C ATOM 1456 CG ARG B 94 -3.395 1.464 0.859 1.00 10.00 C ATOM 1457 CD ARG B 94 -2.819 2.313 1.995 1.00 10.00 C ATOM 1458 NE ARG B 94 -3.721 3.384 2.440 1.00 10.00 N ATOM 1459 CZ ARG B 94 -3.603 4.065 3.568 1.00 10.00 C ATOM 1460 NH1 ARG B 94 -2.721 3.787 4.499 1.00 10.00 N ATOM 1461 NH2 ARG B 94 -4.380 5.077 3.828 1.00 10.00 N ATOM 0 H ARG B 94 -3.512 -1.444 1.238 1.00 10.00 H new ATOM 0 HA ARG B 94 -4.212 0.374 3.217 1.00 10.00 H new ATOM 0 HB2 ARG B 94 -5.038 0.186 0.322 1.00 10.00 H new ATOM 0 HB3 ARG B 94 -5.486 1.527 1.356 1.00 10.00 H new ATOM 0 HG2 ARG B 94 -2.661 0.708 0.581 1.00 10.00 H new ATOM 0 HG3 ARG B 94 -3.543 2.101 -0.013 1.00 10.00 H new ATOM 0 HD2 ARG B 94 -2.590 1.666 2.842 1.00 10.00 H new ATOM 0 HD3 ARG B 94 -1.878 2.754 1.667 1.00 10.00 H new ATOM 0 HE ARG B 94 -4.502 3.622 1.829 1.00 10.00 H new ATOM 0 HH11 ARG B 94 -2.076 3.007 4.374 1.00 10.00 H new ATOM 0 HH12 ARG B 94 -2.680 4.351 5.348 1.00 10.00 H new ATOM 0 HH21 ARG B 94 -5.095 5.357 3.156 1.00 10.00 H new ATOM 0 HH22 ARG B 94 -4.274 5.590 4.703 1.00 10.00 H new ATOM 1475 N THR B 95 -6.841 -1.413 2.146 1.00 10.00 N ATOM 1476 CA THR B 95 -8.187 -1.870 2.563 1.00 10.00 C ATOM 1477 C THR B 95 -8.162 -2.508 3.963 1.00 10.00 C ATOM 1478 O THR B 95 -9.010 -2.199 4.804 1.00 10.00 O ATOM 1479 CB THR B 95 -8.817 -2.853 1.554 1.00 10.00 C ATOM 1480 OG1 THR B 95 -8.472 -2.602 0.214 1.00 10.00 O ATOM 1481 CG2 THR B 95 -10.336 -2.735 1.584 1.00 10.00 C ATOM 0 H THR B 95 -6.511 -1.831 1.276 1.00 10.00 H new ATOM 0 HA THR B 95 -8.809 -0.975 2.594 1.00 10.00 H new ATOM 0 HB THR B 95 -8.442 -3.830 1.860 1.00 10.00 H new ATOM 0 HG1 THR B 95 -7.499 -2.659 0.111 1.00 10.00 H new ATOM 0 HG21 THR B 95 -10.769 -3.433 0.868 1.00 10.00 H new ATOM 0 HG22 THR B 95 -10.699 -2.969 2.585 1.00 10.00 H new ATOM 0 HG23 THR B 95 -10.627 -1.718 1.321 1.00 10.00 H new ATOM 1489 N ALA B 96 -7.174 -3.363 4.247 1.00 10.00 N ATOM 1490 CA ALA B 96 -6.976 -3.981 5.551 1.00 10.00 C ATOM 1491 C ALA B 96 -6.676 -2.947 6.656 1.00 10.00 C ATOM 1492 O ALA B 96 -7.295 -2.992 7.718 1.00 10.00 O ATOM 1493 CB ALA B 96 -5.899 -5.060 5.444 1.00 10.00 C ATOM 0 H ALA B 96 -6.478 -3.647 3.558 1.00 10.00 H new ATOM 0 HA ALA B 96 -7.909 -4.456 5.855 1.00 10.00 H new ATOM 0 HB1 ALA B 96 -5.750 -5.523 6.419 1.00 10.00 H new ATOM 0 HB2 ALA B 96 -6.213 -5.818 4.727 1.00 10.00 H new ATOM 0 HB3 ALA B 96 -4.964 -4.609 5.110 1.00 10.00 H new ATOM 1499 N LYS B 97 -5.793 -1.965 6.397 1.00 10.00 N ATOM 1500 CA LYS B 97 -5.505 -0.822 7.280 1.00 10.00 C ATOM 1501 C LYS B 97 -6.789 -0.075 7.623 1.00 10.00 C ATOM 1502 O LYS B 97 -7.011 0.229 8.797 1.00 10.00 O ATOM 1503 CB LYS B 97 -4.365 0.069 6.706 1.00 10.00 C ATOM 1504 CG LYS B 97 -4.733 1.481 6.215 1.00 10.00 C ATOM 1505 CD LYS B 97 -4.756 2.503 7.360 1.00 10.00 C ATOM 1506 CE LYS B 97 -5.695 3.682 7.073 1.00 10.00 C ATOM 1507 NZ LYS B 97 -5.661 4.641 8.203 1.00 10.00 N ATOM 0 H LYS B 97 -5.243 -1.946 5.538 1.00 10.00 H new ATOM 0 HA LYS B 97 -5.115 -1.188 8.230 1.00 10.00 H new ATOM 0 HB2 LYS B 97 -3.600 0.171 7.476 1.00 10.00 H new ATOM 0 HB3 LYS B 97 -3.909 -0.466 5.873 1.00 10.00 H new ATOM 0 HG2 LYS B 97 -4.015 1.800 5.459 1.00 10.00 H new ATOM 0 HG3 LYS B 97 -5.711 1.454 5.734 1.00 10.00 H new ATOM 0 HD2 LYS B 97 -5.069 2.008 8.279 1.00 10.00 H new ATOM 0 HD3 LYS B 97 -3.747 2.879 7.528 1.00 10.00 H new ATOM 0 HE2 LYS B 97 -5.395 4.181 6.152 1.00 10.00 H new ATOM 0 HE3 LYS B 97 -6.712 3.320 6.922 1.00 10.00 H new ATOM 0 HZ1 LYS B 97 -6.286 5.445 7.995 1.00 10.00 H new ATOM 0 HZ2 LYS B 97 -5.984 4.167 9.070 1.00 10.00 H new ATOM 0 HZ3 LYS B 97 -4.689 4.984 8.338 1.00 10.00 H new ATOM 1521 N TYR B 98 -7.663 0.186 6.649 1.00 10.00 N ATOM 1522 CA TYR B 98 -8.950 0.821 6.902 1.00 10.00 C ATOM 1523 C TYR B 98 -9.802 0.009 7.872 1.00 10.00 C ATOM 1524 O TYR B 98 -10.130 0.530 8.935 1.00 10.00 O ATOM 1525 CB TYR B 98 -9.695 1.114 5.607 1.00 10.00 C ATOM 1526 CG TYR B 98 -9.204 2.342 4.884 1.00 10.00 C ATOM 1527 CD1 TYR B 98 -9.243 3.592 5.516 1.00 10.00 C ATOM 1528 CD2 TYR B 98 -8.770 2.241 3.548 1.00 10.00 C ATOM 1529 CE1 TYR B 98 -8.849 4.746 4.824 1.00 10.00 C ATOM 1530 CE2 TYR B 98 -8.415 3.389 2.826 1.00 10.00 C ATOM 1531 CZ TYR B 98 -8.458 4.649 3.473 1.00 10.00 C ATOM 1532 OH TYR B 98 -8.128 5.792 2.831 1.00 10.00 O ATOM 0 H TYR B 98 -7.496 -0.037 5.668 1.00 10.00 H new ATOM 0 HA TYR B 98 -8.747 1.779 7.381 1.00 10.00 H new ATOM 0 HB2 TYR B 98 -9.604 0.253 4.944 1.00 10.00 H new ATOM 0 HB3 TYR B 98 -10.755 1.235 5.829 1.00 10.00 H new ATOM 0 HD1 TYR B 98 -9.578 3.667 6.540 1.00 10.00 H new ATOM 0 HD2 TYR B 98 -8.710 1.271 3.076 1.00 10.00 H new ATOM 0 HE1 TYR B 98 -8.845 5.704 5.323 1.00 10.00 H new ATOM 0 HE2 TYR B 98 -8.113 3.314 1.792 1.00 10.00 H new ATOM 0 HH TYR B 98 -7.154 5.842 2.732 1.00 10.00 H new ATOM 1542 N VAL B 99 -10.134 -1.247 7.562 1.00 10.00 N ATOM 1543 CA VAL B 99 -10.985 -2.038 8.459 1.00 10.00 C ATOM 1544 C VAL B 99 -10.343 -2.306 9.839 1.00 10.00 C ATOM 1545 O VAL B 99 -11.040 -2.528 10.819 1.00 10.00 O ATOM 1546 CB VAL B 99 -11.470 -3.331 7.792 1.00 10.00 C ATOM 1547 CG1 VAL B 99 -12.220 -3.012 6.489 1.00 10.00 C ATOM 1548 CG2 VAL B 99 -10.342 -4.318 7.493 1.00 10.00 C ATOM 0 H VAL B 99 -9.835 -1.731 6.716 1.00 10.00 H new ATOM 0 HA VAL B 99 -11.862 -1.421 8.657 1.00 10.00 H new ATOM 0 HB VAL B 99 -12.138 -3.808 8.509 1.00 10.00 H new ATOM 0 HG11 VAL B 99 -12.558 -3.940 6.027 1.00 10.00 H new ATOM 0 HG12 VAL B 99 -13.081 -2.382 6.710 1.00 10.00 H new ATOM 0 HG13 VAL B 99 -11.553 -2.488 5.804 1.00 10.00 H new ATOM 0 HG21 VAL B 99 -10.755 -5.210 7.022 1.00 10.00 H new ATOM 0 HG22 VAL B 99 -9.621 -3.853 6.821 1.00 10.00 H new ATOM 0 HG23 VAL B 99 -9.845 -4.595 8.423 1.00 10.00 H new