USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 806 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 81 HIS : no HD1:sc= 0.0107 K(o=-0.29,f=-7.2!) USER MOD Set 1.2: B 617 HIS : no HD1:sc= -0.299 K(o=-0.29,f=-1.4) USER MOD Set 2.1: B 549 MET CE :methyl -142:sc= -1.86 (180deg=-4.38!) USER MOD Set 2.2: B 561 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc=-0.00668 X(o=-0.0067,f=0) USER MOD Single : A 88 SER OG : rot -170:sc= -0.0241 USER MOD Single : B 542 GLN : amide:sc= -0.354 K(o=-0.35,f=-3!) USER MOD Single : B 546 THR OG1 : rot 180:sc= 0 USER MOD Single : B 548 SER OG : rot 180:sc= 0 USER MOD Single : B 552 SER OG : rot 77:sc= 0.662 USER MOD Single : B 556 GLN : amide:sc= -0.332 X(o=-0.33,f=-0.15) USER MOD Single : B 558 GLN : amide:sc= -1.22 K(o=-1.2,f=-4!) USER MOD Single : B 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 560 GLN : amide:sc= -3.55 X(o=-3.5,f=-3.8) USER MOD Single : B 571 GLN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : B 573 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 574 HIS : no HD1:sc= -2.23 X(o=-2.2,f=-1.8!) USER MOD Single : B 576 THR OG1 : rot 180:sc= 0 USER MOD Single : B 580 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 582 THR OG1 : rot 68:sc= 1.26 USER MOD Single : B 584 MET CE :methyl 147:sc= -4.35 (180deg=-8.06!) USER MOD Single : B 590 ASN : amide:sc= -0.142 K(o=-0.14,f=-2.6!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 596 MET CE :methyl -143:sc= -1.4 (180deg=-3.13!) USER MOD Single : B 599 SER OG : rot 180:sc= 0 USER MOD Single : B 602 SER OG : rot 180:sc= 0 USER MOD Single : B 605 SER OG : rot 180:sc= 0 USER MOD Single : B 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 615 GLN : amide:sc= -0.11 K(o=-0.11,f=-1.9!) USER MOD Single : B 618 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 620 LYS NZ :NH3+ 134:sc= -0.307 (180deg=-1.77!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 73 3.042 7.398 -9.134 1.00 0.00 N ATOM 2 CA ALA A 73 3.250 6.046 -8.632 1.00 0.00 C ATOM 3 C ALA A 73 4.670 5.567 -8.916 1.00 0.00 C ATOM 4 O ALA A 73 5.126 5.587 -10.060 1.00 0.00 O ATOM 5 CB ALA A 73 2.236 5.093 -9.248 1.00 0.00 C ATOM 0 HA ALA A 73 3.109 6.060 -7.551 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.403 4.086 -8.864 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.228 5.417 -8.990 1.00 0.00 H new ATOM 0 HB3 ALA A 73 2.350 5.092 -10.332 1.00 0.00 H new ATOM 11 N LYS A 74 5.365 5.136 -7.869 1.00 0.00 N ATOM 12 CA LYS A 74 6.733 4.652 -8.005 1.00 0.00 C ATOM 13 C LYS A 74 6.877 3.256 -7.407 1.00 0.00 C ATOM 14 O LYS A 74 7.502 3.062 -6.363 1.00 0.00 O ATOM 15 CB LYS A 74 7.707 5.614 -7.321 1.00 0.00 C ATOM 16 CG LYS A 74 7.319 5.961 -5.894 1.00 0.00 C ATOM 17 CD LYS A 74 6.462 7.215 -5.839 1.00 0.00 C ATOM 18 CE LYS A 74 6.480 7.841 -4.453 1.00 0.00 C ATOM 19 NZ LYS A 74 5.266 8.667 -4.202 1.00 0.00 N ATOM 0 H LYS A 74 5.003 5.112 -6.916 1.00 0.00 H new ATOM 0 HA LYS A 74 6.970 4.600 -9.068 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.702 5.170 -7.320 1.00 0.00 H new ATOM 0 HB3 LYS A 74 7.768 6.532 -7.905 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.774 5.127 -5.451 1.00 0.00 H new ATOM 0 HG3 LYS A 74 8.219 6.107 -5.297 1.00 0.00 H new ATOM 0 HD2 LYS A 74 6.824 7.937 -6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 74 5.437 6.969 -6.115 1.00 0.00 H new ATOM 0 HE2 LYS A 74 6.547 7.055 -3.700 1.00 0.00 H new ATOM 0 HE3 LYS A 74 7.370 8.461 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 5.316 9.076 -3.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 5.215 9.432 -4.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.418 8.070 -4.279 1.00 0.00 H new ATOM 33 N PRO A 75 6.288 2.258 -8.083 1.00 0.00 N ATOM 34 CA PRO A 75 6.340 0.862 -7.637 1.00 0.00 C ATOM 35 C PRO A 75 7.735 0.261 -7.772 1.00 0.00 C ATOM 36 O PRO A 75 8.417 0.471 -8.775 1.00 0.00 O ATOM 37 CB PRO A 75 5.359 0.154 -8.576 1.00 0.00 C ATOM 38 CG PRO A 75 5.331 1.000 -9.802 1.00 0.00 C ATOM 39 CD PRO A 75 5.528 2.415 -9.333 1.00 0.00 C ATOM 0 HA PRO A 75 6.089 0.762 -6.581 1.00 0.00 H new ATOM 0 HB2 PRO A 75 5.689 -0.860 -8.802 1.00 0.00 H new ATOM 0 HB3 PRO A 75 4.369 0.074 -8.127 1.00 0.00 H new ATOM 0 HG2 PRO A 75 6.118 0.706 -10.497 1.00 0.00 H new ATOM 0 HG3 PRO A 75 4.383 0.892 -10.329 1.00 0.00 H new ATOM 0 HD2 PRO A 75 6.077 3.008 -10.065 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.576 2.918 -9.164 1.00 0.00 H new ATOM 47 N PHE A 76 8.153 -0.487 -6.757 1.00 0.00 N ATOM 48 CA PHE A 76 9.467 -1.118 -6.762 1.00 0.00 C ATOM 49 C PHE A 76 9.350 -2.621 -6.528 1.00 0.00 C ATOM 50 O PHE A 76 9.990 -3.419 -7.213 1.00 0.00 O ATOM 51 CB PHE A 76 10.361 -0.492 -5.689 1.00 0.00 C ATOM 52 CG PHE A 76 11.730 -1.107 -5.616 1.00 0.00 C ATOM 53 CD1 PHE A 76 12.291 -1.715 -6.727 1.00 0.00 C ATOM 54 CD2 PHE A 76 12.454 -1.077 -4.436 1.00 0.00 C ATOM 55 CE1 PHE A 76 13.550 -2.282 -6.662 1.00 0.00 C ATOM 56 CE2 PHE A 76 13.714 -1.642 -4.364 1.00 0.00 C ATOM 57 CZ PHE A 76 14.262 -2.245 -5.479 1.00 0.00 C ATOM 0 H PHE A 76 7.600 -0.671 -5.920 1.00 0.00 H new ATOM 0 HA PHE A 76 9.917 -0.954 -7.741 1.00 0.00 H new ATOM 0 HB2 PHE A 76 10.461 0.575 -5.888 1.00 0.00 H new ATOM 0 HB3 PHE A 76 9.874 -0.591 -4.719 1.00 0.00 H new ATOM 0 HD1 PHE A 76 11.739 -1.746 -7.654 1.00 0.00 H new ATOM 0 HD2 PHE A 76 12.029 -0.607 -3.561 1.00 0.00 H new ATOM 0 HE1 PHE A 76 13.976 -2.753 -7.535 1.00 0.00 H new ATOM 0 HE2 PHE A 76 14.268 -1.612 -3.438 1.00 0.00 H new ATOM 0 HZ PHE A 76 15.246 -2.687 -5.426 1.00 0.00 H new ATOM 67 N VAL A 77 8.527 -3.000 -5.555 1.00 0.00 N ATOM 68 CA VAL A 77 8.325 -4.407 -5.230 1.00 0.00 C ATOM 69 C VAL A 77 9.612 -5.204 -5.412 1.00 0.00 C ATOM 70 O VAL A 77 9.745 -6.015 -6.328 1.00 0.00 O ATOM 71 CB VAL A 77 7.220 -5.031 -6.103 1.00 0.00 C ATOM 72 CG1 VAL A 77 5.847 -4.577 -5.632 1.00 0.00 C ATOM 73 CG2 VAL A 77 7.434 -4.677 -7.567 1.00 0.00 C ATOM 0 H VAL A 77 7.990 -2.352 -4.978 1.00 0.00 H new ATOM 0 HA VAL A 77 8.020 -4.450 -4.184 1.00 0.00 H new ATOM 0 HB VAL A 77 7.272 -6.115 -6.004 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.079 -5.028 -6.261 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.697 -4.886 -4.598 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.780 -3.491 -5.700 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.644 -5.126 -8.169 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.410 -3.594 -7.687 1.00 0.00 H new ATOM 0 HG23 VAL A 77 8.401 -5.057 -7.896 1.00 0.00 H new ATOM 83 N PRO A 78 10.584 -4.969 -4.518 1.00 0.00 N ATOM 84 CA PRO A 78 11.878 -5.656 -4.558 1.00 0.00 C ATOM 85 C PRO A 78 11.763 -7.132 -4.192 1.00 0.00 C ATOM 86 O PRO A 78 10.662 -7.668 -4.074 1.00 0.00 O ATOM 87 CB PRO A 78 12.709 -4.909 -3.512 1.00 0.00 C ATOM 88 CG PRO A 78 11.707 -4.338 -2.570 1.00 0.00 C ATOM 89 CD PRO A 78 10.495 -4.016 -3.400 1.00 0.00 C ATOM 0 HA PRO A 78 12.314 -5.644 -5.557 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.397 -5.581 -2.999 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.312 -4.126 -3.971 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.462 -5.050 -1.782 1.00 0.00 H new ATOM 0 HG3 PRO A 78 12.095 -3.444 -2.082 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.573 -4.147 -2.833 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.510 -2.984 -3.750 1.00 0.00 H new ATOM 97 N ASN A 79 12.907 -7.784 -4.012 1.00 0.00 N ATOM 98 CA ASN A 79 12.934 -9.198 -3.659 1.00 0.00 C ATOM 99 C ASN A 79 13.827 -9.439 -2.446 1.00 0.00 C ATOM 100 O ASN A 79 15.054 -9.447 -2.556 1.00 0.00 O ATOM 101 CB ASN A 79 13.428 -10.032 -4.843 1.00 0.00 C ATOM 102 CG ASN A 79 12.358 -10.223 -5.901 1.00 0.00 C ATOM 103 OD1 ASN A 79 12.466 -9.700 -7.011 1.00 0.00 O ATOM 104 ND2 ASN A 79 11.318 -10.975 -5.562 1.00 0.00 N ATOM 0 H ASN A 79 13.828 -7.355 -4.105 1.00 0.00 H new ATOM 0 HA ASN A 79 11.918 -9.503 -3.407 1.00 0.00 H new ATOM 0 HB2 ASN A 79 14.295 -9.546 -5.290 1.00 0.00 H new ATOM 0 HB3 ASN A 79 13.759 -11.007 -4.485 1.00 0.00 H new ATOM 0 HD21 ASN A 79 10.567 -11.139 -6.233 1.00 0.00 H new ATOM 0 HD22 ASN A 79 11.270 -11.389 -4.631 1.00 0.00 H new ATOM 111 N VAL A 80 13.204 -9.637 -1.289 1.00 0.00 N ATOM 112 CA VAL A 80 13.941 -9.880 -0.055 1.00 0.00 C ATOM 113 C VAL A 80 14.998 -10.962 -0.250 1.00 0.00 C ATOM 114 O VAL A 80 16.023 -10.974 0.432 1.00 0.00 O ATOM 115 CB VAL A 80 12.999 -10.298 1.090 1.00 0.00 C ATOM 116 CG1 VAL A 80 12.132 -11.473 0.665 1.00 0.00 C ATOM 117 CG2 VAL A 80 13.797 -10.638 2.339 1.00 0.00 C ATOM 0 H VAL A 80 12.190 -9.634 -1.180 1.00 0.00 H new ATOM 0 HA VAL A 80 14.429 -8.943 0.211 1.00 0.00 H new ATOM 0 HB VAL A 80 12.344 -9.459 1.323 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.473 -11.755 1.486 1.00 0.00 H new ATOM 0 HG12 VAL A 80 11.533 -11.189 -0.200 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.768 -12.319 0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 80 13.116 -10.931 3.138 1.00 0.00 H new ATOM 0 HG22 VAL A 80 14.478 -11.461 2.123 1.00 0.00 H new ATOM 0 HG23 VAL A 80 14.370 -9.766 2.653 1.00 0.00 H new ATOM 127 N HIS A 81 14.741 -11.870 -1.186 1.00 0.00 N ATOM 128 CA HIS A 81 15.670 -12.957 -1.472 1.00 0.00 C ATOM 129 C HIS A 81 16.853 -12.457 -2.296 1.00 0.00 C ATOM 130 O HIS A 81 17.100 -12.939 -3.401 1.00 0.00 O ATOM 131 CB HIS A 81 14.955 -14.085 -2.217 1.00 0.00 C ATOM 132 CG HIS A 81 13.641 -14.465 -1.608 1.00 0.00 C ATOM 133 ND1 HIS A 81 12.442 -13.903 -1.995 1.00 0.00 N ATOM 134 CD2 HIS A 81 13.340 -15.358 -0.637 1.00 0.00 C ATOM 135 CE1 HIS A 81 11.461 -14.433 -1.286 1.00 0.00 C ATOM 136 NE2 HIS A 81 11.979 -15.319 -0.455 1.00 0.00 N ATOM 0 H HIS A 81 13.897 -11.875 -1.759 1.00 0.00 H new ATOM 0 HA HIS A 81 16.046 -13.340 -0.523 1.00 0.00 H new ATOM 0 HB2 HIS A 81 14.793 -13.781 -3.251 1.00 0.00 H new ATOM 0 HB3 HIS A 81 15.602 -14.962 -2.241 1.00 0.00 H new ATOM 0 HD2 HIS A 81 14.040 -15.985 -0.104 1.00 0.00 H new ATOM 0 HE1 HIS A 81 10.414 -14.184 -1.372 1.00 0.00 H new ATOM 0 HE2 HIS A 81 11.454 -15.883 0.213 1.00 0.00 H new ATOM 144 N ALA A 82 17.581 -11.488 -1.751 1.00 0.00 N ATOM 145 CA ALA A 82 18.738 -10.924 -2.435 1.00 0.00 C ATOM 146 C ALA A 82 19.981 -10.986 -1.554 1.00 0.00 C ATOM 147 O ALA A 82 20.158 -10.164 -0.656 1.00 0.00 O ATOM 148 CB ALA A 82 18.456 -9.489 -2.853 1.00 0.00 C ATOM 0 H ALA A 82 17.390 -11.077 -0.837 1.00 0.00 H new ATOM 0 HA ALA A 82 18.928 -11.520 -3.328 1.00 0.00 H new ATOM 0 HB1 ALA A 82 19.329 -9.080 -3.363 1.00 0.00 H new ATOM 0 HB2 ALA A 82 17.599 -9.468 -3.527 1.00 0.00 H new ATOM 0 HB3 ALA A 82 18.238 -8.889 -1.970 1.00 0.00 H new ATOM 154 N ALA A 83 20.838 -11.968 -1.816 1.00 0.00 N ATOM 155 CA ALA A 83 22.065 -12.136 -1.047 1.00 0.00 C ATOM 156 C ALA A 83 22.894 -10.856 -1.049 1.00 0.00 C ATOM 157 O ALA A 83 22.549 -9.884 -1.720 1.00 0.00 O ATOM 158 CB ALA A 83 22.879 -13.296 -1.600 1.00 0.00 C ATOM 0 H ALA A 83 20.705 -12.659 -2.555 1.00 0.00 H new ATOM 0 HA ALA A 83 21.791 -12.358 -0.016 1.00 0.00 H new ATOM 0 HB1 ALA A 83 23.793 -13.410 -1.016 1.00 0.00 H new ATOM 0 HB2 ALA A 83 22.293 -14.213 -1.540 1.00 0.00 H new ATOM 0 HB3 ALA A 83 23.136 -13.097 -2.641 1.00 0.00 H new ATOM 164 N GLU A 84 23.988 -10.864 -0.294 1.00 0.00 N ATOM 165 CA GLU A 84 24.865 -9.702 -0.209 1.00 0.00 C ATOM 166 C GLU A 84 25.253 -9.210 -1.600 1.00 0.00 C ATOM 167 O GLU A 84 25.496 -10.006 -2.507 1.00 0.00 O ATOM 168 CB GLU A 84 26.123 -10.042 0.593 1.00 0.00 C ATOM 169 CG GLU A 84 25.900 -10.063 2.096 1.00 0.00 C ATOM 170 CD GLU A 84 26.954 -10.869 2.830 1.00 0.00 C ATOM 171 OE1 GLU A 84 28.014 -10.297 3.160 1.00 0.00 O ATOM 172 OE2 GLU A 84 26.719 -12.070 3.075 1.00 0.00 O ATOM 0 H GLU A 84 24.288 -11.661 0.267 1.00 0.00 H new ATOM 0 HA GLU A 84 24.322 -8.906 0.301 1.00 0.00 H new ATOM 0 HB2 GLU A 84 26.494 -11.017 0.276 1.00 0.00 H new ATOM 0 HB3 GLU A 84 26.900 -9.314 0.360 1.00 0.00 H new ATOM 0 HG2 GLU A 84 25.901 -9.041 2.474 1.00 0.00 H new ATOM 0 HG3 GLU A 84 24.916 -10.480 2.308 1.00 0.00 H new ATOM 179 N PHE A 85 25.307 -7.892 -1.761 1.00 0.00 N ATOM 180 CA PHE A 85 25.663 -7.292 -3.042 1.00 0.00 C ATOM 181 C PHE A 85 27.086 -7.671 -3.443 1.00 0.00 C ATOM 182 O PHE A 85 28.008 -7.614 -2.630 1.00 0.00 O ATOM 183 CB PHE A 85 25.530 -5.769 -2.970 1.00 0.00 C ATOM 184 CG PHE A 85 26.718 -5.092 -2.348 1.00 0.00 C ATOM 185 CD1 PHE A 85 27.831 -4.776 -3.112 1.00 0.00 C ATOM 186 CD2 PHE A 85 26.722 -4.771 -1.000 1.00 0.00 C ATOM 187 CE1 PHE A 85 28.925 -4.154 -2.542 1.00 0.00 C ATOM 188 CE2 PHE A 85 27.814 -4.149 -0.425 1.00 0.00 C ATOM 189 CZ PHE A 85 28.916 -3.839 -1.197 1.00 0.00 C ATOM 0 H PHE A 85 25.109 -7.219 -1.021 1.00 0.00 H new ATOM 0 HA PHE A 85 24.977 -7.675 -3.798 1.00 0.00 H new ATOM 0 HB2 PHE A 85 25.384 -5.377 -3.977 1.00 0.00 H new ATOM 0 HB3 PHE A 85 24.637 -5.517 -2.398 1.00 0.00 H new ATOM 0 HD1 PHE A 85 27.843 -5.019 -4.164 1.00 0.00 H new ATOM 0 HD2 PHE A 85 25.862 -5.010 -0.392 1.00 0.00 H new ATOM 0 HE1 PHE A 85 29.787 -3.914 -3.147 1.00 0.00 H new ATOM 0 HE2 PHE A 85 27.805 -3.906 0.627 1.00 0.00 H new ATOM 0 HZ PHE A 85 29.770 -3.351 -0.750 1.00 0.00 H new ATOM 199 N VAL A 86 27.255 -8.060 -4.703 1.00 0.00 N ATOM 200 CA VAL A 86 28.564 -8.449 -5.214 1.00 0.00 C ATOM 201 C VAL A 86 28.488 -8.829 -6.688 1.00 0.00 C ATOM 202 O VAL A 86 27.618 -9.588 -7.115 1.00 0.00 O ATOM 203 CB VAL A 86 29.148 -9.632 -4.419 1.00 0.00 C ATOM 204 CG1 VAL A 86 28.468 -10.932 -4.822 1.00 0.00 C ATOM 205 CG2 VAL A 86 30.652 -9.722 -4.625 1.00 0.00 C ATOM 0 H VAL A 86 26.502 -8.114 -5.389 1.00 0.00 H new ATOM 0 HA VAL A 86 29.218 -7.585 -5.098 1.00 0.00 H new ATOM 0 HB VAL A 86 28.960 -9.464 -3.359 1.00 0.00 H new ATOM 0 HG11 VAL A 86 28.893 -11.757 -4.251 1.00 0.00 H new ATOM 0 HG12 VAL A 86 27.399 -10.862 -4.619 1.00 0.00 H new ATOM 0 HG13 VAL A 86 28.624 -11.109 -5.886 1.00 0.00 H new ATOM 0 HG21 VAL A 86 31.047 -10.563 -4.056 1.00 0.00 H new ATOM 0 HG22 VAL A 86 30.866 -9.867 -5.684 1.00 0.00 H new ATOM 0 HG23 VAL A 86 31.122 -8.800 -4.283 1.00 0.00 H new ATOM 215 N PRO A 87 29.420 -8.289 -7.487 1.00 0.00 N ATOM 216 CA PRO A 87 29.481 -8.557 -8.927 1.00 0.00 C ATOM 217 C PRO A 87 29.909 -9.989 -9.232 1.00 0.00 C ATOM 218 O PRO A 87 31.098 -10.277 -9.365 1.00 0.00 O ATOM 219 CB PRO A 87 30.535 -7.567 -9.428 1.00 0.00 C ATOM 220 CG PRO A 87 31.395 -7.296 -8.243 1.00 0.00 C ATOM 221 CD PRO A 87 30.488 -7.375 -7.046 1.00 0.00 C ATOM 0 HA PRO A 87 28.508 -8.443 -9.404 1.00 0.00 H new ATOM 0 HB2 PRO A 87 31.115 -7.988 -10.250 1.00 0.00 H new ATOM 0 HB3 PRO A 87 30.074 -6.652 -9.800 1.00 0.00 H new ATOM 0 HG2 PRO A 87 32.201 -8.026 -8.171 1.00 0.00 H new ATOM 0 HG3 PRO A 87 31.861 -6.313 -8.315 1.00 0.00 H new ATOM 0 HD2 PRO A 87 31.011 -7.760 -6.171 1.00 0.00 H new ATOM 0 HD3 PRO A 87 30.093 -6.396 -6.776 1.00 0.00 H new ATOM 229 N SER A 88 28.931 -10.883 -9.341 1.00 0.00 N ATOM 230 CA SER A 88 29.207 -12.286 -9.627 1.00 0.00 C ATOM 231 C SER A 88 29.585 -12.478 -11.093 1.00 0.00 C ATOM 232 O SER A 88 28.723 -12.497 -11.971 1.00 0.00 O ATOM 233 CB SER A 88 27.989 -13.147 -9.286 1.00 0.00 C ATOM 234 OG SER A 88 28.365 -14.494 -9.055 1.00 0.00 O ATOM 0 H SER A 88 27.941 -10.661 -9.236 1.00 0.00 H new ATOM 0 HA SER A 88 30.049 -12.598 -9.009 1.00 0.00 H new ATOM 0 HB2 SER A 88 27.494 -12.748 -8.401 1.00 0.00 H new ATOM 0 HB3 SER A 88 27.268 -13.102 -10.102 1.00 0.00 H new ATOM 0 HG SER A 88 27.562 -15.052 -8.996 1.00 0.00 H new ATOM 240 N PHE A 89 30.881 -12.619 -11.349 1.00 0.00 N ATOM 241 CA PHE A 89 31.376 -12.808 -12.708 1.00 0.00 C ATOM 242 C PHE A 89 31.795 -14.257 -12.937 1.00 0.00 C ATOM 243 O PHE A 89 31.831 -14.732 -14.073 1.00 0.00 O ATOM 244 CB PHE A 89 32.558 -11.875 -12.977 1.00 0.00 C ATOM 245 CG PHE A 89 33.824 -12.295 -12.286 1.00 0.00 C ATOM 246 CD1 PHE A 89 34.697 -13.185 -12.893 1.00 0.00 C ATOM 247 CD2 PHE A 89 34.141 -11.801 -11.031 1.00 0.00 C ATOM 248 CE1 PHE A 89 35.861 -13.574 -12.259 1.00 0.00 C ATOM 249 CE2 PHE A 89 35.304 -12.187 -10.393 1.00 0.00 C ATOM 250 CZ PHE A 89 36.166 -13.074 -11.008 1.00 0.00 C ATOM 0 H PHE A 89 31.608 -12.606 -10.633 1.00 0.00 H new ATOM 0 HA PHE A 89 30.568 -12.568 -13.399 1.00 0.00 H new ATOM 0 HB2 PHE A 89 32.738 -11.830 -14.051 1.00 0.00 H new ATOM 0 HB3 PHE A 89 32.295 -10.867 -12.655 1.00 0.00 H new ATOM 0 HD1 PHE A 89 34.464 -13.578 -13.872 1.00 0.00 H new ATOM 0 HD2 PHE A 89 33.471 -11.106 -10.546 1.00 0.00 H new ATOM 0 HE1 PHE A 89 36.532 -14.269 -12.741 1.00 0.00 H new ATOM 0 HE2 PHE A 89 35.539 -11.796 -9.414 1.00 0.00 H new ATOM 0 HZ PHE A 89 37.076 -13.376 -10.512 1.00 0.00 H new ATOM 260 N LEU A 90 32.111 -14.954 -11.852 1.00 0.00 N ATOM 261 CA LEU A 90 32.529 -16.350 -11.933 1.00 0.00 C ATOM 262 C LEU A 90 31.592 -17.246 -11.128 1.00 0.00 C ATOM 263 O LEU A 90 30.607 -16.777 -10.557 1.00 0.00 O ATOM 264 CB LEU A 90 33.963 -16.504 -11.424 1.00 0.00 C ATOM 265 CG LEU A 90 34.890 -17.365 -12.282 1.00 0.00 C ATOM 266 CD1 LEU A 90 35.482 -16.545 -13.418 1.00 0.00 C ATOM 267 CD2 LEU A 90 35.995 -17.972 -11.430 1.00 0.00 C ATOM 0 H LEU A 90 32.086 -14.576 -10.905 1.00 0.00 H new ATOM 0 HA LEU A 90 32.487 -16.657 -12.978 1.00 0.00 H new ATOM 0 HB2 LEU A 90 34.403 -15.511 -11.332 1.00 0.00 H new ATOM 0 HB3 LEU A 90 33.928 -16.931 -10.422 1.00 0.00 H new ATOM 0 HG LEU A 90 34.303 -18.176 -12.713 1.00 0.00 H new ATOM 0 HD11 LEU A 90 36.139 -17.175 -14.018 1.00 0.00 H new ATOM 0 HD12 LEU A 90 34.678 -16.159 -14.045 1.00 0.00 H new ATOM 0 HD13 LEU A 90 36.053 -15.713 -13.007 1.00 0.00 H new ATOM 0 HD21 LEU A 90 36.645 -18.582 -12.058 1.00 0.00 H new ATOM 0 HD22 LEU A 90 36.579 -17.175 -10.969 1.00 0.00 H new ATOM 0 HD23 LEU A 90 35.554 -18.595 -10.652 1.00 0.00 H new ATOM 279 N ARG A 91 31.908 -18.536 -11.086 1.00 0.00 N ATOM 280 CA ARG A 91 31.096 -19.497 -10.350 1.00 0.00 C ATOM 281 C ARG A 91 31.331 -19.371 -8.848 1.00 0.00 C ATOM 282 O ARG A 91 30.462 -19.705 -8.043 1.00 0.00 O ATOM 283 CB ARG A 91 31.414 -20.922 -10.809 1.00 0.00 C ATOM 284 CG ARG A 91 30.761 -21.996 -9.955 1.00 0.00 C ATOM 285 CD ARG A 91 31.752 -22.612 -8.980 1.00 0.00 C ATOM 286 NE ARG A 91 31.539 -24.048 -8.816 1.00 0.00 N ATOM 287 CZ ARG A 91 32.130 -24.776 -7.875 1.00 0.00 C ATOM 288 NH1 ARG A 91 32.966 -24.206 -7.019 1.00 0.00 N ATOM 289 NH2 ARG A 91 31.885 -26.077 -7.790 1.00 0.00 N ATOM 0 H ARG A 91 32.720 -18.940 -11.553 1.00 0.00 H new ATOM 0 HA ARG A 91 30.047 -19.281 -10.555 1.00 0.00 H new ATOM 0 HB2 ARG A 91 31.088 -21.043 -11.842 1.00 0.00 H new ATOM 0 HB3 ARG A 91 32.494 -21.066 -10.796 1.00 0.00 H new ATOM 0 HG2 ARG A 91 29.926 -21.565 -9.403 1.00 0.00 H new ATOM 0 HG3 ARG A 91 30.350 -22.774 -10.598 1.00 0.00 H new ATOM 0 HD2 ARG A 91 32.767 -22.434 -9.335 1.00 0.00 H new ATOM 0 HD3 ARG A 91 31.662 -22.119 -8.012 1.00 0.00 H new ATOM 0 HE ARG A 91 30.902 -24.517 -9.459 1.00 0.00 H new ATOM 0 HH11 ARG A 91 33.157 -23.206 -7.082 1.00 0.00 H new ATOM 0 HH12 ARG A 91 33.418 -24.767 -6.297 1.00 0.00 H new ATOM 0 HH21 ARG A 91 31.242 -26.519 -8.447 1.00 0.00 H new ATOM 0 HH22 ARG A 91 32.339 -26.635 -7.067 1.00 0.00 H new ATOM 303 N GLY A 92 32.512 -18.885 -8.477 1.00 0.00 N ATOM 304 CA GLY A 92 32.840 -18.724 -7.073 1.00 0.00 C ATOM 305 C GLY A 92 31.785 -17.939 -6.318 1.00 0.00 C ATOM 306 O GLY A 92 31.023 -18.488 -5.522 1.00 0.00 O ATOM 0 H GLY A 92 33.247 -18.600 -9.124 1.00 0.00 H new ATOM 0 HA2 GLY A 92 32.955 -19.706 -6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 92 33.800 -18.216 -6.983 1.00 0.00 H new ATOM 310 N PRO A 93 31.733 -16.621 -6.564 1.00 0.00 N ATOM 311 CA PRO A 93 30.769 -15.731 -5.911 1.00 0.00 C ATOM 312 C PRO A 93 29.341 -15.976 -6.385 1.00 0.00 C ATOM 313 O PRO A 93 29.120 -16.580 -7.434 1.00 0.00 O ATOM 314 CB PRO A 93 31.239 -14.334 -6.325 1.00 0.00 C ATOM 315 CG PRO A 93 31.967 -14.545 -7.608 1.00 0.00 C ATOM 316 CD PRO A 93 32.611 -15.899 -7.501 1.00 0.00 C ATOM 0 HA PRO A 93 30.740 -15.883 -4.832 1.00 0.00 H new ATOM 0 HB2 PRO A 93 30.396 -13.655 -6.455 1.00 0.00 H new ATOM 0 HB3 PRO A 93 31.889 -13.894 -5.568 1.00 0.00 H new ATOM 0 HG2 PRO A 93 31.283 -14.504 -8.456 1.00 0.00 H new ATOM 0 HG3 PRO A 93 32.715 -13.768 -7.764 1.00 0.00 H new ATOM 0 HD2 PRO A 93 32.662 -16.397 -8.469 1.00 0.00 H new ATOM 0 HD3 PRO A 93 33.631 -15.830 -7.124 1.00 0.00 H new ATOM 324 N ALA A 94 28.374 -15.501 -5.606 1.00 0.00 N ATOM 325 CA ALA A 94 26.967 -15.666 -5.948 1.00 0.00 C ATOM 326 C ALA A 94 26.395 -14.387 -6.549 1.00 0.00 C ATOM 327 O ALA A 94 25.299 -14.423 -7.107 1.00 0.00 O ATOM 328 CB ALA A 94 26.170 -16.076 -4.718 1.00 0.00 C ATOM 0 H ALA A 94 28.540 -14.999 -4.734 1.00 0.00 H new ATOM 0 HA ALA A 94 26.890 -16.454 -6.697 1.00 0.00 H new ATOM 0 HB1 ALA A 94 25.121 -16.196 -4.988 1.00 0.00 H new ATOM 0 HB2 ALA A 94 26.556 -17.020 -4.333 1.00 0.00 H new ATOM 0 HB3 ALA A 94 26.262 -15.306 -3.952 1.00 0.00 H new TER 334 ALA A 94 ATOM 335 N GLY B 541 32.781 7.729 10.788 1.00 0.00 N ATOM 336 CA GLY B 541 31.963 7.740 9.589 1.00 0.00 C ATOM 337 C GLY B 541 32.643 8.440 8.430 1.00 0.00 C ATOM 338 O GLY B 541 32.656 9.669 8.361 1.00 0.00 O ATOM 0 HA2 GLY B 541 31.729 6.715 9.303 1.00 0.00 H new ATOM 0 HA3 GLY B 541 31.016 8.235 9.803 1.00 0.00 H new ATOM 342 N GLN B 542 33.210 7.657 7.518 1.00 0.00 N ATOM 343 CA GLN B 542 33.897 8.210 6.357 1.00 0.00 C ATOM 344 C GLN B 542 33.002 9.196 5.613 1.00 0.00 C ATOM 345 O GLN B 542 31.787 9.213 5.807 1.00 0.00 O ATOM 346 CB GLN B 542 34.334 7.088 5.413 1.00 0.00 C ATOM 347 CG GLN B 542 35.404 7.511 4.420 1.00 0.00 C ATOM 348 CD GLN B 542 36.597 8.165 5.090 1.00 0.00 C ATOM 349 OE1 GLN B 542 36.697 9.391 5.147 1.00 0.00 O ATOM 350 NE2 GLN B 542 37.509 7.348 5.603 1.00 0.00 N ATOM 0 H GLN B 542 33.207 6.638 7.561 1.00 0.00 H new ATOM 0 HA GLN B 542 34.780 8.743 6.710 1.00 0.00 H new ATOM 0 HB2 GLN B 542 34.709 6.252 6.004 1.00 0.00 H new ATOM 0 HB3 GLN B 542 33.464 6.726 4.865 1.00 0.00 H new ATOM 0 HG2 GLN B 542 35.740 6.638 3.860 1.00 0.00 H new ATOM 0 HG3 GLN B 542 34.971 8.205 3.699 1.00 0.00 H new ATOM 0 HE21 GLN B 542 37.386 6.338 5.533 1.00 0.00 H new ATOM 0 HE22 GLN B 542 38.333 7.730 6.067 1.00 0.00 H new ATOM 359 N GLU B 543 33.611 10.017 4.763 1.00 0.00 N ATOM 360 CA GLU B 543 32.868 11.006 3.992 1.00 0.00 C ATOM 361 C GLU B 543 32.007 10.332 2.928 1.00 0.00 C ATOM 362 O GLU B 543 32.232 9.183 2.548 1.00 0.00 O ATOM 363 CB GLU B 543 33.829 11.998 3.333 1.00 0.00 C ATOM 364 CG GLU B 543 34.151 13.203 4.201 1.00 0.00 C ATOM 365 CD GLU B 543 34.484 12.819 5.630 1.00 0.00 C ATOM 366 OE1 GLU B 543 33.550 12.732 6.454 1.00 0.00 O ATOM 367 OE2 GLU B 543 35.679 12.607 5.924 1.00 0.00 O ATOM 0 H GLU B 543 34.616 10.016 4.591 1.00 0.00 H new ATOM 0 HA GLU B 543 32.213 11.545 4.676 1.00 0.00 H new ATOM 0 HB2 GLU B 543 34.756 11.482 3.084 1.00 0.00 H new ATOM 0 HB3 GLU B 543 33.395 12.343 2.395 1.00 0.00 H new ATOM 0 HG2 GLU B 543 34.993 13.744 3.768 1.00 0.00 H new ATOM 0 HG3 GLU B 543 33.300 13.884 4.200 1.00 0.00 H new ATOM 374 N PRO B 544 30.995 11.063 2.437 1.00 0.00 N ATOM 375 CA PRO B 544 30.079 10.557 1.410 1.00 0.00 C ATOM 376 C PRO B 544 30.756 10.403 0.053 1.00 0.00 C ATOM 377 O PRO B 544 31.956 10.648 -0.085 1.00 0.00 O ATOM 378 CB PRO B 544 28.990 11.631 1.346 1.00 0.00 C ATOM 379 CG PRO B 544 29.658 12.876 1.820 1.00 0.00 C ATOM 380 CD PRO B 544 30.668 12.440 2.845 1.00 0.00 C ATOM 0 HA PRO B 544 29.703 9.563 1.653 1.00 0.00 H new ATOM 0 HB2 PRO B 544 28.608 11.748 0.332 1.00 0.00 H new ATOM 0 HB3 PRO B 544 28.141 11.372 1.978 1.00 0.00 H new ATOM 0 HG2 PRO B 544 30.141 13.398 0.994 1.00 0.00 H new ATOM 0 HG3 PRO B 544 28.934 13.566 2.254 1.00 0.00 H new ATOM 0 HD2 PRO B 544 31.549 13.081 2.839 1.00 0.00 H new ATOM 0 HD3 PRO B 544 30.257 12.473 3.854 1.00 0.00 H new ATOM 388 N LEU B 545 29.982 9.997 -0.947 1.00 0.00 N ATOM 389 CA LEU B 545 30.508 9.811 -2.295 1.00 0.00 C ATOM 390 C LEU B 545 29.917 10.838 -3.256 1.00 0.00 C ATOM 391 O LEU B 545 28.854 11.403 -3.002 1.00 0.00 O ATOM 392 CB LEU B 545 30.204 8.396 -2.791 1.00 0.00 C ATOM 393 CG LEU B 545 30.448 7.267 -1.790 1.00 0.00 C ATOM 394 CD1 LEU B 545 30.034 5.929 -2.384 1.00 0.00 C ATOM 395 CD2 LEU B 545 31.910 7.236 -1.368 1.00 0.00 C ATOM 0 H LEU B 545 28.988 9.790 -0.850 1.00 0.00 H new ATOM 0 HA LEU B 545 31.588 9.953 -2.261 1.00 0.00 H new ATOM 0 HB2 LEU B 545 29.160 8.358 -3.103 1.00 0.00 H new ATOM 0 HB3 LEU B 545 30.809 8.206 -3.678 1.00 0.00 H new ATOM 0 HG LEU B 545 29.839 7.453 -0.905 1.00 0.00 H new ATOM 0 HD11 LEU B 545 30.215 5.137 -1.657 1.00 0.00 H new ATOM 0 HD12 LEU B 545 28.974 5.955 -2.636 1.00 0.00 H new ATOM 0 HD13 LEU B 545 30.616 5.735 -3.285 1.00 0.00 H new ATOM 0 HD21 LEU B 545 32.066 6.426 -0.655 1.00 0.00 H new ATOM 0 HD22 LEU B 545 32.538 7.074 -2.244 1.00 0.00 H new ATOM 0 HD23 LEU B 545 32.174 8.185 -0.902 1.00 0.00 H new ATOM 407 N THR B 546 30.614 11.073 -4.364 1.00 0.00 N ATOM 408 CA THR B 546 30.159 12.030 -5.364 1.00 0.00 C ATOM 409 C THR B 546 30.448 11.530 -6.775 1.00 0.00 C ATOM 410 O THR B 546 31.250 10.617 -6.968 1.00 0.00 O ATOM 411 CB THR B 546 30.827 13.404 -5.172 1.00 0.00 C ATOM 412 OG1 THR B 546 32.250 13.276 -5.272 1.00 0.00 O ATOM 413 CG2 THR B 546 30.460 14.000 -3.820 1.00 0.00 C ATOM 0 H THR B 546 31.496 10.613 -4.591 1.00 0.00 H new ATOM 0 HA THR B 546 29.082 12.136 -5.232 1.00 0.00 H new ATOM 0 HB THR B 546 30.467 14.071 -5.956 1.00 0.00 H new ATOM 0 HG1 THR B 546 32.667 14.155 -5.150 1.00 0.00 H new ATOM 0 HG21 THR B 546 30.943 14.970 -3.707 1.00 0.00 H new ATOM 0 HG22 THR B 546 29.379 14.124 -3.758 1.00 0.00 H new ATOM 0 HG23 THR B 546 30.795 13.333 -3.025 1.00 0.00 H new ATOM 421 N ALA B 547 29.790 12.135 -7.759 1.00 0.00 N ATOM 422 CA ALA B 547 29.980 11.753 -9.152 1.00 0.00 C ATOM 423 C ALA B 547 31.443 11.880 -9.563 1.00 0.00 C ATOM 424 O ALA B 547 31.930 11.122 -10.401 1.00 0.00 O ATOM 425 CB ALA B 547 29.100 12.604 -10.057 1.00 0.00 C ATOM 0 H ALA B 547 29.121 12.892 -7.616 1.00 0.00 H new ATOM 0 HA ALA B 547 29.690 10.708 -9.259 1.00 0.00 H new ATOM 0 HB1 ALA B 547 29.252 12.308 -11.095 1.00 0.00 H new ATOM 0 HB2 ALA B 547 28.054 12.459 -9.788 1.00 0.00 H new ATOM 0 HB3 ALA B 547 29.363 13.655 -9.937 1.00 0.00 H new ATOM 431 N SER B 548 32.138 12.844 -8.968 1.00 0.00 N ATOM 432 CA SER B 548 33.545 13.073 -9.275 1.00 0.00 C ATOM 433 C SER B 548 34.383 11.844 -8.933 1.00 0.00 C ATOM 434 O SER B 548 35.375 11.551 -9.600 1.00 0.00 O ATOM 435 CB SER B 548 34.065 14.289 -8.506 1.00 0.00 C ATOM 436 OG SER B 548 35.237 14.811 -9.109 1.00 0.00 O ATOM 0 H SER B 548 31.750 13.479 -8.271 1.00 0.00 H new ATOM 0 HA SER B 548 33.632 13.264 -10.345 1.00 0.00 H new ATOM 0 HB2 SER B 548 33.295 15.060 -8.474 1.00 0.00 H new ATOM 0 HB3 SER B 548 34.277 14.007 -7.475 1.00 0.00 H new ATOM 0 HG SER B 548 35.549 15.588 -8.600 1.00 0.00 H new ATOM 442 N MET B 549 33.975 11.130 -7.889 1.00 0.00 N ATOM 443 CA MET B 549 34.687 9.932 -7.459 1.00 0.00 C ATOM 444 C MET B 549 34.130 8.691 -8.149 1.00 0.00 C ATOM 445 O MET B 549 34.883 7.816 -8.579 1.00 0.00 O ATOM 446 CB MET B 549 34.588 9.772 -5.941 1.00 0.00 C ATOM 447 CG MET B 549 35.117 8.440 -5.434 1.00 0.00 C ATOM 448 SD MET B 549 35.743 8.537 -3.746 1.00 0.00 S ATOM 449 CE MET B 549 34.920 7.132 -2.998 1.00 0.00 C ATOM 0 H MET B 549 33.156 11.360 -7.326 1.00 0.00 H new ATOM 0 HA MET B 549 35.735 10.042 -7.739 1.00 0.00 H new ATOM 0 HB2 MET B 549 35.142 10.579 -5.462 1.00 0.00 H new ATOM 0 HB3 MET B 549 33.546 9.878 -5.640 1.00 0.00 H new ATOM 0 HG2 MET B 549 34.321 7.697 -5.480 1.00 0.00 H new ATOM 0 HG3 MET B 549 35.914 8.095 -6.093 1.00 0.00 H new ATOM 0 HE1 MET B 549 34.623 7.384 -1.980 1.00 0.00 H new ATOM 0 HE2 MET B 549 34.035 6.876 -3.581 1.00 0.00 H new ATOM 0 HE3 MET B 549 35.600 6.280 -2.978 1.00 0.00 H new ATOM 459 N LEU B 550 32.807 8.620 -8.252 1.00 0.00 N ATOM 460 CA LEU B 550 32.149 7.486 -8.891 1.00 0.00 C ATOM 461 C LEU B 550 32.495 7.420 -10.375 1.00 0.00 C ATOM 462 O LEU B 550 32.462 6.351 -10.983 1.00 0.00 O ATOM 463 CB LEU B 550 30.633 7.584 -8.713 1.00 0.00 C ATOM 464 CG LEU B 550 30.057 6.899 -7.473 1.00 0.00 C ATOM 465 CD1 LEU B 550 30.148 5.387 -7.608 1.00 0.00 C ATOM 466 CD2 LEU B 550 30.780 7.370 -6.219 1.00 0.00 C ATOM 0 H LEU B 550 32.169 9.334 -7.901 1.00 0.00 H new ATOM 0 HA LEU B 550 32.507 6.574 -8.413 1.00 0.00 H new ATOM 0 HB2 LEU B 550 30.358 8.638 -8.682 1.00 0.00 H new ATOM 0 HB3 LEU B 550 30.155 7.156 -9.595 1.00 0.00 H new ATOM 0 HG LEU B 550 29.005 7.172 -7.386 1.00 0.00 H new ATOM 0 HD11 LEU B 550 29.733 4.917 -6.716 1.00 0.00 H new ATOM 0 HD12 LEU B 550 29.584 5.065 -8.484 1.00 0.00 H new ATOM 0 HD13 LEU B 550 31.192 5.094 -7.721 1.00 0.00 H new ATOM 0 HD21 LEU B 550 30.357 6.872 -5.346 1.00 0.00 H new ATOM 0 HD22 LEU B 550 31.840 7.127 -6.297 1.00 0.00 H new ATOM 0 HD23 LEU B 550 30.662 8.448 -6.114 1.00 0.00 H new ATOM 478 N ALA B 551 32.828 8.570 -10.951 1.00 0.00 N ATOM 479 CA ALA B 551 33.185 8.642 -12.362 1.00 0.00 C ATOM 480 C ALA B 551 34.605 8.138 -12.597 1.00 0.00 C ATOM 481 O ALA B 551 34.866 7.412 -13.556 1.00 0.00 O ATOM 482 CB ALA B 551 33.039 10.069 -12.871 1.00 0.00 C ATOM 0 H ALA B 551 32.858 9.465 -10.462 1.00 0.00 H new ATOM 0 HA ALA B 551 32.503 7.998 -12.916 1.00 0.00 H new ATOM 0 HB1 ALA B 551 33.309 10.108 -13.926 1.00 0.00 H new ATOM 0 HB2 ALA B 551 32.006 10.395 -12.748 1.00 0.00 H new ATOM 0 HB3 ALA B 551 33.697 10.727 -12.303 1.00 0.00 H new ATOM 488 N SER B 552 35.519 8.528 -11.715 1.00 0.00 N ATOM 489 CA SER B 552 36.914 8.119 -11.828 1.00 0.00 C ATOM 490 C SER B 552 37.029 6.601 -11.923 1.00 0.00 C ATOM 491 O SER B 552 37.973 6.075 -12.512 1.00 0.00 O ATOM 492 CB SER B 552 37.717 8.629 -10.629 1.00 0.00 C ATOM 493 OG SER B 552 37.478 10.008 -10.405 1.00 0.00 O ATOM 0 H SER B 552 35.319 9.127 -10.914 1.00 0.00 H new ATOM 0 HA SER B 552 37.321 8.555 -12.740 1.00 0.00 H new ATOM 0 HB2 SER B 552 37.448 8.061 -9.739 1.00 0.00 H new ATOM 0 HB3 SER B 552 38.780 8.464 -10.803 1.00 0.00 H new ATOM 0 HG SER B 552 36.610 10.122 -9.964 1.00 0.00 H new ATOM 499 N ALA B 553 36.061 5.903 -11.338 1.00 0.00 N ATOM 500 CA ALA B 553 36.052 4.446 -11.357 1.00 0.00 C ATOM 501 C ALA B 553 35.169 3.917 -12.483 1.00 0.00 C ATOM 502 O ALA B 553 34.308 4.621 -13.011 1.00 0.00 O ATOM 503 CB ALA B 553 35.580 3.903 -10.016 1.00 0.00 C ATOM 0 H ALA B 553 35.273 6.323 -10.845 1.00 0.00 H new ATOM 0 HA ALA B 553 37.071 4.104 -11.537 1.00 0.00 H new ATOM 0 HB1 ALA B 553 35.578 2.813 -10.045 1.00 0.00 H new ATOM 0 HB2 ALA B 553 36.252 4.244 -9.228 1.00 0.00 H new ATOM 0 HB3 ALA B 553 34.571 4.262 -9.813 1.00 0.00 H new ATOM 509 N PRO B 554 35.388 2.650 -12.862 1.00 0.00 N ATOM 510 CA PRO B 554 34.623 1.999 -13.930 1.00 0.00 C ATOM 511 C PRO B 554 33.177 1.733 -13.527 1.00 0.00 C ATOM 512 O PRO B 554 32.803 1.838 -12.359 1.00 0.00 O ATOM 513 CB PRO B 554 35.369 0.681 -14.149 1.00 0.00 C ATOM 514 CG PRO B 554 36.046 0.408 -12.850 1.00 0.00 C ATOM 515 CD PRO B 554 36.399 1.753 -12.277 1.00 0.00 C ATOM 0 HA PRO B 554 34.559 2.621 -14.823 1.00 0.00 H new ATOM 0 HB2 PRO B 554 34.682 -0.123 -14.414 1.00 0.00 H new ATOM 0 HB3 PRO B 554 36.091 0.765 -14.962 1.00 0.00 H new ATOM 0 HG2 PRO B 554 35.390 -0.143 -12.176 1.00 0.00 H new ATOM 0 HG3 PRO B 554 36.938 -0.201 -12.995 1.00 0.00 H new ATOM 0 HD2 PRO B 554 36.352 1.751 -11.188 1.00 0.00 H new ATOM 0 HD3 PRO B 554 37.410 2.054 -12.552 1.00 0.00 H new ATOM 523 N PRO B 555 32.342 1.377 -14.515 1.00 0.00 N ATOM 524 CA PRO B 555 30.923 1.087 -14.287 1.00 0.00 C ATOM 525 C PRO B 555 30.714 -0.210 -13.511 1.00 0.00 C ATOM 526 O PRO B 555 29.633 -0.457 -12.979 1.00 0.00 O ATOM 527 CB PRO B 555 30.355 0.961 -15.702 1.00 0.00 C ATOM 528 CG PRO B 555 31.518 0.565 -16.544 1.00 0.00 C ATOM 529 CD PRO B 555 32.719 1.231 -15.931 1.00 0.00 C ATOM 0 HA PRO B 555 30.440 1.858 -13.687 1.00 0.00 H new ATOM 0 HB2 PRO B 555 29.563 0.214 -15.745 1.00 0.00 H new ATOM 0 HB3 PRO B 555 29.924 1.903 -16.041 1.00 0.00 H new ATOM 0 HG2 PRO B 555 31.638 -0.518 -16.559 1.00 0.00 H new ATOM 0 HG3 PRO B 555 31.379 0.885 -17.577 1.00 0.00 H new ATOM 0 HD2 PRO B 555 33.618 0.625 -16.047 1.00 0.00 H new ATOM 0 HD3 PRO B 555 32.923 2.196 -16.394 1.00 0.00 H new ATOM 537 N GLN B 556 31.756 -1.033 -13.452 1.00 0.00 N ATOM 538 CA GLN B 556 31.685 -2.304 -12.742 1.00 0.00 C ATOM 539 C GLN B 556 32.062 -2.129 -11.274 1.00 0.00 C ATOM 540 O GLN B 556 31.645 -2.911 -10.420 1.00 0.00 O ATOM 541 CB GLN B 556 32.608 -3.332 -13.399 1.00 0.00 C ATOM 542 CG GLN B 556 31.955 -4.096 -14.539 1.00 0.00 C ATOM 543 CD GLN B 556 31.603 -3.204 -15.713 1.00 0.00 C ATOM 544 OE1 GLN B 556 30.454 -2.792 -15.873 1.00 0.00 O ATOM 545 NE2 GLN B 556 32.594 -2.901 -16.544 1.00 0.00 N ATOM 0 H GLN B 556 32.659 -0.842 -13.887 1.00 0.00 H new ATOM 0 HA GLN B 556 30.657 -2.664 -12.794 1.00 0.00 H new ATOM 0 HB2 GLN B 556 33.495 -2.823 -13.775 1.00 0.00 H new ATOM 0 HB3 GLN B 556 32.944 -4.042 -12.643 1.00 0.00 H new ATOM 0 HG2 GLN B 556 32.628 -4.884 -14.876 1.00 0.00 H new ATOM 0 HG3 GLN B 556 31.051 -4.583 -14.174 1.00 0.00 H new ATOM 0 HE21 GLN B 556 33.532 -3.264 -16.373 1.00 0.00 H new ATOM 0 HE22 GLN B 556 32.417 -2.305 -17.353 1.00 0.00 H new ATOM 554 N GLU B 557 32.853 -1.100 -10.990 1.00 0.00 N ATOM 555 CA GLU B 557 33.287 -0.824 -9.625 1.00 0.00 C ATOM 556 C GLU B 557 32.310 0.115 -8.923 1.00 0.00 C ATOM 557 O GLU B 557 32.159 0.069 -7.703 1.00 0.00 O ATOM 558 CB GLU B 557 34.689 -0.211 -9.626 1.00 0.00 C ATOM 559 CG GLU B 557 35.796 -1.226 -9.858 1.00 0.00 C ATOM 560 CD GLU B 557 36.019 -2.130 -8.661 1.00 0.00 C ATOM 561 OE1 GLU B 557 35.557 -1.777 -7.556 1.00 0.00 O ATOM 562 OE2 GLU B 557 36.656 -3.191 -8.830 1.00 0.00 O ATOM 0 H GLU B 557 33.207 -0.444 -11.686 1.00 0.00 H new ATOM 0 HA GLU B 557 33.312 -1.768 -9.081 1.00 0.00 H new ATOM 0 HB2 GLU B 557 34.741 0.555 -10.400 1.00 0.00 H new ATOM 0 HB3 GLU B 557 34.859 0.288 -8.672 1.00 0.00 H new ATOM 0 HG2 GLU B 557 35.549 -1.835 -10.728 1.00 0.00 H new ATOM 0 HG3 GLU B 557 36.723 -0.701 -10.090 1.00 0.00 H new ATOM 569 N GLN B 558 31.651 0.965 -9.704 1.00 0.00 N ATOM 570 CA GLN B 558 30.690 1.916 -9.157 1.00 0.00 C ATOM 571 C GLN B 558 29.664 1.208 -8.278 1.00 0.00 C ATOM 572 O GLN B 558 29.312 1.692 -7.202 1.00 0.00 O ATOM 573 CB GLN B 558 29.981 2.664 -10.287 1.00 0.00 C ATOM 574 CG GLN B 558 30.755 3.869 -10.798 1.00 0.00 C ATOM 575 CD GLN B 558 29.941 4.725 -11.748 1.00 0.00 C ATOM 576 OE1 GLN B 558 29.932 5.952 -11.644 1.00 0.00 O ATOM 577 NE2 GLN B 558 29.252 4.081 -12.683 1.00 0.00 N ATOM 0 H GLN B 558 31.765 1.015 -10.716 1.00 0.00 H new ATOM 0 HA GLN B 558 31.235 2.633 -8.543 1.00 0.00 H new ATOM 0 HB2 GLN B 558 29.808 1.976 -11.115 1.00 0.00 H new ATOM 0 HB3 GLN B 558 29.003 2.993 -9.936 1.00 0.00 H new ATOM 0 HG2 GLN B 558 31.075 4.476 -9.951 1.00 0.00 H new ATOM 0 HG3 GLN B 558 31.658 3.528 -11.305 1.00 0.00 H new ATOM 0 HE21 GLN B 558 29.288 3.063 -12.733 1.00 0.00 H new ATOM 0 HE22 GLN B 558 28.687 4.605 -13.351 1.00 0.00 H new ATOM 586 N LYS B 559 29.187 0.058 -8.743 1.00 0.00 N ATOM 587 CA LYS B 559 28.201 -0.718 -8.000 1.00 0.00 C ATOM 588 C LYS B 559 28.736 -1.101 -6.624 1.00 0.00 C ATOM 589 O LYS B 559 28.154 -0.740 -5.601 1.00 0.00 O ATOM 590 CB LYS B 559 27.822 -1.979 -8.780 1.00 0.00 C ATOM 591 CG LYS B 559 26.743 -1.746 -9.824 1.00 0.00 C ATOM 592 CD LYS B 559 26.322 -3.046 -10.489 1.00 0.00 C ATOM 593 CE LYS B 559 25.077 -2.857 -11.343 1.00 0.00 C ATOM 594 NZ LYS B 559 24.381 -4.148 -11.602 1.00 0.00 N ATOM 0 H LYS B 559 29.468 -0.357 -9.631 1.00 0.00 H new ATOM 0 HA LYS B 559 27.313 -0.100 -7.867 1.00 0.00 H new ATOM 0 HB2 LYS B 559 28.712 -2.374 -9.271 1.00 0.00 H new ATOM 0 HB3 LYS B 559 27.480 -2.741 -8.079 1.00 0.00 H new ATOM 0 HG2 LYS B 559 25.877 -1.278 -9.356 1.00 0.00 H new ATOM 0 HG3 LYS B 559 27.110 -1.052 -10.580 1.00 0.00 H new ATOM 0 HD2 LYS B 559 27.137 -3.419 -11.109 1.00 0.00 H new ATOM 0 HD3 LYS B 559 26.130 -3.801 -9.726 1.00 0.00 H new ATOM 0 HE2 LYS B 559 24.394 -2.170 -10.843 1.00 0.00 H new ATOM 0 HE3 LYS B 559 25.354 -2.397 -12.292 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 23.538 -3.977 -12.187 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 25.024 -4.795 -12.102 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 24.094 -4.575 -10.698 1.00 0.00 H new ATOM 608 N GLN B 560 29.846 -1.831 -6.607 1.00 0.00 N ATOM 609 CA GLN B 560 30.458 -2.261 -5.355 1.00 0.00 C ATOM 610 C GLN B 560 30.669 -1.077 -4.418 1.00 0.00 C ATOM 611 O GLN B 560 30.390 -1.163 -3.222 1.00 0.00 O ATOM 612 CB GLN B 560 31.794 -2.955 -5.628 1.00 0.00 C ATOM 613 CG GLN B 560 31.681 -4.143 -6.570 1.00 0.00 C ATOM 614 CD GLN B 560 32.596 -5.287 -6.180 1.00 0.00 C ATOM 615 OE1 GLN B 560 33.537 -5.618 -6.901 1.00 0.00 O ATOM 616 NE2 GLN B 560 32.324 -5.897 -5.033 1.00 0.00 N ATOM 0 H GLN B 560 30.340 -2.137 -7.445 1.00 0.00 H new ATOM 0 HA GLN B 560 29.782 -2.967 -4.873 1.00 0.00 H new ATOM 0 HB2 GLN B 560 32.490 -2.231 -6.051 1.00 0.00 H new ATOM 0 HB3 GLN B 560 32.219 -3.291 -4.682 1.00 0.00 H new ATOM 0 HG2 GLN B 560 30.650 -4.496 -6.582 1.00 0.00 H new ATOM 0 HG3 GLN B 560 31.919 -3.822 -7.584 1.00 0.00 H new ATOM 0 HE21 GLN B 560 31.533 -5.589 -4.467 1.00 0.00 H new ATOM 0 HE22 GLN B 560 32.906 -6.673 -4.718 1.00 0.00 H new ATOM 625 N MET B 561 31.163 0.027 -4.968 1.00 0.00 N ATOM 626 CA MET B 561 31.410 1.229 -4.180 1.00 0.00 C ATOM 627 C MET B 561 30.137 1.691 -3.479 1.00 0.00 C ATOM 628 O MET B 561 30.115 1.862 -2.260 1.00 0.00 O ATOM 629 CB MET B 561 31.949 2.348 -5.073 1.00 0.00 C ATOM 630 CG MET B 561 33.309 2.040 -5.679 1.00 0.00 C ATOM 631 SD MET B 561 34.655 2.893 -4.835 1.00 0.00 S ATOM 632 CE MET B 561 34.833 4.347 -5.866 1.00 0.00 C ATOM 0 H MET B 561 31.400 0.114 -5.956 1.00 0.00 H new ATOM 0 HA MET B 561 32.155 0.989 -3.421 1.00 0.00 H new ATOM 0 HB2 MET B 561 31.237 2.536 -5.876 1.00 0.00 H new ATOM 0 HB3 MET B 561 32.020 3.266 -4.489 1.00 0.00 H new ATOM 0 HG2 MET B 561 33.485 0.965 -5.640 1.00 0.00 H new ATOM 0 HG3 MET B 561 33.307 2.325 -6.731 1.00 0.00 H new ATOM 0 HE1 MET B 561 35.631 4.977 -5.472 1.00 0.00 H new ATOM 0 HE2 MET B 561 35.079 4.044 -6.884 1.00 0.00 H new ATOM 0 HE3 MET B 561 33.898 4.906 -5.871 1.00 0.00 H new ATOM 642 N LEU B 562 29.078 1.891 -4.256 1.00 0.00 N ATOM 643 CA LEU B 562 27.800 2.333 -3.710 1.00 0.00 C ATOM 644 C LEU B 562 27.350 1.422 -2.573 1.00 0.00 C ATOM 645 O LEU B 562 27.047 1.887 -1.474 1.00 0.00 O ATOM 646 CB LEU B 562 26.736 2.362 -4.808 1.00 0.00 C ATOM 647 CG LEU B 562 26.765 3.574 -5.740 1.00 0.00 C ATOM 648 CD1 LEU B 562 25.707 3.440 -6.824 1.00 0.00 C ATOM 649 CD2 LEU B 562 26.564 4.859 -4.951 1.00 0.00 C ATOM 0 H LEU B 562 29.079 1.754 -5.267 1.00 0.00 H new ATOM 0 HA LEU B 562 27.931 3.340 -3.314 1.00 0.00 H new ATOM 0 HB2 LEU B 562 26.842 1.461 -5.413 1.00 0.00 H new ATOM 0 HB3 LEU B 562 25.755 2.315 -4.336 1.00 0.00 H new ATOM 0 HG LEU B 562 27.743 3.616 -6.220 1.00 0.00 H new ATOM 0 HD11 LEU B 562 25.743 4.312 -7.477 1.00 0.00 H new ATOM 0 HD12 LEU B 562 25.897 2.540 -7.409 1.00 0.00 H new ATOM 0 HD13 LEU B 562 24.721 3.372 -6.364 1.00 0.00 H new ATOM 0 HD21 LEU B 562 26.588 5.711 -5.631 1.00 0.00 H new ATOM 0 HD22 LEU B 562 25.600 4.827 -4.443 1.00 0.00 H new ATOM 0 HD23 LEU B 562 27.360 4.961 -4.213 1.00 0.00 H new ATOM 661 N GLY B 563 27.309 0.121 -2.844 1.00 0.00 N ATOM 662 CA GLY B 563 26.896 -0.835 -1.833 1.00 0.00 C ATOM 663 C GLY B 563 27.790 -0.807 -0.609 1.00 0.00 C ATOM 664 O GLY B 563 27.304 -0.793 0.521 1.00 0.00 O ATOM 0 H GLY B 563 27.554 -0.288 -3.746 1.00 0.00 H new ATOM 0 HA2 GLY B 563 25.869 -0.623 -1.534 1.00 0.00 H new ATOM 0 HA3 GLY B 563 26.902 -1.837 -2.261 1.00 0.00 H new ATOM 668 N GLU B 564 29.100 -0.799 -0.835 1.00 0.00 N ATOM 669 CA GLU B 564 30.063 -0.775 0.260 1.00 0.00 C ATOM 670 C GLU B 564 29.779 0.386 1.209 1.00 0.00 C ATOM 671 O GLU B 564 29.784 0.220 2.429 1.00 0.00 O ATOM 672 CB GLU B 564 31.488 -0.664 -0.287 1.00 0.00 C ATOM 673 CG GLU B 564 32.288 -1.950 -0.166 1.00 0.00 C ATOM 674 CD GLU B 564 33.092 -2.018 1.118 1.00 0.00 C ATOM 675 OE1 GLU B 564 32.907 -1.133 1.980 1.00 0.00 O ATOM 676 OE2 GLU B 564 33.905 -2.955 1.261 1.00 0.00 O ATOM 0 H GLU B 564 29.518 -0.809 -1.765 1.00 0.00 H new ATOM 0 HA GLU B 564 29.966 -1.708 0.816 1.00 0.00 H new ATOM 0 HB2 GLU B 564 31.444 -0.371 -1.336 1.00 0.00 H new ATOM 0 HB3 GLU B 564 32.011 0.131 0.244 1.00 0.00 H new ATOM 0 HG2 GLU B 564 31.609 -2.801 -0.211 1.00 0.00 H new ATOM 0 HG3 GLU B 564 32.963 -2.035 -1.018 1.00 0.00 H new ATOM 683 N ARG B 565 29.533 1.562 0.639 1.00 0.00 N ATOM 684 CA ARG B 565 29.249 2.751 1.434 1.00 0.00 C ATOM 685 C ARG B 565 27.834 2.700 2.002 1.00 0.00 C ATOM 686 O ARG B 565 27.549 3.296 3.041 1.00 0.00 O ATOM 687 CB ARG B 565 29.424 4.011 0.584 1.00 0.00 C ATOM 688 CG ARG B 565 29.821 5.238 1.390 1.00 0.00 C ATOM 689 CD ARG B 565 31.314 5.509 1.293 1.00 0.00 C ATOM 690 NE ARG B 565 32.060 4.848 2.361 1.00 0.00 N ATOM 691 CZ ARG B 565 33.377 4.678 2.340 1.00 0.00 C ATOM 692 NH1 ARG B 565 34.090 5.119 1.313 1.00 0.00 N ATOM 693 NH2 ARG B 565 33.985 4.068 3.350 1.00 0.00 N ATOM 0 H ARG B 565 29.525 1.716 -0.369 1.00 0.00 H new ATOM 0 HA ARG B 565 29.954 2.780 2.265 1.00 0.00 H new ATOM 0 HB2 ARG B 565 30.183 3.824 -0.176 1.00 0.00 H new ATOM 0 HB3 ARG B 565 28.491 4.218 0.059 1.00 0.00 H new ATOM 0 HG2 ARG B 565 29.268 6.106 1.030 1.00 0.00 H new ATOM 0 HG3 ARG B 565 29.543 5.094 2.434 1.00 0.00 H new ATOM 0 HD2 ARG B 565 31.683 5.165 0.327 1.00 0.00 H new ATOM 0 HD3 ARG B 565 31.491 6.584 1.338 1.00 0.00 H new ATOM 0 HE ARG B 565 31.541 4.498 3.167 1.00 0.00 H new ATOM 0 HH11 ARG B 565 33.627 5.590 0.536 1.00 0.00 H new ATOM 0 HH12 ARG B 565 35.101 4.987 1.300 1.00 0.00 H new ATOM 0 HH21 ARG B 565 33.441 3.729 4.143 1.00 0.00 H new ATOM 0 HH22 ARG B 565 34.997 3.938 3.333 1.00 0.00 H new ATOM 707 N LEU B 566 26.951 1.984 1.313 1.00 0.00 N ATOM 708 CA LEU B 566 25.565 1.855 1.749 1.00 0.00 C ATOM 709 C LEU B 566 25.450 0.887 2.922 1.00 0.00 C ATOM 710 O LEU B 566 24.508 0.960 3.711 1.00 0.00 O ATOM 711 CB LEU B 566 24.689 1.376 0.590 1.00 0.00 C ATOM 712 CG LEU B 566 24.372 2.415 -0.486 1.00 0.00 C ATOM 713 CD1 LEU B 566 24.065 1.735 -1.811 1.00 0.00 C ATOM 714 CD2 LEU B 566 23.206 3.293 -0.053 1.00 0.00 C ATOM 0 H LEU B 566 27.170 1.485 0.451 1.00 0.00 H new ATOM 0 HA LEU B 566 25.220 2.836 2.077 1.00 0.00 H new ATOM 0 HB2 LEU B 566 25.182 0.529 0.114 1.00 0.00 H new ATOM 0 HB3 LEU B 566 23.748 1.008 1.000 1.00 0.00 H new ATOM 0 HG LEU B 566 25.248 3.049 -0.621 1.00 0.00 H new ATOM 0 HD11 LEU B 566 23.842 2.490 -2.564 1.00 0.00 H new ATOM 0 HD12 LEU B 566 24.928 1.150 -2.128 1.00 0.00 H new ATOM 0 HD13 LEU B 566 23.205 1.077 -1.691 1.00 0.00 H new ATOM 0 HD21 LEU B 566 22.994 4.027 -0.831 1.00 0.00 H new ATOM 0 HD22 LEU B 566 22.325 2.673 0.110 1.00 0.00 H new ATOM 0 HD23 LEU B 566 23.463 3.809 0.872 1.00 0.00 H new ATOM 726 N PHE B 567 26.417 -0.017 3.033 1.00 0.00 N ATOM 727 CA PHE B 567 26.426 -0.999 4.111 1.00 0.00 C ATOM 728 C PHE B 567 26.334 -0.314 5.471 1.00 0.00 C ATOM 729 O PHE B 567 25.426 -0.568 6.262 1.00 0.00 O ATOM 730 CB PHE B 567 27.693 -1.853 4.041 1.00 0.00 C ATOM 731 CG PHE B 567 28.113 -2.412 5.371 1.00 0.00 C ATOM 732 CD1 PHE B 567 27.233 -3.167 6.129 1.00 0.00 C ATOM 733 CD2 PHE B 567 29.388 -2.182 5.862 1.00 0.00 C ATOM 734 CE1 PHE B 567 27.617 -3.681 7.353 1.00 0.00 C ATOM 735 CE2 PHE B 567 29.778 -2.694 7.085 1.00 0.00 C ATOM 736 CZ PHE B 567 28.891 -3.445 7.831 1.00 0.00 C ATOM 0 H PHE B 567 27.205 -0.090 2.390 1.00 0.00 H new ATOM 0 HA PHE B 567 25.555 -1.644 3.989 1.00 0.00 H new ATOM 0 HB2 PHE B 567 27.529 -2.676 3.345 1.00 0.00 H new ATOM 0 HB3 PHE B 567 28.506 -1.250 3.636 1.00 0.00 H new ATOM 0 HD1 PHE B 567 26.236 -3.356 5.759 1.00 0.00 H new ATOM 0 HD2 PHE B 567 30.085 -1.596 5.282 1.00 0.00 H new ATOM 0 HE1 PHE B 567 26.921 -4.267 7.935 1.00 0.00 H new ATOM 0 HE2 PHE B 567 30.775 -2.507 7.457 1.00 0.00 H new ATOM 0 HZ PHE B 567 29.193 -3.847 8.787 1.00 0.00 H new ATOM 746 N PRO B 568 27.298 0.575 5.751 1.00 0.00 N ATOM 747 CA PRO B 568 27.349 1.316 7.015 1.00 0.00 C ATOM 748 C PRO B 568 26.230 2.345 7.130 1.00 0.00 C ATOM 749 O PRO B 568 25.740 2.625 8.224 1.00 0.00 O ATOM 750 CB PRO B 568 28.712 2.011 6.964 1.00 0.00 C ATOM 751 CG PRO B 568 29.019 2.136 5.512 1.00 0.00 C ATOM 752 CD PRO B 568 28.412 0.928 4.854 1.00 0.00 C ATOM 0 HA PRO B 568 27.221 0.661 7.877 1.00 0.00 H new ATOM 0 HB2 PRO B 568 28.677 2.988 7.447 1.00 0.00 H new ATOM 0 HB3 PRO B 568 29.474 1.427 7.481 1.00 0.00 H new ATOM 0 HG2 PRO B 568 28.600 3.055 5.102 1.00 0.00 H new ATOM 0 HG3 PRO B 568 30.095 2.173 5.343 1.00 0.00 H new ATOM 0 HD2 PRO B 568 28.061 1.153 3.847 1.00 0.00 H new ATOM 0 HD3 PRO B 568 29.131 0.114 4.767 1.00 0.00 H new ATOM 760 N LEU B 569 25.830 2.906 5.994 1.00 0.00 N ATOM 761 CA LEU B 569 24.767 3.904 5.967 1.00 0.00 C ATOM 762 C LEU B 569 23.471 3.337 6.539 1.00 0.00 C ATOM 763 O LEU B 569 22.925 3.867 7.507 1.00 0.00 O ATOM 764 CB LEU B 569 24.535 4.392 4.536 1.00 0.00 C ATOM 765 CG LEU B 569 25.512 5.450 4.021 1.00 0.00 C ATOM 766 CD1 LEU B 569 25.230 5.772 2.561 1.00 0.00 C ATOM 767 CD2 LEU B 569 25.431 6.710 4.872 1.00 0.00 C ATOM 0 H LEU B 569 26.226 2.687 5.080 1.00 0.00 H new ATOM 0 HA LEU B 569 25.078 4.746 6.586 1.00 0.00 H new ATOM 0 HB2 LEU B 569 24.578 3.531 3.869 1.00 0.00 H new ATOM 0 HB3 LEU B 569 23.525 4.796 4.471 1.00 0.00 H new ATOM 0 HG LEU B 569 26.523 5.050 4.095 1.00 0.00 H new ATOM 0 HD11 LEU B 569 25.935 6.527 2.212 1.00 0.00 H new ATOM 0 HD12 LEU B 569 25.339 4.868 1.961 1.00 0.00 H new ATOM 0 HD13 LEU B 569 24.213 6.152 2.462 1.00 0.00 H new ATOM 0 HD21 LEU B 569 26.133 7.452 4.491 1.00 0.00 H new ATOM 0 HD22 LEU B 569 24.419 7.113 4.830 1.00 0.00 H new ATOM 0 HD23 LEU B 569 25.683 6.468 5.905 1.00 0.00 H new ATOM 779 N ILE B 570 22.988 2.257 5.935 1.00 0.00 N ATOM 780 CA ILE B 570 21.759 1.616 6.387 1.00 0.00 C ATOM 781 C ILE B 570 21.994 0.814 7.663 1.00 0.00 C ATOM 782 O ILE B 570 21.052 0.495 8.388 1.00 0.00 O ATOM 783 CB ILE B 570 21.181 0.683 5.307 1.00 0.00 C ATOM 784 CG1 ILE B 570 20.926 1.459 4.013 1.00 0.00 C ATOM 785 CG2 ILE B 570 19.898 0.031 5.801 1.00 0.00 C ATOM 786 CD1 ILE B 570 21.257 0.676 2.763 1.00 0.00 C ATOM 0 H ILE B 570 23.428 1.808 5.132 1.00 0.00 H new ATOM 0 HA ILE B 570 21.043 2.413 6.588 1.00 0.00 H new ATOM 0 HB ILE B 570 21.908 -0.102 5.100 1.00 0.00 H new ATOM 0 HG12 ILE B 570 19.878 1.757 3.978 1.00 0.00 H new ATOM 0 HG13 ILE B 570 21.517 2.375 4.026 1.00 0.00 H new ATOM 0 HG21 ILE B 570 19.502 -0.625 5.026 1.00 0.00 H new ATOM 0 HG22 ILE B 570 20.108 -0.552 6.698 1.00 0.00 H new ATOM 0 HG23 ILE B 570 19.164 0.802 6.033 1.00 0.00 H new ATOM 0 HD11 ILE B 570 21.052 1.288 1.885 1.00 0.00 H new ATOM 0 HD12 ILE B 570 22.312 0.401 2.775 1.00 0.00 H new ATOM 0 HD13 ILE B 570 20.647 -0.226 2.727 1.00 0.00 H new ATOM 798 N GLN B 571 23.256 0.495 7.931 1.00 0.00 N ATOM 799 CA GLN B 571 23.614 -0.268 9.120 1.00 0.00 C ATOM 800 C GLN B 571 23.139 0.440 10.385 1.00 0.00 C ATOM 801 O GLN B 571 22.995 -0.180 11.438 1.00 0.00 O ATOM 802 CB GLN B 571 25.128 -0.481 9.178 1.00 0.00 C ATOM 803 CG GLN B 571 25.627 -0.932 10.542 1.00 0.00 C ATOM 804 CD GLN B 571 26.853 -1.818 10.451 1.00 0.00 C ATOM 805 OE1 GLN B 571 26.747 -3.045 10.441 1.00 0.00 O ATOM 806 NE2 GLN B 571 28.027 -1.201 10.383 1.00 0.00 N ATOM 0 H GLN B 571 24.047 0.753 7.341 1.00 0.00 H new ATOM 0 HA GLN B 571 23.120 -1.238 9.061 1.00 0.00 H new ATOM 0 HB2 GLN B 571 25.411 -1.224 8.433 1.00 0.00 H new ATOM 0 HB3 GLN B 571 25.628 0.449 8.906 1.00 0.00 H new ATOM 0 HG2 GLN B 571 25.861 -0.056 11.147 1.00 0.00 H new ATOM 0 HG3 GLN B 571 24.831 -1.471 11.056 1.00 0.00 H new ATOM 0 HE21 GLN B 571 28.069 -0.182 10.394 1.00 0.00 H new ATOM 0 HE22 GLN B 571 28.887 -1.746 10.319 1.00 0.00 H new ATOM 815 N ALA B 572 22.898 1.742 10.273 1.00 0.00 N ATOM 816 CA ALA B 572 22.438 2.534 11.407 1.00 0.00 C ATOM 817 C ALA B 572 20.919 2.489 11.527 1.00 0.00 C ATOM 818 O ALA B 572 20.330 3.200 12.341 1.00 0.00 O ATOM 819 CB ALA B 572 22.917 3.972 11.275 1.00 0.00 C ATOM 0 H ALA B 572 23.014 2.271 9.408 1.00 0.00 H new ATOM 0 HA ALA B 572 22.861 2.104 12.315 1.00 0.00 H new ATOM 0 HB1 ALA B 572 22.566 4.552 12.129 1.00 0.00 H new ATOM 0 HB2 ALA B 572 24.006 3.991 11.246 1.00 0.00 H new ATOM 0 HB3 ALA B 572 22.522 4.404 10.356 1.00 0.00 H new ATOM 825 N MET B 573 20.289 1.650 10.711 1.00 0.00 N ATOM 826 CA MET B 573 18.838 1.513 10.727 1.00 0.00 C ATOM 827 C MET B 573 18.428 0.048 10.620 1.00 0.00 C ATOM 828 O MET B 573 17.762 -0.487 11.507 1.00 0.00 O ATOM 829 CB MET B 573 18.215 2.313 9.581 1.00 0.00 C ATOM 830 CG MET B 573 18.822 3.696 9.406 1.00 0.00 C ATOM 831 SD MET B 573 17.807 4.774 8.377 1.00 0.00 S ATOM 832 CE MET B 573 18.554 4.512 6.771 1.00 0.00 C ATOM 0 H MET B 573 20.761 1.055 10.030 1.00 0.00 H new ATOM 0 HA MET B 573 18.473 1.906 11.676 1.00 0.00 H new ATOM 0 HB2 MET B 573 18.332 1.754 8.653 1.00 0.00 H new ATOM 0 HB3 MET B 573 17.145 2.415 9.759 1.00 0.00 H new ATOM 0 HG2 MET B 573 18.957 4.156 10.385 1.00 0.00 H new ATOM 0 HG3 MET B 573 19.812 3.600 8.960 1.00 0.00 H new ATOM 0 HE1 MET B 573 18.034 5.113 6.025 1.00 0.00 H new ATOM 0 HE2 MET B 573 19.603 4.805 6.806 1.00 0.00 H new ATOM 0 HE3 MET B 573 18.480 3.458 6.503 1.00 0.00 H new ATOM 842 N HIS B 574 18.832 -0.597 9.530 1.00 0.00 N ATOM 843 CA HIS B 574 18.507 -2.001 9.308 1.00 0.00 C ATOM 844 C HIS B 574 19.774 -2.825 9.095 1.00 0.00 C ATOM 845 O HIS B 574 20.028 -3.348 8.010 1.00 0.00 O ATOM 846 CB HIS B 574 17.580 -2.148 8.101 1.00 0.00 C ATOM 847 CG HIS B 574 16.373 -1.264 8.163 1.00 0.00 C ATOM 848 ND1 HIS B 574 15.151 -1.689 8.641 1.00 0.00 N ATOM 849 CD2 HIS B 574 16.204 0.031 7.804 1.00 0.00 C ATOM 850 CE1 HIS B 574 14.284 -0.695 8.572 1.00 0.00 C ATOM 851 NE2 HIS B 574 14.898 0.360 8.068 1.00 0.00 N ATOM 0 H HIS B 574 19.385 -0.170 8.787 1.00 0.00 H new ATOM 0 HA HIS B 574 17.996 -2.375 10.196 1.00 0.00 H new ATOM 0 HB2 HIS B 574 18.140 -1.922 7.193 1.00 0.00 H new ATOM 0 HB3 HIS B 574 17.257 -3.186 8.026 1.00 0.00 H new ATOM 0 HD2 HIS B 574 16.957 0.683 7.387 1.00 0.00 H new ATOM 0 HE1 HIS B 574 13.249 -0.738 8.876 1.00 0.00 H new ATOM 0 HE2 HIS B 574 14.471 1.271 7.902 1.00 0.00 H new ATOM 859 N PRO B 575 20.589 -2.943 10.153 1.00 0.00 N ATOM 860 CA PRO B 575 21.842 -3.701 10.106 1.00 0.00 C ATOM 861 C PRO B 575 21.607 -5.204 9.996 1.00 0.00 C ATOM 862 O PRO B 575 22.502 -5.956 9.607 1.00 0.00 O ATOM 863 CB PRO B 575 22.513 -3.362 11.440 1.00 0.00 C ATOM 864 CG PRO B 575 21.388 -2.998 12.347 1.00 0.00 C ATOM 865 CD PRO B 575 20.349 -2.346 11.478 1.00 0.00 C ATOM 0 HA PRO B 575 22.442 -3.442 9.233 1.00 0.00 H new ATOM 0 HB2 PRO B 575 23.075 -4.211 11.828 1.00 0.00 H new ATOM 0 HB3 PRO B 575 23.217 -2.537 11.331 1.00 0.00 H new ATOM 0 HG2 PRO B 575 20.984 -3.881 12.842 1.00 0.00 H new ATOM 0 HG3 PRO B 575 21.723 -2.319 13.131 1.00 0.00 H new ATOM 0 HD2 PRO B 575 19.340 -2.552 11.835 1.00 0.00 H new ATOM 0 HD3 PRO B 575 20.465 -1.262 11.457 1.00 0.00 H new ATOM 873 N THR B 576 20.398 -5.636 10.339 1.00 0.00 N ATOM 874 CA THR B 576 20.046 -7.049 10.279 1.00 0.00 C ATOM 875 C THR B 576 20.259 -7.610 8.877 1.00 0.00 C ATOM 876 O THR B 576 20.793 -8.707 8.712 1.00 0.00 O ATOM 877 CB THR B 576 18.581 -7.281 10.694 1.00 0.00 C ATOM 878 OG1 THR B 576 18.300 -6.581 11.912 1.00 0.00 O ATOM 879 CG2 THR B 576 18.299 -8.764 10.879 1.00 0.00 C ATOM 0 H THR B 576 19.646 -5.027 10.661 1.00 0.00 H new ATOM 0 HA THR B 576 20.701 -7.568 10.979 1.00 0.00 H new ATOM 0 HB THR B 576 17.937 -6.901 9.900 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.366 -6.732 12.168 1.00 0.00 H new ATOM 0 HG21 THR B 576 17.258 -8.903 11.172 1.00 0.00 H new ATOM 0 HG22 THR B 576 18.485 -9.289 9.942 1.00 0.00 H new ATOM 0 HG23 THR B 576 18.951 -9.164 11.656 1.00 0.00 H new ATOM 887 N LEU B 577 19.840 -6.850 7.871 1.00 0.00 N ATOM 888 CA LEU B 577 19.987 -7.271 6.482 1.00 0.00 C ATOM 889 C LEU B 577 20.427 -6.105 5.603 1.00 0.00 C ATOM 890 O LEU B 577 20.018 -5.997 4.448 1.00 0.00 O ATOM 891 CB LEU B 577 18.669 -7.848 5.962 1.00 0.00 C ATOM 892 CG LEU B 577 17.840 -8.645 6.970 1.00 0.00 C ATOM 893 CD1 LEU B 577 16.866 -7.732 7.700 1.00 0.00 C ATOM 894 CD2 LEU B 577 17.096 -9.775 6.275 1.00 0.00 C ATOM 0 H LEU B 577 19.396 -5.940 7.991 1.00 0.00 H new ATOM 0 HA LEU B 577 20.756 -8.042 6.441 1.00 0.00 H new ATOM 0 HB2 LEU B 577 18.058 -7.026 5.589 1.00 0.00 H new ATOM 0 HB3 LEU B 577 18.889 -8.494 5.112 1.00 0.00 H new ATOM 0 HG LEU B 577 18.517 -9.081 7.704 1.00 0.00 H new ATOM 0 HD11 LEU B 577 16.285 -8.316 8.413 1.00 0.00 H new ATOM 0 HD12 LEU B 577 17.421 -6.959 8.231 1.00 0.00 H new ATOM 0 HD13 LEU B 577 16.194 -7.266 6.979 1.00 0.00 H new ATOM 0 HD21 LEU B 577 16.512 -10.331 7.008 1.00 0.00 H new ATOM 0 HD22 LEU B 577 16.430 -9.361 5.519 1.00 0.00 H new ATOM 0 HD23 LEU B 577 17.813 -10.444 5.800 1.00 0.00 H new ATOM 906 N ALA B 578 21.264 -5.236 6.158 1.00 0.00 N ATOM 907 CA ALA B 578 21.764 -4.080 5.424 1.00 0.00 C ATOM 908 C ALA B 578 22.306 -4.490 4.059 1.00 0.00 C ATOM 909 O ALA B 578 21.911 -3.940 3.032 1.00 0.00 O ATOM 910 CB ALA B 578 22.840 -3.367 6.229 1.00 0.00 C ATOM 0 H ALA B 578 21.611 -5.310 7.114 1.00 0.00 H new ATOM 0 HA ALA B 578 20.932 -3.394 5.265 1.00 0.00 H new ATOM 0 HB1 ALA B 578 23.204 -2.506 5.668 1.00 0.00 H new ATOM 0 HB2 ALA B 578 22.422 -3.031 7.178 1.00 0.00 H new ATOM 0 HB3 ALA B 578 23.666 -4.052 6.419 1.00 0.00 H new ATOM 916 N GLY B 579 23.216 -5.459 4.055 1.00 0.00 N ATOM 917 CA GLY B 579 23.799 -5.925 2.811 1.00 0.00 C ATOM 918 C GLY B 579 22.751 -6.383 1.816 1.00 0.00 C ATOM 919 O GLY B 579 22.832 -6.069 0.628 1.00 0.00 O ATOM 0 H GLY B 579 23.560 -5.930 4.892 1.00 0.00 H new ATOM 0 HA2 GLY B 579 24.391 -5.124 2.368 1.00 0.00 H new ATOM 0 HA3 GLY B 579 24.482 -6.748 3.019 1.00 0.00 H new ATOM 923 N LYS B 580 21.764 -7.129 2.300 1.00 0.00 N ATOM 924 CA LYS B 580 20.695 -7.633 1.445 1.00 0.00 C ATOM 925 C LYS B 580 19.957 -6.485 0.764 1.00 0.00 C ATOM 926 O LYS B 580 19.936 -6.391 -0.464 1.00 0.00 O ATOM 927 CB LYS B 580 19.711 -8.470 2.265 1.00 0.00 C ATOM 928 CG LYS B 580 20.271 -9.813 2.701 1.00 0.00 C ATOM 929 CD LYS B 580 19.187 -10.710 3.275 1.00 0.00 C ATOM 930 CE LYS B 580 18.333 -11.324 2.177 1.00 0.00 C ATOM 931 NZ LYS B 580 18.694 -12.746 1.923 1.00 0.00 N ATOM 0 H LYS B 580 21.682 -7.398 3.280 1.00 0.00 H new ATOM 0 HA LYS B 580 21.144 -8.261 0.675 1.00 0.00 H new ATOM 0 HB2 LYS B 580 19.415 -7.905 3.149 1.00 0.00 H new ATOM 0 HB3 LYS B 580 18.809 -8.636 1.676 1.00 0.00 H new ATOM 0 HG2 LYS B 580 20.740 -10.306 1.850 1.00 0.00 H new ATOM 0 HG3 LYS B 580 21.050 -9.658 3.448 1.00 0.00 H new ATOM 0 HD2 LYS B 580 19.645 -11.502 3.867 1.00 0.00 H new ATOM 0 HD3 LYS B 580 18.555 -10.133 3.949 1.00 0.00 H new ATOM 0 HE2 LYS B 580 17.281 -11.261 2.457 1.00 0.00 H new ATOM 0 HE3 LYS B 580 18.454 -10.749 1.259 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 18.089 -13.128 1.168 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 19.691 -12.804 1.631 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 18.555 -13.300 2.792 1.00 0.00 H new ATOM 945 N ILE B 581 19.356 -5.614 1.567 1.00 0.00 N ATOM 946 CA ILE B 581 18.620 -4.472 1.040 1.00 0.00 C ATOM 947 C ILE B 581 19.533 -3.553 0.236 1.00 0.00 C ATOM 948 O ILE B 581 19.077 -2.819 -0.642 1.00 0.00 O ATOM 949 CB ILE B 581 17.958 -3.659 2.169 1.00 0.00 C ATOM 950 CG1 ILE B 581 19.008 -3.214 3.189 1.00 0.00 C ATOM 951 CG2 ILE B 581 16.870 -4.480 2.845 1.00 0.00 C ATOM 952 CD1 ILE B 581 18.417 -2.744 4.500 1.00 0.00 C ATOM 0 H ILE B 581 19.364 -5.677 2.585 1.00 0.00 H new ATOM 0 HA ILE B 581 17.844 -4.871 0.387 1.00 0.00 H new ATOM 0 HB ILE B 581 17.499 -2.770 1.736 1.00 0.00 H new ATOM 0 HG12 ILE B 581 19.688 -4.043 3.383 1.00 0.00 H new ATOM 0 HG13 ILE B 581 19.602 -2.408 2.758 1.00 0.00 H new ATOM 0 HG21 ILE B 581 16.412 -3.892 3.640 1.00 0.00 H new ATOM 0 HG22 ILE B 581 16.111 -4.752 2.112 1.00 0.00 H new ATOM 0 HG23 ILE B 581 17.307 -5.385 3.268 1.00 0.00 H new ATOM 0 HD11 ILE B 581 19.219 -2.444 5.174 1.00 0.00 H new ATOM 0 HD12 ILE B 581 17.759 -1.894 4.319 1.00 0.00 H new ATOM 0 HD13 ILE B 581 17.846 -3.555 4.953 1.00 0.00 H new ATOM 964 N THR B 582 20.826 -3.599 0.540 1.00 0.00 N ATOM 965 CA THR B 582 21.805 -2.772 -0.155 1.00 0.00 C ATOM 966 C THR B 582 21.963 -3.209 -1.607 1.00 0.00 C ATOM 967 O THR B 582 21.954 -2.384 -2.519 1.00 0.00 O ATOM 968 CB THR B 582 23.179 -2.826 0.538 1.00 0.00 C ATOM 969 OG1 THR B 582 23.141 -2.082 1.761 1.00 0.00 O ATOM 970 CG2 THR B 582 24.265 -2.265 -0.369 1.00 0.00 C ATOM 0 H THR B 582 21.220 -4.201 1.263 1.00 0.00 H new ATOM 0 HA THR B 582 21.431 -1.748 -0.125 1.00 0.00 H new ATOM 0 HB THR B 582 23.411 -3.869 0.755 1.00 0.00 H new ATOM 0 HG1 THR B 582 22.555 -2.536 2.402 1.00 0.00 H new ATOM 0 HG21 THR B 582 25.227 -2.313 0.142 1.00 0.00 H new ATOM 0 HG22 THR B 582 24.312 -2.851 -1.287 1.00 0.00 H new ATOM 0 HG23 THR B 582 24.036 -1.228 -0.613 1.00 0.00 H new ATOM 978 N GLY B 583 22.106 -4.515 -1.815 1.00 0.00 N ATOM 979 CA GLY B 583 22.263 -5.039 -3.158 1.00 0.00 C ATOM 980 C GLY B 583 21.117 -4.649 -4.071 1.00 0.00 C ATOM 981 O GLY B 583 21.335 -4.231 -5.208 1.00 0.00 O ATOM 0 H GLY B 583 22.116 -5.219 -1.077 1.00 0.00 H new ATOM 0 HA2 GLY B 583 23.200 -4.674 -3.580 1.00 0.00 H new ATOM 0 HA3 GLY B 583 22.335 -6.126 -3.114 1.00 0.00 H new ATOM 985 N MET B 584 19.893 -4.788 -3.573 1.00 0.00 N ATOM 986 CA MET B 584 18.708 -4.447 -4.352 1.00 0.00 C ATOM 987 C MET B 584 18.623 -2.941 -4.580 1.00 0.00 C ATOM 988 O MET B 584 18.420 -2.484 -5.706 1.00 0.00 O ATOM 989 CB MET B 584 17.446 -4.940 -3.642 1.00 0.00 C ATOM 990 CG MET B 584 17.496 -6.411 -3.264 1.00 0.00 C ATOM 991 SD MET B 584 17.056 -6.701 -1.540 1.00 0.00 S ATOM 992 CE MET B 584 15.268 -6.718 -1.645 1.00 0.00 C ATOM 0 H MET B 584 19.696 -5.134 -2.634 1.00 0.00 H new ATOM 0 HA MET B 584 18.786 -4.939 -5.321 1.00 0.00 H new ATOM 0 HB2 MET B 584 17.291 -4.347 -2.741 1.00 0.00 H new ATOM 0 HB3 MET B 584 16.585 -4.769 -4.288 1.00 0.00 H new ATOM 0 HG2 MET B 584 16.817 -6.971 -3.907 1.00 0.00 H new ATOM 0 HG3 MET B 584 18.499 -6.796 -3.448 1.00 0.00 H new ATOM 0 HE1 MET B 584 14.867 -7.413 -0.908 1.00 0.00 H new ATOM 0 HE2 MET B 584 14.882 -5.718 -1.448 1.00 0.00 H new ATOM 0 HE3 MET B 584 14.965 -7.033 -2.643 1.00 0.00 H new ATOM 1002 N LEU B 585 18.777 -2.175 -3.506 1.00 0.00 N ATOM 1003 CA LEU B 585 18.717 -0.720 -3.590 1.00 0.00 C ATOM 1004 C LEU B 585 19.730 -0.190 -4.599 1.00 0.00 C ATOM 1005 O LEU B 585 19.367 0.484 -5.565 1.00 0.00 O ATOM 1006 CB LEU B 585 18.976 -0.099 -2.216 1.00 0.00 C ATOM 1007 CG LEU B 585 17.736 0.286 -1.408 1.00 0.00 C ATOM 1008 CD1 LEU B 585 16.892 1.293 -2.173 1.00 0.00 C ATOM 1009 CD2 LEU B 585 16.917 -0.951 -1.067 1.00 0.00 C ATOM 0 H LEU B 585 18.944 -2.537 -2.567 1.00 0.00 H new ATOM 0 HA LEU B 585 17.718 -0.441 -3.926 1.00 0.00 H new ATOM 0 HB2 LEU B 585 19.565 -0.802 -1.627 1.00 0.00 H new ATOM 0 HB3 LEU B 585 19.588 0.793 -2.352 1.00 0.00 H new ATOM 0 HG LEU B 585 18.062 0.750 -0.477 1.00 0.00 H new ATOM 0 HD11 LEU B 585 16.014 1.555 -1.583 1.00 0.00 H new ATOM 0 HD12 LEU B 585 17.481 2.190 -2.365 1.00 0.00 H new ATOM 0 HD13 LEU B 585 16.575 0.857 -3.120 1.00 0.00 H new ATOM 0 HD21 LEU B 585 16.038 -0.659 -0.492 1.00 0.00 H new ATOM 0 HD22 LEU B 585 16.601 -1.443 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU B 585 17.524 -1.638 -0.478 1.00 0.00 H new ATOM 1021 N LEU B 586 21.002 -0.499 -4.372 1.00 0.00 N ATOM 1022 CA LEU B 586 22.068 -0.056 -5.263 1.00 0.00 C ATOM 1023 C LEU B 586 21.835 -0.559 -6.684 1.00 0.00 C ATOM 1024 O LEU B 586 22.286 0.054 -7.650 1.00 0.00 O ATOM 1025 CB LEU B 586 23.424 -0.548 -4.751 1.00 0.00 C ATOM 1026 CG LEU B 586 23.815 -1.971 -5.150 1.00 0.00 C ATOM 1027 CD1 LEU B 586 24.537 -1.972 -6.488 1.00 0.00 C ATOM 1028 CD2 LEU B 586 24.683 -2.606 -4.073 1.00 0.00 C ATOM 0 H LEU B 586 21.320 -1.055 -3.578 1.00 0.00 H new ATOM 0 HA LEU B 586 22.066 1.034 -5.279 1.00 0.00 H new ATOM 0 HB2 LEU B 586 24.195 0.134 -5.111 1.00 0.00 H new ATOM 0 HB3 LEU B 586 23.424 -0.484 -3.663 1.00 0.00 H new ATOM 0 HG LEU B 586 22.905 -2.562 -5.252 1.00 0.00 H new ATOM 0 HD11 LEU B 586 24.807 -2.994 -6.755 1.00 0.00 H new ATOM 0 HD12 LEU B 586 23.883 -1.558 -7.255 1.00 0.00 H new ATOM 0 HD13 LEU B 586 25.440 -1.365 -6.415 1.00 0.00 H new ATOM 0 HD21 LEU B 586 24.952 -3.619 -4.373 1.00 0.00 H new ATOM 0 HD22 LEU B 586 25.589 -2.014 -3.940 1.00 0.00 H new ATOM 0 HD23 LEU B 586 24.131 -2.641 -3.134 1.00 0.00 H new ATOM 1040 N GLU B 587 21.126 -1.678 -6.801 1.00 0.00 N ATOM 1041 CA GLU B 587 20.832 -2.262 -8.104 1.00 0.00 C ATOM 1042 C GLU B 587 19.729 -1.481 -8.814 1.00 0.00 C ATOM 1043 O GLU B 587 19.574 -1.574 -10.032 1.00 0.00 O ATOM 1044 CB GLU B 587 20.417 -3.726 -7.950 1.00 0.00 C ATOM 1045 CG GLU B 587 21.578 -4.702 -8.052 1.00 0.00 C ATOM 1046 CD GLU B 587 21.170 -6.129 -7.741 1.00 0.00 C ATOM 1047 OE1 GLU B 587 20.707 -6.829 -8.666 1.00 0.00 O ATOM 1048 OE2 GLU B 587 21.314 -6.545 -6.572 1.00 0.00 O ATOM 0 H GLU B 587 20.745 -2.197 -6.010 1.00 0.00 H new ATOM 0 HA GLU B 587 21.737 -2.211 -8.709 1.00 0.00 H new ATOM 0 HB2 GLU B 587 19.927 -3.856 -6.985 1.00 0.00 H new ATOM 0 HB3 GLU B 587 19.681 -3.969 -8.716 1.00 0.00 H new ATOM 0 HG2 GLU B 587 21.997 -4.659 -9.057 1.00 0.00 H new ATOM 0 HG3 GLU B 587 22.367 -4.396 -7.365 1.00 0.00 H new ATOM 1055 N ILE B 588 18.966 -0.714 -8.043 1.00 0.00 N ATOM 1056 CA ILE B 588 17.878 0.082 -8.597 1.00 0.00 C ATOM 1057 C ILE B 588 18.351 0.902 -9.793 1.00 0.00 C ATOM 1058 O ILE B 588 17.872 0.719 -10.912 1.00 0.00 O ATOM 1059 CB ILE B 588 17.282 1.032 -7.541 1.00 0.00 C ATOM 1060 CG1 ILE B 588 16.620 0.231 -6.419 1.00 0.00 C ATOM 1061 CG2 ILE B 588 16.279 1.978 -8.186 1.00 0.00 C ATOM 1062 CD1 ILE B 588 16.127 1.088 -5.274 1.00 0.00 C ATOM 0 H ILE B 588 19.081 -0.627 -7.033 1.00 0.00 H new ATOM 0 HA ILE B 588 17.108 -0.618 -8.921 1.00 0.00 H new ATOM 0 HB ILE B 588 18.089 1.626 -7.111 1.00 0.00 H new ATOM 0 HG12 ILE B 588 15.780 -0.329 -6.830 1.00 0.00 H new ATOM 0 HG13 ILE B 588 17.333 -0.499 -6.035 1.00 0.00 H new ATOM 0 HG21 ILE B 588 15.866 2.643 -7.427 1.00 0.00 H new ATOM 0 HG22 ILE B 588 16.778 2.569 -8.954 1.00 0.00 H new ATOM 0 HG23 ILE B 588 15.473 1.400 -8.639 1.00 0.00 H new ATOM 0 HD11 ILE B 588 15.669 0.453 -4.515 1.00 0.00 H new ATOM 0 HD12 ILE B 588 16.966 1.629 -4.837 1.00 0.00 H new ATOM 0 HD13 ILE B 588 15.390 1.800 -5.644 1.00 0.00 H new ATOM 1074 N ASP B 589 19.294 1.805 -9.548 1.00 0.00 N ATOM 1075 CA ASP B 589 19.834 2.652 -10.606 1.00 0.00 C ATOM 1076 C ASP B 589 20.838 3.652 -10.041 1.00 0.00 C ATOM 1077 O ASP B 589 20.545 4.367 -9.084 1.00 0.00 O ATOM 1078 CB ASP B 589 18.705 3.393 -11.322 1.00 0.00 C ATOM 1079 CG ASP B 589 18.757 3.214 -12.826 1.00 0.00 C ATOM 1080 OD1 ASP B 589 18.393 2.120 -13.307 1.00 0.00 O ATOM 1081 OD2 ASP B 589 19.161 4.168 -13.524 1.00 0.00 O ATOM 0 H ASP B 589 19.700 1.970 -8.627 1.00 0.00 H new ATOM 0 HA ASP B 589 20.349 2.012 -11.323 1.00 0.00 H new ATOM 0 HB2 ASP B 589 17.746 3.034 -10.949 1.00 0.00 H new ATOM 0 HB3 ASP B 589 18.763 4.455 -11.083 1.00 0.00 H new ATOM 1086 N ASN B 590 22.024 3.694 -10.640 1.00 0.00 N ATOM 1087 CA ASN B 590 23.073 4.605 -10.196 1.00 0.00 C ATOM 1088 C ASN B 590 22.638 6.058 -10.364 1.00 0.00 C ATOM 1089 O ASN B 590 23.046 6.931 -9.599 1.00 0.00 O ATOM 1090 CB ASN B 590 24.362 4.353 -10.980 1.00 0.00 C ATOM 1091 CG ASN B 590 24.937 2.974 -10.718 1.00 0.00 C ATOM 1092 OD1 ASN B 590 24.244 1.965 -10.846 1.00 0.00 O ATOM 1093 ND2 ASN B 590 26.212 2.925 -10.348 1.00 0.00 N ATOM 0 H ASN B 590 22.283 3.108 -11.434 1.00 0.00 H new ATOM 0 HA ASN B 590 23.257 4.419 -9.138 1.00 0.00 H new ATOM 0 HB2 ASN B 590 24.164 4.465 -12.046 1.00 0.00 H new ATOM 0 HB3 ASN B 590 25.101 5.109 -10.712 1.00 0.00 H new ATOM 0 HD21 ASN B 590 26.654 2.025 -10.158 1.00 0.00 H new ATOM 0 HD22 ASN B 590 26.749 3.787 -10.254 1.00 0.00 H new ATOM 1100 N SER B 591 21.808 6.309 -11.372 1.00 0.00 N ATOM 1101 CA SER B 591 21.321 7.656 -11.643 1.00 0.00 C ATOM 1102 C SER B 591 20.460 8.165 -10.491 1.00 0.00 C ATOM 1103 O SER B 591 20.658 9.275 -9.999 1.00 0.00 O ATOM 1104 CB SER B 591 20.515 7.677 -12.944 1.00 0.00 C ATOM 1105 OG SER B 591 20.264 9.006 -13.367 1.00 0.00 O ATOM 0 H SER B 591 21.459 5.597 -12.014 1.00 0.00 H new ATOM 0 HA SER B 591 22.184 8.314 -11.747 1.00 0.00 H new ATOM 0 HB2 SER B 591 21.060 7.141 -13.722 1.00 0.00 H new ATOM 0 HB3 SER B 591 19.570 7.154 -12.798 1.00 0.00 H new ATOM 0 HG SER B 591 19.749 8.992 -14.201 1.00 0.00 H new ATOM 1111 N GLU B 592 19.505 7.344 -10.066 1.00 0.00 N ATOM 1112 CA GLU B 592 18.614 7.711 -8.972 1.00 0.00 C ATOM 1113 C GLU B 592 19.362 7.725 -7.642 1.00 0.00 C ATOM 1114 O GLU B 592 19.256 8.677 -6.868 1.00 0.00 O ATOM 1115 CB GLU B 592 17.435 6.738 -8.897 1.00 0.00 C ATOM 1116 CG GLU B 592 16.584 6.713 -10.155 1.00 0.00 C ATOM 1117 CD GLU B 592 15.692 7.933 -10.280 1.00 0.00 C ATOM 1118 OE1 GLU B 592 15.002 8.267 -9.295 1.00 0.00 O ATOM 1119 OE2 GLU B 592 15.684 8.552 -11.365 1.00 0.00 O ATOM 0 H GLU B 592 19.329 6.421 -10.462 1.00 0.00 H new ATOM 0 HA GLU B 592 18.236 8.715 -9.166 1.00 0.00 H new ATOM 0 HB2 GLU B 592 17.815 5.734 -8.706 1.00 0.00 H new ATOM 0 HB3 GLU B 592 16.806 7.008 -8.049 1.00 0.00 H new ATOM 0 HG2 GLU B 592 17.234 6.652 -11.028 1.00 0.00 H new ATOM 0 HG3 GLU B 592 15.967 5.815 -10.154 1.00 0.00 H new ATOM 1126 N LEU B 593 20.117 6.663 -7.384 1.00 0.00 N ATOM 1127 CA LEU B 593 20.883 6.551 -6.147 1.00 0.00 C ATOM 1128 C LEU B 593 21.761 7.781 -5.938 1.00 0.00 C ATOM 1129 O LEU B 593 21.757 8.384 -4.863 1.00 0.00 O ATOM 1130 CB LEU B 593 21.749 5.291 -6.173 1.00 0.00 C ATOM 1131 CG LEU B 593 20.998 3.962 -6.255 1.00 0.00 C ATOM 1132 CD1 LEU B 593 21.843 2.914 -6.963 1.00 0.00 C ATOM 1133 CD2 LEU B 593 20.607 3.484 -4.865 1.00 0.00 C ATOM 0 H LEU B 593 20.215 5.867 -8.014 1.00 0.00 H new ATOM 0 HA LEU B 593 20.179 6.484 -5.317 1.00 0.00 H new ATOM 0 HB2 LEU B 593 22.425 5.357 -7.026 1.00 0.00 H new ATOM 0 HB3 LEU B 593 22.368 5.281 -5.276 1.00 0.00 H new ATOM 0 HG LEU B 593 20.087 4.116 -6.834 1.00 0.00 H new ATOM 0 HD11 LEU B 593 21.292 1.975 -7.012 1.00 0.00 H new ATOM 0 HD12 LEU B 593 22.072 3.253 -7.973 1.00 0.00 H new ATOM 0 HD13 LEU B 593 22.771 2.762 -6.412 1.00 0.00 H new ATOM 0 HD21 LEU B 593 20.073 2.537 -4.943 1.00 0.00 H new ATOM 0 HD22 LEU B 593 21.504 3.347 -4.262 1.00 0.00 H new ATOM 0 HD23 LEU B 593 19.963 4.226 -4.393 1.00 0.00 H new ATOM 1145 N LEU B 594 22.509 8.150 -6.971 1.00 0.00 N ATOM 1146 CA LEU B 594 23.391 9.311 -6.902 1.00 0.00 C ATOM 1147 C LEU B 594 22.634 10.541 -6.413 1.00 0.00 C ATOM 1148 O LEU B 594 23.212 11.432 -5.789 1.00 0.00 O ATOM 1149 CB LEU B 594 24.008 9.589 -8.273 1.00 0.00 C ATOM 1150 CG LEU B 594 25.232 10.506 -8.284 1.00 0.00 C ATOM 1151 CD1 LEU B 594 26.481 9.726 -8.664 1.00 0.00 C ATOM 1152 CD2 LEU B 594 25.017 11.670 -9.241 1.00 0.00 C ATOM 0 H LEU B 594 22.523 7.663 -7.867 1.00 0.00 H new ATOM 0 HA LEU B 594 24.187 9.091 -6.191 1.00 0.00 H new ATOM 0 HB2 LEU B 594 24.288 8.637 -8.723 1.00 0.00 H new ATOM 0 HB3 LEU B 594 23.242 10.030 -8.911 1.00 0.00 H new ATOM 0 HG LEU B 594 25.371 10.907 -7.280 1.00 0.00 H new ATOM 0 HD11 LEU B 594 27.341 10.395 -8.666 1.00 0.00 H new ATOM 0 HD12 LEU B 594 26.645 8.927 -7.941 1.00 0.00 H new ATOM 0 HD13 LEU B 594 26.353 9.296 -9.657 1.00 0.00 H new ATOM 0 HD21 LEU B 594 25.898 12.312 -9.236 1.00 0.00 H new ATOM 0 HD22 LEU B 594 24.852 11.287 -10.248 1.00 0.00 H new ATOM 0 HD23 LEU B 594 24.147 12.245 -8.925 1.00 0.00 H new ATOM 1164 N HIS B 595 21.336 10.583 -6.698 1.00 0.00 N ATOM 1165 CA HIS B 595 20.498 11.704 -6.285 1.00 0.00 C ATOM 1166 C HIS B 595 19.936 11.474 -4.885 1.00 0.00 C ATOM 1167 O HIS B 595 19.687 12.424 -4.143 1.00 0.00 O ATOM 1168 CB HIS B 595 19.355 11.907 -7.280 1.00 0.00 C ATOM 1169 CG HIS B 595 18.682 13.239 -7.154 1.00 0.00 C ATOM 1170 ND1 HIS B 595 17.467 13.412 -6.527 1.00 0.00 N ATOM 1171 CD2 HIS B 595 19.063 14.467 -7.578 1.00 0.00 C ATOM 1172 CE1 HIS B 595 17.128 14.688 -6.572 1.00 0.00 C ATOM 1173 NE2 HIS B 595 18.080 15.350 -7.205 1.00 0.00 N ATOM 0 H HIS B 595 20.842 9.854 -7.213 1.00 0.00 H new ATOM 0 HA HIS B 595 21.116 12.601 -6.266 1.00 0.00 H new ATOM 0 HB2 HIS B 595 19.742 11.799 -8.293 1.00 0.00 H new ATOM 0 HB3 HIS B 595 18.615 11.120 -7.136 1.00 0.00 H new ATOM 0 HD2 HIS B 595 19.971 14.707 -8.111 1.00 0.00 H new ATOM 0 HE1 HIS B 595 16.226 15.117 -6.161 1.00 0.00 H new ATOM 0 HE2 HIS B 595 18.084 16.354 -7.387 1.00 0.00 H new ATOM 1181 N MET B 596 19.738 10.208 -4.533 1.00 0.00 N ATOM 1182 CA MET B 596 19.206 9.855 -3.222 1.00 0.00 C ATOM 1183 C MET B 596 20.241 10.101 -2.130 1.00 0.00 C ATOM 1184 O MET B 596 19.895 10.288 -0.962 1.00 0.00 O ATOM 1185 CB MET B 596 18.767 8.389 -3.204 1.00 0.00 C ATOM 1186 CG MET B 596 19.765 7.465 -2.524 1.00 0.00 C ATOM 1187 SD MET B 596 19.318 5.725 -2.681 1.00 0.00 S ATOM 1188 CE MET B 596 17.590 5.776 -2.214 1.00 0.00 C ATOM 0 H MET B 596 19.938 9.410 -5.136 1.00 0.00 H new ATOM 0 HA MET B 596 18.341 10.489 -3.027 1.00 0.00 H new ATOM 0 HB2 MET B 596 17.807 8.312 -2.694 1.00 0.00 H new ATOM 0 HB3 MET B 596 18.612 8.052 -4.229 1.00 0.00 H new ATOM 0 HG2 MET B 596 20.753 7.623 -2.956 1.00 0.00 H new ATOM 0 HG3 MET B 596 19.834 7.725 -1.468 1.00 0.00 H new ATOM 0 HE1 MET B 596 17.341 4.882 -1.642 1.00 0.00 H new ATOM 0 HE2 MET B 596 17.404 6.660 -1.604 1.00 0.00 H new ATOM 0 HE3 MET B 596 16.972 5.817 -3.111 1.00 0.00 H new ATOM 1198 N LEU B 597 21.513 10.100 -2.515 1.00 0.00 N ATOM 1199 CA LEU B 597 22.600 10.324 -1.568 1.00 0.00 C ATOM 1200 C LEU B 597 22.318 11.541 -0.693 1.00 0.00 C ATOM 1201 O LEU B 597 22.554 11.517 0.514 1.00 0.00 O ATOM 1202 CB LEU B 597 23.922 10.513 -2.314 1.00 0.00 C ATOM 1203 CG LEU B 597 24.230 9.486 -3.404 1.00 0.00 C ATOM 1204 CD1 LEU B 597 25.649 9.664 -3.919 1.00 0.00 C ATOM 1205 CD2 LEU B 597 24.024 8.072 -2.879 1.00 0.00 C ATOM 0 H LEU B 597 21.817 9.947 -3.477 1.00 0.00 H new ATOM 0 HA LEU B 597 22.675 9.447 -0.925 1.00 0.00 H new ATOM 0 HB2 LEU B 597 23.922 11.505 -2.767 1.00 0.00 H new ATOM 0 HB3 LEU B 597 24.733 10.495 -1.586 1.00 0.00 H new ATOM 0 HG LEU B 597 23.542 9.648 -4.233 1.00 0.00 H new ATOM 0 HD11 LEU B 597 25.850 8.924 -4.694 1.00 0.00 H new ATOM 0 HD12 LEU B 597 25.762 10.665 -4.335 1.00 0.00 H new ATOM 0 HD13 LEU B 597 26.353 9.530 -3.098 1.00 0.00 H new ATOM 0 HD21 LEU B 597 24.248 7.355 -3.668 1.00 0.00 H new ATOM 0 HD22 LEU B 597 24.688 7.898 -2.032 1.00 0.00 H new ATOM 0 HD23 LEU B 597 22.989 7.949 -2.560 1.00 0.00 H new ATOM 1217 N GLU B 598 21.810 12.603 -1.311 1.00 0.00 N ATOM 1218 CA GLU B 598 21.495 13.829 -0.587 1.00 0.00 C ATOM 1219 C GLU B 598 19.985 14.027 -0.484 1.00 0.00 C ATOM 1220 O GLU B 598 19.507 15.144 -0.283 1.00 0.00 O ATOM 1221 CB GLU B 598 22.132 15.035 -1.281 1.00 0.00 C ATOM 1222 CG GLU B 598 21.427 15.442 -2.564 1.00 0.00 C ATOM 1223 CD GLU B 598 22.348 16.155 -3.535 1.00 0.00 C ATOM 1224 OE1 GLU B 598 23.314 15.522 -4.010 1.00 0.00 O ATOM 1225 OE2 GLU B 598 22.102 17.345 -3.820 1.00 0.00 O ATOM 0 H GLU B 598 21.608 12.639 -2.310 1.00 0.00 H new ATOM 0 HA GLU B 598 21.902 13.741 0.420 1.00 0.00 H new ATOM 0 HB2 GLU B 598 22.133 15.881 -0.593 1.00 0.00 H new ATOM 0 HB3 GLU B 598 23.174 14.806 -1.506 1.00 0.00 H new ATOM 0 HG2 GLU B 598 21.015 14.555 -3.045 1.00 0.00 H new ATOM 0 HG3 GLU B 598 20.587 16.093 -2.322 1.00 0.00 H new ATOM 1232 N SER B 599 19.240 12.935 -0.623 1.00 0.00 N ATOM 1233 CA SER B 599 17.785 12.988 -0.549 1.00 0.00 C ATOM 1234 C SER B 599 17.265 12.103 0.579 1.00 0.00 C ATOM 1235 O SER B 599 16.850 10.963 0.368 1.00 0.00 O ATOM 1236 CB SER B 599 17.170 12.551 -1.880 1.00 0.00 C ATOM 1237 OG SER B 599 15.907 13.162 -2.084 1.00 0.00 O ATOM 0 H SER B 599 19.620 12.003 -0.787 1.00 0.00 H new ATOM 0 HA SER B 599 17.494 14.018 -0.342 1.00 0.00 H new ATOM 0 HB2 SER B 599 17.841 12.814 -2.698 1.00 0.00 H new ATOM 0 HB3 SER B 599 17.059 11.467 -1.894 1.00 0.00 H new ATOM 0 HG SER B 599 15.536 12.868 -2.942 1.00 0.00 H new ATOM 1243 N PRO B 600 17.288 12.639 1.809 1.00 0.00 N ATOM 1244 CA PRO B 600 16.822 11.917 2.996 1.00 0.00 C ATOM 1245 C PRO B 600 15.310 11.724 3.001 1.00 0.00 C ATOM 1246 O PRO B 600 14.770 11.009 3.845 1.00 0.00 O ATOM 1247 CB PRO B 600 17.250 12.823 4.153 1.00 0.00 C ATOM 1248 CG PRO B 600 17.327 14.186 3.558 1.00 0.00 C ATOM 1249 CD PRO B 600 17.769 13.992 2.134 1.00 0.00 C ATOM 0 HA PRO B 600 17.236 10.910 3.049 1.00 0.00 H new ATOM 0 HB2 PRO B 600 16.530 12.788 4.971 1.00 0.00 H new ATOM 0 HB3 PRO B 600 18.212 12.515 4.562 1.00 0.00 H new ATOM 0 HG2 PRO B 600 16.359 14.686 3.602 1.00 0.00 H new ATOM 0 HG3 PRO B 600 18.034 14.811 4.104 1.00 0.00 H new ATOM 0 HD2 PRO B 600 17.335 14.742 1.473 1.00 0.00 H new ATOM 0 HD3 PRO B 600 18.852 14.068 2.035 1.00 0.00 H new ATOM 1257 N GLU B 601 14.633 12.365 2.054 1.00 0.00 N ATOM 1258 CA GLU B 601 13.182 12.264 1.952 1.00 0.00 C ATOM 1259 C GLU B 601 12.779 11.045 1.126 1.00 0.00 C ATOM 1260 O GLU B 601 11.663 10.540 1.249 1.00 0.00 O ATOM 1261 CB GLU B 601 12.602 13.533 1.323 1.00 0.00 C ATOM 1262 CG GLU B 601 13.175 13.849 -0.048 1.00 0.00 C ATOM 1263 CD GLU B 601 12.478 15.019 -0.716 1.00 0.00 C ATOM 1264 OE1 GLU B 601 11.438 15.468 -0.190 1.00 0.00 O ATOM 1265 OE2 GLU B 601 12.971 15.484 -1.764 1.00 0.00 O ATOM 0 H GLU B 601 15.066 12.959 1.347 1.00 0.00 H new ATOM 0 HA GLU B 601 12.780 12.150 2.959 1.00 0.00 H new ATOM 0 HB2 GLU B 601 11.521 13.425 1.240 1.00 0.00 H new ATOM 0 HB3 GLU B 601 12.788 14.376 1.988 1.00 0.00 H new ATOM 0 HG2 GLU B 601 14.238 14.071 0.049 1.00 0.00 H new ATOM 0 HG3 GLU B 601 13.090 12.969 -0.685 1.00 0.00 H new ATOM 1272 N SER B 602 13.695 10.578 0.285 1.00 0.00 N ATOM 1273 CA SER B 602 13.435 9.422 -0.565 1.00 0.00 C ATOM 1274 C SER B 602 14.173 8.191 -0.047 1.00 0.00 C ATOM 1275 O SER B 602 13.689 7.065 -0.170 1.00 0.00 O ATOM 1276 CB SER B 602 13.857 9.715 -2.006 1.00 0.00 C ATOM 1277 OG SER B 602 13.299 8.772 -2.903 1.00 0.00 O ATOM 0 H SER B 602 14.625 10.982 0.174 1.00 0.00 H new ATOM 0 HA SER B 602 12.364 9.219 -0.543 1.00 0.00 H new ATOM 0 HB2 SER B 602 13.538 10.719 -2.284 1.00 0.00 H new ATOM 0 HB3 SER B 602 14.944 9.694 -2.081 1.00 0.00 H new ATOM 0 HG SER B 602 13.583 8.982 -3.817 1.00 0.00 H new ATOM 1283 N LEU B 603 15.348 8.413 0.532 1.00 0.00 N ATOM 1284 CA LEU B 603 16.155 7.323 1.069 1.00 0.00 C ATOM 1285 C LEU B 603 15.323 6.431 1.985 1.00 0.00 C ATOM 1286 O LEU B 603 15.120 5.250 1.701 1.00 0.00 O ATOM 1287 CB LEU B 603 17.356 7.880 1.834 1.00 0.00 C ATOM 1288 CG LEU B 603 18.334 6.847 2.393 1.00 0.00 C ATOM 1289 CD1 LEU B 603 18.861 5.954 1.280 1.00 0.00 C ATOM 1290 CD2 LEU B 603 19.483 7.535 3.115 1.00 0.00 C ATOM 0 H LEU B 603 15.763 9.338 0.642 1.00 0.00 H new ATOM 0 HA LEU B 603 16.512 6.722 0.233 1.00 0.00 H new ATOM 0 HB2 LEU B 603 17.905 8.549 1.171 1.00 0.00 H new ATOM 0 HB3 LEU B 603 16.985 8.485 2.662 1.00 0.00 H new ATOM 0 HG LEU B 603 17.802 6.223 3.111 1.00 0.00 H new ATOM 0 HD11 LEU B 603 19.556 5.225 1.697 1.00 0.00 H new ATOM 0 HD12 LEU B 603 18.029 5.433 0.807 1.00 0.00 H new ATOM 0 HD13 LEU B 603 19.377 6.563 0.538 1.00 0.00 H new ATOM 0 HD21 LEU B 603 20.169 6.784 3.506 1.00 0.00 H new ATOM 0 HD22 LEU B 603 20.014 8.184 2.418 1.00 0.00 H new ATOM 0 HD23 LEU B 603 19.090 8.131 3.938 1.00 0.00 H new ATOM 1302 N ARG B 604 14.843 7.003 3.084 1.00 0.00 N ATOM 1303 CA ARG B 604 14.033 6.260 4.041 1.00 0.00 C ATOM 1304 C ARG B 604 12.869 5.564 3.343 1.00 0.00 C ATOM 1305 O ARG B 604 12.439 4.486 3.755 1.00 0.00 O ATOM 1306 CB ARG B 604 13.503 7.196 5.129 1.00 0.00 C ATOM 1307 CG ARG B 604 12.342 8.064 4.673 1.00 0.00 C ATOM 1308 CD ARG B 604 11.004 7.404 4.967 1.00 0.00 C ATOM 1309 NE ARG B 604 9.994 7.746 3.969 1.00 0.00 N ATOM 1310 CZ ARG B 604 8.711 7.420 4.080 1.00 0.00 C ATOM 1311 NH1 ARG B 604 8.284 6.748 5.140 1.00 0.00 N ATOM 1312 NH2 ARG B 604 7.852 7.766 3.129 1.00 0.00 N ATOM 0 H ARG B 604 15.001 7.979 3.334 1.00 0.00 H new ATOM 0 HA ARG B 604 14.665 5.501 4.501 1.00 0.00 H new ATOM 0 HB2 ARG B 604 13.186 6.601 5.986 1.00 0.00 H new ATOM 0 HB3 ARG B 604 14.314 7.839 5.470 1.00 0.00 H new ATOM 0 HG2 ARG B 604 12.390 9.031 5.174 1.00 0.00 H new ATOM 0 HG3 ARG B 604 12.427 8.255 3.603 1.00 0.00 H new ATOM 0 HD2 ARG B 604 11.132 6.322 4.997 1.00 0.00 H new ATOM 0 HD3 ARG B 604 10.657 7.711 5.954 1.00 0.00 H new ATOM 0 HE ARG B 604 10.290 8.264 3.141 1.00 0.00 H new ATOM 0 HH11 ARG B 604 8.941 6.480 5.873 1.00 0.00 H new ATOM 0 HH12 ARG B 604 7.298 6.499 5.223 1.00 0.00 H new ATOM 0 HH21 ARG B 604 8.177 8.283 2.312 1.00 0.00 H new ATOM 0 HH22 ARG B 604 6.867 7.515 3.215 1.00 0.00 H new ATOM 1326 N SER B 605 12.362 6.187 2.284 1.00 0.00 N ATOM 1327 CA SER B 605 11.245 5.630 1.531 1.00 0.00 C ATOM 1328 C SER B 605 11.613 4.274 0.936 1.00 0.00 C ATOM 1329 O SER B 605 10.963 3.265 1.210 1.00 0.00 O ATOM 1330 CB SER B 605 10.823 6.590 0.417 1.00 0.00 C ATOM 1331 OG SER B 605 9.463 6.401 0.069 1.00 0.00 O ATOM 0 H SER B 605 12.707 7.078 1.928 1.00 0.00 H new ATOM 0 HA SER B 605 10.410 5.492 2.218 1.00 0.00 H new ATOM 0 HB2 SER B 605 10.979 7.619 0.741 1.00 0.00 H new ATOM 0 HB3 SER B 605 11.451 6.433 -0.460 1.00 0.00 H new ATOM 0 HG SER B 605 9.218 7.027 -0.644 1.00 0.00 H new ATOM 1337 N LYS B 606 12.661 4.259 0.119 1.00 0.00 N ATOM 1338 CA LYS B 606 13.118 3.028 -0.516 1.00 0.00 C ATOM 1339 C LYS B 606 13.455 1.970 0.530 1.00 0.00 C ATOM 1340 O LYS B 606 13.062 0.810 0.402 1.00 0.00 O ATOM 1341 CB LYS B 606 14.344 3.306 -1.389 1.00 0.00 C ATOM 1342 CG LYS B 606 14.158 4.471 -2.346 1.00 0.00 C ATOM 1343 CD LYS B 606 12.942 4.273 -3.235 1.00 0.00 C ATOM 1344 CE LYS B 606 13.026 5.126 -4.492 1.00 0.00 C ATOM 1345 NZ LYS B 606 13.786 4.443 -5.576 1.00 0.00 N ATOM 0 H LYS B 606 13.210 5.085 -0.119 1.00 0.00 H new ATOM 0 HA LYS B 606 12.311 2.650 -1.143 1.00 0.00 H new ATOM 0 HB2 LYS B 606 15.200 3.509 -0.745 1.00 0.00 H new ATOM 0 HB3 LYS B 606 14.582 2.410 -1.962 1.00 0.00 H new ATOM 0 HG2 LYS B 606 14.049 5.395 -1.779 1.00 0.00 H new ATOM 0 HG3 LYS B 606 15.049 4.580 -2.965 1.00 0.00 H new ATOM 0 HD2 LYS B 606 12.860 3.222 -3.512 1.00 0.00 H new ATOM 0 HD3 LYS B 606 12.039 4.528 -2.680 1.00 0.00 H new ATOM 0 HE2 LYS B 606 12.020 5.356 -4.843 1.00 0.00 H new ATOM 0 HE3 LYS B 606 13.506 6.076 -4.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 13.821 5.056 -6.415 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 14.754 4.246 -5.251 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 13.315 3.549 -5.820 1.00 0.00 H new ATOM 1359 N VAL B 607 14.183 2.377 1.564 1.00 0.00 N ATOM 1360 CA VAL B 607 14.570 1.464 2.633 1.00 0.00 C ATOM 1361 C VAL B 607 13.356 0.739 3.204 1.00 0.00 C ATOM 1362 O VAL B 607 13.319 -0.491 3.250 1.00 0.00 O ATOM 1363 CB VAL B 607 15.293 2.207 3.772 1.00 0.00 C ATOM 1364 CG1 VAL B 607 15.679 1.240 4.881 1.00 0.00 C ATOM 1365 CG2 VAL B 607 16.517 2.936 3.240 1.00 0.00 C ATOM 0 H VAL B 607 14.517 3.333 1.685 1.00 0.00 H new ATOM 0 HA VAL B 607 15.252 0.735 2.195 1.00 0.00 H new ATOM 0 HB VAL B 607 14.610 2.947 4.189 1.00 0.00 H new ATOM 0 HG11 VAL B 607 16.189 1.783 5.677 1.00 0.00 H new ATOM 0 HG12 VAL B 607 14.782 0.768 5.281 1.00 0.00 H new ATOM 0 HG13 VAL B 607 16.344 0.474 4.481 1.00 0.00 H new ATOM 0 HG21 VAL B 607 17.015 3.455 4.058 1.00 0.00 H new ATOM 0 HG22 VAL B 607 17.204 2.216 2.795 1.00 0.00 H new ATOM 0 HG23 VAL B 607 16.210 3.659 2.485 1.00 0.00 H new ATOM 1375 N ASP B 608 12.364 1.510 3.637 1.00 0.00 N ATOM 1376 CA ASP B 608 11.147 0.942 4.203 1.00 0.00 C ATOM 1377 C ASP B 608 10.461 0.017 3.202 1.00 0.00 C ATOM 1378 O ASP B 608 9.976 -1.054 3.564 1.00 0.00 O ATOM 1379 CB ASP B 608 10.188 2.056 4.627 1.00 0.00 C ATOM 1380 CG ASP B 608 9.075 1.552 5.524 1.00 0.00 C ATOM 1381 OD1 ASP B 608 9.279 1.508 6.755 1.00 0.00 O ATOM 1382 OD2 ASP B 608 7.999 1.199 4.995 1.00 0.00 O ATOM 0 H ASP B 608 12.379 2.529 3.607 1.00 0.00 H new ATOM 0 HA ASP B 608 11.423 0.357 5.080 1.00 0.00 H new ATOM 0 HB2 ASP B 608 10.747 2.833 5.148 1.00 0.00 H new ATOM 0 HB3 ASP B 608 9.755 2.516 3.739 1.00 0.00 H new ATOM 1387 N GLU B 609 10.425 0.440 1.942 1.00 0.00 N ATOM 1388 CA GLU B 609 9.797 -0.350 0.890 1.00 0.00 C ATOM 1389 C GLU B 609 10.375 -1.761 0.851 1.00 0.00 C ATOM 1390 O GLU B 609 9.636 -2.746 0.857 1.00 0.00 O ATOM 1391 CB GLU B 609 9.986 0.328 -0.469 1.00 0.00 C ATOM 1392 CG GLU B 609 9.295 1.677 -0.578 1.00 0.00 C ATOM 1393 CD GLU B 609 7.939 1.586 -1.249 1.00 0.00 C ATOM 1394 OE1 GLU B 609 7.897 1.496 -2.494 1.00 0.00 O ATOM 1395 OE2 GLU B 609 6.918 1.604 -0.529 1.00 0.00 O ATOM 0 H GLU B 609 10.823 1.324 1.626 1.00 0.00 H new ATOM 0 HA GLU B 609 8.731 -0.418 1.109 1.00 0.00 H new ATOM 0 HB2 GLU B 609 11.052 0.459 -0.655 1.00 0.00 H new ATOM 0 HB3 GLU B 609 9.605 -0.330 -1.250 1.00 0.00 H new ATOM 0 HG2 GLU B 609 9.175 2.101 0.419 1.00 0.00 H new ATOM 0 HG3 GLU B 609 9.929 2.361 -1.141 1.00 0.00 H new ATOM 1402 N ALA B 610 11.700 -1.851 0.810 1.00 0.00 N ATOM 1403 CA ALA B 610 12.377 -3.141 0.771 1.00 0.00 C ATOM 1404 C ALA B 610 12.095 -3.948 2.034 1.00 0.00 C ATOM 1405 O ALA B 610 11.578 -5.063 1.968 1.00 0.00 O ATOM 1406 CB ALA B 610 13.876 -2.945 0.592 1.00 0.00 C ATOM 0 H ALA B 610 12.326 -1.046 0.803 1.00 0.00 H new ATOM 0 HA ALA B 610 11.990 -3.701 -0.080 1.00 0.00 H new ATOM 0 HB1 ALA B 610 14.369 -3.917 0.565 1.00 0.00 H new ATOM 0 HB2 ALA B 610 14.065 -2.416 -0.342 1.00 0.00 H new ATOM 0 HB3 ALA B 610 14.269 -2.362 1.425 1.00 0.00 H new ATOM 1412 N VAL B 611 12.437 -3.377 3.184 1.00 0.00 N ATOM 1413 CA VAL B 611 12.220 -4.043 4.463 1.00 0.00 C ATOM 1414 C VAL B 611 10.786 -4.544 4.585 1.00 0.00 C ATOM 1415 O VAL B 611 10.522 -5.547 5.247 1.00 0.00 O ATOM 1416 CB VAL B 611 12.526 -3.103 5.644 1.00 0.00 C ATOM 1417 CG1 VAL B 611 12.258 -3.803 6.968 1.00 0.00 C ATOM 1418 CG2 VAL B 611 13.963 -2.610 5.574 1.00 0.00 C ATOM 0 H VAL B 611 12.866 -2.454 3.257 1.00 0.00 H new ATOM 0 HA VAL B 611 12.903 -4.892 4.498 1.00 0.00 H new ATOM 0 HB VAL B 611 11.866 -2.238 5.578 1.00 0.00 H new ATOM 0 HG11 VAL B 611 12.480 -3.123 7.791 1.00 0.00 H new ATOM 0 HG12 VAL B 611 11.211 -4.101 7.016 1.00 0.00 H new ATOM 0 HG13 VAL B 611 12.891 -4.687 7.047 1.00 0.00 H new ATOM 0 HG21 VAL B 611 14.162 -1.947 6.416 1.00 0.00 H new ATOM 0 HG22 VAL B 611 14.642 -3.462 5.614 1.00 0.00 H new ATOM 0 HG23 VAL B 611 14.117 -2.068 4.641 1.00 0.00 H new ATOM 1428 N ALA B 612 9.861 -3.838 3.941 1.00 0.00 N ATOM 1429 CA ALA B 612 8.453 -4.213 3.975 1.00 0.00 C ATOM 1430 C ALA B 612 8.181 -5.406 3.066 1.00 0.00 C ATOM 1431 O ALA B 612 7.365 -6.271 3.387 1.00 0.00 O ATOM 1432 CB ALA B 612 7.583 -3.031 3.573 1.00 0.00 C ATOM 0 H ALA B 612 10.062 -3.004 3.390 1.00 0.00 H new ATOM 0 HA ALA B 612 8.204 -4.503 4.996 1.00 0.00 H new ATOM 0 HB1 ALA B 612 6.534 -3.325 3.603 1.00 0.00 H new ATOM 0 HB2 ALA B 612 7.748 -2.205 4.265 1.00 0.00 H new ATOM 0 HB3 ALA B 612 7.843 -2.715 2.563 1.00 0.00 H new ATOM 1438 N VAL B 613 8.868 -5.448 1.929 1.00 0.00 N ATOM 1439 CA VAL B 613 8.700 -6.536 0.973 1.00 0.00 C ATOM 1440 C VAL B 613 8.907 -7.891 1.641 1.00 0.00 C ATOM 1441 O VAL B 613 8.354 -8.901 1.204 1.00 0.00 O ATOM 1442 CB VAL B 613 9.681 -6.402 -0.207 1.00 0.00 C ATOM 1443 CG1 VAL B 613 10.924 -7.246 0.034 1.00 0.00 C ATOM 1444 CG2 VAL B 613 9.003 -6.798 -1.510 1.00 0.00 C ATOM 0 H VAL B 613 9.547 -4.741 1.647 1.00 0.00 H new ATOM 0 HA VAL B 613 7.679 -6.472 0.596 1.00 0.00 H new ATOM 0 HB VAL B 613 9.988 -5.359 -0.286 1.00 0.00 H new ATOM 0 HG11 VAL B 613 11.606 -7.139 -0.810 1.00 0.00 H new ATOM 0 HG12 VAL B 613 11.420 -6.912 0.946 1.00 0.00 H new ATOM 0 HG13 VAL B 613 10.638 -8.293 0.139 1.00 0.00 H new ATOM 0 HG21 VAL B 613 9.710 -6.697 -2.333 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.666 -7.833 -1.445 1.00 0.00 H new ATOM 0 HG23 VAL B 613 8.146 -6.148 -1.686 1.00 0.00 H new ATOM 1454 N LEU B 614 9.706 -7.905 2.702 1.00 0.00 N ATOM 1455 CA LEU B 614 9.985 -9.137 3.432 1.00 0.00 C ATOM 1456 C LEU B 614 8.792 -9.545 4.290 1.00 0.00 C ATOM 1457 O LEU B 614 8.479 -10.729 4.411 1.00 0.00 O ATOM 1458 CB LEU B 614 11.224 -8.961 4.313 1.00 0.00 C ATOM 1459 CG LEU B 614 11.618 -10.167 5.166 1.00 0.00 C ATOM 1460 CD1 LEU B 614 10.816 -10.191 6.458 1.00 0.00 C ATOM 1461 CD2 LEU B 614 11.417 -11.459 4.388 1.00 0.00 C ATOM 0 H LEU B 614 10.172 -7.078 3.076 1.00 0.00 H new ATOM 0 HA LEU B 614 10.172 -9.927 2.704 1.00 0.00 H new ATOM 0 HB2 LEU B 614 12.067 -8.704 3.672 1.00 0.00 H new ATOM 0 HB3 LEU B 614 11.056 -8.112 4.976 1.00 0.00 H new ATOM 0 HG LEU B 614 12.675 -10.079 5.419 1.00 0.00 H new ATOM 0 HD11 LEU B 614 11.110 -11.056 7.053 1.00 0.00 H new ATOM 0 HD12 LEU B 614 11.010 -9.279 7.023 1.00 0.00 H new ATOM 0 HD13 LEU B 614 9.753 -10.255 6.225 1.00 0.00 H new ATOM 0 HD21 LEU B 614 11.702 -12.307 5.011 1.00 0.00 H new ATOM 0 HD22 LEU B 614 10.369 -11.554 4.104 1.00 0.00 H new ATOM 0 HD23 LEU B 614 12.036 -11.443 3.491 1.00 0.00 H new ATOM 1473 N GLN B 615 8.128 -8.556 4.880 1.00 0.00 N ATOM 1474 CA GLN B 615 6.968 -8.813 5.725 1.00 0.00 C ATOM 1475 C GLN B 615 5.896 -9.581 4.959 1.00 0.00 C ATOM 1476 O GLN B 615 5.065 -10.266 5.554 1.00 0.00 O ATOM 1477 CB GLN B 615 6.391 -7.497 6.250 1.00 0.00 C ATOM 1478 CG GLN B 615 7.412 -6.629 6.968 1.00 0.00 C ATOM 1479 CD GLN B 615 7.266 -6.683 8.476 1.00 0.00 C ATOM 1480 OE1 GLN B 615 6.560 -7.538 9.013 1.00 0.00 O ATOM 1481 NE2 GLN B 615 7.933 -5.769 9.169 1.00 0.00 N ATOM 0 H GLN B 615 8.373 -7.570 4.788 1.00 0.00 H new ATOM 0 HA GLN B 615 7.293 -9.422 6.569 1.00 0.00 H new ATOM 0 HB2 GLN B 615 5.971 -6.935 5.415 1.00 0.00 H new ATOM 0 HB3 GLN B 615 5.569 -7.716 6.932 1.00 0.00 H new ATOM 0 HG2 GLN B 615 8.416 -6.952 6.692 1.00 0.00 H new ATOM 0 HG3 GLN B 615 7.306 -5.597 6.633 1.00 0.00 H new ATOM 0 HE21 GLN B 615 8.506 -5.079 8.684 1.00 0.00 H new ATOM 0 HE22 GLN B 615 7.872 -5.756 10.187 1.00 0.00 H new ATOM 1490 N ALA B 616 5.922 -9.463 3.635 1.00 0.00 N ATOM 1491 CA ALA B 616 4.954 -10.148 2.788 1.00 0.00 C ATOM 1492 C ALA B 616 5.513 -11.470 2.275 1.00 0.00 C ATOM 1493 O ALA B 616 5.054 -11.998 1.261 1.00 0.00 O ATOM 1494 CB ALA B 616 4.548 -9.256 1.623 1.00 0.00 C ATOM 0 H ALA B 616 6.603 -8.899 3.126 1.00 0.00 H new ATOM 0 HA ALA B 616 4.071 -10.366 3.389 1.00 0.00 H new ATOM 0 HB1 ALA B 616 3.825 -9.780 0.998 1.00 0.00 H new ATOM 0 HB2 ALA B 616 4.100 -8.339 2.006 1.00 0.00 H new ATOM 0 HB3 ALA B 616 5.428 -9.009 1.030 1.00 0.00 H new ATOM 1500 N HIS B 617 6.507 -12.001 2.980 1.00 0.00 N ATOM 1501 CA HIS B 617 7.129 -13.263 2.595 1.00 0.00 C ATOM 1502 C HIS B 617 6.635 -14.404 3.480 1.00 0.00 C ATOM 1503 O HIS B 617 6.530 -14.256 4.697 1.00 0.00 O ATOM 1504 CB HIS B 617 8.651 -13.154 2.684 1.00 0.00 C ATOM 1505 CG HIS B 617 9.363 -14.433 2.364 1.00 0.00 C ATOM 1506 ND1 HIS B 617 10.535 -14.816 2.980 1.00 0.00 N ATOM 1507 CD2 HIS B 617 9.060 -15.419 1.488 1.00 0.00 C ATOM 1508 CE1 HIS B 617 10.924 -15.981 2.495 1.00 0.00 C ATOM 1509 NE2 HIS B 617 10.046 -16.369 1.588 1.00 0.00 N ATOM 0 H HIS B 617 6.899 -11.577 3.821 1.00 0.00 H new ATOM 0 HA HIS B 617 6.848 -13.479 1.564 1.00 0.00 H new ATOM 0 HB2 HIS B 617 8.992 -12.377 2.000 1.00 0.00 H new ATOM 0 HB3 HIS B 617 8.926 -12.836 3.690 1.00 0.00 H new ATOM 0 HD2 HIS B 617 8.202 -15.452 0.832 1.00 0.00 H new ATOM 0 HE1 HIS B 617 11.810 -16.524 2.790 1.00 0.00 H new ATOM 0 HE2 HIS B 617 10.093 -17.234 1.049 1.00 0.00 H new ATOM 1517 N GLN B 618 6.335 -15.540 2.859 1.00 0.00 N ATOM 1518 CA GLN B 618 5.851 -16.705 3.591 1.00 0.00 C ATOM 1519 C GLN B 618 6.939 -17.769 3.701 1.00 0.00 C ATOM 1520 O GLN B 618 7.392 -18.313 2.694 1.00 0.00 O ATOM 1521 CB GLN B 618 4.616 -17.290 2.904 1.00 0.00 C ATOM 1522 CG GLN B 618 4.042 -18.504 3.615 1.00 0.00 C ATOM 1523 CD GLN B 618 2.875 -19.120 2.868 1.00 0.00 C ATOM 1524 OE1 GLN B 618 2.965 -20.242 2.369 1.00 0.00 O ATOM 1525 NE2 GLN B 618 1.770 -18.387 2.788 1.00 0.00 N ATOM 0 H GLN B 618 6.418 -15.679 1.852 1.00 0.00 H new ATOM 0 HA GLN B 618 5.579 -16.383 4.596 1.00 0.00 H new ATOM 0 HB2 GLN B 618 3.847 -16.520 2.840 1.00 0.00 H new ATOM 0 HB3 GLN B 618 4.876 -17.567 1.882 1.00 0.00 H new ATOM 0 HG2 GLN B 618 4.825 -19.252 3.738 1.00 0.00 H new ATOM 0 HG3 GLN B 618 3.717 -18.215 4.614 1.00 0.00 H new ATOM 0 HE21 GLN B 618 1.740 -17.462 3.216 1.00 0.00 H new ATOM 0 HE22 GLN B 618 0.952 -18.749 2.298 1.00 0.00 H new ATOM 1534 N ALA B 619 7.353 -18.061 4.929 1.00 0.00 N ATOM 1535 CA ALA B 619 8.385 -19.061 5.170 1.00 0.00 C ATOM 1536 C ALA B 619 8.529 -19.355 6.660 1.00 0.00 C ATOM 1537 O ALA B 619 8.216 -18.513 7.502 1.00 0.00 O ATOM 1538 CB ALA B 619 9.714 -18.597 4.592 1.00 0.00 C ATOM 0 H ALA B 619 6.989 -17.619 5.773 1.00 0.00 H new ATOM 0 HA ALA B 619 8.085 -19.983 4.672 1.00 0.00 H new ATOM 0 HB1 ALA B 619 10.476 -19.353 4.779 1.00 0.00 H new ATOM 0 HB2 ALA B 619 9.610 -18.445 3.518 1.00 0.00 H new ATOM 0 HB3 ALA B 619 10.009 -17.660 5.065 1.00 0.00 H new ATOM 1544 N LYS B 620 9.003 -20.554 6.978 1.00 0.00 N ATOM 1545 CA LYS B 620 9.188 -20.960 8.367 1.00 0.00 C ATOM 1546 C LYS B 620 10.670 -21.010 8.725 1.00 0.00 C ATOM 1547 O LYS B 620 11.040 -20.877 9.891 1.00 0.00 O ATOM 1548 CB LYS B 620 8.547 -22.328 8.610 1.00 0.00 C ATOM 1549 CG LYS B 620 8.656 -22.804 10.048 1.00 0.00 C ATOM 1550 CD LYS B 620 7.834 -24.060 10.283 1.00 0.00 C ATOM 1551 CE LYS B 620 6.383 -23.726 10.596 1.00 0.00 C ATOM 1552 NZ LYS B 620 5.569 -23.577 9.359 1.00 0.00 N ATOM 0 H LYS B 620 9.266 -21.262 6.293 1.00 0.00 H new ATOM 0 HA LYS B 620 8.703 -20.221 9.004 1.00 0.00 H new ATOM 0 HB2 LYS B 620 7.495 -22.282 8.330 1.00 0.00 H new ATOM 0 HB3 LYS B 620 9.018 -23.062 7.956 1.00 0.00 H new ATOM 0 HG2 LYS B 620 9.701 -23.001 10.289 1.00 0.00 H new ATOM 0 HG3 LYS B 620 8.317 -22.015 10.720 1.00 0.00 H new ATOM 0 HD2 LYS B 620 7.880 -24.697 9.399 1.00 0.00 H new ATOM 0 HD3 LYS B 620 8.264 -24.628 11.108 1.00 0.00 H new ATOM 0 HE2 LYS B 620 5.956 -24.512 11.219 1.00 0.00 H new ATOM 0 HE3 LYS B 620 6.339 -22.802 11.173 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 4.675 -24.096 9.467 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 5.367 -22.570 9.196 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 6.096 -23.960 8.548 1.00 0.00 H new ATOM 1566 N GLU B 621 11.513 -21.202 7.715 1.00 0.00 N ATOM 1567 CA GLU B 621 12.954 -21.269 7.926 1.00 0.00 C ATOM 1568 C GLU B 621 13.583 -19.882 7.827 1.00 0.00 C ATOM 1569 O GLU B 621 13.894 -19.407 6.736 1.00 0.00 O ATOM 1570 CB GLU B 621 13.598 -22.207 6.904 1.00 0.00 C ATOM 1571 CG GLU B 621 15.041 -22.559 7.225 1.00 0.00 C ATOM 1572 CD GLU B 621 15.158 -23.735 8.174 1.00 0.00 C ATOM 1573 OE1 GLU B 621 15.174 -23.507 9.402 1.00 0.00 O ATOM 1574 OE2 GLU B 621 15.234 -24.884 7.689 1.00 0.00 O ATOM 0 H GLU B 621 11.223 -21.314 6.744 1.00 0.00 H new ATOM 0 HA GLU B 621 13.131 -21.659 8.928 1.00 0.00 H new ATOM 0 HB2 GLU B 621 13.013 -23.125 6.847 1.00 0.00 H new ATOM 0 HB3 GLU B 621 13.557 -21.741 5.919 1.00 0.00 H new ATOM 0 HG2 GLU B 621 15.569 -22.790 6.300 1.00 0.00 H new ATOM 0 HG3 GLU B 621 15.533 -21.692 7.665 1.00 0.00 H new ATOM 1581 N ALA B 622 13.767 -19.239 8.975 1.00 0.00 N ATOM 1582 CA ALA B 622 14.360 -17.908 9.019 1.00 0.00 C ATOM 1583 C ALA B 622 15.618 -17.896 9.881 1.00 0.00 C ATOM 1584 O ALA B 622 15.688 -18.579 10.902 1.00 0.00 O ATOM 1585 CB ALA B 622 13.350 -16.897 9.541 1.00 0.00 C ATOM 0 H ALA B 622 13.514 -19.618 9.887 1.00 0.00 H new ATOM 0 HA ALA B 622 14.644 -17.630 8.004 1.00 0.00 H new ATOM 0 HB1 ALA B 622 13.807 -15.908 9.568 1.00 0.00 H new ATOM 0 HB2 ALA B 622 12.481 -16.878 8.883 1.00 0.00 H new ATOM 0 HB3 ALA B 622 13.038 -17.180 10.546 1.00 0.00 H new ATOM 1591 N ALA B 623 16.608 -17.115 9.463 1.00 0.00 N ATOM 1592 CA ALA B 623 17.863 -17.013 10.198 1.00 0.00 C ATOM 1593 C ALA B 623 17.634 -16.460 11.600 1.00 0.00 C ATOM 1594 O ALA B 623 18.585 -16.220 12.346 1.00 0.00 O ATOM 1595 CB ALA B 623 18.850 -16.139 9.438 1.00 0.00 C ATOM 0 H ALA B 623 16.566 -16.543 8.619 1.00 0.00 H new ATOM 0 HA ALA B 623 18.282 -18.015 10.295 1.00 0.00 H new ATOM 0 HB1 ALA B 623 19.783 -16.072 9.998 1.00 0.00 H new ATOM 0 HB2 ALA B 623 19.045 -16.577 8.459 1.00 0.00 H new ATOM 0 HB3 ALA B 623 18.430 -15.141 9.311 1.00 0.00 H new TER 1601 ALA B 623