USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=18 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= -0.357 K(o=-0.85,f=-1.4) USER MOD Set 1.2: B 617 HIS : no HD1:sc= -0.488 X(o=-0.85,f=-0.62) USER MOD Set 2.1: B 596 MET CE :methyl 169:sc= -0.282 (180deg=-0.625) USER MOD Set 2.2: B 602 SER OG : rot 180:sc= -0.25 USER MOD Set 2.3: B 606 LYS NZ :NH3+ -171:sc= -0.245 (180deg=0) USER MOD Set 3.1: B 558 GLN :FLIP amide:sc= -2.87! C(o=-4.8!,f=-3.9!) USER MOD Set 3.2: B 590 ASN : amide:sc= -1.04 K(o=-3.9,f=-4.8!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 88 SER OG : rot 30:sc= 0.163 USER MOD Single : B 542 GLN : amide:sc= 0 K(o=0,f=-0.92) 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 549 MET CE :methyl -141:sc= -0.76 (180deg=-3.61!) USER MOD Single : B 552 SER OG : rot 180:sc= 0 USER MOD Single : B 556 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 559 LYS NZ :NH3+ -145:sc= -0.202 (180deg=-1.6) USER MOD Single : B 560 GLN : amide:sc= -2.52 K(o=-2.5,f=-6.9!) USER MOD Single : B 561 MET CE :methyl 165:sc=-0.00723 (180deg=-0.209) USER MOD Single : B 571 GLN : amide:sc= -0.812 K(o=-0.81,f=-2.5!) USER MOD Single : B 573 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 574 HIS : no HD1:sc= -0.409 K(o=-0.41,f=-1.1) USER MOD Single : B 576 THR OG1 : rot 180:sc=0.000734 USER MOD Single : B 580 LYS NZ :NH3+ -161:sc= -0.135 (180deg=-0.668) USER MOD Single : B 582 THR OG1 : rot 71:sc= 1.29 USER MOD Single : B 584 MET CE :methyl -121:sc= -2.21 (180deg=-7.29!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HD1:sc= -0.143 X(o=-0.14,f=-0.038) USER MOD Single : B 599 SER OG : rot 180:sc= 0 USER MOD Single : B 605 SER OG : rot 180:sc= 0 USER MOD Single : B 615 GLN : amide:sc= -0.206 K(o=-0.21,f=-2.4!) USER MOD Single : B 618 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 73 1.090 1.948 0.626 1.00 0.00 N ATOM 2 CA ALA A 73 1.790 2.326 -0.595 1.00 0.00 C ATOM 3 C ALA A 73 3.020 1.452 -0.816 1.00 0.00 C ATOM 4 O ALA A 73 3.666 1.018 0.138 1.00 0.00 O ATOM 5 CB ALA A 73 2.186 3.794 -0.544 1.00 0.00 C ATOM 0 HA ALA A 73 1.112 2.173 -1.435 1.00 0.00 H new ATOM 0 HB1 ALA A 73 2.708 4.062 -1.463 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.292 4.409 -0.442 1.00 0.00 H new ATOM 0 HB3 ALA A 73 2.842 3.964 0.309 1.00 0.00 H new ATOM 11 N LYS A 74 3.339 1.197 -2.080 1.00 0.00 N ATOM 12 CA LYS A 74 4.492 0.375 -2.428 1.00 0.00 C ATOM 13 C LYS A 74 4.823 0.500 -3.912 1.00 0.00 C ATOM 14 O LYS A 74 4.635 -0.431 -4.695 1.00 0.00 O ATOM 15 CB LYS A 74 4.225 -1.090 -2.076 1.00 0.00 C ATOM 16 CG LYS A 74 5.487 -1.925 -1.948 1.00 0.00 C ATOM 17 CD LYS A 74 5.166 -3.378 -1.641 1.00 0.00 C ATOM 18 CE LYS A 74 5.041 -3.617 -0.144 1.00 0.00 C ATOM 19 NZ LYS A 74 6.365 -3.864 0.490 1.00 0.00 N ATOM 0 H LYS A 74 2.815 1.548 -2.881 1.00 0.00 H new ATOM 0 HA LYS A 74 5.346 0.731 -1.852 1.00 0.00 H new ATOM 0 HB2 LYS A 74 3.673 -1.134 -1.137 1.00 0.00 H new ATOM 0 HB3 LYS A 74 3.586 -1.528 -2.842 1.00 0.00 H new ATOM 0 HG2 LYS A 74 6.059 -1.866 -2.874 1.00 0.00 H new ATOM 0 HG3 LYS A 74 6.116 -1.516 -1.158 1.00 0.00 H new ATOM 0 HD2 LYS A 74 4.235 -3.658 -2.134 1.00 0.00 H new ATOM 0 HD3 LYS A 74 5.948 -4.018 -2.049 1.00 0.00 H new ATOM 0 HE2 LYS A 74 4.570 -2.753 0.324 1.00 0.00 H new ATOM 0 HE3 LYS A 74 4.388 -4.471 0.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 6.237 -4.022 1.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 6.804 -4.704 0.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 6.980 -3.039 0.342 1.00 0.00 H new ATOM 33 N PRO A 75 5.327 1.678 -4.309 1.00 0.00 N ATOM 34 CA PRO A 75 5.696 1.952 -5.701 1.00 0.00 C ATOM 35 C PRO A 75 6.926 1.165 -6.141 1.00 0.00 C ATOM 36 O PRO A 75 7.258 1.123 -7.325 1.00 0.00 O ATOM 37 CB PRO A 75 5.993 3.453 -5.701 1.00 0.00 C ATOM 38 CG PRO A 75 6.381 3.762 -4.296 1.00 0.00 C ATOM 39 CD PRO A 75 5.577 2.832 -3.430 1.00 0.00 C ATOM 0 HA PRO A 75 4.909 1.660 -6.396 1.00 0.00 H new ATOM 0 HB2 PRO A 75 6.796 3.698 -6.396 1.00 0.00 H new ATOM 0 HB3 PRO A 75 5.120 4.029 -6.007 1.00 0.00 H new ATOM 0 HG2 PRO A 75 7.450 3.611 -4.144 1.00 0.00 H new ATOM 0 HG3 PRO A 75 6.169 4.803 -4.053 1.00 0.00 H new ATOM 0 HD2 PRO A 75 6.126 2.543 -2.534 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.647 3.294 -3.099 1.00 0.00 H new ATOM 47 N PHE A 76 7.599 0.542 -5.179 1.00 0.00 N ATOM 48 CA PHE A 76 8.794 -0.243 -5.466 1.00 0.00 C ATOM 49 C PHE A 76 8.612 -1.692 -5.024 1.00 0.00 C ATOM 50 O PHE A 76 8.162 -1.961 -3.910 1.00 0.00 O ATOM 51 CB PHE A 76 10.011 0.366 -4.768 1.00 0.00 C ATOM 52 CG PHE A 76 11.319 -0.195 -5.245 1.00 0.00 C ATOM 53 CD1 PHE A 76 11.711 -0.047 -6.566 1.00 0.00 C ATOM 54 CD2 PHE A 76 12.158 -0.871 -4.373 1.00 0.00 C ATOM 55 CE1 PHE A 76 12.915 -0.562 -7.009 1.00 0.00 C ATOM 56 CE2 PHE A 76 13.363 -1.388 -4.810 1.00 0.00 C ATOM 57 CZ PHE A 76 13.741 -1.234 -6.130 1.00 0.00 C ATOM 0 H PHE A 76 7.337 0.566 -4.194 1.00 0.00 H new ATOM 0 HA PHE A 76 8.957 -0.228 -6.544 1.00 0.00 H new ATOM 0 HB2 PHE A 76 10.008 1.444 -4.926 1.00 0.00 H new ATOM 0 HB3 PHE A 76 9.924 0.201 -3.694 1.00 0.00 H new ATOM 0 HD1 PHE A 76 11.068 0.477 -7.258 1.00 0.00 H new ATOM 0 HD2 PHE A 76 11.867 -0.995 -3.340 1.00 0.00 H new ATOM 0 HE1 PHE A 76 13.209 -0.439 -8.041 1.00 0.00 H new ATOM 0 HE2 PHE A 76 14.008 -1.912 -4.120 1.00 0.00 H new ATOM 0 HZ PHE A 76 14.681 -1.639 -6.474 1.00 0.00 H new ATOM 67 N VAL A 77 8.964 -2.622 -5.906 1.00 0.00 N ATOM 68 CA VAL A 77 8.840 -4.044 -5.607 1.00 0.00 C ATOM 69 C VAL A 77 10.211 -4.703 -5.496 1.00 0.00 C ATOM 70 O VAL A 77 10.662 -5.411 -6.396 1.00 0.00 O ATOM 71 CB VAL A 77 8.018 -4.775 -6.686 1.00 0.00 C ATOM 72 CG1 VAL A 77 8.591 -4.504 -8.069 1.00 0.00 C ATOM 73 CG2 VAL A 77 7.974 -6.268 -6.401 1.00 0.00 C ATOM 0 H VAL A 77 9.337 -2.417 -6.833 1.00 0.00 H new ATOM 0 HA VAL A 77 8.323 -4.123 -4.651 1.00 0.00 H new ATOM 0 HB VAL A 77 6.997 -4.394 -6.661 1.00 0.00 H new ATOM 0 HG11 VAL A 77 7.998 -5.028 -8.818 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.565 -3.433 -8.270 1.00 0.00 H new ATOM 0 HG13 VAL A 77 9.622 -4.856 -8.111 1.00 0.00 H new ATOM 0 HG21 VAL A 77 7.389 -6.769 -7.173 1.00 0.00 H new ATOM 0 HG22 VAL A 77 8.988 -6.668 -6.397 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.513 -6.439 -5.428 1.00 0.00 H new ATOM 83 N PRO A 78 10.890 -4.467 -4.364 1.00 0.00 N ATOM 84 CA PRO A 78 12.219 -5.029 -4.106 1.00 0.00 C ATOM 85 C PRO A 78 12.177 -6.537 -3.881 1.00 0.00 C ATOM 86 O PRO A 78 11.464 -7.023 -3.005 1.00 0.00 O ATOM 87 CB PRO A 78 12.667 -4.311 -2.831 1.00 0.00 C ATOM 88 CG PRO A 78 11.401 -3.920 -2.151 1.00 0.00 C ATOM 89 CD PRO A 78 10.413 -3.632 -3.248 1.00 0.00 C ATOM 0 HA PRO A 78 12.893 -4.886 -4.951 1.00 0.00 H new ATOM 0 HB2 PRO A 78 13.270 -4.964 -2.200 1.00 0.00 H new ATOM 0 HB3 PRO A 78 13.278 -3.438 -3.062 1.00 0.00 H new ATOM 0 HG2 PRO A 78 11.043 -4.720 -1.503 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.551 -3.043 -1.521 1.00 0.00 H new ATOM 0 HD2 PRO A 78 9.397 -3.896 -2.954 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.403 -2.575 -3.513 1.00 0.00 H new ATOM 97 N ASN A 79 12.946 -7.271 -4.679 1.00 0.00 N ATOM 98 CA ASN A 79 12.996 -8.724 -4.567 1.00 0.00 C ATOM 99 C ASN A 79 13.752 -9.147 -3.311 1.00 0.00 C ATOM 100 O ASN A 79 14.983 -9.130 -3.279 1.00 0.00 O ATOM 101 CB ASN A 79 13.661 -9.330 -5.804 1.00 0.00 C ATOM 102 CG ASN A 79 12.763 -9.280 -7.026 1.00 0.00 C ATOM 103 OD1 ASN A 79 11.607 -9.703 -6.978 1.00 0.00 O ATOM 104 ND2 ASN A 79 13.292 -8.762 -8.128 1.00 0.00 N ATOM 0 H ASN A 79 13.543 -6.883 -5.410 1.00 0.00 H new ATOM 0 HA ASN A 79 11.973 -9.093 -4.496 1.00 0.00 H new ATOM 0 HB2 ASN A 79 14.587 -8.795 -6.015 1.00 0.00 H new ATOM 0 HB3 ASN A 79 13.932 -10.365 -5.597 1.00 0.00 H new ATOM 0 HD21 ASN A 79 12.736 -8.702 -8.981 1.00 0.00 H new ATOM 0 HD22 ASN A 79 14.254 -8.424 -8.122 1.00 0.00 H new ATOM 111 N VAL A 80 13.007 -9.527 -2.278 1.00 0.00 N ATOM 112 CA VAL A 80 13.607 -9.956 -1.020 1.00 0.00 C ATOM 113 C VAL A 80 14.698 -10.994 -1.257 1.00 0.00 C ATOM 114 O VAL A 80 15.655 -11.092 -0.488 1.00 0.00 O ATOM 115 CB VAL A 80 12.550 -10.546 -0.067 1.00 0.00 C ATOM 116 CG1 VAL A 80 11.744 -11.629 -0.767 1.00 0.00 C ATOM 117 CG2 VAL A 80 13.212 -11.090 1.190 1.00 0.00 C ATOM 0 H VAL A 80 11.987 -9.547 -2.287 1.00 0.00 H new ATOM 0 HA VAL A 80 14.046 -9.071 -0.560 1.00 0.00 H new ATOM 0 HB VAL A 80 11.865 -9.750 0.226 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.003 -12.034 -0.078 1.00 0.00 H new ATOM 0 HG12 VAL A 80 11.239 -11.204 -1.634 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.412 -12.427 -1.091 1.00 0.00 H new ATOM 0 HG21 VAL A 80 12.451 -11.503 1.852 1.00 0.00 H new ATOM 0 HG22 VAL A 80 13.920 -11.873 0.919 1.00 0.00 H new ATOM 0 HG23 VAL A 80 13.739 -10.285 1.701 1.00 0.00 H new ATOM 127 N HIS A 81 14.547 -11.769 -2.327 1.00 0.00 N ATOM 128 CA HIS A 81 15.521 -12.800 -2.667 1.00 0.00 C ATOM 129 C HIS A 81 16.761 -12.187 -3.310 1.00 0.00 C ATOM 130 O HIS A 81 17.115 -12.520 -4.440 1.00 0.00 O ATOM 131 CB HIS A 81 14.897 -13.828 -3.612 1.00 0.00 C ATOM 132 CG HIS A 81 13.506 -14.229 -3.228 1.00 0.00 C ATOM 133 ND1 HIS A 81 12.385 -13.533 -3.627 1.00 0.00 N ATOM 134 CD2 HIS A 81 13.058 -15.262 -2.477 1.00 0.00 C ATOM 135 CE1 HIS A 81 11.308 -14.119 -3.138 1.00 0.00 C ATOM 136 NE2 HIS A 81 11.689 -15.171 -2.436 1.00 0.00 N ATOM 0 H HIS A 81 13.760 -11.702 -2.973 1.00 0.00 H new ATOM 0 HA HIS A 81 15.821 -13.299 -1.746 1.00 0.00 H new ATOM 0 HB2 HIS A 81 14.882 -13.419 -4.622 1.00 0.00 H new ATOM 0 HB3 HIS A 81 15.528 -14.716 -3.637 1.00 0.00 H new ATOM 0 HD2 HIS A 81 13.665 -16.017 -1.999 1.00 0.00 H new ATOM 0 HE1 HIS A 81 10.289 -13.794 -3.287 1.00 0.00 H new ATOM 0 HE2 HIS A 81 11.067 -15.812 -1.943 1.00 0.00 H new ATOM 144 N ALA A 82 17.416 -11.288 -2.582 1.00 0.00 N ATOM 145 CA ALA A 82 18.616 -10.629 -3.081 1.00 0.00 C ATOM 146 C ALA A 82 19.751 -10.712 -2.065 1.00 0.00 C ATOM 147 O ALA A 82 19.760 -9.987 -1.071 1.00 0.00 O ATOM 148 CB ALA A 82 18.317 -9.177 -3.424 1.00 0.00 C ATOM 0 H ALA A 82 17.135 -11.000 -1.645 1.00 0.00 H new ATOM 0 HA ALA A 82 18.935 -11.146 -3.986 1.00 0.00 H new ATOM 0 HB1 ALA A 82 19.222 -8.697 -3.795 1.00 0.00 H new ATOM 0 HB2 ALA A 82 17.544 -9.136 -4.191 1.00 0.00 H new ATOM 0 HB3 ALA A 82 17.970 -8.656 -2.531 1.00 0.00 H new ATOM 154 N ALA A 83 20.705 -11.600 -2.322 1.00 0.00 N ATOM 155 CA ALA A 83 21.844 -11.777 -1.431 1.00 0.00 C ATOM 156 C ALA A 83 22.657 -10.491 -1.317 1.00 0.00 C ATOM 157 O ALA A 83 22.395 -9.517 -2.022 1.00 0.00 O ATOM 158 CB ALA A 83 22.724 -12.918 -1.918 1.00 0.00 C ATOM 0 H ALA A 83 20.712 -12.208 -3.141 1.00 0.00 H new ATOM 0 HA ALA A 83 21.463 -12.025 -0.440 1.00 0.00 H new ATOM 0 HB1 ALA A 83 23.571 -13.038 -1.242 1.00 0.00 H new ATOM 0 HB2 ALA A 83 22.144 -13.841 -1.941 1.00 0.00 H new ATOM 0 HB3 ALA A 83 23.089 -12.694 -2.920 1.00 0.00 H new ATOM 164 N GLU A 84 23.643 -10.496 -0.425 1.00 0.00 N ATOM 165 CA GLU A 84 24.492 -9.329 -0.220 1.00 0.00 C ATOM 166 C GLU A 84 25.061 -8.830 -1.545 1.00 0.00 C ATOM 167 O GLU A 84 25.346 -9.617 -2.447 1.00 0.00 O ATOM 168 CB GLU A 84 25.632 -9.664 0.744 1.00 0.00 C ATOM 169 CG GLU A 84 25.158 -10.156 2.101 1.00 0.00 C ATOM 170 CD GLU A 84 26.251 -10.861 2.880 1.00 0.00 C ATOM 171 OE1 GLU A 84 27.415 -10.835 2.428 1.00 0.00 O ATOM 172 OE2 GLU A 84 25.942 -11.440 3.943 1.00 0.00 O ATOM 0 H GLU A 84 23.873 -11.295 0.166 1.00 0.00 H new ATOM 0 HA GLU A 84 23.880 -8.538 0.213 1.00 0.00 H new ATOM 0 HB2 GLU A 84 26.266 -10.427 0.292 1.00 0.00 H new ATOM 0 HB3 GLU A 84 26.250 -8.777 0.884 1.00 0.00 H new ATOM 0 HG2 GLU A 84 24.791 -9.310 2.682 1.00 0.00 H new ATOM 0 HG3 GLU A 84 24.318 -10.837 1.963 1.00 0.00 H new ATOM 179 N PHE A 85 25.222 -7.515 -1.655 1.00 0.00 N ATOM 180 CA PHE A 85 25.755 -6.909 -2.869 1.00 0.00 C ATOM 181 C PHE A 85 27.236 -7.238 -3.036 1.00 0.00 C ATOM 182 O PHE A 85 28.008 -7.182 -2.079 1.00 0.00 O ATOM 183 CB PHE A 85 25.558 -5.392 -2.837 1.00 0.00 C ATOM 184 CG PHE A 85 26.666 -4.659 -2.135 1.00 0.00 C ATOM 185 CD1 PHE A 85 26.602 -4.421 -0.772 1.00 0.00 C ATOM 186 CD2 PHE A 85 27.771 -4.209 -2.839 1.00 0.00 C ATOM 187 CE1 PHE A 85 27.619 -3.746 -0.124 1.00 0.00 C ATOM 188 CE2 PHE A 85 28.792 -3.534 -2.196 1.00 0.00 C ATOM 189 CZ PHE A 85 28.716 -3.303 -0.837 1.00 0.00 C ATOM 0 H PHE A 85 24.991 -6.849 -0.918 1.00 0.00 H new ATOM 0 HA PHE A 85 25.211 -7.321 -3.719 1.00 0.00 H new ATOM 0 HB2 PHE A 85 25.479 -5.022 -3.859 1.00 0.00 H new ATOM 0 HB3 PHE A 85 24.613 -5.166 -2.342 1.00 0.00 H new ATOM 0 HD1 PHE A 85 25.748 -4.767 -0.209 1.00 0.00 H new ATOM 0 HD2 PHE A 85 27.836 -4.387 -3.902 1.00 0.00 H new ATOM 0 HE1 PHE A 85 27.556 -3.565 0.939 1.00 0.00 H new ATOM 0 HE2 PHE A 85 29.648 -3.188 -2.756 1.00 0.00 H new ATOM 0 HZ PHE A 85 29.513 -2.777 -0.332 1.00 0.00 H new ATOM 199 N VAL A 86 27.625 -7.582 -4.260 1.00 0.00 N ATOM 200 CA VAL A 86 29.013 -7.920 -4.554 1.00 0.00 C ATOM 201 C VAL A 86 29.305 -7.793 -6.045 1.00 0.00 C ATOM 202 O VAL A 86 28.405 -7.827 -6.885 1.00 0.00 O ATOM 203 CB VAL A 86 29.351 -9.351 -4.096 1.00 0.00 C ATOM 204 CG1 VAL A 86 29.781 -9.356 -2.637 1.00 0.00 C ATOM 205 CG2 VAL A 86 28.163 -10.275 -4.314 1.00 0.00 C ATOM 0 H VAL A 86 26.999 -7.634 -5.064 1.00 0.00 H new ATOM 0 HA VAL A 86 29.635 -7.214 -4.003 1.00 0.00 H new ATOM 0 HB VAL A 86 30.183 -9.720 -4.697 1.00 0.00 H new ATOM 0 HG11 VAL A 86 30.016 -10.375 -2.330 1.00 0.00 H new ATOM 0 HG12 VAL A 86 30.664 -8.728 -2.516 1.00 0.00 H new ATOM 0 HG13 VAL A 86 28.972 -8.968 -2.018 1.00 0.00 H new ATOM 0 HG21 VAL A 86 28.420 -11.282 -3.985 1.00 0.00 H new ATOM 0 HG22 VAL A 86 27.310 -9.912 -3.741 1.00 0.00 H new ATOM 0 HG23 VAL A 86 27.906 -10.294 -5.373 1.00 0.00 H new ATOM 215 N PRO A 87 30.594 -7.643 -6.385 1.00 0.00 N ATOM 216 CA PRO A 87 31.035 -7.509 -7.776 1.00 0.00 C ATOM 217 C PRO A 87 30.877 -8.806 -8.562 1.00 0.00 C ATOM 218 O PRO A 87 30.265 -9.762 -8.085 1.00 0.00 O ATOM 219 CB PRO A 87 32.515 -7.140 -7.645 1.00 0.00 C ATOM 220 CG PRO A 87 32.928 -7.695 -6.326 1.00 0.00 C ATOM 221 CD PRO A 87 31.719 -7.593 -5.437 1.00 0.00 C ATOM 0 HA PRO A 87 30.445 -6.773 -8.321 1.00 0.00 H new ATOM 0 HB2 PRO A 87 33.103 -7.568 -8.457 1.00 0.00 H new ATOM 0 HB3 PRO A 87 32.659 -6.060 -7.683 1.00 0.00 H new ATOM 0 HG2 PRO A 87 33.255 -8.730 -6.423 1.00 0.00 H new ATOM 0 HG3 PRO A 87 33.766 -7.134 -5.912 1.00 0.00 H new ATOM 0 HD2 PRO A 87 31.677 -8.413 -4.720 1.00 0.00 H new ATOM 0 HD3 PRO A 87 31.720 -6.667 -4.862 1.00 0.00 H new ATOM 229 N SER A 88 31.434 -8.833 -9.769 1.00 0.00 N ATOM 230 CA SER A 88 31.351 -10.013 -10.622 1.00 0.00 C ATOM 231 C SER A 88 32.743 -10.477 -11.043 1.00 0.00 C ATOM 232 O SER A 88 33.545 -9.691 -11.549 1.00 0.00 O ATOM 233 CB SER A 88 30.504 -9.714 -11.861 1.00 0.00 C ATOM 234 OG SER A 88 31.027 -8.612 -12.583 1.00 0.00 O ATOM 0 H SER A 88 31.947 -8.052 -10.178 1.00 0.00 H new ATOM 0 HA SER A 88 30.877 -10.812 -10.051 1.00 0.00 H new ATOM 0 HB2 SER A 88 30.473 -10.593 -12.505 1.00 0.00 H new ATOM 0 HB3 SER A 88 29.478 -9.502 -11.561 1.00 0.00 H new ATOM 0 HG SER A 88 31.999 -8.574 -12.463 1.00 0.00 H new ATOM 240 N PHE A 89 33.022 -11.758 -10.831 1.00 0.00 N ATOM 241 CA PHE A 89 34.316 -12.328 -11.187 1.00 0.00 C ATOM 242 C PHE A 89 34.183 -13.280 -12.372 1.00 0.00 C ATOM 243 O PHE A 89 35.153 -13.542 -13.084 1.00 0.00 O ATOM 244 CB PHE A 89 34.918 -13.067 -9.990 1.00 0.00 C ATOM 245 CG PHE A 89 33.934 -13.944 -9.269 1.00 0.00 C ATOM 246 CD1 PHE A 89 33.452 -15.099 -9.863 1.00 0.00 C ATOM 247 CD2 PHE A 89 33.492 -13.613 -7.999 1.00 0.00 C ATOM 248 CE1 PHE A 89 32.547 -15.909 -9.203 1.00 0.00 C ATOM 249 CE2 PHE A 89 32.587 -14.419 -7.334 1.00 0.00 C ATOM 250 CZ PHE A 89 32.113 -15.568 -7.937 1.00 0.00 C ATOM 0 H PHE A 89 32.369 -12.422 -10.414 1.00 0.00 H new ATOM 0 HA PHE A 89 34.979 -11.511 -11.472 1.00 0.00 H new ATOM 0 HB2 PHE A 89 35.753 -13.678 -10.333 1.00 0.00 H new ATOM 0 HB3 PHE A 89 35.323 -12.337 -9.289 1.00 0.00 H new ATOM 0 HD1 PHE A 89 33.787 -15.370 -10.853 1.00 0.00 H new ATOM 0 HD2 PHE A 89 33.858 -12.715 -7.523 1.00 0.00 H new ATOM 0 HE1 PHE A 89 32.180 -16.807 -9.677 1.00 0.00 H new ATOM 0 HE2 PHE A 89 32.251 -14.151 -6.343 1.00 0.00 H new ATOM 0 HZ PHE A 89 31.405 -16.198 -7.420 1.00 0.00 H new ATOM 260 N LEU A 90 32.977 -13.797 -12.576 1.00 0.00 N ATOM 261 CA LEU A 90 32.716 -14.721 -13.674 1.00 0.00 C ATOM 262 C LEU A 90 31.489 -14.288 -14.470 1.00 0.00 C ATOM 263 O LEU A 90 30.684 -13.483 -14.000 1.00 0.00 O ATOM 264 CB LEU A 90 32.514 -16.139 -13.137 1.00 0.00 C ATOM 265 CG LEU A 90 33.764 -17.019 -13.080 1.00 0.00 C ATOM 266 CD1 LEU A 90 33.811 -17.794 -11.772 1.00 0.00 C ATOM 267 CD2 LEU A 90 33.801 -17.969 -14.267 1.00 0.00 C ATOM 0 H LEU A 90 32.164 -13.592 -11.995 1.00 0.00 H new ATOM 0 HA LEU A 90 33.580 -14.710 -14.338 1.00 0.00 H new ATOM 0 HB2 LEU A 90 32.097 -16.070 -12.132 1.00 0.00 H new ATOM 0 HB3 LEU A 90 31.770 -16.639 -13.758 1.00 0.00 H new ATOM 0 HG LEU A 90 34.642 -16.375 -13.129 1.00 0.00 H new ATOM 0 HD11 LEU A 90 34.707 -18.415 -11.749 1.00 0.00 H new ATOM 0 HD12 LEU A 90 33.832 -17.095 -10.936 1.00 0.00 H new ATOM 0 HD13 LEU A 90 32.928 -18.428 -11.693 1.00 0.00 H new ATOM 0 HD21 LEU A 90 34.697 -18.587 -14.210 1.00 0.00 H new ATOM 0 HD22 LEU A 90 32.918 -18.607 -14.250 1.00 0.00 H new ATOM 0 HD23 LEU A 90 33.815 -17.394 -15.193 1.00 0.00 H new ATOM 279 N ARG A 91 31.352 -14.828 -15.677 1.00 0.00 N ATOM 280 CA ARG A 91 30.223 -14.498 -16.538 1.00 0.00 C ATOM 281 C ARG A 91 29.466 -15.757 -16.949 1.00 0.00 C ATOM 282 O ARG A 91 28.864 -15.810 -18.021 1.00 0.00 O ATOM 283 CB ARG A 91 30.704 -13.750 -17.783 1.00 0.00 C ATOM 284 CG ARG A 91 32.017 -14.276 -18.339 1.00 0.00 C ATOM 285 CD ARG A 91 31.876 -15.703 -18.845 1.00 0.00 C ATOM 286 NE ARG A 91 32.858 -16.018 -19.879 1.00 0.00 N ATOM 287 CZ ARG A 91 32.928 -17.193 -20.494 1.00 0.00 C ATOM 288 NH1 ARG A 91 32.077 -18.161 -20.180 1.00 0.00 N ATOM 289 NH2 ARG A 91 33.850 -17.403 -21.424 1.00 0.00 N ATOM 0 H ARG A 91 32.009 -15.496 -16.080 1.00 0.00 H new ATOM 0 HA ARG A 91 29.546 -13.855 -15.975 1.00 0.00 H new ATOM 0 HB2 ARG A 91 29.938 -13.818 -18.556 1.00 0.00 H new ATOM 0 HB3 ARG A 91 30.819 -12.694 -17.540 1.00 0.00 H new ATOM 0 HG2 ARG A 91 32.353 -13.632 -19.152 1.00 0.00 H new ATOM 0 HG3 ARG A 91 32.783 -14.238 -17.564 1.00 0.00 H new ATOM 0 HD2 ARG A 91 31.992 -16.396 -18.012 1.00 0.00 H new ATOM 0 HD3 ARG A 91 30.872 -15.849 -19.243 1.00 0.00 H new ATOM 0 HE ARG A 91 33.527 -15.295 -20.144 1.00 0.00 H new ATOM 0 HH11 ARG A 91 31.367 -18.004 -19.465 1.00 0.00 H new ATOM 0 HH12 ARG A 91 32.133 -19.063 -20.654 1.00 0.00 H new ATOM 0 HH21 ARG A 91 34.507 -16.662 -21.668 1.00 0.00 H new ATOM 0 HH22 ARG A 91 33.902 -18.306 -21.895 1.00 0.00 H new ATOM 303 N GLY A 92 29.503 -16.771 -16.089 1.00 0.00 N ATOM 304 CA GLY A 92 28.818 -18.017 -16.381 1.00 0.00 C ATOM 305 C GLY A 92 28.064 -18.559 -15.183 1.00 0.00 C ATOM 306 O GLY A 92 28.039 -17.951 -14.112 1.00 0.00 O ATOM 0 H GLY A 92 29.995 -16.752 -15.196 1.00 0.00 H new ATOM 0 HA2 GLY A 92 28.121 -17.861 -17.204 1.00 0.00 H new ATOM 0 HA3 GLY A 92 29.545 -18.758 -16.715 1.00 0.00 H new ATOM 310 N PRO A 93 27.431 -19.728 -15.357 1.00 0.00 N ATOM 311 CA PRO A 93 26.660 -20.377 -14.292 1.00 0.00 C ATOM 312 C PRO A 93 27.551 -20.913 -13.176 1.00 0.00 C ATOM 313 O PRO A 93 27.248 -20.749 -11.995 1.00 0.00 O ATOM 314 CB PRO A 93 25.957 -21.528 -15.014 1.00 0.00 C ATOM 315 CG PRO A 93 26.823 -21.824 -16.190 1.00 0.00 C ATOM 316 CD PRO A 93 27.419 -20.507 -16.606 1.00 0.00 C ATOM 0 HA PRO A 93 25.977 -19.683 -13.802 1.00 0.00 H new ATOM 0 HB2 PRO A 93 25.857 -22.399 -14.367 1.00 0.00 H new ATOM 0 HB3 PRO A 93 24.951 -21.245 -15.324 1.00 0.00 H new ATOM 0 HG2 PRO A 93 27.602 -22.541 -15.931 1.00 0.00 H new ATOM 0 HG3 PRO A 93 26.243 -22.264 -17.001 1.00 0.00 H new ATOM 0 HD2 PRO A 93 28.423 -20.631 -17.012 1.00 0.00 H new ATOM 0 HD3 PRO A 93 26.821 -20.021 -17.377 1.00 0.00 H new ATOM 324 N ALA A 94 28.650 -21.554 -13.559 1.00 0.00 N ATOM 325 CA ALA A 94 29.586 -22.112 -12.591 1.00 0.00 C ATOM 326 C ALA A 94 31.027 -21.796 -12.975 1.00 0.00 C ATOM 327 O ALA A 94 31.256 -21.246 -14.051 1.00 0.00 O ATOM 328 CB ALA A 94 29.387 -23.616 -12.470 1.00 0.00 C ATOM 0 H ALA A 94 28.914 -21.700 -14.533 1.00 0.00 H new ATOM 0 HA ALA A 94 29.387 -21.652 -11.623 1.00 0.00 H new ATOM 0 HB1 ALA A 94 30.093 -24.019 -11.744 1.00 0.00 H new ATOM 0 HB2 ALA A 94 28.369 -23.823 -12.140 1.00 0.00 H new ATOM 0 HB3 ALA A 94 29.557 -24.085 -13.439 1.00 0.00 H new TER 334 ALA A 94 ATOM 335 N GLY B 541 40.729 7.441 3.826 1.00 0.00 N ATOM 336 CA GLY B 541 39.870 8.568 4.141 1.00 0.00 C ATOM 337 C GLY B 541 38.597 8.146 4.848 1.00 0.00 C ATOM 338 O GLY B 541 38.256 6.964 4.871 1.00 0.00 O ATOM 0 HA2 GLY B 541 40.415 9.272 4.770 1.00 0.00 H new ATOM 0 HA3 GLY B 541 39.614 9.094 3.221 1.00 0.00 H new ATOM 342 N GLN B 542 37.894 9.115 5.426 1.00 0.00 N ATOM 343 CA GLN B 542 36.653 8.836 6.139 1.00 0.00 C ATOM 344 C GLN B 542 35.511 9.690 5.598 1.00 0.00 C ATOM 345 O GLN B 542 34.472 9.833 6.241 1.00 0.00 O ATOM 346 CB GLN B 542 36.831 9.092 7.636 1.00 0.00 C ATOM 347 CG GLN B 542 38.162 8.600 8.183 1.00 0.00 C ATOM 348 CD GLN B 542 38.342 8.918 9.654 1.00 0.00 C ATOM 349 OE1 GLN B 542 37.493 9.565 10.270 1.00 0.00 O ATOM 350 NE2 GLN B 542 39.451 8.465 10.227 1.00 0.00 N ATOM 0 H GLN B 542 38.162 10.099 5.415 1.00 0.00 H new ATOM 0 HA GLN B 542 36.403 7.786 5.984 1.00 0.00 H new ATOM 0 HB2 GLN B 542 36.742 10.162 7.826 1.00 0.00 H new ATOM 0 HB3 GLN B 542 36.022 8.603 8.179 1.00 0.00 H new ATOM 0 HG2 GLN B 542 38.234 7.522 8.037 1.00 0.00 H new ATOM 0 HG3 GLN B 542 38.974 9.054 7.615 1.00 0.00 H new ATOM 0 HE21 GLN B 542 40.127 7.933 9.679 1.00 0.00 H new ATOM 0 HE22 GLN B 542 39.626 8.649 11.215 1.00 0.00 H new ATOM 359 N GLU B 543 35.713 10.257 4.412 1.00 0.00 N ATOM 360 CA GLU B 543 34.700 11.098 3.786 1.00 0.00 C ATOM 361 C GLU B 543 33.922 10.319 2.729 1.00 0.00 C ATOM 362 O GLU B 543 34.368 9.285 2.231 1.00 0.00 O ATOM 363 CB GLU B 543 35.349 12.331 3.152 1.00 0.00 C ATOM 364 CG GLU B 543 35.499 13.500 4.111 1.00 0.00 C ATOM 365 CD GLU B 543 36.607 13.285 5.123 1.00 0.00 C ATOM 366 OE1 GLU B 543 37.786 13.246 4.715 1.00 0.00 O ATOM 367 OE2 GLU B 543 36.294 13.157 6.326 1.00 0.00 O ATOM 0 H GLU B 543 36.568 10.149 3.866 1.00 0.00 H new ATOM 0 HA GLU B 543 34.004 11.420 4.560 1.00 0.00 H new ATOM 0 HB2 GLU B 543 36.332 12.057 2.769 1.00 0.00 H new ATOM 0 HB3 GLU B 543 34.751 12.647 2.297 1.00 0.00 H new ATOM 0 HG2 GLU B 543 35.702 14.408 3.543 1.00 0.00 H new ATOM 0 HG3 GLU B 543 34.557 13.657 4.637 1.00 0.00 H new ATOM 374 N PRO B 544 32.731 10.825 2.378 1.00 0.00 N ATOM 375 CA PRO B 544 31.866 10.193 1.377 1.00 0.00 C ATOM 376 C PRO B 544 32.437 10.300 -0.033 1.00 0.00 C ATOM 377 O PRO B 544 33.588 10.697 -0.219 1.00 0.00 O ATOM 378 CB PRO B 544 30.560 10.984 1.487 1.00 0.00 C ATOM 379 CG PRO B 544 30.966 12.314 2.023 1.00 0.00 C ATOM 380 CD PRO B 544 32.137 12.054 2.930 1.00 0.00 C ATOM 0 HA PRO B 544 31.749 9.124 1.556 1.00 0.00 H new ATOM 0 HB2 PRO B 544 30.073 11.080 0.517 1.00 0.00 H new ATOM 0 HB3 PRO B 544 29.852 10.489 2.152 1.00 0.00 H new ATOM 0 HG2 PRO B 544 31.241 12.993 1.216 1.00 0.00 H new ATOM 0 HG3 PRO B 544 30.146 12.782 2.568 1.00 0.00 H new ATOM 0 HD2 PRO B 544 32.845 12.882 2.919 1.00 0.00 H new ATOM 0 HD3 PRO B 544 31.821 11.918 3.964 1.00 0.00 H new ATOM 388 N LEU B 545 31.625 9.945 -1.023 1.00 0.00 N ATOM 389 CA LEU B 545 32.050 10.002 -2.418 1.00 0.00 C ATOM 390 C LEU B 545 30.969 10.631 -3.290 1.00 0.00 C ATOM 391 O LEU B 545 29.798 10.679 -2.911 1.00 0.00 O ATOM 392 CB LEU B 545 32.380 8.598 -2.928 1.00 0.00 C ATOM 393 CG LEU B 545 31.733 7.438 -2.169 1.00 0.00 C ATOM 394 CD1 LEU B 545 30.218 7.560 -2.200 1.00 0.00 C ATOM 395 CD2 LEU B 545 32.175 6.105 -2.755 1.00 0.00 C ATOM 0 H LEU B 545 30.670 9.615 -0.886 1.00 0.00 H new ATOM 0 HA LEU B 545 32.944 10.622 -2.476 1.00 0.00 H new ATOM 0 HB2 LEU B 545 32.080 8.533 -3.974 1.00 0.00 H new ATOM 0 HB3 LEU B 545 33.462 8.467 -2.898 1.00 0.00 H new ATOM 0 HG LEU B 545 32.059 7.481 -1.130 1.00 0.00 H new ATOM 0 HD11 LEU B 545 29.775 6.726 -1.655 1.00 0.00 H new ATOM 0 HD12 LEU B 545 29.919 8.499 -1.733 1.00 0.00 H new ATOM 0 HD13 LEU B 545 29.873 7.543 -3.234 1.00 0.00 H new ATOM 0 HD21 LEU B 545 31.705 5.291 -2.203 1.00 0.00 H new ATOM 0 HD22 LEU B 545 31.878 6.052 -3.802 1.00 0.00 H new ATOM 0 HD23 LEU B 545 33.259 6.016 -2.680 1.00 0.00 H new ATOM 407 N THR B 546 31.369 11.113 -4.464 1.00 0.00 N ATOM 408 CA THR B 546 30.435 11.738 -5.391 1.00 0.00 C ATOM 409 C THR B 546 30.659 11.242 -6.815 1.00 0.00 C ATOM 410 O THR B 546 31.583 10.473 -7.076 1.00 0.00 O ATOM 411 CB THR B 546 30.563 13.273 -5.368 1.00 0.00 C ATOM 412 OG1 THR B 546 31.771 13.673 -6.026 1.00 0.00 O ATOM 413 CG2 THR B 546 30.562 13.795 -3.940 1.00 0.00 C ATOM 0 H THR B 546 32.334 11.082 -4.794 1.00 0.00 H new ATOM 0 HA THR B 546 29.433 11.460 -5.066 1.00 0.00 H new ATOM 0 HB THR B 546 29.706 13.695 -5.893 1.00 0.00 H new ATOM 0 HG1 THR B 546 31.845 14.650 -6.009 1.00 0.00 H new ATOM 0 HG21 THR B 546 30.653 14.881 -3.950 1.00 0.00 H new ATOM 0 HG22 THR B 546 29.630 13.514 -3.450 1.00 0.00 H new ATOM 0 HG23 THR B 546 31.402 13.365 -3.395 1.00 0.00 H new ATOM 421 N ALA B 547 29.807 11.687 -7.733 1.00 0.00 N ATOM 422 CA ALA B 547 29.914 11.290 -9.131 1.00 0.00 C ATOM 423 C ALA B 547 31.326 11.518 -9.660 1.00 0.00 C ATOM 424 O ALA B 547 31.789 10.802 -10.548 1.00 0.00 O ATOM 425 CB ALA B 547 28.903 12.052 -9.975 1.00 0.00 C ATOM 0 H ALA B 547 29.035 12.323 -7.533 1.00 0.00 H new ATOM 0 HA ALA B 547 29.697 10.224 -9.198 1.00 0.00 H new ATOM 0 HB1 ALA B 547 28.994 11.745 -11.017 1.00 0.00 H new ATOM 0 HB2 ALA B 547 27.896 11.835 -9.620 1.00 0.00 H new ATOM 0 HB3 ALA B 547 29.094 13.122 -9.894 1.00 0.00 H new ATOM 431 N SER B 548 32.004 12.519 -9.109 1.00 0.00 N ATOM 432 CA SER B 548 33.362 12.844 -9.529 1.00 0.00 C ATOM 433 C SER B 548 34.312 11.685 -9.242 1.00 0.00 C ATOM 434 O SER B 548 35.078 11.267 -10.109 1.00 0.00 O ATOM 435 CB SER B 548 33.851 14.107 -8.817 1.00 0.00 C ATOM 436 OG SER B 548 35.188 14.410 -9.175 1.00 0.00 O ATOM 0 H SER B 548 31.636 13.119 -8.371 1.00 0.00 H new ATOM 0 HA SER B 548 33.350 13.023 -10.604 1.00 0.00 H new ATOM 0 HB2 SER B 548 33.204 14.946 -9.073 1.00 0.00 H new ATOM 0 HB3 SER B 548 33.783 13.969 -7.738 1.00 0.00 H new ATOM 0 HG SER B 548 35.476 15.222 -8.708 1.00 0.00 H new ATOM 442 N MET B 549 34.255 11.171 -8.018 1.00 0.00 N ATOM 443 CA MET B 549 35.108 10.059 -7.615 1.00 0.00 C ATOM 444 C MET B 549 34.552 8.734 -8.127 1.00 0.00 C ATOM 445 O MET B 549 35.294 7.769 -8.313 1.00 0.00 O ATOM 446 CB MET B 549 35.241 10.016 -6.092 1.00 0.00 C ATOM 447 CG MET B 549 35.934 8.764 -5.578 1.00 0.00 C ATOM 448 SD MET B 549 36.625 8.981 -3.927 1.00 0.00 S ATOM 449 CE MET B 549 35.934 7.561 -3.081 1.00 0.00 C ATOM 0 H MET B 549 33.627 11.507 -7.288 1.00 0.00 H new ATOM 0 HA MET B 549 36.094 10.212 -8.054 1.00 0.00 H new ATOM 0 HB2 MET B 549 35.797 10.892 -5.759 1.00 0.00 H new ATOM 0 HB3 MET B 549 34.248 10.081 -5.647 1.00 0.00 H new ATOM 0 HG2 MET B 549 35.222 7.939 -5.564 1.00 0.00 H new ATOM 0 HG3 MET B 549 36.731 8.485 -6.267 1.00 0.00 H new ATOM 0 HE1 MET B 549 35.649 7.844 -2.068 1.00 0.00 H new ATOM 0 HE2 MET B 549 35.055 7.209 -3.620 1.00 0.00 H new ATOM 0 HE3 MET B 549 36.677 6.765 -3.040 1.00 0.00 H new ATOM 459 N LEU B 550 33.244 8.695 -8.353 1.00 0.00 N ATOM 460 CA LEU B 550 32.589 7.487 -8.844 1.00 0.00 C ATOM 461 C LEU B 550 33.083 7.129 -10.242 1.00 0.00 C ATOM 462 O LEU B 550 33.094 5.960 -10.626 1.00 0.00 O ATOM 463 CB LEU B 550 31.071 7.678 -8.860 1.00 0.00 C ATOM 464 CG LEU B 550 30.239 6.481 -8.396 1.00 0.00 C ATOM 465 CD1 LEU B 550 30.441 5.297 -9.329 1.00 0.00 C ATOM 466 CD2 LEU B 550 30.599 6.104 -6.967 1.00 0.00 C ATOM 0 H LEU B 550 32.616 9.485 -8.204 1.00 0.00 H new ATOM 0 HA LEU B 550 32.839 6.668 -8.170 1.00 0.00 H new ATOM 0 HB2 LEU B 550 30.826 8.532 -8.229 1.00 0.00 H new ATOM 0 HB3 LEU B 550 30.768 7.934 -9.875 1.00 0.00 H new ATOM 0 HG LEU B 550 29.186 6.762 -8.422 1.00 0.00 H new ATOM 0 HD11 LEU B 550 29.841 4.455 -8.983 1.00 0.00 H new ATOM 0 HD12 LEU B 550 30.133 5.572 -10.338 1.00 0.00 H new ATOM 0 HD13 LEU B 550 31.494 5.014 -9.336 1.00 0.00 H new ATOM 0 HD21 LEU B 550 29.998 5.251 -6.653 1.00 0.00 H new ATOM 0 HD22 LEU B 550 31.656 5.842 -6.915 1.00 0.00 H new ATOM 0 HD23 LEU B 550 30.402 6.949 -6.307 1.00 0.00 H new ATOM 478 N ALA B 551 33.492 8.143 -10.997 1.00 0.00 N ATOM 479 CA ALA B 551 33.991 7.935 -12.350 1.00 0.00 C ATOM 480 C ALA B 551 35.366 7.274 -12.333 1.00 0.00 C ATOM 481 O ALA B 551 35.741 6.574 -13.274 1.00 0.00 O ATOM 482 CB ALA B 551 34.048 9.257 -13.101 1.00 0.00 C ATOM 0 H ALA B 551 33.487 9.117 -10.694 1.00 0.00 H new ATOM 0 HA ALA B 551 33.302 7.266 -12.866 1.00 0.00 H new ATOM 0 HB1 ALA B 551 34.423 9.086 -14.110 1.00 0.00 H new ATOM 0 HB2 ALA B 551 33.049 9.689 -13.153 1.00 0.00 H new ATOM 0 HB3 ALA B 551 34.714 9.944 -12.578 1.00 0.00 H new ATOM 488 N SER B 552 36.113 7.502 -11.258 1.00 0.00 N ATOM 489 CA SER B 552 37.449 6.933 -11.120 1.00 0.00 C ATOM 490 C SER B 552 37.411 5.416 -11.276 1.00 0.00 C ATOM 491 O SER B 552 38.398 4.797 -11.671 1.00 0.00 O ATOM 492 CB SER B 552 38.046 7.303 -9.761 1.00 0.00 C ATOM 493 OG SER B 552 39.462 7.270 -9.801 1.00 0.00 O ATOM 0 H SER B 552 35.816 8.077 -10.469 1.00 0.00 H new ATOM 0 HA SER B 552 38.077 7.347 -11.909 1.00 0.00 H new ATOM 0 HB2 SER B 552 37.710 8.299 -9.472 1.00 0.00 H new ATOM 0 HB3 SER B 552 37.684 6.611 -9.001 1.00 0.00 H new ATOM 0 HG SER B 552 39.820 7.512 -8.921 1.00 0.00 H new ATOM 499 N ALA B 553 36.263 4.823 -10.961 1.00 0.00 N ATOM 500 CA ALA B 553 36.095 3.379 -11.068 1.00 0.00 C ATOM 501 C ALA B 553 35.263 3.012 -12.292 1.00 0.00 C ATOM 502 O ALA B 553 34.532 3.835 -12.845 1.00 0.00 O ATOM 503 CB ALA B 553 35.450 2.829 -9.804 1.00 0.00 C ATOM 0 H ALA B 553 35.436 5.321 -10.630 1.00 0.00 H new ATOM 0 HA ALA B 553 37.081 2.930 -11.185 1.00 0.00 H new ATOM 0 HB1 ALA B 553 35.330 1.750 -9.897 1.00 0.00 H new ATOM 0 HB2 ALA B 553 36.084 3.051 -8.946 1.00 0.00 H new ATOM 0 HB3 ALA B 553 34.473 3.292 -9.663 1.00 0.00 H new ATOM 509 N PRO B 554 35.375 1.749 -12.727 1.00 0.00 N ATOM 510 CA PRO B 554 34.640 1.244 -13.891 1.00 0.00 C ATOM 511 C PRO B 554 33.143 1.123 -13.624 1.00 0.00 C ATOM 512 O PRO B 554 32.682 1.215 -12.486 1.00 0.00 O ATOM 513 CB PRO B 554 35.254 -0.138 -14.127 1.00 0.00 C ATOM 514 CG PRO B 554 35.781 -0.550 -12.796 1.00 0.00 C ATOM 515 CD PRO B 554 36.227 0.715 -12.116 1.00 0.00 C ATOM 0 HA PRO B 554 34.723 1.914 -14.747 1.00 0.00 H new ATOM 0 HB2 PRO B 554 34.510 -0.845 -14.494 1.00 0.00 H new ATOM 0 HB3 PRO B 554 36.049 -0.096 -14.872 1.00 0.00 H new ATOM 0 HG2 PRO B 554 35.013 -1.057 -12.212 1.00 0.00 H new ATOM 0 HG3 PRO B 554 36.611 -1.248 -12.904 1.00 0.00 H new ATOM 0 HD2 PRO B 554 36.084 0.663 -11.037 1.00 0.00 H new ATOM 0 HD3 PRO B 554 37.285 0.912 -12.288 1.00 0.00 H new ATOM 523 N PRO B 555 32.365 0.912 -14.696 1.00 0.00 N ATOM 524 CA PRO B 555 30.909 0.773 -14.602 1.00 0.00 C ATOM 525 C PRO B 555 30.494 -0.527 -13.922 1.00 0.00 C ATOM 526 O PRO B 555 29.336 -0.696 -13.540 1.00 0.00 O ATOM 527 CB PRO B 555 30.457 0.780 -16.064 1.00 0.00 C ATOM 528 CG PRO B 555 31.640 0.296 -16.829 1.00 0.00 C ATOM 529 CD PRO B 555 32.847 0.793 -16.082 1.00 0.00 C ATOM 0 HA PRO B 555 30.462 1.564 -14.000 1.00 0.00 H new ATOM 0 HB2 PRO B 555 29.595 0.130 -16.215 1.00 0.00 H new ATOM 0 HB3 PRO B 555 30.162 1.780 -16.382 1.00 0.00 H new ATOM 0 HG2 PRO B 555 31.643 -0.792 -16.896 1.00 0.00 H new ATOM 0 HG3 PRO B 555 31.628 0.678 -17.850 1.00 0.00 H new ATOM 0 HD2 PRO B 555 33.682 0.097 -16.159 1.00 0.00 H new ATOM 0 HD3 PRO B 555 33.194 1.751 -16.470 1.00 0.00 H new ATOM 537 N GLN B 556 31.446 -1.442 -13.774 1.00 0.00 N ATOM 538 CA GLN B 556 31.177 -2.728 -13.140 1.00 0.00 C ATOM 539 C GLN B 556 31.577 -2.703 -11.668 1.00 0.00 C ATOM 540 O GLN B 556 31.435 -3.700 -10.960 1.00 0.00 O ATOM 541 CB GLN B 556 31.928 -3.845 -13.866 1.00 0.00 C ATOM 542 CG GLN B 556 31.344 -4.186 -15.227 1.00 0.00 C ATOM 543 CD GLN B 556 31.818 -5.530 -15.746 1.00 0.00 C ATOM 544 OE1 GLN B 556 31.068 -6.507 -15.749 1.00 0.00 O ATOM 545 NE2 GLN B 556 33.068 -5.586 -16.189 1.00 0.00 N ATOM 0 H GLN B 556 32.410 -1.317 -14.084 1.00 0.00 H new ATOM 0 HA GLN B 556 30.106 -2.919 -13.203 1.00 0.00 H new ATOM 0 HB2 GLN B 556 32.970 -3.550 -13.991 1.00 0.00 H new ATOM 0 HB3 GLN B 556 31.923 -4.739 -13.243 1.00 0.00 H new ATOM 0 HG2 GLN B 556 30.256 -4.190 -15.161 1.00 0.00 H new ATOM 0 HG3 GLN B 556 31.617 -3.408 -15.940 1.00 0.00 H new ATOM 0 HE21 GLN B 556 33.654 -4.752 -16.168 1.00 0.00 H new ATOM 0 HE22 GLN B 556 33.442 -6.463 -16.551 1.00 0.00 H new ATOM 554 N GLU B 557 32.078 -1.558 -11.215 1.00 0.00 N ATOM 555 CA GLU B 557 32.500 -1.405 -9.828 1.00 0.00 C ATOM 556 C GLU B 557 31.644 -0.365 -9.110 1.00 0.00 C ATOM 557 O GLU B 557 31.561 -0.356 -7.883 1.00 0.00 O ATOM 558 CB GLU B 557 33.974 -1.003 -9.761 1.00 0.00 C ATOM 559 CG GLU B 557 34.932 -2.175 -9.896 1.00 0.00 C ATOM 560 CD GLU B 557 35.169 -2.889 -8.579 1.00 0.00 C ATOM 561 OE1 GLU B 557 34.540 -2.501 -7.573 1.00 0.00 O ATOM 562 OE2 GLU B 557 35.984 -3.835 -8.555 1.00 0.00 O ATOM 0 H GLU B 557 32.201 -0.723 -11.788 1.00 0.00 H new ATOM 0 HA GLU B 557 32.370 -2.365 -9.328 1.00 0.00 H new ATOM 0 HB2 GLU B 557 34.181 -0.282 -10.552 1.00 0.00 H new ATOM 0 HB3 GLU B 557 34.162 -0.499 -8.813 1.00 0.00 H new ATOM 0 HG2 GLU B 557 34.534 -2.883 -10.623 1.00 0.00 H new ATOM 0 HG3 GLU B 557 35.884 -1.818 -10.288 1.00 0.00 H new ATOM 569 N GLN B 558 31.012 0.509 -9.887 1.00 0.00 N ATOM 570 CA GLN B 558 30.164 1.555 -9.326 1.00 0.00 C ATOM 571 C GLN B 558 29.197 0.978 -8.297 1.00 0.00 C ATOM 572 O GLN B 558 29.021 1.535 -7.213 1.00 0.00 O ATOM 573 CB GLN B 558 29.385 2.260 -10.437 1.00 0.00 C ATOM 574 CG GLN B 558 30.273 2.929 -11.473 1.00 0.00 C ATOM 575 CD GLN B 558 29.547 4.003 -12.259 1.00 0.00 C ATOM 576 OE1 GLN B 558 28.369 3.666 -12.772 1.00 0.00 O flip ATOM 577 NE2 GLN B 558 30.039 5.122 -12.403 1.00 0.00 N flip ATOM 0 H GLN B 558 31.071 0.514 -10.905 1.00 0.00 H new ATOM 0 HA GLN B 558 30.807 2.280 -8.827 1.00 0.00 H new ATOM 0 HB2 GLN B 558 28.743 1.534 -10.936 1.00 0.00 H new ATOM 0 HB3 GLN B 558 28.732 3.010 -9.991 1.00 0.00 H new ATOM 0 HG2 GLN B 558 31.137 3.370 -10.975 1.00 0.00 H new ATOM 0 HG3 GLN B 558 30.653 2.174 -12.162 1.00 0.00 H new ATOM 0 HE21 GLN B 558 30.947 5.337 -11.991 1.00 0.00 H new ATOM 0 HE22 GLN B 558 29.539 5.835 -12.934 1.00 0.00 H new ATOM 586 N LYS B 559 28.571 -0.142 -8.644 1.00 0.00 N ATOM 587 CA LYS B 559 27.621 -0.796 -7.751 1.00 0.00 C ATOM 588 C LYS B 559 28.268 -1.111 -6.406 1.00 0.00 C ATOM 589 O LYS B 559 27.665 -0.901 -5.354 1.00 0.00 O ATOM 590 CB LYS B 559 27.093 -2.082 -8.390 1.00 0.00 C ATOM 591 CG LYS B 559 26.020 -1.846 -9.437 1.00 0.00 C ATOM 592 CD LYS B 559 26.002 -2.953 -10.478 1.00 0.00 C ATOM 593 CE LYS B 559 25.275 -4.187 -9.967 1.00 0.00 C ATOM 594 NZ LYS B 559 26.111 -4.967 -9.012 1.00 0.00 N ATOM 0 H LYS B 559 28.704 -0.616 -9.537 1.00 0.00 H new ATOM 0 HA LYS B 559 26.788 -0.113 -7.582 1.00 0.00 H new ATOM 0 HB2 LYS B 559 27.924 -2.617 -8.849 1.00 0.00 H new ATOM 0 HB3 LYS B 559 26.691 -2.727 -7.609 1.00 0.00 H new ATOM 0 HG2 LYS B 559 25.045 -1.785 -8.953 1.00 0.00 H new ATOM 0 HG3 LYS B 559 26.193 -0.888 -9.927 1.00 0.00 H new ATOM 0 HD2 LYS B 559 25.516 -2.593 -11.385 1.00 0.00 H new ATOM 0 HD3 LYS B 559 27.025 -3.217 -10.747 1.00 0.00 H new ATOM 0 HE2 LYS B 559 24.349 -3.886 -9.477 1.00 0.00 H new ATOM 0 HE3 LYS B 559 24.999 -4.821 -10.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 25.920 -5.982 -9.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 27.117 -4.779 -9.198 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 25.880 -4.685 -8.038 1.00 0.00 H new ATOM 608 N GLN B 560 29.497 -1.614 -6.449 1.00 0.00 N ATOM 609 CA GLN B 560 30.224 -1.957 -5.233 1.00 0.00 C ATOM 610 C GLN B 560 30.472 -0.718 -4.379 1.00 0.00 C ATOM 611 O GLN B 560 30.326 -0.755 -3.157 1.00 0.00 O ATOM 612 CB GLN B 560 31.556 -2.626 -5.580 1.00 0.00 C ATOM 613 CG GLN B 560 31.439 -3.686 -6.663 1.00 0.00 C ATOM 614 CD GLN B 560 30.211 -4.559 -6.495 1.00 0.00 C ATOM 615 OE1 GLN B 560 29.988 -5.138 -5.432 1.00 0.00 O ATOM 616 NE2 GLN B 560 29.407 -4.658 -7.547 1.00 0.00 N ATOM 0 H GLN B 560 30.010 -1.793 -7.312 1.00 0.00 H new ATOM 0 HA GLN B 560 29.613 -2.655 -4.660 1.00 0.00 H new ATOM 0 HB2 GLN B 560 32.263 -1.863 -5.905 1.00 0.00 H new ATOM 0 HB3 GLN B 560 31.970 -3.081 -4.680 1.00 0.00 H new ATOM 0 HG2 GLN B 560 31.405 -3.201 -7.639 1.00 0.00 H new ATOM 0 HG3 GLN B 560 32.330 -4.313 -6.650 1.00 0.00 H new ATOM 0 HE21 GLN B 560 29.631 -4.160 -8.409 1.00 0.00 H new ATOM 0 HE22 GLN B 560 28.565 -5.232 -7.493 1.00 0.00 H new ATOM 625 N MET B 561 30.847 0.378 -5.030 1.00 0.00 N ATOM 626 CA MET B 561 31.114 1.629 -4.330 1.00 0.00 C ATOM 627 C MET B 561 29.871 2.115 -3.591 1.00 0.00 C ATOM 628 O MET B 561 29.881 2.262 -2.368 1.00 0.00 O ATOM 629 CB MET B 561 31.586 2.700 -5.315 1.00 0.00 C ATOM 630 CG MET B 561 32.723 2.240 -6.214 1.00 0.00 C ATOM 631 SD MET B 561 33.564 3.612 -7.027 1.00 0.00 S ATOM 632 CE MET B 561 34.509 4.286 -5.663 1.00 0.00 C ATOM 0 H MET B 561 30.973 0.425 -6.041 1.00 0.00 H new ATOM 0 HA MET B 561 31.902 1.445 -3.599 1.00 0.00 H new ATOM 0 HB2 MET B 561 30.744 3.007 -5.936 1.00 0.00 H new ATOM 0 HB3 MET B 561 31.908 3.579 -4.757 1.00 0.00 H new ATOM 0 HG2 MET B 561 33.444 1.677 -5.622 1.00 0.00 H new ATOM 0 HG3 MET B 561 32.331 1.560 -6.970 1.00 0.00 H new ATOM 0 HE1 MET B 561 35.274 4.959 -6.048 1.00 0.00 H new ATOM 0 HE2 MET B 561 33.844 4.836 -4.996 1.00 0.00 H new ATOM 0 HE3 MET B 561 34.984 3.474 -5.113 1.00 0.00 H new ATOM 642 N LEU B 562 28.802 2.362 -4.340 1.00 0.00 N ATOM 643 CA LEU B 562 27.550 2.831 -3.755 1.00 0.00 C ATOM 644 C LEU B 562 27.116 1.930 -2.604 1.00 0.00 C ATOM 645 O LEU B 562 26.787 2.408 -1.518 1.00 0.00 O ATOM 646 CB LEU B 562 26.454 2.881 -4.821 1.00 0.00 C ATOM 647 CG LEU B 562 26.491 4.082 -5.766 1.00 0.00 C ATOM 648 CD1 LEU B 562 25.383 3.980 -6.803 1.00 0.00 C ATOM 649 CD2 LEU B 562 26.372 5.381 -4.983 1.00 0.00 C ATOM 0 H LEU B 562 28.777 2.246 -5.353 1.00 0.00 H new ATOM 0 HA LEU B 562 27.713 3.835 -3.364 1.00 0.00 H new ATOM 0 HB2 LEU B 562 26.515 1.972 -5.419 1.00 0.00 H new ATOM 0 HB3 LEU B 562 25.486 2.868 -4.319 1.00 0.00 H new ATOM 0 HG LEU B 562 27.449 4.081 -6.286 1.00 0.00 H new ATOM 0 HD11 LEU B 562 25.425 4.844 -7.467 1.00 0.00 H new ATOM 0 HD12 LEU B 562 25.513 3.068 -7.386 1.00 0.00 H new ATOM 0 HD13 LEU B 562 24.416 3.955 -6.301 1.00 0.00 H new ATOM 0 HD21 LEU B 562 26.400 6.225 -5.672 1.00 0.00 H new ATOM 0 HD22 LEU B 562 25.429 5.391 -4.436 1.00 0.00 H new ATOM 0 HD23 LEU B 562 27.201 5.459 -4.280 1.00 0.00 H new ATOM 661 N GLY B 563 27.119 0.623 -2.848 1.00 0.00 N ATOM 662 CA GLY B 563 26.725 -0.324 -1.821 1.00 0.00 C ATOM 663 C GLY B 563 27.643 -0.288 -0.616 1.00 0.00 C ATOM 664 O GLY B 563 27.181 -0.320 0.525 1.00 0.00 O ATOM 0 H GLY B 563 27.387 0.203 -3.738 1.00 0.00 H new ATOM 0 HA2 GLY B 563 25.705 -0.107 -1.503 1.00 0.00 H new ATOM 0 HA3 GLY B 563 26.721 -1.330 -2.241 1.00 0.00 H new ATOM 668 N GLU B 564 28.947 -0.222 -0.868 1.00 0.00 N ATOM 669 CA GLU B 564 29.931 -0.184 0.207 1.00 0.00 C ATOM 670 C GLU B 564 29.652 0.975 1.160 1.00 0.00 C ATOM 671 O GLU B 564 29.704 0.815 2.380 1.00 0.00 O ATOM 672 CB GLU B 564 31.343 -0.055 -0.369 1.00 0.00 C ATOM 673 CG GLU B 564 32.072 -1.383 -0.494 1.00 0.00 C ATOM 674 CD GLU B 564 32.750 -1.799 0.797 1.00 0.00 C ATOM 675 OE1 GLU B 564 33.321 -0.920 1.477 1.00 0.00 O ATOM 676 OE2 GLU B 564 32.711 -3.003 1.127 1.00 0.00 O ATOM 0 H GLU B 564 29.346 -0.194 -1.806 1.00 0.00 H new ATOM 0 HA GLU B 564 29.857 -1.117 0.765 1.00 0.00 H new ATOM 0 HB2 GLU B 564 31.284 0.412 -1.352 1.00 0.00 H new ATOM 0 HB3 GLU B 564 31.926 0.612 0.266 1.00 0.00 H new ATOM 0 HG2 GLU B 564 31.364 -2.155 -0.793 1.00 0.00 H new ATOM 0 HG3 GLU B 564 32.818 -1.311 -1.285 1.00 0.00 H new ATOM 683 N ARG B 565 29.356 2.140 0.594 1.00 0.00 N ATOM 684 CA ARG B 565 29.070 3.326 1.393 1.00 0.00 C ATOM 685 C ARG B 565 27.671 3.251 1.997 1.00 0.00 C ATOM 686 O ARG B 565 27.413 3.807 3.066 1.00 0.00 O ATOM 687 CB ARG B 565 29.199 4.587 0.536 1.00 0.00 C ATOM 688 CG ARG B 565 30.540 4.709 -0.169 1.00 0.00 C ATOM 689 CD ARG B 565 31.495 5.608 0.601 1.00 0.00 C ATOM 690 NE ARG B 565 31.840 5.049 1.906 1.00 0.00 N ATOM 691 CZ ARG B 565 32.457 5.738 2.860 1.00 0.00 C ATOM 692 NH1 ARG B 565 32.795 7.003 2.655 1.00 0.00 N ATOM 693 NH2 ARG B 565 32.737 5.160 4.021 1.00 0.00 N ATOM 0 H ARG B 565 29.308 2.288 -0.414 1.00 0.00 H new ATOM 0 HA ARG B 565 29.796 3.370 2.205 1.00 0.00 H new ATOM 0 HB2 ARG B 565 28.404 4.592 -0.210 1.00 0.00 H new ATOM 0 HB3 ARG B 565 29.049 5.462 1.168 1.00 0.00 H new ATOM 0 HG2 ARG B 565 30.983 3.720 -0.284 1.00 0.00 H new ATOM 0 HG3 ARG B 565 30.390 5.110 -1.172 1.00 0.00 H new ATOM 0 HD2 ARG B 565 32.404 5.755 0.018 1.00 0.00 H new ATOM 0 HD3 ARG B 565 31.040 6.589 0.736 1.00 0.00 H new ATOM 0 HE ARG B 565 31.594 4.077 2.095 1.00 0.00 H new ATOM 0 HH11 ARG B 565 32.582 7.450 1.763 1.00 0.00 H new ATOM 0 HH12 ARG B 565 33.269 7.530 3.389 1.00 0.00 H new ATOM 0 HH21 ARG B 565 32.479 4.186 4.181 1.00 0.00 H new ATOM 0 HH22 ARG B 565 33.211 5.689 4.753 1.00 0.00 H new ATOM 707 N LEU B 566 26.770 2.560 1.306 1.00 0.00 N ATOM 708 CA LEU B 566 25.397 2.411 1.774 1.00 0.00 C ATOM 709 C LEU B 566 25.316 1.401 2.914 1.00 0.00 C ATOM 710 O LEU B 566 24.376 1.420 3.709 1.00 0.00 O ATOM 711 CB LEU B 566 24.490 1.972 0.623 1.00 0.00 C ATOM 712 CG LEU B 566 24.175 3.038 -0.427 1.00 0.00 C ATOM 713 CD1 LEU B 566 23.900 2.392 -1.776 1.00 0.00 C ATOM 714 CD2 LEU B 566 22.991 3.887 0.012 1.00 0.00 C ATOM 0 H LEU B 566 26.966 2.094 0.420 1.00 0.00 H new ATOM 0 HA LEU B 566 25.059 3.378 2.146 1.00 0.00 H new ATOM 0 HB2 LEU B 566 24.957 1.124 0.122 1.00 0.00 H new ATOM 0 HB3 LEU B 566 23.550 1.616 1.043 1.00 0.00 H new ATOM 0 HG LEU B 566 25.044 3.689 -0.529 1.00 0.00 H new ATOM 0 HD11 LEU B 566 23.678 3.165 -2.511 1.00 0.00 H new ATOM 0 HD12 LEU B 566 24.777 1.829 -2.095 1.00 0.00 H new ATOM 0 HD13 LEU B 566 23.048 1.718 -1.690 1.00 0.00 H new ATOM 0 HD21 LEU B 566 22.782 4.640 -0.748 1.00 0.00 H new ATOM 0 HD22 LEU B 566 22.116 3.251 0.143 1.00 0.00 H new ATOM 0 HD23 LEU B 566 23.226 4.379 0.956 1.00 0.00 H new ATOM 726 N PHE B 567 26.309 0.521 2.989 1.00 0.00 N ATOM 727 CA PHE B 567 26.351 -0.497 4.033 1.00 0.00 C ATOM 728 C PHE B 567 26.272 0.140 5.417 1.00 0.00 C ATOM 729 O PHE B 567 25.381 -0.154 6.214 1.00 0.00 O ATOM 730 CB PHE B 567 27.630 -1.327 3.914 1.00 0.00 C ATOM 731 CG PHE B 567 28.076 -1.932 5.214 1.00 0.00 C ATOM 732 CD1 PHE B 567 27.219 -2.732 5.952 1.00 0.00 C ATOM 733 CD2 PHE B 567 29.353 -1.700 5.699 1.00 0.00 C ATOM 734 CE1 PHE B 567 27.626 -3.290 7.149 1.00 0.00 C ATOM 735 CE2 PHE B 567 29.766 -2.255 6.896 1.00 0.00 C ATOM 736 CZ PHE B 567 28.901 -3.050 7.622 1.00 0.00 C ATOM 0 H PHE B 567 27.095 0.492 2.340 1.00 0.00 H new ATOM 0 HA PHE B 567 25.488 -1.151 3.903 1.00 0.00 H new ATOM 0 HB2 PHE B 567 27.470 -2.124 3.188 1.00 0.00 H new ATOM 0 HB3 PHE B 567 28.428 -0.696 3.524 1.00 0.00 H new ATOM 0 HD1 PHE B 567 26.220 -2.922 5.587 1.00 0.00 H new ATOM 0 HD2 PHE B 567 30.033 -1.079 5.136 1.00 0.00 H new ATOM 0 HE1 PHE B 567 26.948 -3.913 7.714 1.00 0.00 H new ATOM 0 HE2 PHE B 567 30.764 -2.067 7.263 1.00 0.00 H new ATOM 0 HZ PHE B 567 29.221 -3.483 8.558 1.00 0.00 H new ATOM 746 N PRO B 568 27.228 1.035 5.712 1.00 0.00 N ATOM 747 CA PRO B 568 27.289 1.732 7.000 1.00 0.00 C ATOM 748 C PRO B 568 26.157 2.740 7.168 1.00 0.00 C ATOM 749 O PRO B 568 25.695 2.990 8.282 1.00 0.00 O ATOM 750 CB PRO B 568 28.640 2.450 6.950 1.00 0.00 C ATOM 751 CG PRO B 568 28.921 2.628 5.498 1.00 0.00 C ATOM 752 CD PRO B 568 28.321 1.434 4.810 1.00 0.00 C ATOM 0 HA PRO B 568 27.186 1.046 7.840 1.00 0.00 H new ATOM 0 HB2 PRO B 568 28.598 3.409 7.466 1.00 0.00 H new ATOM 0 HB3 PRO B 568 29.419 1.862 7.435 1.00 0.00 H new ATOM 0 HG2 PRO B 568 28.482 3.554 5.126 1.00 0.00 H new ATOM 0 HG3 PRO B 568 29.993 2.687 5.313 1.00 0.00 H new ATOM 0 HD2 PRO B 568 27.950 1.687 3.817 1.00 0.00 H new ATOM 0 HD3 PRO B 568 29.051 0.634 4.684 1.00 0.00 H new ATOM 760 N LEU B 569 25.714 3.316 6.055 1.00 0.00 N ATOM 761 CA LEU B 569 24.634 4.297 6.080 1.00 0.00 C ATOM 762 C LEU B 569 23.356 3.686 6.645 1.00 0.00 C ATOM 763 O LEU B 569 22.790 4.193 7.614 1.00 0.00 O ATOM 764 CB LEU B 569 24.376 4.835 4.671 1.00 0.00 C ATOM 765 CG LEU B 569 25.423 5.805 4.121 1.00 0.00 C ATOM 766 CD1 LEU B 569 25.302 5.920 2.610 1.00 0.00 C ATOM 767 CD2 LEU B 569 25.279 7.172 4.775 1.00 0.00 C ATOM 0 H LEU B 569 26.086 3.121 5.125 1.00 0.00 H new ATOM 0 HA LEU B 569 24.938 5.120 6.727 1.00 0.00 H new ATOM 0 HB2 LEU B 569 24.300 3.988 3.989 1.00 0.00 H new ATOM 0 HB3 LEU B 569 23.408 5.336 4.666 1.00 0.00 H new ATOM 0 HG LEU B 569 26.413 5.414 4.357 1.00 0.00 H new ATOM 0 HD11 LEU B 569 26.055 6.614 2.237 1.00 0.00 H new ATOM 0 HD12 LEU B 569 25.455 4.940 2.157 1.00 0.00 H new ATOM 0 HD13 LEU B 569 24.309 6.288 2.351 1.00 0.00 H new ATOM 0 HD21 LEU B 569 26.032 7.849 4.372 1.00 0.00 H new ATOM 0 HD22 LEU B 569 24.285 7.570 4.570 1.00 0.00 H new ATOM 0 HD23 LEU B 569 25.417 7.076 5.852 1.00 0.00 H new ATOM 779 N ILE B 570 22.908 2.594 6.035 1.00 0.00 N ATOM 780 CA ILE B 570 21.699 1.912 6.480 1.00 0.00 C ATOM 781 C ILE B 570 21.954 1.115 7.754 1.00 0.00 C ATOM 782 O ILE B 570 21.022 0.771 8.479 1.00 0.00 O ATOM 783 CB ILE B 570 21.156 0.964 5.395 1.00 0.00 C ATOM 784 CG1 ILE B 570 20.883 1.735 4.102 1.00 0.00 C ATOM 785 CG2 ILE B 570 19.892 0.271 5.881 1.00 0.00 C ATOM 786 CD1 ILE B 570 21.239 0.963 2.851 1.00 0.00 C ATOM 0 H ILE B 570 23.364 2.163 5.231 1.00 0.00 H new ATOM 0 HA ILE B 570 20.957 2.685 6.681 1.00 0.00 H new ATOM 0 HB ILE B 570 21.909 0.203 5.190 1.00 0.00 H new ATOM 0 HG12 ILE B 570 19.827 2.004 4.065 1.00 0.00 H new ATOM 0 HG13 ILE B 570 21.449 2.666 4.118 1.00 0.00 H new ATOM 0 HG21 ILE B 570 19.520 -0.396 5.103 1.00 0.00 H new ATOM 0 HG22 ILE B 570 20.116 -0.307 6.778 1.00 0.00 H new ATOM 0 HG23 ILE B 570 19.133 1.018 6.111 1.00 0.00 H new ATOM 0 HD11 ILE B 570 21.019 1.571 1.973 1.00 0.00 H new ATOM 0 HD12 ILE B 570 22.301 0.717 2.865 1.00 0.00 H new ATOM 0 HD13 ILE B 570 20.654 0.044 2.812 1.00 0.00 H new ATOM 798 N GLN B 571 23.224 0.827 8.021 1.00 0.00 N ATOM 799 CA GLN B 571 23.602 0.072 9.210 1.00 0.00 C ATOM 800 C GLN B 571 23.118 0.771 10.476 1.00 0.00 C ATOM 801 O GLN B 571 22.990 0.148 11.530 1.00 0.00 O ATOM 802 CB GLN B 571 25.120 -0.111 9.262 1.00 0.00 C ATOM 803 CG GLN B 571 25.645 -0.448 10.649 1.00 0.00 C ATOM 804 CD GLN B 571 26.957 -1.205 10.608 1.00 0.00 C ATOM 805 OE1 GLN B 571 27.571 -1.350 9.550 1.00 0.00 O ATOM 806 NE2 GLN B 571 27.396 -1.693 11.763 1.00 0.00 N ATOM 0 H GLN B 571 24.008 1.105 7.431 1.00 0.00 H new ATOM 0 HA GLN B 571 23.127 -0.907 9.154 1.00 0.00 H new ATOM 0 HB2 GLN B 571 25.406 -0.905 8.572 1.00 0.00 H new ATOM 0 HB3 GLN B 571 25.600 0.803 8.913 1.00 0.00 H new ATOM 0 HG2 GLN B 571 25.779 0.473 11.216 1.00 0.00 H new ATOM 0 HG3 GLN B 571 24.902 -1.044 11.180 1.00 0.00 H new ATOM 0 HE21 GLN B 571 26.855 -1.549 12.616 1.00 0.00 H new ATOM 0 HE22 GLN B 571 28.274 -2.211 11.797 1.00 0.00 H new ATOM 815 N ALA B 572 22.851 2.068 10.365 1.00 0.00 N ATOM 816 CA ALA B 572 22.380 2.851 11.500 1.00 0.00 C ATOM 817 C ALA B 572 20.859 2.808 11.603 1.00 0.00 C ATOM 818 O ALA B 572 20.259 3.548 12.382 1.00 0.00 O ATOM 819 CB ALA B 572 22.863 4.289 11.386 1.00 0.00 C ATOM 0 H ALA B 572 22.953 2.599 9.500 1.00 0.00 H new ATOM 0 HA ALA B 572 22.792 2.412 12.409 1.00 0.00 H new ATOM 0 HB1 ALA B 572 22.504 4.862 12.241 1.00 0.00 H new ATOM 0 HB2 ALA B 572 23.953 4.307 11.370 1.00 0.00 H new ATOM 0 HB3 ALA B 572 22.479 4.730 10.466 1.00 0.00 H new ATOM 825 N MET B 573 20.241 1.938 10.811 1.00 0.00 N ATOM 826 CA MET B 573 18.790 1.799 10.814 1.00 0.00 C ATOM 827 C MET B 573 18.383 0.332 10.723 1.00 0.00 C ATOM 828 O MET B 573 17.711 -0.193 11.611 1.00 0.00 O ATOM 829 CB MET B 573 18.179 2.583 9.650 1.00 0.00 C ATOM 830 CG MET B 573 18.748 3.984 9.495 1.00 0.00 C ATOM 831 SD MET B 573 17.789 5.001 8.357 1.00 0.00 S ATOM 832 CE MET B 573 18.459 4.471 6.783 1.00 0.00 C ATOM 0 H MET B 573 20.723 1.319 10.159 1.00 0.00 H new ATOM 0 HA MET B 573 18.414 2.204 11.753 1.00 0.00 H new ATOM 0 HB2 MET B 573 18.341 2.030 8.725 1.00 0.00 H new ATOM 0 HB3 MET B 573 17.101 2.652 9.795 1.00 0.00 H new ATOM 0 HG2 MET B 573 18.780 4.469 10.471 1.00 0.00 H new ATOM 0 HG3 MET B 573 19.776 3.917 9.138 1.00 0.00 H new ATOM 0 HE1 MET B 573 17.965 5.012 5.976 1.00 0.00 H new ATOM 0 HE2 MET B 573 19.529 4.677 6.755 1.00 0.00 H new ATOM 0 HE3 MET B 573 18.292 3.401 6.658 1.00 0.00 H new ATOM 842 N HIS B 574 18.796 -0.326 9.644 1.00 0.00 N ATOM 843 CA HIS B 574 18.475 -1.734 9.437 1.00 0.00 C ATOM 844 C HIS B 574 19.727 -2.531 9.084 1.00 0.00 C ATOM 845 O HIS B 574 19.882 -3.027 7.968 1.00 0.00 O ATOM 846 CB HIS B 574 17.432 -1.884 8.330 1.00 0.00 C ATOM 847 CG HIS B 574 16.145 -1.173 8.618 1.00 0.00 C ATOM 848 ND1 HIS B 574 15.023 -1.813 9.099 1.00 0.00 N ATOM 849 CD2 HIS B 574 15.807 0.132 8.493 1.00 0.00 C ATOM 850 CE1 HIS B 574 14.050 -0.934 9.255 1.00 0.00 C ATOM 851 NE2 HIS B 574 14.500 0.254 8.895 1.00 0.00 N ATOM 0 H HIS B 574 19.353 0.093 8.900 1.00 0.00 H new ATOM 0 HA HIS B 574 18.065 -2.128 10.367 1.00 0.00 H new ATOM 0 HB2 HIS B 574 17.847 -1.503 7.397 1.00 0.00 H new ATOM 0 HB3 HIS B 574 17.226 -2.943 8.178 1.00 0.00 H new ATOM 0 HD2 HIS B 574 16.446 0.929 8.142 1.00 0.00 H new ATOM 0 HE1 HIS B 574 13.055 -1.150 9.616 1.00 0.00 H new ATOM 0 HE2 HIS B 574 13.964 1.121 8.913 1.00 0.00 H new ATOM 859 N PRO B 575 20.643 -2.656 10.056 1.00 0.00 N ATOM 860 CA PRO B 575 21.898 -3.391 9.871 1.00 0.00 C ATOM 861 C PRO B 575 21.676 -4.895 9.751 1.00 0.00 C ATOM 862 O PRO B 575 22.493 -5.609 9.168 1.00 0.00 O ATOM 863 CB PRO B 575 22.689 -3.067 11.141 1.00 0.00 C ATOM 864 CG PRO B 575 21.653 -2.741 12.160 1.00 0.00 C ATOM 865 CD PRO B 575 20.524 -2.090 11.410 1.00 0.00 C ATOM 0 HA PRO B 575 22.407 -3.104 8.951 1.00 0.00 H new ATOM 0 HB2 PRO B 575 23.299 -3.914 11.454 1.00 0.00 H new ATOM 0 HB3 PRO B 575 23.366 -2.228 10.982 1.00 0.00 H new ATOM 0 HG2 PRO B 575 21.313 -3.641 12.673 1.00 0.00 H new ATOM 0 HG3 PRO B 575 22.052 -2.072 12.922 1.00 0.00 H new ATOM 0 HD2 PRO B 575 19.558 -2.321 11.859 1.00 0.00 H new ATOM 0 HD3 PRO B 575 20.620 -1.004 11.402 1.00 0.00 H new ATOM 873 N THR B 576 20.566 -5.371 10.306 1.00 0.00 N ATOM 874 CA THR B 576 20.237 -6.790 10.262 1.00 0.00 C ATOM 875 C THR B 576 20.322 -7.330 8.838 1.00 0.00 C ATOM 876 O THR B 576 20.759 -8.460 8.617 1.00 0.00 O ATOM 877 CB THR B 576 18.826 -7.058 10.817 1.00 0.00 C ATOM 878 OG1 THR B 576 18.663 -6.399 12.078 1.00 0.00 O ATOM 879 CG2 THR B 576 18.584 -8.550 10.984 1.00 0.00 C ATOM 0 H THR B 576 19.879 -4.794 10.792 1.00 0.00 H new ATOM 0 HA THR B 576 20.968 -7.303 10.887 1.00 0.00 H new ATOM 0 HB THR B 576 18.099 -6.666 10.105 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.763 -6.573 12.424 1.00 0.00 H new ATOM 0 HG21 THR B 576 17.581 -8.714 11.377 1.00 0.00 H new ATOM 0 HG22 THR B 576 18.680 -9.045 10.017 1.00 0.00 H new ATOM 0 HG23 THR B 576 19.317 -8.962 11.677 1.00 0.00 H new ATOM 887 N LEU B 577 19.902 -6.516 7.876 1.00 0.00 N ATOM 888 CA LEU B 577 19.930 -6.912 6.473 1.00 0.00 C ATOM 889 C LEU B 577 20.338 -5.741 5.585 1.00 0.00 C ATOM 890 O LEU B 577 19.917 -5.646 4.432 1.00 0.00 O ATOM 891 CB LEU B 577 18.561 -7.440 6.043 1.00 0.00 C ATOM 892 CG LEU B 577 17.792 -8.245 7.092 1.00 0.00 C ATOM 893 CD1 LEU B 577 16.893 -7.333 7.911 1.00 0.00 C ATOM 894 CD2 LEU B 577 16.977 -9.344 6.427 1.00 0.00 C ATOM 0 H LEU B 577 19.538 -5.578 8.042 1.00 0.00 H new ATOM 0 HA LEU B 577 20.669 -7.705 6.360 1.00 0.00 H new ATOM 0 HB2 LEU B 577 17.945 -6.593 5.741 1.00 0.00 H new ATOM 0 HB3 LEU B 577 18.696 -8.066 5.161 1.00 0.00 H new ATOM 0 HG LEU B 577 18.512 -8.710 7.765 1.00 0.00 H new ATOM 0 HD11 LEU B 577 16.354 -7.923 8.652 1.00 0.00 H new ATOM 0 HD12 LEU B 577 17.500 -6.582 8.417 1.00 0.00 H new ATOM 0 HD13 LEU B 577 16.179 -6.838 7.252 1.00 0.00 H new ATOM 0 HD21 LEU B 577 16.436 -9.907 7.188 1.00 0.00 H new ATOM 0 HD22 LEU B 577 16.266 -8.899 5.731 1.00 0.00 H new ATOM 0 HD23 LEU B 577 17.644 -10.015 5.885 1.00 0.00 H new ATOM 906 N ALA B 578 21.162 -4.851 6.129 1.00 0.00 N ATOM 907 CA ALA B 578 21.630 -3.688 5.385 1.00 0.00 C ATOM 908 C ALA B 578 22.179 -4.094 4.021 1.00 0.00 C ATOM 909 O ALA B 578 21.732 -3.595 2.989 1.00 0.00 O ATOM 910 CB ALA B 578 22.691 -2.944 6.182 1.00 0.00 C ATOM 0 H ALA B 578 21.519 -4.913 7.082 1.00 0.00 H new ATOM 0 HA ALA B 578 20.780 -3.025 5.223 1.00 0.00 H new ATOM 0 HB1 ALA B 578 23.032 -2.078 5.615 1.00 0.00 H new ATOM 0 HB2 ALA B 578 22.268 -2.613 7.131 1.00 0.00 H new ATOM 0 HB3 ALA B 578 23.535 -3.607 6.373 1.00 0.00 H new ATOM 916 N GLY B 579 23.151 -5.001 4.024 1.00 0.00 N ATOM 917 CA GLY B 579 23.744 -5.457 2.781 1.00 0.00 C ATOM 918 C GLY B 579 22.709 -5.959 1.794 1.00 0.00 C ATOM 919 O GLY B 579 22.798 -5.687 0.597 1.00 0.00 O ATOM 0 H GLY B 579 23.538 -5.428 4.865 1.00 0.00 H new ATOM 0 HA2 GLY B 579 24.306 -4.640 2.329 1.00 0.00 H new ATOM 0 HA3 GLY B 579 24.456 -6.255 2.993 1.00 0.00 H new ATOM 923 N LYS B 580 21.725 -6.697 2.296 1.00 0.00 N ATOM 924 CA LYS B 580 20.667 -7.240 1.452 1.00 0.00 C ATOM 925 C LYS B 580 19.899 -6.121 0.755 1.00 0.00 C ATOM 926 O LYS B 580 19.891 -6.032 -0.473 1.00 0.00 O ATOM 927 CB LYS B 580 19.707 -8.091 2.285 1.00 0.00 C ATOM 928 CG LYS B 580 18.781 -8.958 1.450 1.00 0.00 C ATOM 929 CD LYS B 580 17.444 -9.172 2.139 1.00 0.00 C ATOM 930 CE LYS B 580 17.569 -10.132 3.313 1.00 0.00 C ATOM 931 NZ LYS B 580 18.107 -11.455 2.892 1.00 0.00 N ATOM 0 H LYS B 580 21.638 -6.933 3.284 1.00 0.00 H new ATOM 0 HA LYS B 580 21.130 -7.868 0.691 1.00 0.00 H new ATOM 0 HB2 LYS B 580 20.286 -8.730 2.951 1.00 0.00 H new ATOM 0 HB3 LYS B 580 19.106 -7.435 2.915 1.00 0.00 H new ATOM 0 HG2 LYS B 580 18.620 -8.489 0.479 1.00 0.00 H new ATOM 0 HG3 LYS B 580 19.254 -9.922 1.264 1.00 0.00 H new ATOM 0 HD2 LYS B 580 17.057 -8.215 2.490 1.00 0.00 H new ATOM 0 HD3 LYS B 580 16.723 -9.564 1.422 1.00 0.00 H new ATOM 0 HE2 LYS B 580 18.223 -9.698 4.069 1.00 0.00 H new ATOM 0 HE3 LYS B 580 16.592 -10.268 3.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 17.883 -12.167 3.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 17.676 -11.733 1.988 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 19.139 -11.390 2.778 1.00 0.00 H new ATOM 945 N ILE B 581 19.255 -5.270 1.547 1.00 0.00 N ATOM 946 CA ILE B 581 18.486 -4.156 1.005 1.00 0.00 C ATOM 947 C ILE B 581 19.374 -3.220 0.192 1.00 0.00 C ATOM 948 O ILE B 581 18.899 -2.512 -0.696 1.00 0.00 O ATOM 949 CB ILE B 581 17.798 -3.351 2.123 1.00 0.00 C ATOM 950 CG1 ILE B 581 18.829 -2.876 3.149 1.00 0.00 C ATOM 951 CG2 ILE B 581 16.723 -4.192 2.796 1.00 0.00 C ATOM 952 CD1 ILE B 581 18.214 -2.373 4.436 1.00 0.00 C ATOM 0 H ILE B 581 19.250 -5.330 2.565 1.00 0.00 H new ATOM 0 HA ILE B 581 17.723 -4.585 0.355 1.00 0.00 H new ATOM 0 HB ILE B 581 17.324 -2.475 1.680 1.00 0.00 H new ATOM 0 HG12 ILE B 581 19.508 -3.698 3.377 1.00 0.00 H new ATOM 0 HG13 ILE B 581 19.429 -2.080 2.707 1.00 0.00 H new ATOM 0 HG21 ILE B 581 16.246 -3.610 3.584 1.00 0.00 H new ATOM 0 HG22 ILE B 581 15.976 -4.486 2.059 1.00 0.00 H new ATOM 0 HG23 ILE B 581 17.176 -5.084 3.228 1.00 0.00 H new ATOM 0 HD11 ILE B 581 19.004 -2.053 5.116 1.00 0.00 H new ATOM 0 HD12 ILE B 581 17.557 -1.530 4.220 1.00 0.00 H new ATOM 0 HD13 ILE B 581 17.637 -3.173 4.901 1.00 0.00 H new ATOM 964 N THR B 582 20.667 -3.222 0.501 1.00 0.00 N ATOM 965 CA THR B 582 21.622 -2.373 -0.200 1.00 0.00 C ATOM 966 C THR B 582 21.823 -2.843 -1.636 1.00 0.00 C ATOM 967 O THR B 582 21.810 -2.042 -2.570 1.00 0.00 O ATOM 968 CB THR B 582 22.985 -2.349 0.517 1.00 0.00 C ATOM 969 OG1 THR B 582 22.873 -1.644 1.758 1.00 0.00 O ATOM 970 CG2 THR B 582 24.043 -1.689 -0.354 1.00 0.00 C ATOM 0 H THR B 582 21.077 -3.803 1.233 1.00 0.00 H new ATOM 0 HA THR B 582 21.206 -1.366 -0.205 1.00 0.00 H new ATOM 0 HB THR B 582 23.287 -3.378 0.711 1.00 0.00 H new ATOM 0 HG1 THR B 582 22.356 -2.182 2.394 1.00 0.00 H new ATOM 0 HG21 THR B 582 24.997 -1.684 0.173 1.00 0.00 H new ATOM 0 HG22 THR B 582 24.146 -2.246 -1.285 1.00 0.00 H new ATOM 0 HG23 THR B 582 23.745 -0.664 -0.575 1.00 0.00 H new ATOM 978 N GLY B 583 22.010 -4.149 -1.806 1.00 0.00 N ATOM 979 CA GLY B 583 22.212 -4.703 -3.132 1.00 0.00 C ATOM 980 C GLY B 583 21.088 -4.348 -4.086 1.00 0.00 C ATOM 981 O GLY B 583 21.333 -3.996 -5.239 1.00 0.00 O ATOM 0 H GLY B 583 22.025 -4.833 -1.049 1.00 0.00 H new ATOM 0 HA2 GLY B 583 23.156 -4.337 -3.535 1.00 0.00 H new ATOM 0 HA3 GLY B 583 22.295 -5.787 -3.061 1.00 0.00 H new ATOM 985 N MET B 584 19.853 -4.442 -3.604 1.00 0.00 N ATOM 986 CA MET B 584 18.688 -4.128 -4.423 1.00 0.00 C ATOM 987 C MET B 584 18.589 -2.626 -4.673 1.00 0.00 C ATOM 988 O MET B 584 18.472 -2.183 -5.817 1.00 0.00 O ATOM 989 CB MET B 584 17.412 -4.629 -3.746 1.00 0.00 C ATOM 990 CG MET B 584 17.459 -6.103 -3.376 1.00 0.00 C ATOM 991 SD MET B 584 17.059 -6.398 -1.643 1.00 0.00 S ATOM 992 CE MET B 584 15.275 -6.536 -1.725 1.00 0.00 C ATOM 0 H MET B 584 19.633 -4.733 -2.651 1.00 0.00 H new ATOM 0 HA MET B 584 18.803 -4.632 -5.383 1.00 0.00 H new ATOM 0 HB2 MET B 584 17.234 -4.042 -2.845 1.00 0.00 H new ATOM 0 HB3 MET B 584 16.566 -4.457 -4.411 1.00 0.00 H new ATOM 0 HG2 MET B 584 16.760 -6.654 -4.005 1.00 0.00 H new ATOM 0 HG3 MET B 584 18.454 -6.495 -3.587 1.00 0.00 H new ATOM 0 HE1 MET B 584 14.822 -5.776 -1.088 1.00 0.00 H new ATOM 0 HE2 MET B 584 14.946 -6.391 -2.754 1.00 0.00 H new ATOM 0 HE3 MET B 584 14.970 -7.525 -1.383 1.00 0.00 H new ATOM 1002 N LEU B 585 18.635 -1.847 -3.598 1.00 0.00 N ATOM 1003 CA LEU B 585 18.550 -0.395 -3.701 1.00 0.00 C ATOM 1004 C LEU B 585 19.608 0.146 -4.658 1.00 0.00 C ATOM 1005 O LEU B 585 19.294 0.876 -5.599 1.00 0.00 O ATOM 1006 CB LEU B 585 18.718 0.245 -2.322 1.00 0.00 C ATOM 1007 CG LEU B 585 17.431 0.692 -1.628 1.00 0.00 C ATOM 1008 CD1 LEU B 585 16.398 -0.425 -1.647 1.00 0.00 C ATOM 1009 CD2 LEU B 585 17.719 1.129 -0.199 1.00 0.00 C ATOM 0 H LEU B 585 18.731 -2.197 -2.645 1.00 0.00 H new ATOM 0 HA LEU B 585 17.566 -0.141 -4.095 1.00 0.00 H new ATOM 0 HB2 LEU B 585 19.229 -0.467 -1.673 1.00 0.00 H new ATOM 0 HB3 LEU B 585 19.372 1.111 -2.423 1.00 0.00 H new ATOM 0 HG LEU B 585 17.025 1.544 -2.173 1.00 0.00 H new ATOM 0 HD11 LEU B 585 15.489 -0.088 -1.149 1.00 0.00 H new ATOM 0 HD12 LEU B 585 16.169 -0.691 -2.679 1.00 0.00 H new ATOM 0 HD13 LEU B 585 16.795 -1.297 -1.127 1.00 0.00 H new ATOM 0 HD21 LEU B 585 16.791 1.444 0.279 1.00 0.00 H new ATOM 0 HD22 LEU B 585 18.149 0.296 0.357 1.00 0.00 H new ATOM 0 HD23 LEU B 585 18.423 1.961 -0.208 1.00 0.00 H new ATOM 1021 N LEU B 586 20.861 -0.217 -4.412 1.00 0.00 N ATOM 1022 CA LEU B 586 21.967 0.230 -5.252 1.00 0.00 C ATOM 1023 C LEU B 586 21.819 -0.303 -6.674 1.00 0.00 C ATOM 1024 O LEU B 586 22.331 0.288 -7.624 1.00 0.00 O ATOM 1025 CB LEU B 586 23.301 -0.227 -4.660 1.00 0.00 C ATOM 1026 CG LEU B 586 23.805 -1.596 -5.119 1.00 0.00 C ATOM 1027 CD1 LEU B 586 24.637 -1.462 -6.385 1.00 0.00 C ATOM 1028 CD2 LEU B 586 24.613 -2.264 -4.016 1.00 0.00 C ATOM 0 H LEU B 586 21.137 -0.820 -3.637 1.00 0.00 H new ATOM 0 HA LEU B 586 21.947 1.319 -5.287 1.00 0.00 H new ATOM 0 HB2 LEU B 586 24.058 0.518 -4.905 1.00 0.00 H new ATOM 0 HB3 LEU B 586 23.208 -0.242 -3.574 1.00 0.00 H new ATOM 0 HG LEU B 586 22.942 -2.224 -5.341 1.00 0.00 H new ATOM 0 HD11 LEU B 586 24.987 -2.446 -6.696 1.00 0.00 H new ATOM 0 HD12 LEU B 586 24.027 -1.026 -7.177 1.00 0.00 H new ATOM 0 HD13 LEU B 586 25.494 -0.817 -6.191 1.00 0.00 H new ATOM 0 HD21 LEU B 586 24.964 -3.237 -4.360 1.00 0.00 H new ATOM 0 HD22 LEU B 586 25.469 -1.639 -3.762 1.00 0.00 H new ATOM 0 HD23 LEU B 586 23.986 -2.395 -3.134 1.00 0.00 H new ATOM 1040 N GLU B 587 21.114 -1.421 -6.811 1.00 0.00 N ATOM 1041 CA GLU B 587 20.898 -2.032 -8.118 1.00 0.00 C ATOM 1042 C GLU B 587 19.846 -1.262 -8.911 1.00 0.00 C ATOM 1043 O GLU B 587 19.765 -1.382 -10.134 1.00 0.00 O ATOM 1044 CB GLU B 587 20.466 -3.491 -7.959 1.00 0.00 C ATOM 1045 CG GLU B 587 20.054 -4.150 -9.264 1.00 0.00 C ATOM 1046 CD GLU B 587 21.184 -4.201 -10.274 1.00 0.00 C ATOM 1047 OE1 GLU B 587 21.650 -3.123 -10.699 1.00 0.00 O ATOM 1048 OE2 GLU B 587 21.603 -5.320 -10.638 1.00 0.00 O ATOM 0 H GLU B 587 20.683 -1.922 -6.034 1.00 0.00 H new ATOM 0 HA GLU B 587 21.839 -1.997 -8.667 1.00 0.00 H new ATOM 0 HB2 GLU B 587 21.286 -4.058 -7.519 1.00 0.00 H new ATOM 0 HB3 GLU B 587 19.633 -3.540 -7.258 1.00 0.00 H new ATOM 0 HG2 GLU B 587 19.707 -5.163 -9.061 1.00 0.00 H new ATOM 0 HG3 GLU B 587 19.213 -3.605 -9.692 1.00 0.00 H new ATOM 1055 N ILE B 588 19.043 -0.472 -8.206 1.00 0.00 N ATOM 1056 CA ILE B 588 17.996 0.317 -8.844 1.00 0.00 C ATOM 1057 C ILE B 588 18.549 1.112 -10.022 1.00 0.00 C ATOM 1058 O ILE B 588 18.143 0.908 -11.167 1.00 0.00 O ATOM 1059 CB ILE B 588 17.338 1.289 -7.847 1.00 0.00 C ATOM 1060 CG1 ILE B 588 16.656 0.512 -6.719 1.00 0.00 C ATOM 1061 CG2 ILE B 588 16.336 2.183 -8.562 1.00 0.00 C ATOM 1062 CD1 ILE B 588 16.133 1.395 -5.608 1.00 0.00 C ATOM 0 H ILE B 588 19.097 -0.361 -7.193 1.00 0.00 H new ATOM 0 HA ILE B 588 17.245 -0.386 -9.203 1.00 0.00 H new ATOM 0 HB ILE B 588 18.113 1.920 -7.412 1.00 0.00 H new ATOM 0 HG12 ILE B 588 15.829 -0.064 -7.134 1.00 0.00 H new ATOM 0 HG13 ILE B 588 17.365 -0.203 -6.301 1.00 0.00 H new ATOM 0 HG21 ILE B 588 15.879 2.864 -7.844 1.00 0.00 H new ATOM 0 HG22 ILE B 588 16.848 2.758 -9.334 1.00 0.00 H new ATOM 0 HG23 ILE B 588 15.562 1.568 -9.021 1.00 0.00 H new ATOM 0 HD11 ILE B 588 15.662 0.777 -4.843 1.00 0.00 H new ATOM 0 HD12 ILE B 588 16.959 1.952 -5.167 1.00 0.00 H new ATOM 0 HD13 ILE B 588 15.400 2.093 -6.012 1.00 0.00 H new ATOM 1074 N ASP B 589 19.477 2.017 -9.735 1.00 0.00 N ATOM 1075 CA ASP B 589 20.088 2.842 -10.771 1.00 0.00 C ATOM 1076 C ASP B 589 21.039 3.867 -10.160 1.00 0.00 C ATOM 1077 O ASP B 589 20.662 4.619 -9.263 1.00 0.00 O ATOM 1078 CB ASP B 589 19.009 3.552 -11.590 1.00 0.00 C ATOM 1079 CG ASP B 589 18.896 3.004 -12.999 1.00 0.00 C ATOM 1080 OD1 ASP B 589 19.913 3.016 -13.722 1.00 0.00 O ATOM 1081 OD2 ASP B 589 17.790 2.565 -13.378 1.00 0.00 O ATOM 0 H ASP B 589 19.823 2.199 -8.793 1.00 0.00 H new ATOM 0 HA ASP B 589 20.661 2.189 -11.429 1.00 0.00 H new ATOM 0 HB2 ASP B 589 18.048 3.450 -11.086 1.00 0.00 H new ATOM 0 HB3 ASP B 589 19.234 4.618 -11.635 1.00 0.00 H new ATOM 1086 N ASN B 590 22.273 3.889 -10.653 1.00 0.00 N ATOM 1087 CA ASN B 590 23.278 4.821 -10.154 1.00 0.00 C ATOM 1088 C ASN B 590 22.870 6.263 -10.436 1.00 0.00 C ATOM 1089 O ASN B 590 23.232 7.178 -9.695 1.00 0.00 O ATOM 1090 CB ASN B 590 24.637 4.529 -10.794 1.00 0.00 C ATOM 1091 CG ASN B 590 25.171 3.160 -10.418 1.00 0.00 C ATOM 1092 OD1 ASN B 590 24.464 2.348 -9.821 1.00 0.00 O ATOM 1093 ND2 ASN B 590 26.426 2.899 -10.765 1.00 0.00 N ATOM 0 H ASN B 590 22.601 3.273 -11.397 1.00 0.00 H new ATOM 0 HA ASN B 590 23.356 4.689 -9.075 1.00 0.00 H new ATOM 0 HB2 ASN B 590 24.547 4.596 -11.878 1.00 0.00 H new ATOM 0 HB3 ASN B 590 25.352 5.292 -10.486 1.00 0.00 H new ATOM 0 HD21 ASN B 590 26.841 1.995 -10.537 1.00 0.00 H new ATOM 0 HD22 ASN B 590 26.975 3.602 -11.259 1.00 0.00 H new ATOM 1100 N SER B 591 22.114 6.459 -11.511 1.00 0.00 N ATOM 1101 CA SER B 591 21.659 7.791 -11.894 1.00 0.00 C ATOM 1102 C SER B 591 20.795 8.406 -10.797 1.00 0.00 C ATOM 1103 O SER B 591 21.016 9.543 -10.382 1.00 0.00 O ATOM 1104 CB SER B 591 20.871 7.727 -13.203 1.00 0.00 C ATOM 1105 OG SER B 591 20.258 8.972 -13.491 1.00 0.00 O ATOM 0 H SER B 591 21.803 5.712 -12.133 1.00 0.00 H new ATOM 0 HA SER B 591 22.537 8.421 -12.037 1.00 0.00 H new ATOM 0 HB2 SER B 591 21.538 7.449 -14.019 1.00 0.00 H new ATOM 0 HB3 SER B 591 20.109 6.950 -13.135 1.00 0.00 H new ATOM 0 HG SER B 591 19.762 8.905 -14.333 1.00 0.00 H new ATOM 1111 N GLU B 592 19.809 7.644 -10.332 1.00 0.00 N ATOM 1112 CA GLU B 592 18.911 8.114 -9.284 1.00 0.00 C ATOM 1113 C GLU B 592 19.593 8.064 -7.920 1.00 0.00 C ATOM 1114 O GLU B 592 19.499 9.005 -7.131 1.00 0.00 O ATOM 1115 CB GLU B 592 17.635 7.270 -9.259 1.00 0.00 C ATOM 1116 CG GLU B 592 16.872 7.280 -10.573 1.00 0.00 C ATOM 1117 CD GLU B 592 16.175 8.601 -10.833 1.00 0.00 C ATOM 1118 OE1 GLU B 592 15.674 9.209 -9.864 1.00 0.00 O ATOM 1119 OE2 GLU B 592 16.132 9.028 -12.006 1.00 0.00 O ATOM 0 H GLU B 592 19.613 6.700 -10.664 1.00 0.00 H new ATOM 0 HA GLU B 592 18.650 9.149 -9.503 1.00 0.00 H new ATOM 0 HB2 GLU B 592 17.895 6.242 -9.007 1.00 0.00 H new ATOM 0 HB3 GLU B 592 16.982 7.637 -8.467 1.00 0.00 H new ATOM 0 HG2 GLU B 592 17.562 7.070 -11.391 1.00 0.00 H new ATOM 0 HG3 GLU B 592 16.133 6.479 -10.566 1.00 0.00 H new ATOM 1126 N LEU B 593 20.279 6.959 -7.648 1.00 0.00 N ATOM 1127 CA LEU B 593 20.977 6.785 -6.379 1.00 0.00 C ATOM 1128 C LEU B 593 21.880 7.979 -6.086 1.00 0.00 C ATOM 1129 O LEU B 593 21.899 8.496 -4.968 1.00 0.00 O ATOM 1130 CB LEU B 593 21.805 5.499 -6.403 1.00 0.00 C ATOM 1131 CG LEU B 593 21.014 4.191 -6.433 1.00 0.00 C ATOM 1132 CD1 LEU B 593 21.825 3.091 -7.100 1.00 0.00 C ATOM 1133 CD2 LEU B 593 20.609 3.780 -5.025 1.00 0.00 C ATOM 0 H LEU B 593 20.367 6.170 -8.289 1.00 0.00 H new ATOM 0 HA LEU B 593 20.230 6.715 -5.588 1.00 0.00 H new ATOM 0 HB2 LEU B 593 22.456 5.526 -7.277 1.00 0.00 H new ATOM 0 HB3 LEU B 593 22.450 5.490 -5.525 1.00 0.00 H new ATOM 0 HG LEU B 593 20.108 4.350 -7.018 1.00 0.00 H new ATOM 0 HD11 LEU B 593 21.245 2.168 -7.112 1.00 0.00 H new ATOM 0 HD12 LEU B 593 22.063 3.383 -8.123 1.00 0.00 H new ATOM 0 HD13 LEU B 593 22.749 2.932 -6.544 1.00 0.00 H new ATOM 0 HD21 LEU B 593 20.047 2.847 -5.066 1.00 0.00 H new ATOM 0 HD22 LEU B 593 21.502 3.639 -4.416 1.00 0.00 H new ATOM 0 HD23 LEU B 593 19.988 4.559 -4.583 1.00 0.00 H new ATOM 1145 N LEU B 594 22.625 8.413 -7.097 1.00 0.00 N ATOM 1146 CA LEU B 594 23.528 9.549 -6.948 1.00 0.00 C ATOM 1147 C LEU B 594 22.811 10.737 -6.316 1.00 0.00 C ATOM 1148 O LEU B 594 23.416 11.527 -5.591 1.00 0.00 O ATOM 1149 CB LEU B 594 24.102 9.950 -8.308 1.00 0.00 C ATOM 1150 CG LEU B 594 25.612 9.780 -8.476 1.00 0.00 C ATOM 1151 CD1 LEU B 594 26.057 10.275 -9.844 1.00 0.00 C ATOM 1152 CD2 LEU B 594 26.358 10.515 -7.372 1.00 0.00 C ATOM 0 H LEU B 594 22.622 7.996 -8.028 1.00 0.00 H new ATOM 0 HA LEU B 594 24.343 9.249 -6.290 1.00 0.00 H new ATOM 0 HB2 LEU B 594 23.603 9.362 -9.078 1.00 0.00 H new ATOM 0 HB3 LEU B 594 23.852 10.995 -8.492 1.00 0.00 H new ATOM 0 HG LEU B 594 25.849 8.719 -8.402 1.00 0.00 H new ATOM 0 HD11 LEU B 594 27.135 10.146 -9.945 1.00 0.00 H new ATOM 0 HD12 LEU B 594 25.549 9.704 -10.621 1.00 0.00 H new ATOM 0 HD13 LEU B 594 25.807 11.331 -9.948 1.00 0.00 H new ATOM 0 HD21 LEU B 594 27.431 10.383 -7.508 1.00 0.00 H new ATOM 0 HD22 LEU B 594 26.115 11.577 -7.413 1.00 0.00 H new ATOM 0 HD23 LEU B 594 26.063 10.113 -6.403 1.00 0.00 H new ATOM 1164 N HIS B 595 21.516 10.856 -6.593 1.00 0.00 N ATOM 1165 CA HIS B 595 20.715 11.947 -6.049 1.00 0.00 C ATOM 1166 C HIS B 595 20.033 11.524 -4.751 1.00 0.00 C ATOM 1167 O HIS B 595 19.714 12.360 -3.907 1.00 0.00 O ATOM 1168 CB HIS B 595 19.666 12.394 -7.068 1.00 0.00 C ATOM 1169 CG HIS B 595 19.270 13.832 -6.928 1.00 0.00 C ATOM 1170 ND1 HIS B 595 18.016 14.303 -7.254 1.00 0.00 N ATOM 1171 CD2 HIS B 595 19.971 14.904 -6.491 1.00 0.00 C ATOM 1172 CE1 HIS B 595 17.963 15.603 -7.027 1.00 0.00 C ATOM 1173 NE2 HIS B 595 19.137 15.993 -6.563 1.00 0.00 N ATOM 0 H HIS B 595 20.999 10.211 -7.191 1.00 0.00 H new ATOM 0 HA HIS B 595 21.381 12.783 -5.834 1.00 0.00 H new ATOM 0 HB2 HIS B 595 20.054 12.229 -8.073 1.00 0.00 H new ATOM 0 HB3 HIS B 595 18.779 11.769 -6.962 1.00 0.00 H new ATOM 0 HD2 HIS B 595 20.996 14.903 -6.149 1.00 0.00 H new ATOM 0 HE1 HIS B 595 17.106 16.239 -7.192 1.00 0.00 H new ATOM 0 HE2 HIS B 595 19.384 16.947 -6.301 1.00 0.00 H new ATOM 1181 N MET B 596 19.813 10.222 -4.600 1.00 0.00 N ATOM 1182 CA MET B 596 19.170 9.690 -3.405 1.00 0.00 C ATOM 1183 C MET B 596 20.083 9.825 -2.190 1.00 0.00 C ATOM 1184 O MET B 596 19.615 9.877 -1.052 1.00 0.00 O ATOM 1185 CB MET B 596 18.793 8.222 -3.613 1.00 0.00 C ATOM 1186 CG MET B 596 17.684 8.018 -4.632 1.00 0.00 C ATOM 1187 SD MET B 596 17.488 6.290 -5.109 1.00 0.00 S ATOM 1188 CE MET B 596 17.565 5.487 -3.511 1.00 0.00 C ATOM 0 H MET B 596 20.071 9.517 -5.290 1.00 0.00 H new ATOM 0 HA MET B 596 18.264 10.268 -3.223 1.00 0.00 H new ATOM 0 HB2 MET B 596 19.677 7.671 -3.934 1.00 0.00 H new ATOM 0 HB3 MET B 596 18.481 7.797 -2.659 1.00 0.00 H new ATOM 0 HG2 MET B 596 16.745 8.386 -4.219 1.00 0.00 H new ATOM 0 HG3 MET B 596 17.897 8.614 -5.519 1.00 0.00 H new ATOM 0 HE1 MET B 596 17.266 4.444 -3.613 1.00 0.00 H new ATOM 0 HE2 MET B 596 18.584 5.537 -3.128 1.00 0.00 H new ATOM 0 HE3 MET B 596 16.892 5.991 -2.818 1.00 0.00 H new ATOM 1198 N LEU B 597 21.387 9.882 -2.439 1.00 0.00 N ATOM 1199 CA LEU B 597 22.366 10.011 -1.365 1.00 0.00 C ATOM 1200 C LEU B 597 21.969 11.122 -0.397 1.00 0.00 C ATOM 1201 O LEU B 597 22.002 10.938 0.819 1.00 0.00 O ATOM 1202 CB LEU B 597 23.753 10.295 -1.944 1.00 0.00 C ATOM 1203 CG LEU B 597 24.187 9.408 -3.111 1.00 0.00 C ATOM 1204 CD1 LEU B 597 25.649 9.653 -3.453 1.00 0.00 C ATOM 1205 CD2 LEU B 597 23.954 7.941 -2.781 1.00 0.00 C ATOM 0 H LEU B 597 21.791 9.841 -3.375 1.00 0.00 H new ATOM 0 HA LEU B 597 22.394 9.069 -0.817 1.00 0.00 H new ATOM 0 HB2 LEU B 597 23.782 11.334 -2.273 1.00 0.00 H new ATOM 0 HB3 LEU B 597 24.486 10.194 -1.144 1.00 0.00 H new ATOM 0 HG LEU B 597 23.583 9.665 -3.981 1.00 0.00 H new ATOM 0 HD11 LEU B 597 25.940 9.013 -4.286 1.00 0.00 H new ATOM 0 HD12 LEU B 597 25.787 10.697 -3.733 1.00 0.00 H new ATOM 0 HD13 LEU B 597 26.269 9.424 -2.586 1.00 0.00 H new ATOM 0 HD21 LEU B 597 24.269 7.324 -3.623 1.00 0.00 H new ATOM 0 HD22 LEU B 597 24.532 7.671 -1.897 1.00 0.00 H new ATOM 0 HD23 LEU B 597 22.894 7.776 -2.586 1.00 0.00 H new ATOM 1217 N GLU B 598 21.593 12.272 -0.947 1.00 0.00 N ATOM 1218 CA GLU B 598 21.189 13.411 -0.131 1.00 0.00 C ATOM 1219 C GLU B 598 19.670 13.564 -0.124 1.00 0.00 C ATOM 1220 O GLU B 598 19.146 14.652 0.115 1.00 0.00 O ATOM 1221 CB GLU B 598 21.839 14.695 -0.650 1.00 0.00 C ATOM 1222 CG GLU B 598 21.372 15.095 -2.040 1.00 0.00 C ATOM 1223 CD GLU B 598 21.749 16.521 -2.394 1.00 0.00 C ATOM 1224 OE1 GLU B 598 21.072 17.451 -1.907 1.00 0.00 O ATOM 1225 OE2 GLU B 598 22.719 16.707 -3.158 1.00 0.00 O ATOM 0 H GLU B 598 21.560 12.440 -1.953 1.00 0.00 H new ATOM 0 HA GLU B 598 21.524 13.230 0.890 1.00 0.00 H new ATOM 0 HB2 GLU B 598 21.624 15.507 0.044 1.00 0.00 H new ATOM 0 HB3 GLU B 598 22.921 14.565 -0.663 1.00 0.00 H new ATOM 0 HG2 GLU B 598 21.805 14.416 -2.774 1.00 0.00 H new ATOM 0 HG3 GLU B 598 20.290 14.983 -2.102 1.00 0.00 H new ATOM 1232 N SER B 599 18.970 12.466 -0.389 1.00 0.00 N ATOM 1233 CA SER B 599 17.512 12.478 -0.419 1.00 0.00 C ATOM 1234 C SER B 599 16.939 11.596 0.687 1.00 0.00 C ATOM 1235 O SER B 599 16.571 10.442 0.467 1.00 0.00 O ATOM 1236 CB SER B 599 17.004 12.002 -1.781 1.00 0.00 C ATOM 1237 OG SER B 599 15.689 12.468 -2.026 1.00 0.00 O ATOM 0 H SER B 599 19.389 11.557 -0.586 1.00 0.00 H new ATOM 0 HA SER B 599 17.178 13.502 -0.253 1.00 0.00 H new ATOM 0 HB2 SER B 599 17.671 12.358 -2.566 1.00 0.00 H new ATOM 0 HB3 SER B 599 17.020 10.913 -1.818 1.00 0.00 H new ATOM 0 HG SER B 599 15.388 12.152 -2.903 1.00 0.00 H new ATOM 1243 N PRO B 600 16.862 12.151 1.905 1.00 0.00 N ATOM 1244 CA PRO B 600 16.335 11.434 3.070 1.00 0.00 C ATOM 1245 C PRO B 600 14.831 11.199 2.975 1.00 0.00 C ATOM 1246 O PRO B 600 14.254 10.483 3.792 1.00 0.00 O ATOM 1247 CB PRO B 600 16.657 12.370 4.238 1.00 0.00 C ATOM 1248 CG PRO B 600 16.738 13.726 3.626 1.00 0.00 C ATOM 1249 CD PRO B 600 17.283 13.522 2.240 1.00 0.00 C ATOM 0 HA PRO B 600 16.772 10.440 3.169 1.00 0.00 H new ATOM 0 HB2 PRO B 600 15.883 12.327 5.004 1.00 0.00 H new ATOM 0 HB3 PRO B 600 17.596 12.096 4.718 1.00 0.00 H new ATOM 0 HG2 PRO B 600 15.757 14.199 3.594 1.00 0.00 H new ATOM 0 HG3 PRO B 600 17.388 14.379 4.209 1.00 0.00 H new ATOM 0 HD2 PRO B 600 16.877 14.250 1.538 1.00 0.00 H new ATOM 0 HD3 PRO B 600 18.368 13.626 2.216 1.00 0.00 H new ATOM 1257 N GLU B 601 14.205 11.806 1.972 1.00 0.00 N ATOM 1258 CA GLU B 601 12.767 11.662 1.771 1.00 0.00 C ATOM 1259 C GLU B 601 12.464 10.511 0.817 1.00 0.00 C ATOM 1260 O GLU B 601 11.303 10.214 0.535 1.00 0.00 O ATOM 1261 CB GLU B 601 12.173 12.962 1.225 1.00 0.00 C ATOM 1262 CG GLU B 601 12.488 13.206 -0.242 1.00 0.00 C ATOM 1263 CD GLU B 601 12.809 14.658 -0.536 1.00 0.00 C ATOM 1264 OE1 GLU B 601 11.885 15.496 -0.468 1.00 0.00 O ATOM 1265 OE2 GLU B 601 13.985 14.957 -0.834 1.00 0.00 O ATOM 0 H GLU B 601 14.670 12.401 1.287 1.00 0.00 H new ATOM 0 HA GLU B 601 12.311 11.441 2.736 1.00 0.00 H new ATOM 0 HB2 GLU B 601 11.091 12.941 1.357 1.00 0.00 H new ATOM 0 HB3 GLU B 601 12.550 13.799 1.813 1.00 0.00 H new ATOM 0 HG2 GLU B 601 13.333 12.584 -0.537 1.00 0.00 H new ATOM 0 HG3 GLU B 601 11.637 12.896 -0.849 1.00 0.00 H new ATOM 1272 N SER B 602 13.517 9.866 0.323 1.00 0.00 N ATOM 1273 CA SER B 602 13.364 8.750 -0.603 1.00 0.00 C ATOM 1274 C SER B 602 14.094 7.513 -0.088 1.00 0.00 C ATOM 1275 O SER B 602 13.542 6.412 -0.076 1.00 0.00 O ATOM 1276 CB SER B 602 13.896 9.131 -1.986 1.00 0.00 C ATOM 1277 OG SER B 602 13.405 8.251 -2.982 1.00 0.00 O ATOM 0 H SER B 602 14.484 10.097 0.549 1.00 0.00 H new ATOM 0 HA SER B 602 12.302 8.518 -0.681 1.00 0.00 H new ATOM 0 HB2 SER B 602 13.602 10.154 -2.223 1.00 0.00 H new ATOM 0 HB3 SER B 602 14.986 9.106 -1.979 1.00 0.00 H new ATOM 0 HG SER B 602 13.758 8.517 -3.857 1.00 0.00 H new ATOM 1283 N LEU B 603 15.338 7.703 0.338 1.00 0.00 N ATOM 1284 CA LEU B 603 16.145 6.603 0.855 1.00 0.00 C ATOM 1285 C LEU B 603 15.379 5.815 1.913 1.00 0.00 C ATOM 1286 O LEU B 603 15.344 4.585 1.881 1.00 0.00 O ATOM 1287 CB LEU B 603 17.451 7.137 1.447 1.00 0.00 C ATOM 1288 CG LEU B 603 18.348 6.107 2.133 1.00 0.00 C ATOM 1289 CD1 LEU B 603 18.728 5.000 1.161 1.00 0.00 C ATOM 1290 CD2 LEU B 603 19.594 6.775 2.696 1.00 0.00 C ATOM 0 H LEU B 603 15.809 8.607 0.336 1.00 0.00 H new ATOM 0 HA LEU B 603 16.375 5.934 0.026 1.00 0.00 H new ATOM 0 HB2 LEU B 603 18.021 7.611 0.648 1.00 0.00 H new ATOM 0 HB3 LEU B 603 17.207 7.915 2.170 1.00 0.00 H new ATOM 0 HG LEU B 603 17.793 5.663 2.960 1.00 0.00 H new ATOM 0 HD11 LEU B 603 19.367 4.276 1.666 1.00 0.00 H new ATOM 0 HD12 LEU B 603 17.826 4.502 0.805 1.00 0.00 H new ATOM 0 HD13 LEU B 603 19.264 5.428 0.314 1.00 0.00 H new ATOM 0 HD21 LEU B 603 20.221 6.026 3.181 1.00 0.00 H new ATOM 0 HD22 LEU B 603 20.152 7.246 1.886 1.00 0.00 H new ATOM 0 HD23 LEU B 603 19.303 7.532 3.425 1.00 0.00 H new ATOM 1302 N ARG B 604 14.764 6.533 2.848 1.00 0.00 N ATOM 1303 CA ARG B 604 13.997 5.901 3.914 1.00 0.00 C ATOM 1304 C ARG B 604 12.933 4.970 3.341 1.00 0.00 C ATOM 1305 O ARG B 604 12.907 3.777 3.646 1.00 0.00 O ATOM 1306 CB ARG B 604 13.338 6.963 4.796 1.00 0.00 C ATOM 1307 CG ARG B 604 14.324 7.742 5.651 1.00 0.00 C ATOM 1308 CD ARG B 604 13.927 7.720 7.119 1.00 0.00 C ATOM 1309 NE ARG B 604 14.497 8.844 7.857 1.00 0.00 N ATOM 1310 CZ ARG B 604 14.548 8.902 9.183 1.00 0.00 C ATOM 1311 NH1 ARG B 604 14.067 7.905 9.913 1.00 0.00 N ATOM 1312 NH2 ARG B 604 15.083 9.959 9.782 1.00 0.00 N ATOM 0 H ARG B 604 14.782 7.552 2.888 1.00 0.00 H new ATOM 0 HA ARG B 604 14.684 5.310 4.520 1.00 0.00 H new ATOM 0 HB2 ARG B 604 12.790 7.660 4.162 1.00 0.00 H new ATOM 0 HB3 ARG B 604 12.608 6.481 5.446 1.00 0.00 H new ATOM 0 HG2 ARG B 604 15.321 7.318 5.536 1.00 0.00 H new ATOM 0 HG3 ARG B 604 14.374 8.773 5.302 1.00 0.00 H new ATOM 0 HD2 ARG B 604 12.840 7.746 7.201 1.00 0.00 H new ATOM 0 HD3 ARG B 604 14.258 6.785 7.570 1.00 0.00 H new ATOM 0 HE ARG B 604 14.877 9.627 7.325 1.00 0.00 H new ATOM 0 HH11 ARG B 604 13.656 7.091 9.456 1.00 0.00 H new ATOM 0 HH12 ARG B 604 14.108 7.953 10.931 1.00 0.00 H new ATOM 0 HH21 ARG B 604 15.455 10.727 9.224 1.00 0.00 H new ATOM 0 HH22 ARG B 604 15.122 10.003 10.800 1.00 0.00 H new ATOM 1326 N SER B 605 12.056 5.523 2.509 1.00 0.00 N ATOM 1327 CA SER B 605 10.987 4.743 1.896 1.00 0.00 C ATOM 1328 C SER B 605 11.538 3.468 1.263 1.00 0.00 C ATOM 1329 O SER B 605 10.980 2.385 1.434 1.00 0.00 O ATOM 1330 CB SER B 605 10.260 5.577 0.839 1.00 0.00 C ATOM 1331 OG SER B 605 8.881 5.256 0.796 1.00 0.00 O ATOM 0 H SER B 605 12.065 6.508 2.244 1.00 0.00 H new ATOM 0 HA SER B 605 10.281 4.464 2.678 1.00 0.00 H new ATOM 0 HB2 SER B 605 10.383 6.637 1.060 1.00 0.00 H new ATOM 0 HB3 SER B 605 10.708 5.401 -0.139 1.00 0.00 H new ATOM 0 HG SER B 605 8.439 5.804 0.114 1.00 0.00 H new ATOM 1337 N LYS B 606 12.639 3.607 0.532 1.00 0.00 N ATOM 1338 CA LYS B 606 13.269 2.468 -0.126 1.00 0.00 C ATOM 1339 C LYS B 606 13.615 1.379 0.884 1.00 0.00 C ATOM 1340 O LYS B 606 13.200 0.229 0.739 1.00 0.00 O ATOM 1341 CB LYS B 606 14.533 2.915 -0.864 1.00 0.00 C ATOM 1342 CG LYS B 606 14.590 2.448 -2.309 1.00 0.00 C ATOM 1343 CD LYS B 606 13.462 3.044 -3.133 1.00 0.00 C ATOM 1344 CE LYS B 606 13.959 4.168 -4.029 1.00 0.00 C ATOM 1345 NZ LYS B 606 13.695 5.508 -3.437 1.00 0.00 N ATOM 0 H LYS B 606 13.114 4.497 0.380 1.00 0.00 H new ATOM 0 HA LYS B 606 12.561 2.058 -0.846 1.00 0.00 H new ATOM 0 HB2 LYS B 606 14.592 4.003 -0.840 1.00 0.00 H new ATOM 0 HB3 LYS B 606 15.407 2.536 -0.334 1.00 0.00 H new ATOM 0 HG2 LYS B 606 15.548 2.729 -2.746 1.00 0.00 H new ATOM 0 HG3 LYS B 606 14.531 1.360 -2.343 1.00 0.00 H new ATOM 0 HD2 LYS B 606 13.006 2.265 -3.744 1.00 0.00 H new ATOM 0 HD3 LYS B 606 12.686 3.423 -2.468 1.00 0.00 H new ATOM 0 HE2 LYS B 606 15.029 4.051 -4.199 1.00 0.00 H new ATOM 0 HE3 LYS B 606 13.472 4.099 -5.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 13.907 6.246 -4.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 12.695 5.573 -3.158 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 14.298 5.643 -2.600 1.00 0.00 H new ATOM 1359 N VAL B 607 14.377 1.749 1.908 1.00 0.00 N ATOM 1360 CA VAL B 607 14.777 0.804 2.944 1.00 0.00 C ATOM 1361 C VAL B 607 13.567 0.086 3.530 1.00 0.00 C ATOM 1362 O VAL B 607 13.502 -1.144 3.531 1.00 0.00 O ATOM 1363 CB VAL B 607 15.542 1.508 4.081 1.00 0.00 C ATOM 1364 CG1 VAL B 607 15.951 0.506 5.150 1.00 0.00 C ATOM 1365 CG2 VAL B 607 16.757 2.240 3.531 1.00 0.00 C ATOM 0 H VAL B 607 14.730 2.697 2.043 1.00 0.00 H new ATOM 0 HA VAL B 607 15.434 0.075 2.470 1.00 0.00 H new ATOM 0 HB VAL B 607 14.881 2.243 4.540 1.00 0.00 H new ATOM 0 HG11 VAL B 607 16.490 1.022 5.945 1.00 0.00 H new ATOM 0 HG12 VAL B 607 15.061 0.032 5.564 1.00 0.00 H new ATOM 0 HG13 VAL B 607 16.595 -0.254 4.709 1.00 0.00 H new ATOM 0 HG21 VAL B 607 17.286 2.732 4.347 1.00 0.00 H new ATOM 0 HG22 VAL B 607 17.423 1.526 3.045 1.00 0.00 H new ATOM 0 HG23 VAL B 607 16.434 2.987 2.806 1.00 0.00 H new ATOM 1375 N ASP B 608 12.609 0.861 4.027 1.00 0.00 N ATOM 1376 CA ASP B 608 11.398 0.299 4.614 1.00 0.00 C ATOM 1377 C ASP B 608 10.688 -0.618 3.623 1.00 0.00 C ATOM 1378 O ASP B 608 10.217 -1.694 3.988 1.00 0.00 O ATOM 1379 CB ASP B 608 10.455 1.418 5.059 1.00 0.00 C ATOM 1380 CG ASP B 608 9.359 0.920 5.980 1.00 0.00 C ATOM 1381 OD1 ASP B 608 9.671 0.571 7.138 1.00 0.00 O ATOM 1382 OD2 ASP B 608 8.190 0.877 5.544 1.00 0.00 O ATOM 0 H ASP B 608 12.648 1.880 4.035 1.00 0.00 H new ATOM 0 HA ASP B 608 11.686 -0.291 5.484 1.00 0.00 H new ATOM 0 HB2 ASP B 608 11.029 2.192 5.568 1.00 0.00 H new ATOM 0 HB3 ASP B 608 10.005 1.881 4.181 1.00 0.00 H new ATOM 1387 N GLU B 609 10.615 -0.182 2.369 1.00 0.00 N ATOM 1388 CA GLU B 609 9.961 -0.964 1.327 1.00 0.00 C ATOM 1389 C GLU B 609 10.566 -2.362 1.234 1.00 0.00 C ATOM 1390 O GLU B 609 9.847 -3.358 1.176 1.00 0.00 O ATOM 1391 CB GLU B 609 10.078 -0.254 -0.023 1.00 0.00 C ATOM 1392 CG GLU B 609 9.094 0.890 -0.197 1.00 0.00 C ATOM 1393 CD GLU B 609 7.748 0.427 -0.719 1.00 0.00 C ATOM 1394 OE1 GLU B 609 7.656 0.110 -1.924 1.00 0.00 O ATOM 1395 OE2 GLU B 609 6.786 0.383 0.076 1.00 0.00 O ATOM 0 H GLU B 609 11.000 0.707 2.051 1.00 0.00 H new ATOM 0 HA GLU B 609 8.907 -1.061 1.588 1.00 0.00 H new ATOM 0 HB2 GLU B 609 11.092 0.130 -0.135 1.00 0.00 H new ATOM 0 HB3 GLU B 609 9.922 -0.980 -0.821 1.00 0.00 H new ATOM 0 HG2 GLU B 609 8.955 1.393 0.760 1.00 0.00 H new ATOM 0 HG3 GLU B 609 9.514 1.624 -0.885 1.00 0.00 H new ATOM 1402 N ALA B 610 11.893 -2.425 1.219 1.00 0.00 N ATOM 1403 CA ALA B 610 12.596 -3.699 1.135 1.00 0.00 C ATOM 1404 C ALA B 610 12.324 -4.559 2.364 1.00 0.00 C ATOM 1405 O ALA B 610 11.809 -5.672 2.255 1.00 0.00 O ATOM 1406 CB ALA B 610 14.091 -3.468 0.970 1.00 0.00 C ATOM 0 H ALA B 610 12.503 -1.609 1.264 1.00 0.00 H new ATOM 0 HA ALA B 610 12.224 -4.233 0.261 1.00 0.00 H new ATOM 0 HB1 ALA B 610 14.603 -4.428 0.909 1.00 0.00 H new ATOM 0 HB2 ALA B 610 14.273 -2.901 0.057 1.00 0.00 H new ATOM 0 HB3 ALA B 610 14.469 -2.909 1.826 1.00 0.00 H new ATOM 1412 N VAL B 611 12.675 -4.036 3.535 1.00 0.00 N ATOM 1413 CA VAL B 611 12.468 -4.756 4.786 1.00 0.00 C ATOM 1414 C VAL B 611 11.033 -5.257 4.902 1.00 0.00 C ATOM 1415 O VAL B 611 10.785 -6.350 5.408 1.00 0.00 O ATOM 1416 CB VAL B 611 12.791 -3.870 6.004 1.00 0.00 C ATOM 1417 CG1 VAL B 611 12.495 -4.611 7.298 1.00 0.00 C ATOM 1418 CG2 VAL B 611 14.242 -3.414 5.961 1.00 0.00 C ATOM 0 H VAL B 611 13.104 -3.117 3.643 1.00 0.00 H new ATOM 0 HA VAL B 611 13.147 -5.609 4.776 1.00 0.00 H new ATOM 0 HB VAL B 611 12.155 -2.986 5.967 1.00 0.00 H new ATOM 0 HG11 VAL B 611 12.730 -3.969 8.147 1.00 0.00 H new ATOM 0 HG12 VAL B 611 11.440 -4.882 7.329 1.00 0.00 H new ATOM 0 HG13 VAL B 611 13.103 -5.514 7.347 1.00 0.00 H new ATOM 0 HG21 VAL B 611 14.453 -2.789 6.829 1.00 0.00 H new ATOM 0 HG22 VAL B 611 14.898 -4.285 5.973 1.00 0.00 H new ATOM 0 HG23 VAL B 611 14.416 -2.841 5.050 1.00 0.00 H new ATOM 1428 N ALA B 612 10.090 -4.448 4.428 1.00 0.00 N ATOM 1429 CA ALA B 612 8.679 -4.810 4.476 1.00 0.00 C ATOM 1430 C ALA B 612 8.340 -5.841 3.405 1.00 0.00 C ATOM 1431 O ALA B 612 7.497 -6.714 3.614 1.00 0.00 O ATOM 1432 CB ALA B 612 7.811 -3.571 4.312 1.00 0.00 C ATOM 0 H ALA B 612 10.278 -3.538 4.007 1.00 0.00 H new ATOM 0 HA ALA B 612 8.477 -5.256 5.450 1.00 0.00 H new ATOM 0 HB1 ALA B 612 6.760 -3.856 4.350 1.00 0.00 H new ATOM 0 HB2 ALA B 612 8.025 -2.867 5.116 1.00 0.00 H new ATOM 0 HB3 ALA B 612 8.025 -3.101 3.352 1.00 0.00 H new ATOM 1438 N VAL B 613 9.002 -5.736 2.257 1.00 0.00 N ATOM 1439 CA VAL B 613 8.771 -6.660 1.154 1.00 0.00 C ATOM 1440 C VAL B 613 8.949 -8.106 1.602 1.00 0.00 C ATOM 1441 O VAL B 613 8.366 -9.023 1.022 1.00 0.00 O ATOM 1442 CB VAL B 613 9.724 -6.378 -0.023 1.00 0.00 C ATOM 1443 CG1 VAL B 613 10.871 -7.378 -0.033 1.00 0.00 C ATOM 1444 CG2 VAL B 613 8.966 -6.410 -1.342 1.00 0.00 C ATOM 0 H VAL B 613 9.703 -5.020 2.067 1.00 0.00 H new ATOM 0 HA VAL B 613 7.743 -6.509 0.824 1.00 0.00 H new ATOM 0 HB VAL B 613 10.145 -5.380 0.104 1.00 0.00 H new ATOM 0 HG11 VAL B 613 11.534 -7.163 -0.871 1.00 0.00 H new ATOM 0 HG12 VAL B 613 11.429 -7.301 0.900 1.00 0.00 H new ATOM 0 HG13 VAL B 613 10.473 -8.387 -0.135 1.00 0.00 H new ATOM 0 HG21 VAL B 613 9.655 -6.209 -2.162 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.516 -7.393 -1.479 1.00 0.00 H new ATOM 0 HG23 VAL B 613 8.184 -5.651 -1.331 1.00 0.00 H new ATOM 1454 N LEU B 614 9.756 -8.304 2.638 1.00 0.00 N ATOM 1455 CA LEU B 614 10.010 -9.640 3.166 1.00 0.00 C ATOM 1456 C LEU B 614 8.812 -10.149 3.960 1.00 0.00 C ATOM 1457 O LEU B 614 8.286 -11.227 3.685 1.00 0.00 O ATOM 1458 CB LEU B 614 11.257 -9.631 4.052 1.00 0.00 C ATOM 1459 CG LEU B 614 11.546 -10.923 4.816 1.00 0.00 C ATOM 1460 CD1 LEU B 614 10.792 -10.943 6.136 1.00 0.00 C ATOM 1461 CD2 LEU B 614 11.181 -12.135 3.972 1.00 0.00 C ATOM 0 H LEU B 614 10.246 -7.556 3.129 1.00 0.00 H new ATOM 0 HA LEU B 614 10.175 -10.311 2.323 1.00 0.00 H new ATOM 0 HB2 LEU B 614 12.120 -9.401 3.428 1.00 0.00 H new ATOM 0 HB3 LEU B 614 11.160 -8.820 4.773 1.00 0.00 H new ATOM 0 HG LEU B 614 12.614 -10.964 5.031 1.00 0.00 H new ATOM 0 HD11 LEU B 614 11.010 -11.870 6.666 1.00 0.00 H new ATOM 0 HD12 LEU B 614 11.103 -10.095 6.746 1.00 0.00 H new ATOM 0 HD13 LEU B 614 9.721 -10.878 5.944 1.00 0.00 H new ATOM 0 HD21 LEU B 614 11.393 -13.046 4.532 1.00 0.00 H new ATOM 0 HD22 LEU B 614 10.120 -12.100 3.725 1.00 0.00 H new ATOM 0 HD23 LEU B 614 11.768 -12.129 3.053 1.00 0.00 H new ATOM 1473 N GLN B 615 8.384 -9.364 4.944 1.00 0.00 N ATOM 1474 CA GLN B 615 7.246 -9.736 5.776 1.00 0.00 C ATOM 1475 C GLN B 615 6.015 -10.020 4.921 1.00 0.00 C ATOM 1476 O GLN B 615 5.131 -10.776 5.321 1.00 0.00 O ATOM 1477 CB GLN B 615 6.938 -8.624 6.781 1.00 0.00 C ATOM 1478 CG GLN B 615 8.164 -8.120 7.526 1.00 0.00 C ATOM 1479 CD GLN B 615 7.844 -7.667 8.936 1.00 0.00 C ATOM 1480 OE1 GLN B 615 6.717 -7.819 9.410 1.00 0.00 O ATOM 1481 NE2 GLN B 615 8.837 -7.106 9.618 1.00 0.00 N ATOM 0 H GLN B 615 8.808 -8.468 5.184 1.00 0.00 H new ATOM 0 HA GLN B 615 7.506 -10.645 6.318 1.00 0.00 H new ATOM 0 HB2 GLN B 615 6.474 -7.789 6.256 1.00 0.00 H new ATOM 0 HB3 GLN B 615 6.209 -8.991 7.504 1.00 0.00 H new ATOM 0 HG2 GLN B 615 8.912 -8.912 7.564 1.00 0.00 H new ATOM 0 HG3 GLN B 615 8.605 -7.291 6.973 1.00 0.00 H new ATOM 0 HE21 GLN B 615 9.755 -7.000 9.187 1.00 0.00 H new ATOM 0 HE22 GLN B 615 8.681 -6.782 10.572 1.00 0.00 H new ATOM 1490 N ALA B 616 5.966 -9.408 3.742 1.00 0.00 N ATOM 1491 CA ALA B 616 4.845 -9.596 2.830 1.00 0.00 C ATOM 1492 C ALA B 616 4.942 -10.938 2.111 1.00 0.00 C ATOM 1493 O ALA B 616 3.929 -11.515 1.714 1.00 0.00 O ATOM 1494 CB ALA B 616 4.787 -8.458 1.823 1.00 0.00 C ATOM 0 H ALA B 616 6.690 -8.778 3.396 1.00 0.00 H new ATOM 0 HA ALA B 616 3.926 -9.593 3.417 1.00 0.00 H new ATOM 0 HB1 ALA B 616 3.945 -8.612 1.148 1.00 0.00 H new ATOM 0 HB2 ALA B 616 4.662 -7.512 2.350 1.00 0.00 H new ATOM 0 HB3 ALA B 616 5.713 -8.433 1.248 1.00 0.00 H new ATOM 1500 N HIS B 617 6.166 -11.428 1.946 1.00 0.00 N ATOM 1501 CA HIS B 617 6.395 -12.703 1.274 1.00 0.00 C ATOM 1502 C HIS B 617 6.183 -13.869 2.234 1.00 0.00 C ATOM 1503 O HIS B 617 5.866 -13.669 3.406 1.00 0.00 O ATOM 1504 CB HIS B 617 7.810 -12.752 0.697 1.00 0.00 C ATOM 1505 CG HIS B 617 7.900 -13.484 -0.607 1.00 0.00 C ATOM 1506 ND1 HIS B 617 8.522 -14.707 -0.742 1.00 0.00 N ATOM 1507 CD2 HIS B 617 7.440 -13.159 -1.838 1.00 0.00 C ATOM 1508 CE1 HIS B 617 8.443 -15.102 -2.000 1.00 0.00 C ATOM 1509 NE2 HIS B 617 7.790 -14.181 -2.686 1.00 0.00 N ATOM 0 H HIS B 617 7.015 -10.962 2.268 1.00 0.00 H new ATOM 0 HA HIS B 617 5.676 -12.791 0.460 1.00 0.00 H new ATOM 0 HB2 HIS B 617 8.172 -11.733 0.558 1.00 0.00 H new ATOM 0 HB3 HIS B 617 8.472 -13.230 1.419 1.00 0.00 H new ATOM 0 HD2 HIS B 617 6.899 -12.263 -2.104 1.00 0.00 H new ATOM 0 HE1 HIS B 617 8.844 -16.022 -2.400 1.00 0.00 H new ATOM 0 HE2 HIS B 617 7.580 -14.222 -3.683 1.00 0.00 H new ATOM 1517 N GLN B 618 6.361 -15.085 1.728 1.00 0.00 N ATOM 1518 CA GLN B 618 6.187 -16.283 2.542 1.00 0.00 C ATOM 1519 C GLN B 618 7.022 -17.437 1.996 1.00 0.00 C ATOM 1520 O GLN B 618 7.931 -17.928 2.665 1.00 0.00 O ATOM 1521 CB GLN B 618 4.712 -16.684 2.590 1.00 0.00 C ATOM 1522 CG GLN B 618 4.437 -17.887 3.477 1.00 0.00 C ATOM 1523 CD GLN B 618 3.161 -18.612 3.098 1.00 0.00 C ATOM 1524 OE1 GLN B 618 2.984 -19.022 1.950 1.00 0.00 O ATOM 1525 NE2 GLN B 618 2.263 -18.775 4.062 1.00 0.00 N ATOM 0 H GLN B 618 6.625 -15.267 0.760 1.00 0.00 H new ATOM 0 HA GLN B 618 6.527 -16.057 3.553 1.00 0.00 H new ATOM 0 HB2 GLN B 618 4.126 -15.838 2.948 1.00 0.00 H new ATOM 0 HB3 GLN B 618 4.371 -16.903 1.578 1.00 0.00 H new ATOM 0 HG2 GLN B 618 5.276 -18.580 3.414 1.00 0.00 H new ATOM 0 HG3 GLN B 618 4.370 -17.561 4.515 1.00 0.00 H new ATOM 0 HE21 GLN B 618 2.451 -18.419 4.999 1.00 0.00 H new ATOM 0 HE22 GLN B 618 1.385 -19.256 3.865 1.00 0.00 H new ATOM 1534 N ALA B 619 6.707 -17.864 0.778 1.00 0.00 N ATOM 1535 CA ALA B 619 7.429 -18.959 0.142 1.00 0.00 C ATOM 1536 C ALA B 619 7.066 -19.072 -1.334 1.00 0.00 C ATOM 1537 O ALA B 619 6.097 -18.468 -1.794 1.00 0.00 O ATOM 1538 CB ALA B 619 7.141 -20.269 0.861 1.00 0.00 C ATOM 0 H ALA B 619 5.957 -17.468 0.212 1.00 0.00 H new ATOM 0 HA ALA B 619 8.496 -18.747 0.211 1.00 0.00 H new ATOM 0 HB1 ALA B 619 7.687 -21.078 0.375 1.00 0.00 H new ATOM 0 HB2 ALA B 619 7.458 -20.191 1.901 1.00 0.00 H new ATOM 0 HB3 ALA B 619 6.072 -20.478 0.822 1.00 0.00 H new ATOM 1544 N LYS B 620 7.850 -19.850 -2.074 1.00 0.00 N ATOM 1545 CA LYS B 620 7.611 -20.043 -3.499 1.00 0.00 C ATOM 1546 C LYS B 620 7.047 -21.433 -3.773 1.00 0.00 C ATOM 1547 O LYS B 620 6.366 -21.650 -4.775 1.00 0.00 O ATOM 1548 CB LYS B 620 8.909 -19.844 -4.286 1.00 0.00 C ATOM 1549 CG LYS B 620 9.935 -20.939 -4.053 1.00 0.00 C ATOM 1550 CD LYS B 620 11.342 -20.462 -4.373 1.00 0.00 C ATOM 1551 CE LYS B 620 11.524 -20.224 -5.864 1.00 0.00 C ATOM 1552 NZ LYS B 620 12.846 -19.609 -6.170 1.00 0.00 N ATOM 0 H LYS B 620 8.657 -20.357 -1.710 1.00 0.00 H new ATOM 0 HA LYS B 620 6.879 -19.303 -3.823 1.00 0.00 H new ATOM 0 HB2 LYS B 620 8.676 -19.797 -5.350 1.00 0.00 H new ATOM 0 HB3 LYS B 620 9.346 -18.884 -4.013 1.00 0.00 H new ATOM 0 HG2 LYS B 620 9.889 -21.267 -3.015 1.00 0.00 H new ATOM 0 HG3 LYS B 620 9.693 -21.803 -4.672 1.00 0.00 H new ATOM 0 HD2 LYS B 620 11.547 -19.540 -3.829 1.00 0.00 H new ATOM 0 HD3 LYS B 620 12.065 -21.202 -4.031 1.00 0.00 H new ATOM 0 HE2 LYS B 620 11.432 -21.170 -6.397 1.00 0.00 H new ATOM 0 HE3 LYS B 620 10.728 -19.574 -6.228 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 12.932 -19.463 -7.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 12.924 -18.694 -5.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 13.606 -20.241 -5.846 1.00 0.00 H new ATOM 1566 N GLU B 621 7.332 -22.371 -2.874 1.00 0.00 N ATOM 1567 CA GLU B 621 6.852 -23.740 -3.020 1.00 0.00 C ATOM 1568 C GLU B 621 5.329 -23.774 -3.113 1.00 0.00 C ATOM 1569 O GLU B 621 4.636 -23.048 -2.401 1.00 0.00 O ATOM 1570 CB GLU B 621 7.321 -24.597 -1.843 1.00 0.00 C ATOM 1571 CG GLU B 621 8.833 -24.715 -1.741 1.00 0.00 C ATOM 1572 CD GLU B 621 9.270 -25.902 -0.905 1.00 0.00 C ATOM 1573 OE1 GLU B 621 8.389 -26.646 -0.426 1.00 0.00 O ATOM 1574 OE2 GLU B 621 10.492 -26.088 -0.731 1.00 0.00 O ATOM 0 H GLU B 621 7.893 -22.207 -2.038 1.00 0.00 H new ATOM 0 HA GLU B 621 7.265 -24.147 -3.943 1.00 0.00 H new ATOM 0 HB2 GLU B 621 6.935 -24.171 -0.917 1.00 0.00 H new ATOM 0 HB3 GLU B 621 6.893 -25.595 -1.937 1.00 0.00 H new ATOM 0 HG2 GLU B 621 9.255 -24.805 -2.742 1.00 0.00 H new ATOM 0 HG3 GLU B 621 9.237 -23.801 -1.306 1.00 0.00 H new ATOM 1581 N ALA B 622 4.815 -24.624 -3.996 1.00 0.00 N ATOM 1582 CA ALA B 622 3.376 -24.755 -4.182 1.00 0.00 C ATOM 1583 C ALA B 622 2.747 -25.560 -3.050 1.00 0.00 C ATOM 1584 O ALA B 622 2.066 -25.007 -2.186 1.00 0.00 O ATOM 1585 CB ALA B 622 3.074 -25.405 -5.524 1.00 0.00 C ATOM 0 H ALA B 622 5.375 -25.232 -4.594 1.00 0.00 H new ATOM 0 HA ALA B 622 2.941 -23.756 -4.168 1.00 0.00 H new ATOM 0 HB1 ALA B 622 1.995 -25.497 -5.649 1.00 0.00 H new ATOM 0 HB2 ALA B 622 3.482 -24.790 -6.326 1.00 0.00 H new ATOM 0 HB3 ALA B 622 3.529 -26.395 -5.559 1.00 0.00 H new ATOM 1591 N ALA B 623 2.979 -26.869 -3.060 1.00 0.00 N ATOM 1592 CA ALA B 623 2.437 -27.749 -2.033 1.00 0.00 C ATOM 1593 C ALA B 623 3.518 -28.169 -1.043 1.00 0.00 C ATOM 1594 O ALA B 623 4.699 -28.233 -1.388 1.00 0.00 O ATOM 1595 CB ALA B 623 1.798 -28.974 -2.671 1.00 0.00 C ATOM 0 H ALA B 623 3.539 -27.343 -3.769 1.00 0.00 H new ATOM 0 HA ALA B 623 1.673 -27.198 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA B 623 1.397 -29.623 -1.892 1.00 0.00 H new ATOM 0 HB2 ALA B 623 0.991 -28.660 -3.333 1.00 0.00 H new ATOM 0 HB3 ALA B 623 2.548 -29.518 -3.246 1.00 0.00 H new TER 1601 ALA B 623