USER MOD reduce.3.24.130724 H: found=0, std=0, add=1158, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1152 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 22 GLN : amide:sc= 1.02 K(o=2.2,f=-1.1) USER MOD Set 1.2: A 150 GLN :FLIP amide:sc= 1.14 F(o=0.67,f=2.2) USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.976 K(o=0.98,f=-3.8!) USER MOD Set 2.2: A 137 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 87 THR OG1 : rot -46:sc= 0.836 USER MOD Set 3.2: A 124 THR OG1 : rot 104:sc= 0.618 USER MOD Set 4.1: A 16 LYS NZ :NH3+ -178:sc= 1.42 (180deg=0.895) USER MOD Set 4.2: A 58 THR OG1 : rot 170:sc= 0.368 USER MOD Set 5.1: A 25 GLN : amide:sc= 0.00588 K(o=-0.11,f=-0.83) USER MOD Set 5.2: A 27 HIS : no HE2:sc= -0.12 X(o=-0.11,f=-0.56) USER MOD Single : A 1 MET CE :methyl -167:sc=-0.00423 (180deg=-0.2) USER MOD Single : A 1 MET N :NH3+ 176:sc= -0.399 (180deg=-0.417) USER MOD Single : A 2 THR OG1 : rot 174:sc= 0.817 USER MOD Single : A 4 TYR OH : rot 178:sc= 1.72 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 7:sc= 1 USER MOD Single : A 20 THR OG1 : rot -24:sc= 0.953 USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 117:sc= 0.965 USER MOD Single : A 42 LYS NZ :NH3+ -177:sc= 0.882 (180deg=0.874) USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot -21:sc= 0.463 USER MOD Single : A 70 GLN : amide:sc= 0.713 K(o=0.71,f=-0.64) USER MOD Single : A 71 TYR OH : rot 30:sc= -0.0976 USER MOD Single : A 72 MET CE :methyl -155:sc= -3.01 (180deg=-4.25!) USER MOD Single : A 74 THR OG1 : rot 86:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -2.3! C(o=-2.3!,f=-7.2!) USER MOD Single : A 86 ASN : amide:sc= -0.284 K(o=-0.28,f=-1.3) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot -85:sc= 1.12 USER MOD Single : A 95 GLN :FLIP amide:sc= -0.0648 F(o=-2.4!,f=-0.065) USER MOD Single : A 96 TYR OH : rot 150:sc= 0 USER MOD Single : A 99 GLN :FLIP amide:sc= -0.0172 F(o=-2!,f=-0.017) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 174:sc= -0.265 (180deg=-0.289) USER MOD Single : A 106 SER OG : rot 180:sc= -0.0141 USER MOD Single : A 111 MET CE :methyl -178:sc= -0.165 (180deg=-0.171) USER MOD Single : A 116 ASN : amide:sc= -0.8! C(o=-0.8!,f=-11!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 CYS SG : rot 92:sc= -0.511 USER MOD Single : A 127 SER OG : rot -107:sc= 1.02 USER MOD Single : A 129 GLN :FLIP amide:sc= -0.0879 F(o=-2!,f=-0.088) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot -49:sc= 1.26 USER MOD Single : A 141 TYR OH : rot 165:sc= 0 USER MOD Single : A 144 THR OG1 : rot 26:sc= 1.3 USER MOD Single : A 145 SER OG : rot 162:sc= 0.862 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 122:sc= 0.904 USER MOD Single : A 158 THR OG1 : rot 81:sc= 0.723 USER MOD Single : A 165 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.22) USER MOD Single : A 166 HIS : no HD1:sc= 0.63 K(o=0.63,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.309 -6.222 -0.470 1.00 0.00 N ATOM 2 CA MET A 1 -22.768 -5.514 0.685 1.00 0.00 C ATOM 3 C MET A 1 -21.352 -5.990 0.999 1.00 0.00 C ATOM 4 O MET A 1 -20.924 -5.979 2.154 1.00 0.00 O ATOM 5 CB MET A 1 -23.675 -5.708 1.897 1.00 0.00 C ATOM 6 CG MET A 1 -25.069 -5.117 1.742 1.00 0.00 C ATOM 7 SD MET A 1 -25.046 -3.324 1.552 1.00 0.00 S ATOM 8 CE MET A 1 -24.597 -2.812 3.207 1.00 0.00 C ATOM 0 H1 MET A 1 -24.296 -5.932 -0.624 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.745 -5.993 -1.313 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.273 -7.247 -0.297 1.00 0.00 H new ATOM 0 HA MET A 1 -22.725 -4.451 0.446 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.767 -6.775 2.099 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.198 -5.258 2.768 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.555 -5.564 0.875 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.669 -5.378 2.613 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.765 -1.740 3.315 1.00 0.00 H new ATOM 0 HE2 MET A 1 -25.208 -3.350 3.932 1.00 0.00 H new ATOM 0 HE3 MET A 1 -23.544 -3.034 3.383 1.00 0.00 H new ATOM 18 N THR A 2 -20.630 -6.407 -0.036 1.00 0.00 N ATOM 19 CA THR A 2 -19.259 -6.878 0.129 1.00 0.00 C ATOM 20 C THR A 2 -18.352 -5.761 0.633 1.00 0.00 C ATOM 21 O THR A 2 -18.348 -4.659 0.088 1.00 0.00 O ATOM 22 CB THR A 2 -18.691 -7.434 -1.190 1.00 0.00 C ATOM 23 OG1 THR A 2 -19.524 -8.502 -1.660 1.00 0.00 O ATOM 24 CG2 THR A 2 -17.275 -7.952 -0.984 1.00 0.00 C ATOM 0 H THR A 2 -20.971 -6.428 -0.997 1.00 0.00 H new ATOM 0 HA THR A 2 -19.287 -7.680 0.867 1.00 0.00 H new ATOM 0 HB THR A 2 -18.670 -6.631 -1.926 1.00 0.00 H new ATOM 0 HG1 THR A 2 -19.221 -8.787 -2.547 1.00 0.00 H new ATOM 0 HG21 THR A 2 -16.889 -8.341 -1.926 1.00 0.00 H new ATOM 0 HG22 THR A 2 -16.637 -7.139 -0.639 1.00 0.00 H new ATOM 0 HG23 THR A 2 -17.283 -8.748 -0.239 1.00 0.00 H new ATOM 32 N GLU A 3 -17.583 -6.057 1.676 1.00 0.00 N ATOM 33 CA GLU A 3 -16.632 -5.093 2.219 1.00 0.00 C ATOM 34 C GLU A 3 -15.207 -5.636 2.144 1.00 0.00 C ATOM 35 O GLU A 3 -14.951 -6.792 2.483 1.00 0.00 O ATOM 36 CB GLU A 3 -16.989 -4.741 3.665 1.00 0.00 C ATOM 37 CG GLU A 3 -16.042 -3.748 4.322 1.00 0.00 C ATOM 38 CD GLU A 3 -16.471 -3.432 5.727 1.00 0.00 C ATOM 39 OE1 GLU A 3 -17.425 -4.015 6.183 1.00 0.00 O ATOM 40 OE2 GLU A 3 -15.780 -2.690 6.387 1.00 0.00 O ATOM 0 H GLU A 3 -17.599 -6.954 2.161 1.00 0.00 H new ATOM 0 HA GLU A 3 -16.688 -4.187 1.616 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -17.999 -4.331 3.688 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -17.003 -5.657 4.256 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -15.032 -4.157 4.331 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -16.009 -2.830 3.735 1.00 0.00 H new ATOM 47 N TYR A 4 -14.283 -4.793 1.697 1.00 0.00 N ATOM 48 CA TYR A 4 -12.874 -5.164 1.639 1.00 0.00 C ATOM 49 C TYR A 4 -12.043 -4.296 2.581 1.00 0.00 C ATOM 50 O TYR A 4 -12.117 -3.069 2.541 1.00 0.00 O ATOM 51 CB TYR A 4 -12.345 -5.044 0.208 1.00 0.00 C ATOM 52 CG TYR A 4 -12.911 -6.075 -0.743 1.00 0.00 C ATOM 53 CD1 TYR A 4 -12.458 -7.387 -0.720 1.00 0.00 C ATOM 54 CD2 TYR A 4 -13.893 -5.736 -1.662 1.00 0.00 C ATOM 55 CE1 TYR A 4 -12.970 -8.334 -1.586 1.00 0.00 C ATOM 56 CE2 TYR A 4 -14.413 -6.675 -2.532 1.00 0.00 C ATOM 57 CZ TYR A 4 -13.948 -7.974 -2.491 1.00 0.00 C ATOM 58 OH TYR A 4 -14.460 -8.912 -3.356 1.00 0.00 O ATOM 0 H TYR A 4 -14.484 -3.848 1.370 1.00 0.00 H new ATOM 0 HA TYR A 4 -12.786 -6.202 1.960 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -12.575 -4.049 -0.172 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -11.259 -5.136 0.224 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -11.693 -7.672 -0.013 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -14.258 -4.720 -1.698 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -12.607 -9.351 -1.555 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -15.179 -6.394 -3.240 1.00 0.00 H new ATOM 0 HH TYR A 4 -15.162 -8.503 -3.904 1.00 0.00 H new ATOM 68 N LYS A 5 -11.251 -4.946 3.427 1.00 0.00 N ATOM 69 CA LYS A 5 -10.529 -4.251 4.487 1.00 0.00 C ATOM 70 C LYS A 5 -9.034 -4.205 4.187 1.00 0.00 C ATOM 71 O LYS A 5 -8.358 -5.235 4.196 1.00 0.00 O ATOM 72 CB LYS A 5 -10.778 -4.925 5.838 1.00 0.00 C ATOM 73 CG LYS A 5 -12.228 -4.891 6.300 1.00 0.00 C ATOM 74 CD LYS A 5 -12.402 -5.611 7.630 1.00 0.00 C ATOM 75 CE LYS A 5 -13.843 -5.540 8.114 1.00 0.00 C ATOM 76 NZ LYS A 5 -14.013 -6.175 9.449 1.00 0.00 N ATOM 0 H LYS A 5 -11.093 -5.953 3.399 1.00 0.00 H new ATOM 0 HA LYS A 5 -10.901 -3.228 4.534 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -10.453 -5.964 5.777 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -10.158 -4.440 6.592 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.556 -3.856 6.399 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -12.863 -5.356 5.546 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -12.103 -6.654 7.523 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -11.743 -5.166 8.376 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -14.158 -4.498 8.165 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -14.493 -6.034 7.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -15.008 -6.105 9.742 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -13.737 -7.176 9.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -13.412 -5.688 10.144 1.00 0.00 H new ATOM 90 N LEU A 6 -8.525 -3.009 3.924 1.00 0.00 N ATOM 91 CA LEU A 6 -7.128 -2.838 3.540 1.00 0.00 C ATOM 92 C LEU A 6 -6.340 -2.138 4.642 1.00 0.00 C ATOM 93 O LEU A 6 -6.802 -1.155 5.220 1.00 0.00 O ATOM 94 CB LEU A 6 -7.030 -2.051 2.227 1.00 0.00 C ATOM 95 CG LEU A 6 -5.620 -1.578 1.853 1.00 0.00 C ATOM 96 CD1 LEU A 6 -4.723 -2.778 1.579 1.00 0.00 C ATOM 97 CD2 LEU A 6 -5.694 -0.671 0.634 1.00 0.00 C ATOM 0 H LEU A 6 -9.059 -2.141 3.969 1.00 0.00 H new ATOM 0 HA LEU A 6 -6.692 -3.826 3.390 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -7.413 -2.674 1.419 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.682 -1.180 2.294 1.00 0.00 H new ATOM 0 HG LEU A 6 -5.193 -1.015 2.683 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -3.724 -2.432 1.314 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -4.667 -3.401 2.471 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -5.136 -3.360 0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.691 -0.335 0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -6.126 -1.220 -0.203 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -6.318 0.193 0.861 1.00 0.00 H new ATOM 109 N VAL A 7 -5.146 -2.649 4.926 1.00 0.00 N ATOM 110 CA VAL A 7 -4.223 -1.977 5.832 1.00 0.00 C ATOM 111 C VAL A 7 -3.056 -1.360 5.070 1.00 0.00 C ATOM 112 O VAL A 7 -2.345 -2.049 4.339 1.00 0.00 O ATOM 113 CB VAL A 7 -3.674 -2.942 6.899 1.00 0.00 C ATOM 114 CG1 VAL A 7 -2.682 -2.228 7.805 1.00 0.00 C ATOM 115 CG2 VAL A 7 -4.811 -3.533 7.718 1.00 0.00 C ATOM 0 H VAL A 7 -4.796 -3.526 4.541 1.00 0.00 H new ATOM 0 HA VAL A 7 -4.788 -1.188 6.327 1.00 0.00 H new ATOM 0 HB VAL A 7 -3.154 -3.755 6.392 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.305 -2.926 8.553 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -1.851 -1.851 7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -3.178 -1.395 8.303 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.405 -4.213 8.467 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -5.357 -2.731 8.214 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.487 -4.080 7.061 1.00 0.00 H new ATOM 125 N VAL A 8 -2.864 -0.055 5.246 1.00 0.00 N ATOM 126 CA VAL A 8 -1.815 0.665 4.535 1.00 0.00 C ATOM 127 C VAL A 8 -0.654 1.002 5.464 1.00 0.00 C ATOM 128 O VAL A 8 -0.847 1.589 6.529 1.00 0.00 O ATOM 129 CB VAL A 8 -2.350 1.965 3.904 1.00 0.00 C ATOM 130 CG1 VAL A 8 -1.218 2.746 3.254 1.00 0.00 C ATOM 131 CG2 VAL A 8 -3.436 1.655 2.886 1.00 0.00 C ATOM 0 H VAL A 8 -3.421 0.524 5.875 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.462 0.006 3.741 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.783 2.579 4.694 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -1.614 3.661 2.813 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -0.471 2.999 4.007 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.757 2.138 2.475 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -3.802 2.585 2.450 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -3.027 1.022 2.099 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -4.259 1.136 3.378 1.00 0.00 H new ATOM 141 N VAL A 9 0.554 0.627 5.054 1.00 0.00 N ATOM 142 CA VAL A 9 1.733 0.795 5.893 1.00 0.00 C ATOM 143 C VAL A 9 2.832 1.549 5.153 1.00 0.00 C ATOM 144 O VAL A 9 2.832 1.615 3.924 1.00 0.00 O ATOM 145 CB VAL A 9 2.287 -0.562 6.369 1.00 0.00 C ATOM 146 CG1 VAL A 9 1.250 -1.296 7.207 1.00 0.00 C ATOM 147 CG2 VAL A 9 2.708 -1.413 5.179 1.00 0.00 C ATOM 0 H VAL A 9 0.741 0.204 4.145 1.00 0.00 H new ATOM 0 HA VAL A 9 1.420 1.374 6.762 1.00 0.00 H new ATOM 0 HB VAL A 9 3.164 -0.377 6.989 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.658 -2.252 7.535 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.993 -0.693 8.078 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.355 -1.469 6.609 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.097 -2.368 5.534 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.847 -1.589 4.535 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.482 -0.893 4.615 1.00 0.00 H new ATOM 157 N GLY A 10 3.766 2.118 5.909 1.00 0.00 N ATOM 158 CA GLY A 10 4.904 2.786 5.305 1.00 0.00 C ATOM 159 C GLY A 10 5.618 3.705 6.275 1.00 0.00 C ATOM 160 O GLY A 10 5.031 4.161 7.255 1.00 0.00 O ATOM 0 H GLY A 10 3.755 2.128 6.929 1.00 0.00 H new ATOM 0 HA2 GLY A 10 5.605 2.039 4.934 1.00 0.00 H new ATOM 0 HA3 GLY A 10 4.568 3.363 4.443 1.00 0.00 H new ATOM 164 N ALA A 11 6.890 3.976 6.003 1.00 0.00 N ATOM 165 CA ALA A 11 7.707 4.787 6.897 1.00 0.00 C ATOM 166 C ALA A 11 7.368 6.268 6.761 1.00 0.00 C ATOM 167 O ALA A 11 6.731 6.682 5.792 1.00 0.00 O ATOM 168 CB ALA A 11 9.185 4.554 6.621 1.00 0.00 C ATOM 0 H ALA A 11 7.377 3.646 5.170 1.00 0.00 H new ATOM 0 HA ALA A 11 7.488 4.484 7.921 1.00 0.00 H new ATOM 0 HB1 ALA A 11 9.782 5.167 7.296 1.00 0.00 H new ATOM 0 HB2 ALA A 11 9.423 3.502 6.779 1.00 0.00 H new ATOM 0 HB3 ALA A 11 9.410 4.826 5.590 1.00 0.00 H new ATOM 174 N GLY A 12 7.796 7.062 7.737 1.00 0.00 N ATOM 175 CA GLY A 12 7.507 8.484 7.718 1.00 0.00 C ATOM 176 C GLY A 12 8.171 9.195 6.555 1.00 0.00 C ATOM 177 O GLY A 12 9.345 8.969 6.270 1.00 0.00 O ATOM 0 H GLY A 12 8.338 6.746 8.541 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.428 8.632 7.662 1.00 0.00 H new ATOM 0 HA3 GLY A 12 7.842 8.932 8.653 1.00 0.00 H new ATOM 181 N GLY A 13 7.414 10.055 5.880 1.00 0.00 N ATOM 182 CA GLY A 13 7.959 10.801 4.759 1.00 0.00 C ATOM 183 C GLY A 13 7.049 10.772 3.548 1.00 0.00 C ATOM 184 O GLY A 13 7.340 11.397 2.529 1.00 0.00 O ATOM 0 H GLY A 13 6.435 10.249 6.089 1.00 0.00 H new ATOM 0 HA2 GLY A 13 8.125 11.835 5.061 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.931 10.388 4.490 1.00 0.00 H new ATOM 188 N VAL A 14 5.944 10.040 3.657 1.00 0.00 N ATOM 189 CA VAL A 14 4.939 10.010 2.601 1.00 0.00 C ATOM 190 C VAL A 14 3.565 10.395 3.138 1.00 0.00 C ATOM 191 O VAL A 14 3.366 10.494 4.347 1.00 0.00 O ATOM 192 CB VAL A 14 4.853 8.619 1.943 1.00 0.00 C ATOM 193 CG1 VAL A 14 6.177 8.257 1.287 1.00 0.00 C ATOM 194 CG2 VAL A 14 4.464 7.568 2.970 1.00 0.00 C ATOM 0 H VAL A 14 5.723 9.460 4.466 1.00 0.00 H new ATOM 0 HA VAL A 14 5.248 10.737 1.850 1.00 0.00 H new ATOM 0 HB VAL A 14 4.083 8.650 1.172 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.098 7.272 0.827 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.418 8.996 0.523 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.965 8.244 2.040 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.408 6.592 2.488 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.212 7.539 3.762 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.493 7.818 3.397 1.00 0.00 H new ATOM 204 N GLY A 15 2.619 10.611 2.230 1.00 0.00 N ATOM 205 CA GLY A 15 1.322 11.134 2.618 1.00 0.00 C ATOM 206 C GLY A 15 0.241 10.072 2.603 1.00 0.00 C ATOM 207 O GLY A 15 -0.741 10.185 1.870 1.00 0.00 O ATOM 0 H GLY A 15 2.728 10.433 1.232 1.00 0.00 H new ATOM 0 HA2 GLY A 15 1.391 11.564 3.617 1.00 0.00 H new ATOM 0 HA3 GLY A 15 1.043 11.942 1.942 1.00 0.00 H new ATOM 211 N LYS A 16 0.420 9.036 3.416 1.00 0.00 N ATOM 212 CA LYS A 16 -0.486 7.895 3.412 1.00 0.00 C ATOM 213 C LYS A 16 -1.935 8.351 3.563 1.00 0.00 C ATOM 214 O LYS A 16 -2.833 7.822 2.908 1.00 0.00 O ATOM 215 CB LYS A 16 -0.122 6.916 4.530 1.00 0.00 C ATOM 216 CG LYS A 16 1.230 6.236 4.352 1.00 0.00 C ATOM 217 CD LYS A 16 1.452 5.165 5.411 1.00 0.00 C ATOM 218 CE LYS A 16 1.729 5.781 6.773 1.00 0.00 C ATOM 219 NZ LYS A 16 2.275 4.786 7.734 1.00 0.00 N ATOM 0 H LYS A 16 1.185 8.964 4.086 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.383 7.386 2.454 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.125 7.450 5.480 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -0.895 6.150 4.593 1.00 0.00 H new ATOM 0 HG2 LYS A 16 1.287 5.787 3.360 1.00 0.00 H new ATOM 0 HG3 LYS A 16 2.025 6.980 4.411 1.00 0.00 H new ATOM 0 HD2 LYS A 16 0.573 4.524 5.472 1.00 0.00 H new ATOM 0 HD3 LYS A 16 2.289 4.531 5.120 1.00 0.00 H new ATOM 0 HE2 LYS A 16 2.436 6.603 6.662 1.00 0.00 H new ATOM 0 HE3 LYS A 16 0.808 6.204 7.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 2.418 5.239 8.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 1.605 3.997 7.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 3.184 4.425 7.381 1.00 0.00 H new ATOM 233 N SER A 17 -2.153 9.335 4.429 1.00 0.00 N ATOM 234 CA SER A 17 -3.490 9.873 4.653 1.00 0.00 C ATOM 235 C SER A 17 -3.967 10.667 3.440 1.00 0.00 C ATOM 236 O SER A 17 -5.135 10.601 3.062 1.00 0.00 O ATOM 237 CB SER A 17 -3.503 10.742 5.896 1.00 0.00 C ATOM 238 OG SER A 17 -3.324 9.990 7.065 1.00 0.00 O ATOM 0 H SER A 17 -1.422 9.776 4.987 1.00 0.00 H new ATOM 0 HA SER A 17 -4.176 9.039 4.801 1.00 0.00 H new ATOM 0 HB2 SER A 17 -2.715 11.491 5.823 1.00 0.00 H new ATOM 0 HB3 SER A 17 -4.449 11.280 5.952 1.00 0.00 H new ATOM 0 HG SER A 17 -3.121 9.061 6.828 1.00 0.00 H new ATOM 244 N ALA A 18 -3.051 11.418 2.836 1.00 0.00 N ATOM 245 CA ALA A 18 -3.395 12.291 1.721 1.00 0.00 C ATOM 246 C ALA A 18 -3.858 11.482 0.514 1.00 0.00 C ATOM 247 O ALA A 18 -4.767 11.893 -0.209 1.00 0.00 O ATOM 248 CB ALA A 18 -2.204 13.164 1.347 1.00 0.00 C ATOM 0 H ALA A 18 -2.066 11.439 3.100 1.00 0.00 H new ATOM 0 HA ALA A 18 -4.219 12.933 2.034 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -2.475 13.811 0.513 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.918 13.776 2.203 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -1.365 12.531 1.057 1.00 0.00 H new ATOM 254 N LEU A 19 -3.230 10.332 0.302 1.00 0.00 N ATOM 255 CA LEU A 19 -3.502 9.518 -0.879 1.00 0.00 C ATOM 256 C LEU A 19 -4.904 8.920 -0.818 1.00 0.00 C ATOM 257 O LEU A 19 -5.620 8.887 -1.819 1.00 0.00 O ATOM 258 CB LEU A 19 -2.452 8.408 -1.012 1.00 0.00 C ATOM 259 CG LEU A 19 -1.009 8.894 -1.200 1.00 0.00 C ATOM 260 CD1 LEU A 19 -0.057 7.705 -1.228 1.00 0.00 C ATOM 261 CD2 LEU A 19 -0.907 9.697 -2.488 1.00 0.00 C ATOM 0 H LEU A 19 -2.529 9.941 0.931 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.447 10.161 -1.757 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.494 7.781 -0.121 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.719 7.777 -1.859 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.729 9.535 -0.364 1.00 0.00 H new ATOM 0 HD11 LEU A 19 0.965 8.060 -1.362 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.131 7.158 -0.288 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.323 7.045 -2.054 1.00 0.00 H new ATOM 0 HD21 LEU A 19 0.118 10.042 -2.621 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.191 9.068 -3.332 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -1.575 10.557 -2.435 1.00 0.00 H new ATOM 273 N THR A 20 -5.292 8.452 0.363 1.00 0.00 N ATOM 274 CA THR A 20 -6.630 7.913 0.570 1.00 0.00 C ATOM 275 C THR A 20 -7.694 8.980 0.340 1.00 0.00 C ATOM 276 O THR A 20 -8.799 8.679 -0.111 1.00 0.00 O ATOM 277 CB THR A 20 -6.794 7.338 1.989 1.00 0.00 C ATOM 278 OG1 THR A 20 -6.540 8.365 2.957 1.00 0.00 O ATOM 279 CG2 THR A 20 -5.826 6.185 2.213 1.00 0.00 C ATOM 0 H THR A 20 -4.698 8.435 1.192 1.00 0.00 H new ATOM 0 HA THR A 20 -6.761 7.110 -0.155 1.00 0.00 H new ATOM 0 HB THR A 20 -7.814 6.970 2.099 1.00 0.00 H new ATOM 0 HG1 THR A 20 -5.965 9.053 2.561 1.00 0.00 H new ATOM 0 HG21 THR A 20 -5.956 5.791 3.221 1.00 0.00 H new ATOM 0 HG22 THR A 20 -6.025 5.397 1.487 1.00 0.00 H new ATOM 0 HG23 THR A 20 -4.803 6.540 2.092 1.00 0.00 H new ATOM 287 N ILE A 21 -7.353 10.227 0.649 1.00 0.00 N ATOM 288 CA ILE A 21 -8.270 11.340 0.445 1.00 0.00 C ATOM 289 C ILE A 21 -8.562 11.550 -1.036 1.00 0.00 C ATOM 290 O ILE A 21 -9.670 11.929 -1.413 1.00 0.00 O ATOM 291 CB ILE A 21 -7.712 12.646 1.039 1.00 0.00 C ATOM 292 CG1 ILE A 21 -7.695 12.573 2.569 1.00 0.00 C ATOM 293 CG2 ILE A 21 -8.532 13.838 0.569 1.00 0.00 C ATOM 294 CD1 ILE A 21 -6.921 13.693 3.225 1.00 0.00 C ATOM 0 H ILE A 21 -6.449 10.491 1.041 1.00 0.00 H new ATOM 0 HA ILE A 21 -9.195 11.083 0.960 1.00 0.00 H new ATOM 0 HB ILE A 21 -6.688 12.775 0.689 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.721 12.590 2.936 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -7.264 11.619 2.873 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.123 14.753 0.999 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.494 13.899 -0.519 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -9.567 13.717 0.890 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.955 13.573 4.308 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -5.885 13.665 2.889 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -7.365 14.650 2.952 1.00 0.00 H new ATOM 306 N GLN A 22 -7.561 11.296 -1.873 1.00 0.00 N ATOM 307 CA GLN A 22 -7.696 11.498 -3.311 1.00 0.00 C ATOM 308 C GLN A 22 -8.884 10.714 -3.860 1.00 0.00 C ATOM 309 O GLN A 22 -9.711 11.254 -4.595 1.00 0.00 O ATOM 310 CB GLN A 22 -6.415 11.076 -4.036 1.00 0.00 C ATOM 311 CG GLN A 22 -5.202 11.928 -3.704 1.00 0.00 C ATOM 312 CD GLN A 22 -3.929 11.393 -4.332 1.00 0.00 C ATOM 313 OE1 GLN A 22 -3.918 10.304 -4.914 1.00 0.00 O ATOM 314 NE2 GLN A 22 -2.848 12.154 -4.216 1.00 0.00 N ATOM 0 H GLN A 22 -6.647 10.950 -1.580 1.00 0.00 H new ATOM 0 HA GLN A 22 -7.868 12.560 -3.486 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -6.195 10.038 -3.787 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.590 11.116 -5.111 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -5.373 12.948 -4.048 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.079 11.973 -2.622 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -2.903 13.047 -3.726 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -1.962 11.846 -4.616 1.00 0.00 H new ATOM 323 N LEU A 23 -8.962 9.438 -3.499 1.00 0.00 N ATOM 324 CA LEU A 23 -10.026 8.567 -3.989 1.00 0.00 C ATOM 325 C LEU A 23 -11.382 9.010 -3.450 1.00 0.00 C ATOM 326 O LEU A 23 -12.384 8.984 -4.166 1.00 0.00 O ATOM 327 CB LEU A 23 -9.743 7.111 -3.598 1.00 0.00 C ATOM 328 CG LEU A 23 -10.814 6.101 -4.027 1.00 0.00 C ATOM 329 CD1 LEU A 23 -10.961 6.107 -5.542 1.00 0.00 C ATOM 330 CD2 LEU A 23 -10.434 4.714 -3.528 1.00 0.00 C ATOM 0 H LEU A 23 -8.302 8.983 -2.869 1.00 0.00 H new ATOM 0 HA LEU A 23 -10.054 8.638 -5.076 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.790 6.813 -4.034 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.629 7.058 -2.515 1.00 0.00 H new ATOM 0 HG LEU A 23 -11.773 6.381 -3.590 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.724 5.386 -5.836 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.254 7.103 -5.875 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.010 5.836 -6.001 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.196 3.996 -3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.472 4.425 -3.953 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.362 4.726 -2.440 1.00 0.00 H new ATOM 342 N ILE A 24 -11.407 9.418 -2.186 1.00 0.00 N ATOM 343 CA ILE A 24 -12.661 9.677 -1.491 1.00 0.00 C ATOM 344 C ILE A 24 -13.397 10.863 -2.108 1.00 0.00 C ATOM 345 O ILE A 24 -14.620 10.844 -2.244 1.00 0.00 O ATOM 346 CB ILE A 24 -12.432 9.949 0.007 1.00 0.00 C ATOM 347 CG1 ILE A 24 -11.925 8.686 0.707 1.00 0.00 C ATOM 348 CG2 ILE A 24 -13.712 10.446 0.660 1.00 0.00 C ATOM 349 CD1 ILE A 24 -11.368 8.935 2.091 1.00 0.00 C ATOM 0 H ILE A 24 -10.572 9.576 -1.622 1.00 0.00 H new ATOM 0 HA ILE A 24 -13.271 8.780 -1.597 1.00 0.00 H new ATOM 0 HB ILE A 24 -11.674 10.726 0.106 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -12.743 7.969 0.779 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -11.151 8.227 0.092 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -13.532 10.633 1.719 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -14.032 11.370 0.178 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -14.492 9.692 0.553 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -11.029 7.993 2.522 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -10.528 9.627 2.026 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -12.144 9.365 2.724 1.00 0.00 H new ATOM 361 N GLN A 25 -12.642 11.892 -2.482 1.00 0.00 N ATOM 362 CA GLN A 25 -13.230 13.150 -2.923 1.00 0.00 C ATOM 363 C GLN A 25 -13.038 13.345 -4.424 1.00 0.00 C ATOM 364 O GLN A 25 -13.345 14.406 -4.966 1.00 0.00 O ATOM 365 CB GLN A 25 -12.614 14.327 -2.164 1.00 0.00 C ATOM 366 CG GLN A 25 -12.841 14.288 -0.662 1.00 0.00 C ATOM 367 CD GLN A 25 -12.183 15.452 0.054 1.00 0.00 C ATOM 368 OE1 GLN A 25 -11.497 16.271 -0.564 1.00 0.00 O ATOM 369 NE2 GLN A 25 -12.386 15.531 1.364 1.00 0.00 N ATOM 0 H GLN A 25 -11.622 11.878 -2.488 1.00 0.00 H new ATOM 0 HA GLN A 25 -14.298 13.111 -2.711 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -11.542 14.348 -2.357 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -13.027 15.255 -2.558 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -13.912 14.299 -0.459 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -12.450 13.352 -0.263 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -12.961 14.832 1.834 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -11.967 16.291 1.900 1.00 0.00 H new ATOM 378 N ASN A 26 -12.529 12.313 -5.089 1.00 0.00 N ATOM 379 CA ASN A 26 -12.242 12.391 -6.516 1.00 0.00 C ATOM 380 C ASN A 26 -11.327 13.574 -6.823 1.00 0.00 C ATOM 381 O ASN A 26 -11.557 14.319 -7.777 1.00 0.00 O ATOM 382 CB ASN A 26 -13.515 12.482 -7.336 1.00 0.00 C ATOM 383 CG ASN A 26 -14.358 11.239 -7.285 1.00 0.00 C ATOM 384 OD1 ASN A 26 -13.849 10.126 -7.107 1.00 0.00 O ATOM 385 ND2 ASN A 26 -15.634 11.411 -7.520 1.00 0.00 N ATOM 0 H ASN A 26 -12.307 11.413 -4.662 1.00 0.00 H new ATOM 0 HA ASN A 26 -11.728 11.471 -6.795 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.106 13.326 -6.980 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -13.254 12.691 -8.373 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -16.258 10.605 -7.563 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.005 12.351 -7.660 1.00 0.00 H new ATOM 392 N HIS A 27 -10.289 13.740 -6.010 1.00 0.00 N ATOM 393 CA HIS A 27 -9.445 14.927 -6.080 1.00 0.00 C ATOM 394 C HIS A 27 -7.975 14.541 -6.207 1.00 0.00 C ATOM 395 O HIS A 27 -7.581 13.430 -5.854 1.00 0.00 O ATOM 396 CB HIS A 27 -9.652 15.814 -4.848 1.00 0.00 C ATOM 397 CG HIS A 27 -10.915 16.617 -4.889 1.00 0.00 C ATOM 398 ND1 HIS A 27 -11.525 17.103 -3.752 1.00 0.00 N ATOM 399 CD2 HIS A 27 -11.684 17.015 -5.929 1.00 0.00 C ATOM 400 CE1 HIS A 27 -12.615 17.769 -4.092 1.00 0.00 C ATOM 401 NE2 HIS A 27 -12.734 17.730 -5.406 1.00 0.00 N ATOM 0 H HIS A 27 -10.012 13.067 -5.295 1.00 0.00 H new ATOM 0 HA HIS A 27 -9.733 15.490 -6.967 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -9.660 15.186 -3.957 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -8.804 16.492 -4.753 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -11.188 16.970 -2.799 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -11.506 16.809 -6.974 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -13.293 18.261 -3.411 1.00 0.00 H new ATOM 548 N GLU A 37 -3.191 6.254 13.441 1.00 0.00 N ATOM 549 CA GLU A 37 -4.388 5.437 13.605 1.00 0.00 C ATOM 550 C GLU A 37 -5.598 6.114 12.971 1.00 0.00 C ATOM 551 O GLU A 37 -6.491 6.594 13.670 1.00 0.00 O ATOM 552 CB GLU A 37 -4.652 5.162 15.087 1.00 0.00 C ATOM 553 CG GLU A 37 -3.584 4.322 15.772 1.00 0.00 C ATOM 554 CD GLU A 37 -3.911 4.096 17.221 1.00 0.00 C ATOM 555 OE1 GLU A 37 -4.974 3.595 17.499 1.00 0.00 O ATOM 556 OE2 GLU A 37 -3.055 4.321 18.046 1.00 0.00 O ATOM 0 HA GLU A 37 -4.220 4.487 13.098 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -4.739 6.114 15.611 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.612 4.656 15.184 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.492 3.362 15.264 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.618 4.820 15.689 1.00 0.00 H new ATOM 563 N ASP A 38 -5.622 6.149 11.644 1.00 0.00 N ATOM 564 CA ASP A 38 -6.623 6.922 10.916 1.00 0.00 C ATOM 565 C ASP A 38 -7.311 6.062 9.861 1.00 0.00 C ATOM 566 O ASP A 38 -6.664 5.542 8.952 1.00 0.00 O ATOM 567 CB ASP A 38 -5.986 8.150 10.264 1.00 0.00 C ATOM 568 CG ASP A 38 -6.976 9.086 9.584 1.00 0.00 C ATOM 569 OD1 ASP A 38 -8.135 8.749 9.522 1.00 0.00 O ATOM 570 OD2 ASP A 38 -6.601 10.193 9.275 1.00 0.00 O ATOM 0 H ASP A 38 -4.960 5.651 11.049 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.375 7.257 11.631 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -5.441 8.708 11.025 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.255 7.817 9.527 1.00 0.00 H new ATOM 575 N SER A 39 -8.626 5.915 9.990 1.00 0.00 N ATOM 576 CA SER A 39 -9.382 5.010 9.131 1.00 0.00 C ATOM 577 C SER A 39 -10.167 5.788 8.080 1.00 0.00 C ATOM 578 O SER A 39 -10.628 6.902 8.332 1.00 0.00 O ATOM 579 CB SER A 39 -10.314 4.152 9.964 1.00 0.00 C ATOM 580 OG SER A 39 -11.253 4.922 10.663 1.00 0.00 O ATOM 0 H SER A 39 -9.190 6.411 10.681 1.00 0.00 H new ATOM 0 HA SER A 39 -8.677 4.359 8.613 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.834 3.447 9.316 1.00 0.00 H new ATOM 0 HB3 SER A 39 -9.730 3.563 10.671 1.00 0.00 H new ATOM 0 HG SER A 39 -11.835 4.332 11.186 1.00 0.00 H new ATOM 586 N TYR A 40 -10.318 5.192 6.903 1.00 0.00 N ATOM 587 CA TYR A 40 -11.134 5.783 5.847 1.00 0.00 C ATOM 588 C TYR A 40 -12.083 4.748 5.249 1.00 0.00 C ATOM 589 O TYR A 40 -11.768 3.558 5.196 1.00 0.00 O ATOM 590 CB TYR A 40 -10.247 6.379 4.753 1.00 0.00 C ATOM 591 CG TYR A 40 -9.380 7.526 5.224 1.00 0.00 C ATOM 592 CD1 TYR A 40 -9.851 8.830 5.196 1.00 0.00 C ATOM 593 CD2 TYR A 40 -8.093 7.302 5.693 1.00 0.00 C ATOM 594 CE1 TYR A 40 -9.065 9.883 5.624 1.00 0.00 C ATOM 595 CE2 TYR A 40 -7.299 8.346 6.124 1.00 0.00 C ATOM 596 CZ TYR A 40 -7.788 9.636 6.088 1.00 0.00 C ATOM 597 OH TYR A 40 -7.000 10.680 6.515 1.00 0.00 O ATOM 0 H TYR A 40 -9.887 4.301 6.655 1.00 0.00 H new ATOM 0 HA TYR A 40 -11.730 6.582 6.289 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -9.607 5.594 4.350 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -10.879 6.726 3.935 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -10.849 9.026 4.833 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -7.706 6.294 5.721 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -9.447 10.893 5.596 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -6.300 8.154 6.487 1.00 0.00 H new ATOM 0 HH TYR A 40 -6.804 10.573 7.469 1.00 0.00 H new ATOM 607 N ARG A 41 -13.244 5.210 4.801 1.00 0.00 N ATOM 608 CA ARG A 41 -14.177 4.356 4.072 1.00 0.00 C ATOM 609 C ARG A 41 -14.631 5.027 2.779 1.00 0.00 C ATOM 610 O ARG A 41 -14.889 6.231 2.749 1.00 0.00 O ATOM 611 CB ARG A 41 -15.360 3.932 4.928 1.00 0.00 C ATOM 612 CG ARG A 41 -15.042 2.889 5.988 1.00 0.00 C ATOM 613 CD ARG A 41 -16.209 2.474 6.808 1.00 0.00 C ATOM 614 NE ARG A 41 -15.917 1.447 7.795 1.00 0.00 N ATOM 615 CZ ARG A 41 -16.782 1.024 8.738 1.00 0.00 C ATOM 616 NH1 ARG A 41 -17.977 1.560 8.850 1.00 0.00 N ATOM 617 NH2 ARG A 41 -16.386 0.072 9.565 1.00 0.00 N ATOM 0 H ARG A 41 -13.563 6.170 4.929 1.00 0.00 H new ATOM 0 HA ARG A 41 -13.643 3.443 3.809 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -15.769 4.815 5.419 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -16.140 3.540 4.275 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -14.624 2.008 5.500 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -14.270 3.284 6.649 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -16.607 3.350 7.320 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -16.993 2.110 6.144 1.00 0.00 H new ATOM 0 HE ARG A 41 -14.993 1.016 7.772 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -18.262 2.308 8.218 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -18.619 1.228 9.569 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -15.449 -0.321 9.479 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -17.018 -0.269 10.289 1.00 0.00 H new ATOM 631 N LYS A 42 -14.725 4.241 1.712 1.00 0.00 N ATOM 632 CA LYS A 42 -15.267 4.728 0.449 1.00 0.00 C ATOM 633 C LYS A 42 -15.880 3.587 -0.355 1.00 0.00 C ATOM 634 O LYS A 42 -15.256 2.541 -0.541 1.00 0.00 O ATOM 635 CB LYS A 42 -14.178 5.426 -0.369 1.00 0.00 C ATOM 636 CG LYS A 42 -14.649 5.964 -1.713 1.00 0.00 C ATOM 637 CD LYS A 42 -15.607 7.133 -1.537 1.00 0.00 C ATOM 638 CE LYS A 42 -16.184 7.583 -2.871 1.00 0.00 C ATOM 639 NZ LYS A 42 -17.261 6.673 -3.346 1.00 0.00 N ATOM 0 H LYS A 42 -14.433 3.264 1.697 1.00 0.00 H new ATOM 0 HA LYS A 42 -16.052 5.450 0.675 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -13.773 6.251 0.217 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -13.362 4.724 -0.538 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -13.788 6.282 -2.301 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -15.141 5.169 -2.273 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -16.417 6.844 -0.867 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -15.085 7.965 -1.065 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -16.580 8.594 -2.773 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -15.389 7.623 -3.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -17.592 6.985 -4.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -16.891 5.704 -3.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -18.054 6.693 -2.673 1.00 0.00 H new ATOM 653 N GLN A 43 -17.104 3.794 -0.830 1.00 0.00 N ATOM 654 CA GLN A 43 -17.768 2.815 -1.682 1.00 0.00 C ATOM 655 C GLN A 43 -17.181 2.828 -3.090 1.00 0.00 C ATOM 656 O GLN A 43 -17.147 3.867 -3.748 1.00 0.00 O ATOM 657 CB GLN A 43 -19.273 3.091 -1.746 1.00 0.00 C ATOM 658 CG GLN A 43 -20.059 2.071 -2.551 1.00 0.00 C ATOM 659 CD GLN A 43 -21.556 2.311 -2.485 1.00 0.00 C ATOM 660 OE1 GLN A 43 -22.020 3.247 -1.828 1.00 0.00 O ATOM 661 NE2 GLN A 43 -22.321 1.463 -3.164 1.00 0.00 N ATOM 0 H GLN A 43 -17.656 4.631 -0.639 1.00 0.00 H new ATOM 0 HA GLN A 43 -17.605 1.829 -1.246 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -19.669 3.120 -0.731 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -19.432 4.079 -2.178 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -19.734 2.104 -3.591 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -19.837 1.070 -2.180 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -21.894 0.703 -3.694 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -23.335 1.572 -3.155 1.00 0.00 H new ATOM 670 N VAL A 44 -16.719 1.668 -3.544 1.00 0.00 N ATOM 671 CA VAL A 44 -16.019 1.569 -4.819 1.00 0.00 C ATOM 672 C VAL A 44 -16.472 0.340 -5.600 1.00 0.00 C ATOM 673 O VAL A 44 -17.092 -0.568 -5.047 1.00 0.00 O ATOM 674 CB VAL A 44 -14.493 1.510 -4.624 1.00 0.00 C ATOM 675 CG1 VAL A 44 -13.989 2.792 -3.978 1.00 0.00 C ATOM 676 CG2 VAL A 44 -14.110 0.303 -3.781 1.00 0.00 C ATOM 0 H VAL A 44 -16.817 0.783 -3.047 1.00 0.00 H new ATOM 0 HA VAL A 44 -16.267 2.467 -5.385 1.00 0.00 H new ATOM 0 HB VAL A 44 -14.024 1.409 -5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -12.908 2.733 -3.847 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -14.232 3.641 -4.617 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -14.465 2.921 -3.006 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -13.028 0.277 -3.653 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -14.589 0.374 -2.805 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -14.438 -0.609 -4.280 1.00 0.00 H new ATOM 686 N VAL A 45 -16.156 0.318 -6.892 1.00 0.00 N ATOM 687 CA VAL A 45 -16.355 -0.874 -7.707 1.00 0.00 C ATOM 688 C VAL A 45 -15.022 -1.502 -8.098 1.00 0.00 C ATOM 689 O VAL A 45 -14.238 -0.907 -8.839 1.00 0.00 O ATOM 690 CB VAL A 45 -17.160 -0.560 -8.982 1.00 0.00 C ATOM 691 CG1 VAL A 45 -17.320 -1.811 -9.832 1.00 0.00 C ATOM 692 CG2 VAL A 45 -18.520 0.018 -8.623 1.00 0.00 C ATOM 0 H VAL A 45 -15.761 1.112 -7.396 1.00 0.00 H new ATOM 0 HA VAL A 45 -16.920 -1.580 -7.099 1.00 0.00 H new ATOM 0 HB VAL A 45 -16.612 0.183 -9.562 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -17.891 -1.571 -10.729 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -16.337 -2.185 -10.117 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -17.847 -2.575 -9.260 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -19.076 0.234 -9.535 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -19.075 -0.703 -8.022 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -18.386 0.938 -8.053 1.00 0.00 H new ATOM 702 N ILE A 46 -14.771 -2.706 -7.597 1.00 0.00 N ATOM 703 CA ILE A 46 -13.514 -3.396 -7.863 1.00 0.00 C ATOM 704 C ILE A 46 -13.757 -4.726 -8.567 1.00 0.00 C ATOM 705 O ILE A 46 -14.465 -5.593 -8.056 1.00 0.00 O ATOM 706 CB ILE A 46 -12.724 -3.649 -6.566 1.00 0.00 C ATOM 707 CG1 ILE A 46 -12.414 -2.325 -5.862 1.00 0.00 C ATOM 708 CG2 ILE A 46 -11.441 -4.408 -6.865 1.00 0.00 C ATOM 709 CD1 ILE A 46 -11.794 -2.491 -4.494 1.00 0.00 C ATOM 0 H ILE A 46 -15.420 -3.224 -7.005 1.00 0.00 H new ATOM 0 HA ILE A 46 -12.928 -2.746 -8.512 1.00 0.00 H new ATOM 0 HB ILE A 46 -13.336 -4.257 -5.901 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -11.739 -1.741 -6.488 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -13.336 -1.751 -5.765 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -10.895 -4.579 -5.937 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -11.684 -5.366 -7.325 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -10.824 -3.824 -7.548 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -11.604 -1.510 -4.059 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -12.476 -3.047 -3.850 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -10.855 -3.036 -4.584 1.00 0.00 H new ATOM 721 N ASP A 47 -13.163 -4.881 -9.745 1.00 0.00 N ATOM 722 CA ASP A 47 -13.300 -6.111 -10.516 1.00 0.00 C ATOM 723 C ASP A 47 -14.754 -6.339 -10.921 1.00 0.00 C ATOM 724 O ASP A 47 -15.219 -7.475 -10.991 1.00 0.00 O ATOM 725 CB ASP A 47 -12.781 -7.308 -9.715 1.00 0.00 C ATOM 726 CG ASP A 47 -12.348 -8.494 -10.566 1.00 0.00 C ATOM 727 OD1 ASP A 47 -12.153 -8.314 -11.745 1.00 0.00 O ATOM 728 OD2 ASP A 47 -12.064 -9.528 -10.009 1.00 0.00 O ATOM 0 H ASP A 47 -12.581 -4.169 -10.187 1.00 0.00 H new ATOM 0 HA ASP A 47 -12.702 -6.010 -11.422 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -11.936 -6.984 -9.108 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.561 -7.635 -9.027 1.00 0.00 H new ATOM 733 N GLY A 48 -15.467 -5.248 -11.185 1.00 0.00 N ATOM 734 CA GLY A 48 -16.851 -5.352 -11.605 1.00 0.00 C ATOM 735 C GLY A 48 -17.802 -5.510 -10.434 1.00 0.00 C ATOM 736 O GLY A 48 -19.017 -5.425 -10.599 1.00 0.00 O ATOM 0 H GLY A 48 -15.110 -4.295 -11.115 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -17.123 -4.462 -12.173 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -16.961 -6.204 -12.276 1.00 0.00 H new ATOM 740 N GLU A 49 -17.245 -5.743 -9.250 1.00 0.00 N ATOM 741 CA GLU A 49 -18.054 -5.939 -8.052 1.00 0.00 C ATOM 742 C GLU A 49 -18.182 -4.637 -7.265 1.00 0.00 C ATOM 743 O GLU A 49 -17.192 -3.957 -6.999 1.00 0.00 O ATOM 744 CB GLU A 49 -17.452 -7.033 -7.170 1.00 0.00 C ATOM 745 CG GLU A 49 -18.280 -7.377 -5.939 1.00 0.00 C ATOM 746 CD GLU A 49 -17.592 -8.407 -5.087 1.00 0.00 C ATOM 747 OE1 GLU A 49 -16.433 -8.661 -5.315 1.00 0.00 O ATOM 748 OE2 GLU A 49 -18.189 -8.859 -4.139 1.00 0.00 O ATOM 0 H GLU A 49 -16.239 -5.801 -9.094 1.00 0.00 H new ATOM 0 HA GLU A 49 -19.050 -6.252 -8.365 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -17.322 -7.935 -7.769 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -16.459 -6.718 -6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -18.455 -6.475 -5.352 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -19.256 -7.751 -6.248 1.00 0.00 H new ATOM 755 N THR A 50 -19.414 -4.297 -6.895 1.00 0.00 N ATOM 756 CA THR A 50 -19.665 -3.126 -6.065 1.00 0.00 C ATOM 757 C THR A 50 -19.518 -3.457 -4.585 1.00 0.00 C ATOM 758 O THR A 50 -20.158 -4.380 -4.079 1.00 0.00 O ATOM 759 CB THR A 50 -21.071 -2.547 -6.315 1.00 0.00 C ATOM 760 OG1 THR A 50 -21.196 -2.169 -7.692 1.00 0.00 O ATOM 761 CG2 THR A 50 -21.311 -1.330 -5.435 1.00 0.00 C ATOM 0 H THR A 50 -20.252 -4.816 -7.157 1.00 0.00 H new ATOM 0 HA THR A 50 -18.920 -2.380 -6.342 1.00 0.00 H new ATOM 0 HB THR A 50 -21.811 -3.310 -6.071 1.00 0.00 H new ATOM 0 HG1 THR A 50 -22.091 -1.802 -7.851 1.00 0.00 H new ATOM 0 HG21 THR A 50 -22.309 -0.935 -5.625 1.00 0.00 H new ATOM 0 HG22 THR A 50 -21.228 -1.617 -4.387 1.00 0.00 H new ATOM 0 HG23 THR A 50 -20.568 -0.565 -5.662 1.00 0.00 H new ATOM 769 N CYS A 51 -18.672 -2.701 -3.894 1.00 0.00 N ATOM 770 CA CYS A 51 -18.260 -3.054 -2.541 1.00 0.00 C ATOM 771 C CYS A 51 -17.855 -1.811 -1.755 1.00 0.00 C ATOM 772 O CYS A 51 -17.739 -0.719 -2.314 1.00 0.00 O ATOM 773 CB CYS A 51 -17.053 -3.960 -2.779 1.00 0.00 C ATOM 774 SG CYS A 51 -15.659 -3.152 -3.599 1.00 0.00 S ATOM 0 H CYS A 51 -18.258 -1.839 -4.249 1.00 0.00 H new ATOM 0 HA CYS A 51 -19.050 -3.529 -1.959 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -16.716 -4.354 -1.820 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -17.368 -4.813 -3.381 1.00 0.00 H new ATOM 0 HG CYS A 51 -16.079 -2.094 -4.227 1.00 0.00 H new ATOM 780 N LEU A 52 -17.641 -1.983 -0.456 1.00 0.00 N ATOM 781 CA LEU A 52 -17.139 -0.901 0.386 1.00 0.00 C ATOM 782 C LEU A 52 -15.671 -1.120 0.738 1.00 0.00 C ATOM 783 O LEU A 52 -15.302 -2.152 1.299 1.00 0.00 O ATOM 784 CB LEU A 52 -17.983 -0.787 1.662 1.00 0.00 C ATOM 785 CG LEU A 52 -17.501 0.263 2.672 1.00 0.00 C ATOM 786 CD1 LEU A 52 -17.665 1.661 2.090 1.00 0.00 C ATOM 787 CD2 LEU A 52 -18.287 0.122 3.967 1.00 0.00 C ATOM 0 H LEU A 52 -17.807 -2.860 0.038 1.00 0.00 H new ATOM 0 HA LEU A 52 -17.218 0.031 -0.173 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -19.009 -0.552 1.380 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -18.002 -1.759 2.154 1.00 0.00 H new ATOM 0 HG LEU A 52 -16.444 0.104 2.885 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -17.320 2.399 2.814 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -17.076 1.746 1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -18.716 1.839 1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -17.944 0.868 4.684 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -19.348 0.272 3.767 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -18.133 -0.875 4.379 1.00 0.00 H new ATOM 799 N LEU A 53 -14.836 -0.142 0.405 1.00 0.00 N ATOM 800 CA LEU A 53 -13.407 -0.229 0.678 1.00 0.00 C ATOM 801 C LEU A 53 -13.055 0.496 1.973 1.00 0.00 C ATOM 802 O LEU A 53 -13.159 1.720 2.059 1.00 0.00 O ATOM 803 CB LEU A 53 -12.605 0.348 -0.495 1.00 0.00 C ATOM 804 CG LEU A 53 -11.081 0.298 -0.333 1.00 0.00 C ATOM 805 CD1 LEU A 53 -10.618 -1.146 -0.209 1.00 0.00 C ATOM 806 CD2 LEU A 53 -10.419 0.976 -1.524 1.00 0.00 C ATOM 0 H LEU A 53 -15.125 0.721 -0.055 1.00 0.00 H new ATOM 0 HA LEU A 53 -13.145 -1.280 0.797 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -12.876 -0.194 -1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -12.904 1.386 -0.643 1.00 0.00 H new ATOM 0 HG LEU A 53 -10.794 0.828 0.575 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -9.534 -1.172 -0.094 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -11.086 -1.605 0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -10.901 -1.697 -1.106 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.336 0.940 -1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -10.703 0.459 -2.441 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.744 2.015 -1.578 1.00 0.00 H new ATOM 818 N ASP A 54 -12.634 -0.267 2.976 1.00 0.00 N ATOM 819 CA ASP A 54 -12.273 0.302 4.269 1.00 0.00 C ATOM 820 C ASP A 54 -10.762 0.264 4.478 1.00 0.00 C ATOM 821 O ASP A 54 -10.171 -0.808 4.609 1.00 0.00 O ATOM 822 CB ASP A 54 -12.982 -0.446 5.402 1.00 0.00 C ATOM 823 CG ASP A 54 -12.738 0.136 6.789 1.00 0.00 C ATOM 824 OD1 ASP A 54 -11.890 0.989 6.914 1.00 0.00 O ATOM 825 OD2 ASP A 54 -13.502 -0.158 7.676 1.00 0.00 O ATOM 0 H ASP A 54 -12.534 -1.280 2.918 1.00 0.00 H new ATOM 0 HA ASP A 54 -12.595 1.343 4.281 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -14.054 -0.447 5.205 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -12.655 -1.486 5.395 1.00 0.00 H new ATOM 830 N ILE A 55 -10.145 1.440 4.506 1.00 0.00 N ATOM 831 CA ILE A 55 -8.691 1.539 4.517 1.00 0.00 C ATOM 832 C ILE A 55 -8.183 2.026 5.870 1.00 0.00 C ATOM 833 O ILE A 55 -8.596 3.079 6.358 1.00 0.00 O ATOM 834 CB ILE A 55 -8.181 2.485 3.416 1.00 0.00 C ATOM 835 CG1 ILE A 55 -8.598 1.970 2.035 1.00 0.00 C ATOM 836 CG2 ILE A 55 -6.670 2.632 3.498 1.00 0.00 C ATOM 837 CD1 ILE A 55 -8.354 2.958 0.917 1.00 0.00 C ATOM 0 H ILE A 55 -10.629 2.338 4.521 1.00 0.00 H new ATOM 0 HA ILE A 55 -8.306 0.537 4.327 1.00 0.00 H new ATOM 0 HB ILE A 55 -8.629 3.467 3.568 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -8.053 1.051 1.820 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -9.657 1.715 2.057 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -6.327 3.304 2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.396 3.041 4.471 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.202 1.656 3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -8.674 2.523 -0.030 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -8.921 3.870 1.107 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -7.291 3.195 0.866 1.00 0.00 H new ATOM 849 N LEU A 56 -7.283 1.254 6.471 1.00 0.00 N ATOM 850 CA LEU A 56 -6.696 1.622 7.754 1.00 0.00 C ATOM 851 C LEU A 56 -5.285 2.170 7.570 1.00 0.00 C ATOM 852 O LEU A 56 -4.374 1.445 7.170 1.00 0.00 O ATOM 853 CB LEU A 56 -6.682 0.414 8.699 1.00 0.00 C ATOM 854 CG LEU A 56 -8.054 -0.220 8.967 1.00 0.00 C ATOM 855 CD1 LEU A 56 -7.896 -1.450 9.852 1.00 0.00 C ATOM 856 CD2 LEU A 56 -8.967 0.803 9.623 1.00 0.00 C ATOM 0 H LEU A 56 -6.945 0.370 6.090 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.309 2.407 8.197 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.023 -0.347 8.281 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.249 0.722 9.651 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.501 -0.534 8.024 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.874 -1.893 10.037 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.256 -2.178 9.353 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.444 -1.160 10.801 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -9.941 0.352 9.813 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -8.529 1.130 10.566 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -9.087 1.661 8.961 1.00 0.00 H new ATOM 868 N ASP A 57 -5.110 3.453 7.865 1.00 0.00 N ATOM 869 CA ASP A 57 -3.814 4.106 7.706 1.00 0.00 C ATOM 870 C ASP A 57 -3.031 4.082 9.014 1.00 0.00 C ATOM 871 O ASP A 57 -3.496 4.578 10.040 1.00 0.00 O ATOM 872 CB ASP A 57 -3.993 5.547 7.224 1.00 0.00 C ATOM 873 CG ASP A 57 -2.689 6.283 6.943 1.00 0.00 C ATOM 874 OD1 ASP A 57 -1.649 5.726 7.203 1.00 0.00 O ATOM 875 OD2 ASP A 57 -2.737 7.323 6.330 1.00 0.00 O ATOM 0 H ASP A 57 -5.849 4.063 8.216 1.00 0.00 H new ATOM 0 HA ASP A 57 -3.248 3.554 6.955 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -4.596 5.541 6.316 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -4.554 6.102 7.976 1.00 0.00 H new ATOM 880 N THR A 58 -1.837 3.498 8.972 1.00 0.00 N ATOM 881 CA THR A 58 -1.003 3.375 10.162 1.00 0.00 C ATOM 882 C THR A 58 -0.243 4.667 10.435 1.00 0.00 C ATOM 883 O THR A 58 -0.156 5.542 9.574 1.00 0.00 O ATOM 884 CB THR A 58 0.002 2.216 10.029 1.00 0.00 C ATOM 885 OG1 THR A 58 0.875 2.462 8.919 1.00 0.00 O ATOM 886 CG2 THR A 58 -0.727 0.899 9.814 1.00 0.00 C ATOM 0 H THR A 58 -1.426 3.103 8.126 1.00 0.00 H new ATOM 0 HA THR A 58 -1.672 3.168 10.997 1.00 0.00 H new ATOM 0 HB THR A 58 0.582 2.151 10.949 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.610 1.814 8.931 1.00 0.00 H new ATOM 0 HG21 THR A 58 -0.000 0.092 9.722 1.00 0.00 H new ATOM 0 HG22 THR A 58 -1.382 0.703 10.663 1.00 0.00 H new ATOM 0 HG23 THR A 58 -1.322 0.957 8.903 1.00 0.00 H new ATOM 1053 N GLN A 70 -2.875 -3.685 16.269 1.00 0.00 N ATOM 1054 CA GLN A 70 -4.313 -3.918 16.328 1.00 0.00 C ATOM 1055 C GLN A 70 -4.897 -4.072 14.929 1.00 0.00 C ATOM 1056 O GLN A 70 -5.785 -4.896 14.702 1.00 0.00 O ATOM 1057 CB GLN A 70 -5.015 -2.770 17.060 1.00 0.00 C ATOM 1058 CG GLN A 70 -4.983 -1.446 16.315 1.00 0.00 C ATOM 1059 CD GLN A 70 -5.460 -0.289 17.172 1.00 0.00 C ATOM 1060 OE1 GLN A 70 -6.062 -0.488 18.230 1.00 0.00 O ATOM 1061 NE2 GLN A 70 -5.197 0.931 16.717 1.00 0.00 N ATOM 0 HA GLN A 70 -4.479 -4.844 16.879 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -6.053 -3.049 17.239 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -4.548 -2.637 18.036 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -3.966 -1.248 15.975 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -5.608 -1.518 15.425 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -4.696 1.050 15.836 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -5.496 1.749 17.248 1.00 0.00 H new ATOM 1070 N TYR A 71 -4.396 -3.276 13.993 1.00 0.00 N ATOM 1071 CA TYR A 71 -4.905 -3.287 12.626 1.00 0.00 C ATOM 1072 C TYR A 71 -4.690 -4.650 11.976 1.00 0.00 C ATOM 1073 O TYR A 71 -5.420 -5.034 11.062 1.00 0.00 O ATOM 1074 CB TYR A 71 -4.232 -2.194 11.793 1.00 0.00 C ATOM 1075 CG TYR A 71 -4.756 -0.801 12.071 1.00 0.00 C ATOM 1076 CD1 TYR A 71 -5.845 -0.603 12.906 1.00 0.00 C ATOM 1077 CD2 TYR A 71 -4.156 0.310 11.498 1.00 0.00 C ATOM 1078 CE1 TYR A 71 -6.328 0.666 13.162 1.00 0.00 C ATOM 1079 CE2 TYR A 71 -4.629 1.584 11.749 1.00 0.00 C ATOM 1080 CZ TYR A 71 -5.716 1.758 12.581 1.00 0.00 C ATOM 1081 OH TYR A 71 -6.191 3.024 12.835 1.00 0.00 O ATOM 0 H TYR A 71 -3.637 -2.614 14.155 1.00 0.00 H new ATOM 0 HA TYR A 71 -5.976 -3.089 12.664 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.159 -2.213 11.985 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -4.371 -2.419 10.736 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -6.324 -1.456 13.364 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -3.306 0.178 10.845 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -7.179 0.802 13.813 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -4.150 2.440 11.296 1.00 0.00 H new ATOM 0 HH TYR A 71 -6.588 3.051 13.731 1.00 0.00 H new ATOM 1091 N MET A 72 -3.685 -5.374 12.454 1.00 0.00 N ATOM 1092 CA MET A 72 -3.357 -6.684 11.900 1.00 0.00 C ATOM 1093 C MET A 72 -4.583 -7.589 11.880 1.00 0.00 C ATOM 1094 O MET A 72 -4.689 -8.487 11.044 1.00 0.00 O ATOM 1095 CB MET A 72 -2.232 -7.332 12.706 1.00 0.00 C ATOM 1096 CG MET A 72 -0.886 -6.631 12.584 1.00 0.00 C ATOM 1097 SD MET A 72 -0.112 -6.884 10.975 1.00 0.00 S ATOM 1098 CE MET A 72 0.051 -8.667 10.954 1.00 0.00 C ATOM 0 H MET A 72 -3.083 -5.078 13.223 1.00 0.00 H new ATOM 0 HA MET A 72 -3.020 -6.546 10.873 1.00 0.00 H new ATOM 0 HB2 MET A 72 -2.522 -7.356 13.757 1.00 0.00 H new ATOM 0 HB3 MET A 72 -2.120 -8.367 12.383 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.021 -5.563 12.754 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.219 -6.996 13.365 1.00 0.00 H new ATOM 0 HE1 MET A 72 0.867 -8.950 10.289 1.00 0.00 H new ATOM 0 HE2 MET A 72 0.263 -9.025 11.961 1.00 0.00 H new ATOM 0 HE3 MET A 72 -0.878 -9.113 10.599 1.00 0.00 H new ATOM 1108 N ARG A 73 -5.507 -7.347 12.803 1.00 0.00 N ATOM 1109 CA ARG A 73 -6.731 -8.135 12.885 1.00 0.00 C ATOM 1110 C ARG A 73 -7.433 -8.190 11.530 1.00 0.00 C ATOM 1111 O ARG A 73 -8.107 -9.169 11.208 1.00 0.00 O ATOM 1112 CB ARG A 73 -7.663 -7.638 13.979 1.00 0.00 C ATOM 1113 CG ARG A 73 -8.944 -8.442 14.143 1.00 0.00 C ATOM 1114 CD ARG A 73 -9.795 -8.012 15.282 1.00 0.00 C ATOM 1115 NE ARG A 73 -11.104 -8.644 15.327 1.00 0.00 N ATOM 1116 CZ ARG A 73 -12.073 -8.333 16.209 1.00 0.00 C ATOM 1117 NH1 ARG A 73 -11.875 -7.428 17.142 1.00 0.00 N ATOM 1118 NH2 ARG A 73 -13.224 -8.978 16.127 1.00 0.00 N ATOM 0 H ARG A 73 -5.432 -6.611 13.505 1.00 0.00 H new ATOM 0 HA ARG A 73 -6.446 -9.151 13.159 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -7.124 -7.644 14.926 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.926 -6.601 13.769 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -9.525 -8.369 13.223 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.685 -9.493 14.275 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -9.270 -8.226 16.213 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.928 -6.931 15.232 1.00 0.00 H new ATOM 0 HE ARG A 73 -11.302 -9.374 14.643 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.977 -6.949 17.206 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -12.620 -7.205 17.802 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -13.360 -9.690 15.409 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -13.976 -8.764 16.782 1.00 0.00 H new ATOM 1132 N THR A 74 -7.269 -7.132 10.741 1.00 0.00 N ATOM 1133 CA THR A 74 -7.786 -7.109 9.380 1.00 0.00 C ATOM 1134 C THR A 74 -7.226 -8.264 8.557 1.00 0.00 C ATOM 1135 O THR A 74 -7.976 -9.095 8.044 1.00 0.00 O ATOM 1136 CB THR A 74 -7.455 -5.780 8.673 1.00 0.00 C ATOM 1137 OG1 THR A 74 -8.184 -4.712 9.292 1.00 0.00 O ATOM 1138 CG2 THR A 74 -7.822 -5.853 7.199 1.00 0.00 C ATOM 0 H THR A 74 -6.782 -6.281 11.022 1.00 0.00 H new ATOM 0 HA THR A 74 -8.869 -7.212 9.454 1.00 0.00 H new ATOM 0 HB THR A 74 -6.384 -5.597 8.760 1.00 0.00 H new ATOM 0 HG1 THR A 74 -7.678 -4.372 10.059 1.00 0.00 H new ATOM 0 HG21 THR A 74 -7.581 -4.906 6.717 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.259 -6.656 6.723 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.889 -6.050 7.099 1.00 0.00 H new ATOM 1146 N GLY A 75 -5.903 -8.312 8.436 1.00 0.00 N ATOM 1147 CA GLY A 75 -5.232 -9.557 8.110 1.00 0.00 C ATOM 1148 C GLY A 75 -5.399 -9.941 6.653 1.00 0.00 C ATOM 1149 O GLY A 75 -4.819 -10.924 6.194 1.00 0.00 O ATOM 0 H GLY A 75 -5.284 -7.511 8.558 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -4.170 -9.465 8.339 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -5.626 -10.354 8.740 1.00 0.00 H new ATOM 1153 N GLU A 76 -6.197 -9.165 5.925 1.00 0.00 N ATOM 1154 CA GLU A 76 -6.516 -9.484 4.539 1.00 0.00 C ATOM 1155 C GLU A 76 -5.329 -9.188 3.627 1.00 0.00 C ATOM 1156 O GLU A 76 -4.799 -10.083 2.970 1.00 0.00 O ATOM 1157 CB GLU A 76 -7.746 -8.701 4.077 1.00 0.00 C ATOM 1158 CG GLU A 76 -9.046 -9.120 4.748 1.00 0.00 C ATOM 1159 CD GLU A 76 -10.205 -8.297 4.259 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -10.004 -7.478 3.394 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -11.311 -8.562 4.666 1.00 0.00 O ATOM 0 H GLU A 76 -6.634 -8.311 6.273 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.738 -10.550 4.480 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -7.579 -7.641 4.266 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -7.853 -8.819 2.999 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -9.237 -10.175 4.549 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.951 -9.012 5.828 1.00 0.00 H new ATOM 1168 N GLY A 77 -4.918 -7.924 3.592 1.00 0.00 N ATOM 1169 CA GLY A 77 -3.784 -7.535 2.772 1.00 0.00 C ATOM 1170 C GLY A 77 -3.153 -6.238 3.235 1.00 0.00 C ATOM 1171 O GLY A 77 -3.765 -5.472 3.982 1.00 0.00 O ATOM 0 H GLY A 77 -5.349 -7.163 4.116 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -3.036 -8.327 2.793 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -4.108 -7.429 1.737 1.00 0.00 H new ATOM 1175 N PHE A 78 -1.924 -5.988 2.793 1.00 0.00 N ATOM 1176 CA PHE A 78 -1.156 -4.846 3.273 1.00 0.00 C ATOM 1177 C PHE A 78 -0.522 -4.089 2.110 1.00 0.00 C ATOM 1178 O PHE A 78 0.176 -4.675 1.280 1.00 0.00 O ATOM 1179 CB PHE A 78 -0.078 -5.300 4.258 1.00 0.00 C ATOM 1180 CG PHE A 78 -0.626 -5.930 5.508 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -0.932 -7.283 5.543 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -0.837 -5.173 6.650 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -1.436 -7.864 6.691 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.340 -5.750 7.799 1.00 0.00 C ATOM 1185 CZ PHE A 78 -1.640 -7.097 7.820 1.00 0.00 C ATOM 0 H PHE A 78 -1.439 -6.562 2.103 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.840 -4.172 3.789 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.579 -6.014 3.760 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.535 -4.441 4.533 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.774 -7.889 4.663 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -0.605 -4.118 6.641 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.670 -8.918 6.705 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.499 -5.147 8.681 1.00 0.00 H new ATOM 0 HZ PHE A 78 -2.034 -7.550 8.718 1.00 0.00 H new ATOM 1195 N LEU A 79 -0.770 -2.786 2.054 1.00 0.00 N ATOM 1196 CA LEU A 79 -0.224 -1.948 0.991 1.00 0.00 C ATOM 1197 C LEU A 79 0.969 -1.142 1.492 1.00 0.00 C ATOM 1198 O LEU A 79 0.865 -0.397 2.468 1.00 0.00 O ATOM 1199 CB LEU A 79 -1.310 -1.013 0.442 1.00 0.00 C ATOM 1200 CG LEU A 79 -0.845 -0.046 -0.654 1.00 0.00 C ATOM 1201 CD1 LEU A 79 -0.460 -0.823 -1.907 1.00 0.00 C ATOM 1202 CD2 LEU A 79 -1.953 0.950 -0.958 1.00 0.00 C ATOM 0 H LEU A 79 -1.345 -2.286 2.732 1.00 0.00 H new ATOM 0 HA LEU A 79 0.120 -2.597 0.186 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.124 -1.620 0.047 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.718 -0.431 1.269 1.00 0.00 H new ATOM 0 HG LEU A 79 0.032 0.500 -0.308 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.131 -0.128 -2.680 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.350 -1.514 -1.672 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.323 -1.384 -2.267 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.621 1.637 -1.737 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.839 0.415 -1.299 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.193 1.513 -0.056 1.00 0.00 H new ATOM 1214 N CYS A 80 2.103 -1.292 0.815 1.00 0.00 N ATOM 1215 CA CYS A 80 3.337 -0.637 1.235 1.00 0.00 C ATOM 1216 C CYS A 80 3.650 0.555 0.337 1.00 0.00 C ATOM 1217 O CYS A 80 3.925 0.395 -0.852 1.00 0.00 O ATOM 1218 CB CYS A 80 4.383 -1.737 1.058 1.00 0.00 C ATOM 1219 SG CYS A 80 4.167 -3.160 2.153 1.00 0.00 S ATOM 0 H CYS A 80 2.193 -1.861 -0.027 1.00 0.00 H new ATOM 0 HA CYS A 80 3.292 -0.241 2.250 1.00 0.00 H new ATOM 0 HB2 CYS A 80 4.357 -2.083 0.025 1.00 0.00 H new ATOM 0 HB3 CYS A 80 5.372 -1.311 1.227 1.00 0.00 H new ATOM 0 HG CYS A 80 5.102 -4.033 1.920 1.00 0.00 H new ATOM 1225 N VAL A 81 3.606 1.753 0.915 1.00 0.00 N ATOM 1226 CA VAL A 81 3.819 2.978 0.153 1.00 0.00 C ATOM 1227 C VAL A 81 5.118 3.661 0.564 1.00 0.00 C ATOM 1228 O VAL A 81 5.357 3.907 1.745 1.00 0.00 O ATOM 1229 CB VAL A 81 2.651 3.965 0.333 1.00 0.00 C ATOM 1230 CG1 VAL A 81 2.918 5.251 -0.434 1.00 0.00 C ATOM 1231 CG2 VAL A 81 1.345 3.334 -0.127 1.00 0.00 C ATOM 0 H VAL A 81 3.425 1.900 1.908 1.00 0.00 H new ATOM 0 HA VAL A 81 3.879 2.690 -0.897 1.00 0.00 H new ATOM 0 HB VAL A 81 2.564 4.206 1.392 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.082 5.937 -0.296 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.833 5.713 -0.062 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.031 5.025 -1.494 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.530 4.045 0.007 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.422 3.065 -1.180 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.146 2.439 0.462 1.00 0.00 H new ATOM 1241 N PHE A 82 5.956 3.967 -0.423 1.00 0.00 N ATOM 1242 CA PHE A 82 7.242 4.606 -0.163 1.00 0.00 C ATOM 1243 C PHE A 82 7.583 5.606 -1.262 1.00 0.00 C ATOM 1244 O PHE A 82 6.894 5.687 -2.279 1.00 0.00 O ATOM 1245 CB PHE A 82 8.348 3.556 -0.041 1.00 0.00 C ATOM 1246 CG PHE A 82 8.545 2.736 -1.284 1.00 0.00 C ATOM 1247 CD1 PHE A 82 7.799 1.587 -1.502 1.00 0.00 C ATOM 1248 CD2 PHE A 82 9.477 3.113 -2.240 1.00 0.00 C ATOM 1249 CE1 PHE A 82 7.980 0.832 -2.644 1.00 0.00 C ATOM 1250 CE2 PHE A 82 9.659 2.360 -3.385 1.00 0.00 C ATOM 1251 CZ PHE A 82 8.911 1.219 -3.587 1.00 0.00 C ATOM 0 H PHE A 82 5.768 3.783 -1.408 1.00 0.00 H new ATOM 0 HA PHE A 82 7.167 5.146 0.781 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.285 4.056 0.206 1.00 0.00 H new ATOM 0 HB3 PHE A 82 8.114 2.890 0.789 1.00 0.00 H new ATOM 0 HD1 PHE A 82 7.068 1.279 -0.769 1.00 0.00 H new ATOM 0 HD2 PHE A 82 10.067 4.005 -2.088 1.00 0.00 H new ATOM 0 HE1 PHE A 82 7.393 -0.061 -2.799 1.00 0.00 H new ATOM 0 HE2 PHE A 82 10.387 2.665 -4.122 1.00 0.00 H new ATOM 0 HZ PHE A 82 9.053 0.630 -4.481 1.00 0.00 H new ATOM 1261 N ALA A 83 8.652 6.366 -1.052 1.00 0.00 N ATOM 1262 CA ALA A 83 9.079 7.370 -2.018 1.00 0.00 C ATOM 1263 C ALA A 83 10.271 6.878 -2.832 1.00 0.00 C ATOM 1264 O ALA A 83 11.181 6.244 -2.297 1.00 0.00 O ATOM 1265 CB ALA A 83 9.423 8.672 -1.310 1.00 0.00 C ATOM 0 H ALA A 83 9.239 6.305 -0.220 1.00 0.00 H new ATOM 0 HA ALA A 83 8.253 7.550 -2.705 1.00 0.00 H new ATOM 0 HB1 ALA A 83 9.740 9.413 -2.044 1.00 0.00 H new ATOM 0 HB2 ALA A 83 8.545 9.040 -0.779 1.00 0.00 H new ATOM 0 HB3 ALA A 83 10.230 8.497 -0.599 1.00 0.00 H new ATOM 1271 N ILE A 84 10.258 7.172 -4.127 1.00 0.00 N ATOM 1272 CA ILE A 84 11.313 6.716 -5.024 1.00 0.00 C ATOM 1273 C ILE A 84 12.652 7.352 -4.665 1.00 0.00 C ATOM 1274 O ILE A 84 13.706 6.899 -5.112 1.00 0.00 O ATOM 1275 CB ILE A 84 10.981 7.032 -6.493 1.00 0.00 C ATOM 1276 CG1 ILE A 84 11.831 6.170 -7.430 1.00 0.00 C ATOM 1277 CG2 ILE A 84 11.197 8.510 -6.782 1.00 0.00 C ATOM 1278 CD1 ILE A 84 11.352 6.171 -8.864 1.00 0.00 C ATOM 0 H ILE A 84 9.529 7.724 -4.579 1.00 0.00 H new ATOM 0 HA ILE A 84 11.384 5.635 -4.904 1.00 0.00 H new ATOM 0 HB ILE A 84 9.931 6.798 -6.669 1.00 0.00 H new ATOM 0 HG12 ILE A 84 12.861 6.525 -7.401 1.00 0.00 H new ATOM 0 HG13 ILE A 84 11.837 5.145 -7.060 1.00 0.00 H new ATOM 0 HG21 ILE A 84 10.957 8.716 -7.825 1.00 0.00 H new ATOM 0 HG22 ILE A 84 10.550 9.105 -6.137 1.00 0.00 H new ATOM 0 HG23 ILE A 84 12.238 8.770 -6.591 1.00 0.00 H new ATOM 0 HD11 ILE A 84 12.004 5.538 -9.466 1.00 0.00 H new ATOM 0 HD12 ILE A 84 10.333 5.787 -8.907 1.00 0.00 H new ATOM 0 HD13 ILE A 84 11.373 7.189 -9.254 1.00 0.00 H new ATOM 1290 N ASN A 85 12.604 8.403 -3.853 1.00 0.00 N ATOM 1291 CA ASN A 85 13.816 9.064 -3.385 1.00 0.00 C ATOM 1292 C ASN A 85 14.310 8.436 -2.085 1.00 0.00 C ATOM 1293 O ASN A 85 15.264 8.916 -1.475 1.00 0.00 O ATOM 1294 CB ASN A 85 13.603 10.555 -3.203 1.00 0.00 C ATOM 1295 CG ASN A 85 12.497 10.896 -2.241 1.00 0.00 C ATOM 1296 OD1 ASN A 85 11.328 10.564 -2.467 1.00 0.00 O ATOM 1297 ND2 ASN A 85 12.848 11.625 -1.214 1.00 0.00 N ATOM 0 H ASN A 85 11.738 8.815 -3.505 1.00 0.00 H new ATOM 0 HA ASN A 85 14.579 8.925 -4.151 1.00 0.00 H new ATOM 0 HB2 ASN A 85 14.531 11.005 -2.850 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.380 11.002 -4.172 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.142 11.948 -0.553 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.828 11.871 -1.074 1.00 0.00 H new ATOM 1304 N ASN A 86 13.652 7.360 -1.667 1.00 0.00 N ATOM 1305 CA ASN A 86 14.022 6.668 -0.437 1.00 0.00 C ATOM 1306 C ASN A 86 14.592 5.286 -0.741 1.00 0.00 C ATOM 1307 O ASN A 86 13.851 4.339 -1.006 1.00 0.00 O ATOM 1308 CB ASN A 86 12.844 6.554 0.513 1.00 0.00 C ATOM 1309 CG ASN A 86 12.449 7.859 1.147 1.00 0.00 C ATOM 1310 OD1 ASN A 86 13.247 8.800 1.227 1.00 0.00 O ATOM 1311 ND2 ASN A 86 11.250 7.893 1.668 1.00 0.00 N ATOM 0 H ASN A 86 12.860 6.948 -2.161 1.00 0.00 H new ATOM 0 HA ASN A 86 14.793 7.263 0.052 1.00 0.00 H new ATOM 0 HB2 ASN A 86 11.989 6.151 -0.030 1.00 0.00 H new ATOM 0 HB3 ASN A 86 13.090 5.839 1.298 1.00 0.00 H new ATOM 0 HD21 ASN A 86 10.935 8.724 2.169 1.00 0.00 H new ATOM 0 HD22 ASN A 86 10.630 7.089 1.573 1.00 0.00 H new ATOM 1318 N THR A 87 15.917 5.178 -0.698 1.00 0.00 N ATOM 1319 CA THR A 87 16.578 3.879 -0.722 1.00 0.00 C ATOM 1320 C THR A 87 16.263 3.079 0.538 1.00 0.00 C ATOM 1321 O THR A 87 15.923 1.897 0.467 1.00 0.00 O ATOM 1322 CB THR A 87 18.105 4.025 -0.857 1.00 0.00 C ATOM 1323 OG1 THR A 87 18.416 4.675 -2.096 1.00 0.00 O ATOM 1324 CG2 THR A 87 18.775 2.660 -0.824 1.00 0.00 C ATOM 0 H THR A 87 16.553 5.974 -0.646 1.00 0.00 H new ATOM 0 HA THR A 87 16.195 3.347 -1.593 1.00 0.00 H new ATOM 0 HB THR A 87 18.474 4.621 -0.022 1.00 0.00 H new ATOM 0 HG1 THR A 87 17.887 4.275 -2.817 1.00 0.00 H new ATOM 0 HG21 THR A 87 19.854 2.782 -0.921 1.00 0.00 H new ATOM 0 HG22 THR A 87 18.549 2.166 0.121 1.00 0.00 H new ATOM 0 HG23 THR A 87 18.403 2.052 -1.649 1.00 0.00 H new ATOM 1332 N LYS A 88 16.378 3.730 1.690 1.00 0.00 N ATOM 1333 CA LYS A 88 16.259 3.044 2.972 1.00 0.00 C ATOM 1334 C LYS A 88 14.896 2.372 3.105 1.00 0.00 C ATOM 1335 O LYS A 88 14.752 1.374 3.812 1.00 0.00 O ATOM 1336 CB LYS A 88 16.482 4.022 4.127 1.00 0.00 C ATOM 1337 CG LYS A 88 17.916 4.512 4.269 1.00 0.00 C ATOM 1338 CD LYS A 88 18.060 5.472 5.442 1.00 0.00 C ATOM 1339 CE LYS A 88 19.497 5.947 5.596 1.00 0.00 C ATOM 1340 NZ LYS A 88 19.650 6.895 6.733 1.00 0.00 N ATOM 0 H LYS A 88 16.554 4.732 1.763 1.00 0.00 H new ATOM 0 HA LYS A 88 17.028 2.272 3.014 1.00 0.00 H new ATOM 0 HB2 LYS A 88 15.829 4.884 3.989 1.00 0.00 H new ATOM 0 HB3 LYS A 88 16.182 3.541 5.058 1.00 0.00 H new ATOM 0 HG2 LYS A 88 18.581 3.660 4.410 1.00 0.00 H new ATOM 0 HG3 LYS A 88 18.225 5.009 3.350 1.00 0.00 H new ATOM 0 HD2 LYS A 88 17.405 6.331 5.294 1.00 0.00 H new ATOM 0 HD3 LYS A 88 17.738 4.979 6.359 1.00 0.00 H new ATOM 0 HE2 LYS A 88 20.149 5.087 5.750 1.00 0.00 H new ATOM 0 HE3 LYS A 88 19.820 6.431 4.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 20.643 7.195 6.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 19.048 7.728 6.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 19.366 6.426 7.617 1.00 0.00 H new ATOM 1354 N SER A 89 13.901 2.923 2.419 1.00 0.00 N ATOM 1355 CA SER A 89 12.539 2.408 2.502 1.00 0.00 C ATOM 1356 C SER A 89 12.490 0.935 2.107 1.00 0.00 C ATOM 1357 O SER A 89 11.595 0.199 2.523 1.00 0.00 O ATOM 1358 CB SER A 89 11.616 3.225 1.619 1.00 0.00 C ATOM 1359 OG SER A 89 11.801 2.944 0.259 1.00 0.00 O ATOM 0 H SER A 89 14.012 3.726 1.800 1.00 0.00 H new ATOM 0 HA SER A 89 12.202 2.492 3.535 1.00 0.00 H new ATOM 0 HB2 SER A 89 10.581 3.023 1.893 1.00 0.00 H new ATOM 0 HB3 SER A 89 11.791 4.286 1.796 1.00 0.00 H new ATOM 0 HG SER A 89 12.540 3.485 -0.089 1.00 0.00 H new ATOM 1365 N PHE A 90 13.459 0.513 1.300 1.00 0.00 N ATOM 1366 CA PHE A 90 13.536 -0.876 0.862 1.00 0.00 C ATOM 1367 C PHE A 90 13.736 -1.811 2.050 1.00 0.00 C ATOM 1368 O PHE A 90 13.111 -2.868 2.132 1.00 0.00 O ATOM 1369 CB PHE A 90 14.669 -1.056 -0.149 1.00 0.00 C ATOM 1370 CG PHE A 90 14.320 -0.603 -1.539 1.00 0.00 C ATOM 1371 CD1 PHE A 90 13.022 -0.231 -1.857 1.00 0.00 C ATOM 1372 CD2 PHE A 90 15.287 -0.547 -2.530 1.00 0.00 C ATOM 1373 CE1 PHE A 90 12.700 0.185 -3.134 1.00 0.00 C ATOM 1374 CE2 PHE A 90 14.968 -0.130 -3.808 1.00 0.00 C ATOM 1375 CZ PHE A 90 13.672 0.237 -4.110 1.00 0.00 C ATOM 0 H PHE A 90 14.200 1.112 0.937 1.00 0.00 H new ATOM 0 HA PHE A 90 12.592 -1.131 0.380 1.00 0.00 H new ATOM 0 HB2 PHE A 90 15.542 -0.501 0.195 1.00 0.00 H new ATOM 0 HB3 PHE A 90 14.952 -2.108 -0.180 1.00 0.00 H new ATOM 0 HD1 PHE A 90 12.255 -0.267 -1.098 1.00 0.00 H new ATOM 0 HD2 PHE A 90 16.303 -0.833 -2.300 1.00 0.00 H new ATOM 0 HE1 PHE A 90 11.685 0.470 -3.368 1.00 0.00 H new ATOM 0 HE2 PHE A 90 15.732 -0.091 -4.570 1.00 0.00 H new ATOM 0 HZ PHE A 90 13.420 0.564 -5.108 1.00 0.00 H new ATOM 1385 N GLU A 91 14.613 -1.414 2.967 1.00 0.00 N ATOM 1386 CA GLU A 91 14.864 -2.196 4.173 1.00 0.00 C ATOM 1387 C GLU A 91 13.631 -2.223 5.071 1.00 0.00 C ATOM 1388 O GLU A 91 13.333 -3.235 5.705 1.00 0.00 O ATOM 1389 CB GLU A 91 16.064 -1.634 4.937 1.00 0.00 C ATOM 1390 CG GLU A 91 17.403 -1.832 4.241 1.00 0.00 C ATOM 1391 CD GLU A 91 18.514 -1.146 4.987 1.00 0.00 C ATOM 1392 OE1 GLU A 91 18.233 -0.494 5.964 1.00 0.00 O ATOM 1393 OE2 GLU A 91 19.653 -1.365 4.649 1.00 0.00 O ATOM 0 H GLU A 91 15.161 -0.557 2.898 1.00 0.00 H new ATOM 0 HA GLU A 91 15.090 -3.219 3.871 1.00 0.00 H new ATOM 0 HB2 GLU A 91 15.908 -0.568 5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.106 -2.104 5.919 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.620 -2.897 4.161 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.348 -1.441 3.225 1.00 0.00 H new ATOM 1400 N ASP A 92 12.920 -1.101 5.121 1.00 0.00 N ATOM 1401 CA ASP A 92 11.724 -0.991 5.949 1.00 0.00 C ATOM 1402 C ASP A 92 10.634 -1.936 5.456 1.00 0.00 C ATOM 1403 O ASP A 92 9.874 -2.491 6.252 1.00 0.00 O ATOM 1404 CB ASP A 92 11.208 0.451 5.961 1.00 0.00 C ATOM 1405 CG ASP A 92 12.057 1.415 6.779 1.00 0.00 C ATOM 1406 OD1 ASP A 92 12.879 0.957 7.536 1.00 0.00 O ATOM 1407 OD2 ASP A 92 11.989 2.594 6.526 1.00 0.00 O ATOM 0 H ASP A 92 13.151 -0.256 4.599 1.00 0.00 H new ATOM 0 HA ASP A 92 11.991 -1.275 6.967 1.00 0.00 H new ATOM 0 HB2 ASP A 92 11.155 0.814 4.935 1.00 0.00 H new ATOM 0 HB3 ASP A 92 10.191 0.457 6.354 1.00 0.00 H new ATOM 1412 N ILE A 93 10.559 -2.112 4.141 1.00 0.00 N ATOM 1413 CA ILE A 93 9.598 -3.033 3.548 1.00 0.00 C ATOM 1414 C ILE A 93 9.818 -4.456 4.051 1.00 0.00 C ATOM 1415 O ILE A 93 8.866 -5.161 4.387 1.00 0.00 O ATOM 1416 CB ILE A 93 9.680 -3.022 2.010 1.00 0.00 C ATOM 1417 CG1 ILE A 93 9.180 -1.685 1.459 1.00 0.00 C ATOM 1418 CG2 ILE A 93 8.881 -4.177 1.427 1.00 0.00 C ATOM 1419 CD1 ILE A 93 9.501 -1.468 -0.002 1.00 0.00 C ATOM 0 H ILE A 93 11.152 -1.629 3.466 1.00 0.00 H new ATOM 0 HA ILE A 93 8.607 -2.693 3.851 1.00 0.00 H new ATOM 0 HB ILE A 93 10.722 -3.145 1.716 1.00 0.00 H new ATOM 0 HG12 ILE A 93 8.100 -1.627 1.596 1.00 0.00 H new ATOM 0 HG13 ILE A 93 9.619 -0.875 2.042 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.950 -4.154 0.339 1.00 0.00 H new ATOM 0 HG22 ILE A 93 9.283 -5.120 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 93 7.837 -4.085 1.727 1.00 0.00 H new ATOM 0 HD11 ILE A 93 9.115 -0.499 -0.319 1.00 0.00 H new ATOM 0 HD12 ILE A 93 10.581 -1.492 -0.145 1.00 0.00 H new ATOM 0 HD13 ILE A 93 9.039 -2.256 -0.597 1.00 0.00 H new ATOM 1431 N HIS A 94 11.080 -4.872 4.104 1.00 0.00 N ATOM 1432 CA HIS A 94 11.426 -6.207 4.577 1.00 0.00 C ATOM 1433 C HIS A 94 11.101 -6.360 6.059 1.00 0.00 C ATOM 1434 O HIS A 94 10.606 -7.401 6.492 1.00 0.00 O ATOM 1435 CB HIS A 94 12.908 -6.504 4.330 1.00 0.00 C ATOM 1436 CG HIS A 94 13.295 -7.921 4.621 1.00 0.00 C ATOM 1437 ND1 HIS A 94 13.965 -8.289 5.769 1.00 0.00 N ATOM 1438 CD2 HIS A 94 13.107 -9.060 3.913 1.00 0.00 C ATOM 1439 CE1 HIS A 94 14.171 -9.595 5.754 1.00 0.00 C ATOM 1440 NE2 HIS A 94 13.661 -10.085 4.640 1.00 0.00 N ATOM 0 H HIS A 94 11.879 -4.303 3.825 1.00 0.00 H new ATOM 0 HA HIS A 94 10.828 -6.925 4.015 1.00 0.00 H new ATOM 0 HB2 HIS A 94 13.146 -6.278 3.291 1.00 0.00 H new ATOM 0 HB3 HIS A 94 13.511 -5.838 4.948 1.00 0.00 H new ATOM 0 HD1 HIS A 94 14.256 -7.654 6.512 1.00 0.00 H new ATOM 0 HD2 HIS A 94 12.614 -9.146 2.956 1.00 0.00 H new ATOM 0 HE1 HIS A 94 14.672 -10.164 6.523 1.00 0.00 H new ATOM 1447 N GLN A 95 11.384 -5.316 6.831 1.00 0.00 N ATOM 1448 CA GLN A 95 11.006 -5.285 8.241 1.00 0.00 C ATOM 1449 C GLN A 95 9.495 -5.409 8.402 1.00 0.00 C ATOM 1450 O GLN A 95 9.011 -6.157 9.252 1.00 0.00 O ATOM 1451 CB GLN A 95 11.494 -3.991 8.899 1.00 0.00 C ATOM 1452 CG GLN A 95 13.002 -3.903 9.056 1.00 0.00 C ATOM 1453 CD GLN A 95 13.466 -2.504 9.415 1.00 0.00 C ATOM 1454 OE1 GLN A 95 12.533 -1.559 9.433 1.00 0.00 O flip ATOM 1455 NE2 GLN A 95 14.650 -2.275 9.676 1.00 0.00 N flip ATOM 0 H GLN A 95 11.873 -4.482 6.506 1.00 0.00 H new ATOM 0 HA GLN A 95 11.479 -6.134 8.734 1.00 0.00 H new ATOM 0 HB2 GLN A 95 11.152 -3.143 8.306 1.00 0.00 H new ATOM 0 HB3 GLN A 95 11.032 -3.900 9.882 1.00 0.00 H new ATOM 0 HG2 GLN A 95 13.325 -4.600 9.830 1.00 0.00 H new ATOM 0 HG3 GLN A 95 13.480 -4.214 8.127 1.00 0.00 H new ATOM 0 HE21 GLN A 95 15.334 -3.032 9.650 1.00 0.00 H new ATOM 0 HE22 GLN A 95 14.945 -1.329 9.918 1.00 0.00 H new ATOM 1464 N TYR A 96 8.754 -4.673 7.582 1.00 0.00 N ATOM 1465 CA TYR A 96 7.299 -4.781 7.559 1.00 0.00 C ATOM 1466 C TYR A 96 6.865 -6.214 7.269 1.00 0.00 C ATOM 1467 O TYR A 96 5.906 -6.715 7.856 1.00 0.00 O ATOM 1468 CB TYR A 96 6.706 -3.830 6.519 1.00 0.00 C ATOM 1469 CG TYR A 96 6.438 -2.436 7.043 1.00 0.00 C ATOM 1470 CD1 TYR A 96 5.524 -2.226 8.065 1.00 0.00 C ATOM 1471 CD2 TYR A 96 7.098 -1.337 6.516 1.00 0.00 C ATOM 1472 CE1 TYR A 96 5.274 -0.956 8.549 1.00 0.00 C ATOM 1473 CE2 TYR A 96 6.856 -0.062 6.992 1.00 0.00 C ATOM 1474 CZ TYR A 96 5.943 0.123 8.010 1.00 0.00 C ATOM 1475 OH TYR A 96 5.697 1.390 8.487 1.00 0.00 O ATOM 0 H TYR A 96 9.136 -3.994 6.924 1.00 0.00 H new ATOM 0 HA TYR A 96 6.925 -4.500 8.544 1.00 0.00 H new ATOM 0 HB2 TYR A 96 7.388 -3.764 5.671 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.773 -4.252 6.145 1.00 0.00 H new ATOM 0 HD1 TYR A 96 4.999 -3.069 8.490 1.00 0.00 H new ATOM 0 HD2 TYR A 96 7.814 -1.479 5.720 1.00 0.00 H new ATOM 0 HE1 TYR A 96 4.559 -0.809 9.345 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.378 0.784 6.570 1.00 0.00 H new ATOM 0 HH TYR A 96 6.504 1.938 8.391 1.00 0.00 H new ATOM 1485 N ARG A 97 7.579 -6.869 6.359 1.00 0.00 N ATOM 1486 CA ARG A 97 7.253 -8.237 5.973 1.00 0.00 C ATOM 1487 C ARG A 97 7.332 -9.173 7.176 1.00 0.00 C ATOM 1488 O ARG A 97 6.419 -9.961 7.422 1.00 0.00 O ATOM 1489 CB ARG A 97 8.116 -8.732 4.822 1.00 0.00 C ATOM 1490 CG ARG A 97 7.766 -10.121 4.312 1.00 0.00 C ATOM 1491 CD ARG A 97 8.707 -10.655 3.293 1.00 0.00 C ATOM 1492 NE ARG A 97 10.038 -10.950 3.798 1.00 0.00 N ATOM 1493 CZ ARG A 97 10.373 -12.075 4.458 1.00 0.00 C ATOM 1494 NH1 ARG A 97 9.474 -12.995 4.728 1.00 0.00 N ATOM 1495 NH2 ARG A 97 11.628 -12.220 4.849 1.00 0.00 N ATOM 0 H ARG A 97 8.386 -6.475 5.876 1.00 0.00 H new ATOM 0 HA ARG A 97 6.225 -8.236 5.611 1.00 0.00 H new ATOM 0 HB2 ARG A 97 8.034 -8.026 3.996 1.00 0.00 H new ATOM 0 HB3 ARG A 97 9.158 -8.730 5.141 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.736 -10.809 5.157 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.763 -10.096 3.886 1.00 0.00 H new ATOM 0 HD2 ARG A 97 8.284 -11.565 2.867 1.00 0.00 H new ATOM 0 HD3 ARG A 97 8.792 -9.933 2.481 1.00 0.00 H new ATOM 0 HE ARG A 97 10.769 -10.256 3.641 1.00 0.00 H new ATOM 0 HH11 ARG A 97 8.505 -12.863 4.437 1.00 0.00 H new ATOM 0 HH12 ARG A 97 9.745 -13.841 5.229 1.00 0.00 H new ATOM 0 HH21 ARG A 97 12.312 -11.490 4.649 1.00 0.00 H new ATOM 0 HH22 ARG A 97 11.912 -13.061 5.351 1.00 0.00 H new ATOM 1509 N GLU A 98 8.431 -9.082 7.920 1.00 0.00 N ATOM 1510 CA GLU A 98 8.673 -9.989 9.036 1.00 0.00 C ATOM 1511 C GLU A 98 7.732 -9.684 10.198 1.00 0.00 C ATOM 1512 O GLU A 98 7.235 -10.593 10.862 1.00 0.00 O ATOM 1513 CB GLU A 98 10.130 -9.896 9.498 1.00 0.00 C ATOM 1514 CG GLU A 98 11.136 -10.493 8.524 1.00 0.00 C ATOM 1515 CD GLU A 98 12.540 -10.372 9.047 1.00 0.00 C ATOM 1516 OE1 GLU A 98 12.727 -9.720 10.046 1.00 0.00 O ATOM 1517 OE2 GLU A 98 13.409 -11.023 8.516 1.00 0.00 O ATOM 0 H GLU A 98 9.166 -8.391 7.770 1.00 0.00 H new ATOM 0 HA GLU A 98 8.479 -11.005 8.693 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.380 -8.848 9.663 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.227 -10.402 10.458 1.00 0.00 H new ATOM 0 HG2 GLU A 98 10.899 -11.543 8.351 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.059 -9.986 7.562 1.00 0.00 H new ATOM 1524 N GLN A 99 7.495 -8.399 10.439 1.00 0.00 N ATOM 1525 CA GLN A 99 6.599 -7.974 11.507 1.00 0.00 C ATOM 1526 C GLN A 99 5.169 -8.421 11.229 1.00 0.00 C ATOM 1527 O GLN A 99 4.476 -8.912 12.122 1.00 0.00 O ATOM 1528 CB GLN A 99 6.643 -6.452 11.673 1.00 0.00 C ATOM 1529 CG GLN A 99 7.924 -5.932 12.301 1.00 0.00 C ATOM 1530 CD GLN A 99 8.044 -4.422 12.204 1.00 0.00 C ATOM 1531 OE1 GLN A 99 7.068 -3.792 11.560 1.00 0.00 O flip ATOM 1532 NE2 GLN A 99 9.003 -3.828 12.705 1.00 0.00 N flip ATOM 0 H GLN A 99 7.911 -7.634 9.909 1.00 0.00 H new ATOM 0 HA GLN A 99 6.937 -8.442 12.431 1.00 0.00 H new ATOM 0 HB2 GLN A 99 6.516 -5.987 10.695 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.798 -6.140 12.287 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.959 -6.230 13.349 1.00 0.00 H new ATOM 0 HG3 GLN A 99 8.780 -6.394 11.810 1.00 0.00 H new ATOM 0 HE21 GLN A 99 9.730 -4.353 13.191 1.00 0.00 H new ATOM 0 HE22 GLN A 99 9.068 -2.813 12.633 1.00 0.00 H new ATOM 1541 N ILE A 100 4.732 -8.250 9.987 1.00 0.00 N ATOM 1542 CA ILE A 100 3.437 -8.763 9.554 1.00 0.00 C ATOM 1543 C ILE A 100 3.389 -10.285 9.644 1.00 0.00 C ATOM 1544 O ILE A 100 2.379 -10.863 10.045 1.00 0.00 O ATOM 1545 CB ILE A 100 3.112 -8.331 8.112 1.00 0.00 C ATOM 1546 CG1 ILE A 100 2.843 -6.825 8.054 1.00 0.00 C ATOM 1547 CG2 ILE A 100 1.918 -9.110 7.581 1.00 0.00 C ATOM 1548 CD1 ILE A 100 2.815 -6.264 6.651 1.00 0.00 C ATOM 0 H ILE A 100 5.255 -7.760 9.261 1.00 0.00 H new ATOM 0 HA ILE A 100 2.690 -8.340 10.226 1.00 0.00 H new ATOM 0 HB ILE A 100 3.973 -8.551 7.481 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.889 -6.617 8.538 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.611 -6.306 8.628 1.00 0.00 H new ATOM 0 HG21 ILE A 100 1.701 -8.793 6.561 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.146 -10.176 7.589 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.050 -8.920 8.212 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.619 -5.192 6.691 1.00 0.00 H new ATOM 0 HD12 ILE A 100 3.777 -6.439 6.170 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.028 -6.755 6.078 1.00 0.00 H new ATOM 1560 N LYS A 101 4.491 -10.927 9.272 1.00 0.00 N ATOM 1561 CA LYS A 101 4.560 -12.384 9.261 1.00 0.00 C ATOM 1562 C LYS A 101 4.363 -12.949 10.665 1.00 0.00 C ATOM 1563 O LYS A 101 3.537 -13.837 10.876 1.00 0.00 O ATOM 1564 CB LYS A 101 5.897 -12.854 8.685 1.00 0.00 C ATOM 1565 CG LYS A 101 6.030 -14.367 8.560 1.00 0.00 C ATOM 1566 CD LYS A 101 7.417 -14.761 8.073 1.00 0.00 C ATOM 1567 CE LYS A 101 7.562 -16.273 7.979 1.00 0.00 C ATOM 1568 NZ LYS A 101 8.929 -16.675 7.549 1.00 0.00 N ATOM 0 H LYS A 101 5.349 -10.462 8.974 1.00 0.00 H new ATOM 0 HA LYS A 101 3.756 -12.755 8.626 1.00 0.00 H new ATOM 0 HB2 LYS A 101 6.032 -12.407 7.700 1.00 0.00 H new ATOM 0 HB3 LYS A 101 6.703 -12.481 9.318 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.836 -14.833 9.526 1.00 0.00 H new ATOM 0 HG3 LYS A 101 5.278 -14.744 7.867 1.00 0.00 H new ATOM 0 HD2 LYS A 101 7.602 -14.314 7.096 1.00 0.00 H new ATOM 0 HD3 LYS A 101 8.170 -14.363 8.753 1.00 0.00 H new ATOM 0 HE2 LYS A 101 7.341 -16.720 8.948 1.00 0.00 H new ATOM 0 HE3 LYS A 101 6.830 -16.664 7.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.986 -17.712 7.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 9.131 -16.270 6.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 9.626 -16.324 8.236 1.00 0.00 H new ATOM 1582 N ARG A 102 5.126 -12.428 11.619 1.00 0.00 N ATOM 1583 CA ARG A 102 5.187 -13.012 12.953 1.00 0.00 C ATOM 1584 C ARG A 102 3.907 -12.723 13.732 1.00 0.00 C ATOM 1585 O ARG A 102 3.351 -13.608 14.383 1.00 0.00 O ATOM 1586 CB ARG A 102 6.423 -12.566 13.721 1.00 0.00 C ATOM 1587 CG ARG A 102 7.733 -13.151 13.220 1.00 0.00 C ATOM 1588 CD ARG A 102 8.934 -12.682 13.957 1.00 0.00 C ATOM 1589 NE ARG A 102 10.180 -13.306 13.538 1.00 0.00 N ATOM 1590 CZ ARG A 102 11.390 -13.022 14.058 1.00 0.00 C ATOM 1591 NH1 ARG A 102 11.530 -12.100 14.985 1.00 0.00 N ATOM 1592 NH2 ARG A 102 12.439 -13.677 13.591 1.00 0.00 N ATOM 0 H ARG A 102 5.711 -11.602 11.493 1.00 0.00 H new ATOM 0 HA ARG A 102 5.271 -14.092 12.831 1.00 0.00 H new ATOM 0 HB2 ARG A 102 6.487 -11.479 13.678 1.00 0.00 H new ATOM 0 HB3 ARG A 102 6.299 -12.836 14.770 1.00 0.00 H new ATOM 0 HG2 ARG A 102 7.681 -14.238 13.287 1.00 0.00 H new ATOM 0 HG3 ARG A 102 7.848 -12.902 12.165 1.00 0.00 H new ATOM 0 HD2 ARG A 102 9.023 -11.603 13.833 1.00 0.00 H new ATOM 0 HD3 ARG A 102 8.788 -12.869 15.021 1.00 0.00 H new ATOM 0 HE ARG A 102 10.134 -14.007 12.799 1.00 0.00 H new ATOM 0 HH11 ARG A 102 10.715 -11.587 15.321 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.454 -11.898 15.368 1.00 0.00 H new ATOM 0 HH21 ARG A 102 12.319 -14.375 12.857 1.00 0.00 H new ATOM 0 HH22 ARG A 102 13.368 -13.484 13.965 1.00 0.00 H new ATOM 1606 N VAL A 103 3.445 -11.479 13.661 1.00 0.00 N ATOM 1607 CA VAL A 103 2.268 -11.056 14.413 1.00 0.00 C ATOM 1608 C VAL A 103 1.017 -11.776 13.924 1.00 0.00 C ATOM 1609 O VAL A 103 0.122 -12.093 14.709 1.00 0.00 O ATOM 1610 CB VAL A 103 2.049 -9.535 14.312 1.00 0.00 C ATOM 1611 CG1 VAL A 103 0.715 -9.146 14.931 1.00 0.00 C ATOM 1612 CG2 VAL A 103 3.187 -8.786 14.988 1.00 0.00 C ATOM 0 H VAL A 103 3.867 -10.746 13.091 1.00 0.00 H new ATOM 0 HA VAL A 103 2.449 -11.317 15.456 1.00 0.00 H new ATOM 0 HB VAL A 103 2.033 -9.260 13.257 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.577 -8.068 14.851 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.092 -9.655 14.405 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.703 -9.436 15.982 1.00 0.00 H new ATOM 0 HG21 VAL A 103 3.015 -7.713 14.907 1.00 0.00 H new ATOM 0 HG22 VAL A 103 3.233 -9.067 16.040 1.00 0.00 H new ATOM 0 HG23 VAL A 103 4.129 -9.040 14.502 1.00 0.00 H new ATOM 1622 N LYS A 104 0.958 -12.032 12.621 1.00 0.00 N ATOM 1623 CA LYS A 104 -0.190 -12.703 12.024 1.00 0.00 C ATOM 1624 C LYS A 104 -0.073 -14.217 12.171 1.00 0.00 C ATOM 1625 O LYS A 104 -0.978 -14.960 11.790 1.00 0.00 O ATOM 1626 CB LYS A 104 -0.324 -12.326 10.547 1.00 0.00 C ATOM 1627 CG LYS A 104 -1.700 -12.591 9.953 1.00 0.00 C ATOM 1628 CD LYS A 104 -2.773 -11.769 10.651 1.00 0.00 C ATOM 1629 CE LYS A 104 -4.152 -12.052 10.073 1.00 0.00 C ATOM 1630 NZ LYS A 104 -5.227 -11.352 10.829 1.00 0.00 N ATOM 0 H LYS A 104 1.693 -11.784 11.958 1.00 0.00 H new ATOM 0 HA LYS A 104 -1.084 -12.374 12.553 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -0.090 -11.268 10.432 1.00 0.00 H new ATOM 0 HB3 LYS A 104 0.419 -12.881 9.974 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -1.691 -12.352 8.889 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -1.938 -13.651 10.040 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -2.770 -11.995 11.717 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -2.545 -10.708 10.549 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -4.179 -11.738 9.029 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -4.338 -13.126 10.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -6.137 -11.488 10.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.285 -11.742 11.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.010 -10.336 10.880 1.00 0.00 H new ATOM 1644 N ASP A 105 1.046 -14.668 12.729 1.00 0.00 N ATOM 1645 CA ASP A 105 1.355 -16.092 12.780 1.00 0.00 C ATOM 1646 C ASP A 105 1.079 -16.756 11.435 1.00 0.00 C ATOM 1647 O ASP A 105 0.427 -17.799 11.368 1.00 0.00 O ATOM 1648 CB ASP A 105 0.548 -16.779 13.884 1.00 0.00 C ATOM 1649 CG ASP A 105 0.857 -16.283 15.291 1.00 0.00 C ATOM 1650 OD1 ASP A 105 2.012 -16.215 15.635 1.00 0.00 O ATOM 1651 OD2 ASP A 105 -0.048 -15.830 15.951 1.00 0.00 O ATOM 0 H ASP A 105 1.754 -14.068 13.152 1.00 0.00 H new ATOM 0 HA ASP A 105 2.416 -16.199 13.005 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -0.514 -16.633 13.685 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.736 -17.852 13.841 1.00 0.00 H new ATOM 1656 N SER A 106 1.577 -16.145 10.364 1.00 0.00 N ATOM 1657 CA SER A 106 1.336 -16.645 9.017 1.00 0.00 C ATOM 1658 C SER A 106 2.499 -16.299 8.093 1.00 0.00 C ATOM 1659 O SER A 106 3.234 -15.340 8.332 1.00 0.00 O ATOM 1660 CB SER A 106 0.039 -16.079 8.474 1.00 0.00 C ATOM 1661 OG SER A 106 0.124 -14.700 8.237 1.00 0.00 O ATOM 0 H SER A 106 2.150 -15.302 10.404 1.00 0.00 H new ATOM 0 HA SER A 106 1.253 -17.731 9.062 1.00 0.00 H new ATOM 0 HB2 SER A 106 -0.219 -16.591 7.547 1.00 0.00 H new ATOM 0 HB3 SER A 106 -0.766 -16.276 9.182 1.00 0.00 H new ATOM 0 HG SER A 106 -0.731 -14.375 7.886 1.00 0.00 H new ATOM 1667 N ASP A 107 2.662 -17.088 7.036 1.00 0.00 N ATOM 1668 CA ASP A 107 3.667 -16.805 6.018 1.00 0.00 C ATOM 1669 C ASP A 107 3.340 -15.512 5.275 1.00 0.00 C ATOM 1670 O ASP A 107 2.370 -14.829 5.598 1.00 0.00 O ATOM 1671 CB ASP A 107 3.775 -17.970 5.031 1.00 0.00 C ATOM 1672 CG ASP A 107 2.536 -18.182 4.170 1.00 0.00 C ATOM 1673 OD1 ASP A 107 1.684 -17.326 4.170 1.00 0.00 O ATOM 1674 OD2 ASP A 107 2.522 -19.115 3.404 1.00 0.00 O ATOM 0 H ASP A 107 2.111 -17.929 6.862 1.00 0.00 H new ATOM 0 HA ASP A 107 4.628 -16.680 6.518 1.00 0.00 H new ATOM 0 HB2 ASP A 107 4.631 -17.799 4.378 1.00 0.00 H new ATOM 0 HB3 ASP A 107 3.976 -18.885 5.588 1.00 0.00 H new ATOM 1679 N ASP A 108 4.158 -15.186 4.280 1.00 0.00 N ATOM 1680 CA ASP A 108 4.047 -13.907 3.588 1.00 0.00 C ATOM 1681 C ASP A 108 2.619 -13.673 3.106 1.00 0.00 C ATOM 1682 O ASP A 108 1.849 -14.616 2.929 1.00 0.00 O ATOM 1683 CB ASP A 108 5.020 -13.846 2.408 1.00 0.00 C ATOM 1684 CG ASP A 108 6.484 -13.715 2.807 1.00 0.00 C ATOM 1685 OD1 ASP A 108 6.745 -13.434 3.953 1.00 0.00 O ATOM 1686 OD2 ASP A 108 7.328 -14.050 2.010 1.00 0.00 O ATOM 0 H ASP A 108 4.905 -15.789 3.935 1.00 0.00 H new ATOM 0 HA ASP A 108 4.306 -13.118 4.294 1.00 0.00 H new ATOM 0 HB2 ASP A 108 4.899 -14.747 1.806 1.00 0.00 H new ATOM 0 HB3 ASP A 108 4.751 -13.001 1.774 1.00 0.00 H new ATOM 1691 N VAL A 109 2.271 -12.407 2.895 1.00 0.00 N ATOM 1692 CA VAL A 109 0.877 -12.018 2.710 1.00 0.00 C ATOM 1693 C VAL A 109 0.706 -11.165 1.459 1.00 0.00 C ATOM 1694 O VAL A 109 1.667 -10.625 0.908 1.00 0.00 O ATOM 1695 CB VAL A 109 0.341 -11.239 3.927 1.00 0.00 C ATOM 1696 CG1 VAL A 109 0.411 -12.098 5.182 1.00 0.00 C ATOM 1697 CG2 VAL A 109 1.124 -9.950 4.122 1.00 0.00 C ATOM 0 H VAL A 109 2.935 -11.634 2.848 1.00 0.00 H new ATOM 0 HA VAL A 109 0.305 -12.940 2.600 1.00 0.00 H new ATOM 0 HB VAL A 109 -0.702 -10.984 3.740 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.029 -11.532 6.032 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.192 -12.996 5.043 1.00 0.00 H new ATOM 0 HG13 VAL A 109 1.446 -12.382 5.371 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.732 -9.413 4.986 1.00 0.00 H new ATOM 0 HG22 VAL A 109 2.176 -10.185 4.287 1.00 0.00 H new ATOM 0 HG23 VAL A 109 1.027 -9.327 3.233 1.00 0.00 H new ATOM 1707 N PRO A 110 -0.546 -11.040 0.995 1.00 0.00 N ATOM 1708 CA PRO A 110 -0.892 -10.152 -0.119 1.00 0.00 C ATOM 1709 C PRO A 110 -0.353 -8.739 0.079 1.00 0.00 C ATOM 1710 O PRO A 110 -0.682 -8.069 1.056 1.00 0.00 O ATOM 1711 CB PRO A 110 -2.425 -10.176 -0.147 1.00 0.00 C ATOM 1712 CG PRO A 110 -2.785 -11.495 0.447 1.00 0.00 C ATOM 1713 CD PRO A 110 -1.769 -11.737 1.531 1.00 0.00 C ATOM 0 HA PRO A 110 -0.449 -10.481 -1.059 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -2.846 -9.352 0.429 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -2.806 -10.081 -1.164 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -3.796 -11.480 0.853 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.754 -12.285 -0.303 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -2.088 -11.320 2.486 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -1.592 -12.801 1.691 1.00 0.00 H new ATOM 1721 N MET A 111 0.477 -8.292 -0.860 1.00 0.00 N ATOM 1722 CA MET A 111 1.163 -7.013 -0.725 1.00 0.00 C ATOM 1723 C MET A 111 1.335 -6.341 -2.084 1.00 0.00 C ATOM 1724 O MET A 111 1.424 -7.013 -3.111 1.00 0.00 O ATOM 1725 CB MET A 111 2.522 -7.210 -0.055 1.00 0.00 C ATOM 1726 CG MET A 111 2.451 -7.516 1.434 1.00 0.00 C ATOM 1727 SD MET A 111 4.081 -7.671 2.191 1.00 0.00 S ATOM 1728 CE MET A 111 4.615 -9.245 1.527 1.00 0.00 C ATOM 0 H MET A 111 0.690 -8.797 -1.721 1.00 0.00 H new ATOM 0 HA MET A 111 0.552 -6.363 -0.099 1.00 0.00 H new ATOM 0 HB2 MET A 111 3.046 -8.024 -0.556 1.00 0.00 H new ATOM 0 HB3 MET A 111 3.119 -6.310 -0.200 1.00 0.00 H new ATOM 0 HG2 MET A 111 1.895 -6.725 1.937 1.00 0.00 H new ATOM 0 HG3 MET A 111 1.895 -8.442 1.585 1.00 0.00 H new ATOM 0 HE1 MET A 111 5.595 -9.497 1.933 1.00 0.00 H new ATOM 0 HE2 MET A 111 3.898 -10.018 1.803 1.00 0.00 H new ATOM 0 HE3 MET A 111 4.678 -9.179 0.441 1.00 0.00 H new ATOM 1738 N VAL A 112 1.380 -5.013 -2.081 1.00 0.00 N ATOM 1739 CA VAL A 112 1.775 -4.259 -3.264 1.00 0.00 C ATOM 1740 C VAL A 112 2.771 -3.160 -2.908 1.00 0.00 C ATOM 1741 O VAL A 112 2.634 -2.493 -1.882 1.00 0.00 O ATOM 1742 CB VAL A 112 0.557 -3.628 -3.966 1.00 0.00 C ATOM 1743 CG1 VAL A 112 1.001 -2.798 -5.161 1.00 0.00 C ATOM 1744 CG2 VAL A 112 -0.424 -4.706 -4.401 1.00 0.00 C ATOM 0 H VAL A 112 1.148 -4.437 -1.272 1.00 0.00 H new ATOM 0 HA VAL A 112 2.247 -4.967 -3.945 1.00 0.00 H new ATOM 0 HB VAL A 112 0.054 -2.970 -3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 112 0.128 -2.360 -5.644 1.00 0.00 H new ATOM 0 HG12 VAL A 112 1.666 -2.003 -4.825 1.00 0.00 H new ATOM 0 HG13 VAL A 112 1.527 -3.435 -5.871 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -1.278 -4.243 -4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 112 0.069 -5.389 -5.093 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -0.767 -5.260 -3.527 1.00 0.00 H new ATOM 1754 N LEU A 113 3.771 -2.977 -3.763 1.00 0.00 N ATOM 1755 CA LEU A 113 4.756 -1.918 -3.571 1.00 0.00 C ATOM 1756 C LEU A 113 4.424 -0.702 -4.432 1.00 0.00 C ATOM 1757 O LEU A 113 4.275 -0.813 -5.649 1.00 0.00 O ATOM 1758 CB LEU A 113 6.163 -2.435 -3.895 1.00 0.00 C ATOM 1759 CG LEU A 113 6.669 -3.563 -2.985 1.00 0.00 C ATOM 1760 CD1 LEU A 113 8.150 -3.814 -3.240 1.00 0.00 C ATOM 1761 CD2 LEU A 113 6.427 -3.189 -1.530 1.00 0.00 C ATOM 0 H LEU A 113 3.921 -3.547 -4.595 1.00 0.00 H new ATOM 0 HA LEU A 113 4.727 -1.611 -2.526 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.175 -2.788 -4.926 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.862 -1.601 -3.836 1.00 0.00 H new ATOM 0 HG LEU A 113 6.125 -4.481 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.500 -4.616 -2.590 1.00 0.00 H new ATOM 0 HD12 LEU A 113 8.296 -4.101 -4.281 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.714 -2.905 -3.031 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.786 -3.990 -0.884 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.961 -2.268 -1.297 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.360 -3.041 -1.365 1.00 0.00 H new ATOM 1773 N VAL A 114 4.310 0.457 -3.792 1.00 0.00 N ATOM 1774 CA VAL A 114 3.995 1.692 -4.500 1.00 0.00 C ATOM 1775 C VAL A 114 5.094 2.731 -4.308 1.00 0.00 C ATOM 1776 O VAL A 114 5.493 3.029 -3.182 1.00 0.00 O ATOM 1777 CB VAL A 114 2.652 2.286 -4.030 1.00 0.00 C ATOM 1778 CG1 VAL A 114 2.373 3.600 -4.744 1.00 0.00 C ATOM 1779 CG2 VAL A 114 1.521 1.299 -4.272 1.00 0.00 C ATOM 0 H VAL A 114 4.431 0.567 -2.785 1.00 0.00 H new ATOM 0 HA VAL A 114 3.919 1.438 -5.557 1.00 0.00 H new ATOM 0 HB VAL A 114 2.716 2.482 -2.960 1.00 0.00 H new ATOM 0 HG11 VAL A 114 1.421 4.006 -4.401 1.00 0.00 H new ATOM 0 HG12 VAL A 114 3.171 4.310 -4.524 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.327 3.427 -5.819 1.00 0.00 H new ATOM 0 HG21 VAL A 114 0.580 1.734 -3.935 1.00 0.00 H new ATOM 0 HG22 VAL A 114 1.456 1.074 -5.337 1.00 0.00 H new ATOM 0 HG23 VAL A 114 1.715 0.380 -3.718 1.00 0.00 H new ATOM 1789 N GLY A 115 5.581 3.281 -5.417 1.00 0.00 N ATOM 1790 CA GLY A 115 6.592 4.320 -5.348 1.00 0.00 C ATOM 1791 C GLY A 115 6.063 5.672 -5.784 1.00 0.00 C ATOM 1792 O GLY A 115 5.627 5.838 -6.923 1.00 0.00 O ATOM 0 H GLY A 115 5.293 3.025 -6.362 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.966 4.392 -4.327 1.00 0.00 H new ATOM 0 HA3 GLY A 115 7.437 4.043 -5.978 1.00 0.00 H new ATOM 1796 N ASN A 116 6.101 6.641 -4.876 1.00 0.00 N ATOM 1797 CA ASN A 116 5.617 7.986 -5.171 1.00 0.00 C ATOM 1798 C ASN A 116 6.769 8.903 -5.566 1.00 0.00 C ATOM 1799 O ASN A 116 7.939 8.562 -5.392 1.00 0.00 O ATOM 1800 CB ASN A 116 4.853 8.572 -3.998 1.00 0.00 C ATOM 1801 CG ASN A 116 3.809 9.578 -4.398 1.00 0.00 C ATOM 1802 OD1 ASN A 116 3.809 10.088 -5.525 1.00 0.00 O ATOM 1803 ND2 ASN A 116 2.969 9.925 -3.457 1.00 0.00 N ATOM 0 H ASN A 116 6.462 6.521 -3.930 1.00 0.00 H new ATOM 0 HA ASN A 116 4.930 7.908 -6.014 1.00 0.00 H new ATOM 0 HB2 ASN A 116 4.373 7.763 -3.448 1.00 0.00 H new ATOM 0 HB3 ASN A 116 5.559 9.046 -3.316 1.00 0.00 H new ATOM 0 HD21 ASN A 116 2.272 10.648 -3.637 1.00 0.00 H new ATOM 0 HD22 ASN A 116 3.011 9.473 -2.544 1.00 0.00 H new ATOM 1810 N LYS A 117 6.429 10.074 -6.098 1.00 0.00 N ATOM 1811 CA LYS A 117 7.427 11.090 -6.412 1.00 0.00 C ATOM 1812 C LYS A 117 8.316 10.641 -7.566 1.00 0.00 C ATOM 1813 O LYS A 117 9.515 10.925 -7.585 1.00 0.00 O ATOM 1814 CB LYS A 117 8.278 11.405 -5.180 1.00 0.00 C ATOM 1815 CG LYS A 117 7.481 11.851 -3.962 1.00 0.00 C ATOM 1816 CD LYS A 117 6.439 12.895 -4.334 1.00 0.00 C ATOM 1817 CE LYS A 117 7.082 14.245 -4.618 1.00 0.00 C ATOM 1818 NZ LYS A 117 6.086 15.250 -5.075 1.00 0.00 N ATOM 0 H LYS A 117 5.470 10.342 -6.320 1.00 0.00 H new ATOM 0 HA LYS A 117 6.902 11.996 -6.716 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.856 10.519 -4.916 1.00 0.00 H new ATOM 0 HB3 LYS A 117 8.993 12.187 -5.437 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.990 10.989 -3.511 1.00 0.00 H new ATOM 0 HG3 LYS A 117 8.158 12.261 -3.212 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.886 12.562 -5.212 1.00 0.00 H new ATOM 0 HD3 LYS A 117 5.718 12.997 -3.523 1.00 0.00 H new ATOM 0 HE2 LYS A 117 7.576 14.608 -3.717 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.853 14.127 -5.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 6.565 16.155 -5.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.632 14.916 -5.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.364 15.383 -4.339 1.00 0.00 H new ATOM 1832 N CYS A 118 7.723 9.943 -8.527 1.00 0.00 N ATOM 1833 CA CYS A 118 8.470 9.427 -9.670 1.00 0.00 C ATOM 1834 C CYS A 118 8.814 10.546 -10.646 1.00 0.00 C ATOM 1835 O CYS A 118 9.576 10.346 -11.592 1.00 0.00 O ATOM 1836 CB CYS A 118 7.486 8.442 -10.302 1.00 0.00 C ATOM 1837 SG CYS A 118 7.110 6.997 -9.280 1.00 0.00 S ATOM 0 H CYS A 118 6.728 9.721 -8.539 1.00 0.00 H new ATOM 0 HA CYS A 118 9.421 8.973 -9.393 1.00 0.00 H new ATOM 0 HB2 CYS A 118 6.557 8.967 -10.522 1.00 0.00 H new ATOM 0 HB3 CYS A 118 7.893 8.102 -11.254 1.00 0.00 H new ATOM 0 HG CYS A 118 6.058 7.240 -8.556 1.00 0.00 H new ATOM 1843 N ASP A 119 8.245 11.723 -10.411 1.00 0.00 N ATOM 1844 CA ASP A 119 8.565 12.901 -11.211 1.00 0.00 C ATOM 1845 C ASP A 119 9.645 13.739 -10.536 1.00 0.00 C ATOM 1846 O ASP A 119 10.070 14.767 -11.066 1.00 0.00 O ATOM 1847 CB ASP A 119 7.312 13.746 -11.449 1.00 0.00 C ATOM 1848 CG ASP A 119 6.245 13.065 -12.294 1.00 0.00 C ATOM 1849 OD1 ASP A 119 6.594 12.454 -13.278 1.00 0.00 O ATOM 1850 OD2 ASP A 119 5.115 13.025 -11.870 1.00 0.00 O ATOM 0 H ASP A 119 7.560 11.888 -9.673 1.00 0.00 H new ATOM 0 HA ASP A 119 8.945 12.561 -12.174 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.879 14.012 -10.484 1.00 0.00 H new ATOM 0 HB3 ASP A 119 7.603 14.677 -11.935 1.00 0.00 H new ATOM 1855 N LEU A 120 10.086 13.294 -9.363 1.00 0.00 N ATOM 1856 CA LEU A 120 11.164 13.967 -8.646 1.00 0.00 C ATOM 1857 C LEU A 120 12.514 13.677 -9.298 1.00 0.00 C ATOM 1858 O LEU A 120 12.827 12.531 -9.614 1.00 0.00 O ATOM 1859 CB LEU A 120 11.175 13.536 -7.175 1.00 0.00 C ATOM 1860 CG LEU A 120 12.221 14.236 -6.297 1.00 0.00 C ATOM 1861 CD1 LEU A 120 11.912 15.725 -6.206 1.00 0.00 C ATOM 1862 CD2 LEU A 120 12.230 13.602 -4.914 1.00 0.00 C ATOM 0 H LEU A 120 9.714 12.471 -8.889 1.00 0.00 H new ATOM 0 HA LEU A 120 10.988 15.042 -8.694 1.00 0.00 H new ATOM 0 HB2 LEU A 120 10.187 13.719 -6.752 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.347 12.461 -7.129 1.00 0.00 H new ATOM 0 HG LEU A 120 13.209 14.118 -6.743 1.00 0.00 H new ATOM 0 HD11 LEU A 120 12.659 16.214 -5.581 1.00 0.00 H new ATOM 0 HD12 LEU A 120 11.931 16.162 -7.204 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.924 15.865 -5.767 1.00 0.00 H new ATOM 0 HD21 LEU A 120 12.973 14.099 -4.291 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.245 13.708 -4.459 1.00 0.00 H new ATOM 0 HD23 LEU A 120 12.478 12.544 -5.000 1.00 0.00 H new ATOM 1874 N ALA A 121 13.309 14.724 -9.491 1.00 0.00 N ATOM 1875 CA ALA A 121 14.596 14.593 -10.161 1.00 0.00 C ATOM 1876 C ALA A 121 15.627 13.942 -9.244 1.00 0.00 C ATOM 1877 O ALA A 121 16.373 13.058 -9.663 1.00 0.00 O ATOM 1878 CB ALA A 121 15.089 15.954 -10.630 1.00 0.00 C ATOM 0 H ALA A 121 13.084 15.673 -9.192 1.00 0.00 H new ATOM 0 HA ALA A 121 14.462 13.949 -11.030 1.00 0.00 H new ATOM 0 HB1 ALA A 121 16.052 15.840 -11.129 1.00 0.00 H new ATOM 0 HB2 ALA A 121 14.368 16.382 -11.326 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.201 16.616 -9.771 1.00 0.00 H new ATOM 1884 N ALA A 122 15.662 14.386 -7.992 1.00 0.00 N ATOM 1885 CA ALA A 122 16.600 13.843 -7.016 1.00 0.00 C ATOM 1886 C ALA A 122 16.050 12.572 -6.375 1.00 0.00 C ATOM 1887 O ALA A 122 15.488 12.612 -5.281 1.00 0.00 O ATOM 1888 CB ALA A 122 16.912 14.882 -5.950 1.00 0.00 C ATOM 0 H ALA A 122 15.053 15.119 -7.630 1.00 0.00 H new ATOM 0 HA ALA A 122 17.522 13.586 -7.538 1.00 0.00 H new ATOM 0 HB1 ALA A 122 17.613 14.463 -5.228 1.00 0.00 H new ATOM 0 HB2 ALA A 122 17.354 15.762 -6.418 1.00 0.00 H new ATOM 0 HB3 ALA A 122 15.992 15.167 -5.439 1.00 0.00 H new ATOM 1894 N ARG A 123 16.216 11.449 -7.065 1.00 0.00 N ATOM 1895 CA ARG A 123 15.808 10.155 -6.527 1.00 0.00 C ATOM 1896 C ARG A 123 17.016 9.244 -6.330 1.00 0.00 C ATOM 1897 O ARG A 123 18.037 9.394 -7.001 1.00 0.00 O ATOM 1898 CB ARG A 123 14.737 9.490 -7.378 1.00 0.00 C ATOM 1899 CG ARG A 123 15.143 9.215 -8.816 1.00 0.00 C ATOM 1900 CD ARG A 123 14.114 8.503 -9.618 1.00 0.00 C ATOM 1901 NE ARG A 123 14.428 8.381 -11.032 1.00 0.00 N ATOM 1902 CZ ARG A 123 15.160 7.386 -11.570 1.00 0.00 C ATOM 1903 NH1 ARG A 123 15.685 6.447 -10.815 1.00 0.00 N ATOM 1904 NH2 ARG A 123 15.356 7.393 -12.877 1.00 0.00 N ATOM 0 H ARG A 123 16.629 11.408 -7.997 1.00 0.00 H new ATOM 0 HA ARG A 123 15.359 10.336 -5.550 1.00 0.00 H new ATOM 0 HB2 ARG A 123 14.454 8.548 -6.909 1.00 0.00 H new ATOM 0 HB3 ARG A 123 13.850 10.124 -7.381 1.00 0.00 H new ATOM 0 HG2 ARG A 123 15.375 10.162 -9.303 1.00 0.00 H new ATOM 0 HG3 ARG A 123 16.059 8.624 -8.816 1.00 0.00 H new ATOM 0 HD2 ARG A 123 13.975 7.505 -9.203 1.00 0.00 H new ATOM 0 HD3 ARG A 123 13.164 9.027 -9.514 1.00 0.00 H new ATOM 0 HE ARG A 123 14.069 9.099 -11.661 1.00 0.00 H new ATOM 0 HH11 ARG A 123 15.541 6.464 -9.805 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.237 5.701 -11.239 1.00 0.00 H new ATOM 0 HH21 ARG A 123 14.957 8.138 -13.448 1.00 0.00 H new ATOM 0 HH22 ARG A 123 15.906 6.653 -13.314 1.00 0.00 H new ATOM 1918 N THR A 124 16.892 8.298 -5.405 1.00 0.00 N ATOM 1919 CA THR A 124 17.963 7.347 -5.136 1.00 0.00 C ATOM 1920 C THR A 124 17.486 5.912 -5.329 1.00 0.00 C ATOM 1921 O THR A 124 18.073 4.974 -4.792 1.00 0.00 O ATOM 1922 CB THR A 124 18.516 7.507 -3.707 1.00 0.00 C ATOM 1923 OG1 THR A 124 17.458 7.310 -2.759 1.00 0.00 O ATOM 1924 CG2 THR A 124 19.111 8.893 -3.517 1.00 0.00 C ATOM 0 H THR A 124 16.060 8.170 -4.829 1.00 0.00 H new ATOM 0 HA THR A 124 18.760 7.561 -5.849 1.00 0.00 H new ATOM 0 HB THR A 124 19.298 6.764 -3.550 1.00 0.00 H new ATOM 0 HG1 THR A 124 17.545 6.423 -2.351 1.00 0.00 H new ATOM 0 HG21 THR A 124 19.496 8.987 -2.502 1.00 0.00 H new ATOM 0 HG22 THR A 124 19.923 9.041 -4.229 1.00 0.00 H new ATOM 0 HG23 THR A 124 18.341 9.646 -3.684 1.00 0.00 H new ATOM 1932 N VAL A 125 16.416 5.748 -6.101 1.00 0.00 N ATOM 1933 CA VAL A 125 15.940 4.422 -6.478 1.00 0.00 C ATOM 1934 C VAL A 125 15.809 4.296 -7.990 1.00 0.00 C ATOM 1935 O VAL A 125 15.043 5.025 -8.621 1.00 0.00 O ATOM 1936 CB VAL A 125 14.582 4.103 -5.824 1.00 0.00 C ATOM 1937 CG1 VAL A 125 14.055 2.764 -6.319 1.00 0.00 C ATOM 1938 CG2 VAL A 125 14.708 4.097 -4.309 1.00 0.00 C ATOM 0 H VAL A 125 15.862 6.517 -6.478 1.00 0.00 H new ATOM 0 HA VAL A 125 16.680 3.707 -6.120 1.00 0.00 H new ATOM 0 HB VAL A 125 13.872 4.880 -6.107 1.00 0.00 H new ATOM 0 HG11 VAL A 125 13.095 2.554 -5.847 1.00 0.00 H new ATOM 0 HG12 VAL A 125 13.927 2.801 -7.401 1.00 0.00 H new ATOM 0 HG13 VAL A 125 14.765 1.977 -6.064 1.00 0.00 H new ATOM 0 HG21 VAL A 125 13.739 3.870 -3.864 1.00 0.00 H new ATOM 0 HG22 VAL A 125 15.432 3.340 -4.007 1.00 0.00 H new ATOM 0 HG23 VAL A 125 15.043 5.076 -3.968 1.00 0.00 H new ATOM 1948 N GLU A 126 16.560 3.364 -8.568 1.00 0.00 N ATOM 1949 CA GLU A 126 16.341 2.954 -9.950 1.00 0.00 C ATOM 1950 C GLU A 126 15.087 2.094 -10.069 1.00 0.00 C ATOM 1951 O GLU A 126 14.848 1.208 -9.248 1.00 0.00 O ATOM 1952 CB GLU A 126 17.556 2.195 -10.485 1.00 0.00 C ATOM 1953 CG GLU A 126 17.484 1.858 -11.968 1.00 0.00 C ATOM 1954 CD GLU A 126 18.746 1.189 -12.438 1.00 0.00 C ATOM 1955 OE1 GLU A 126 19.615 0.966 -11.629 1.00 0.00 O ATOM 1956 OE2 GLU A 126 18.797 0.798 -13.580 1.00 0.00 O ATOM 0 H GLU A 126 17.326 2.879 -8.100 1.00 0.00 H new ATOM 0 HA GLU A 126 16.200 3.853 -10.550 1.00 0.00 H new ATOM 0 HB2 GLU A 126 18.450 2.791 -10.303 1.00 0.00 H new ATOM 0 HB3 GLU A 126 17.669 1.270 -9.920 1.00 0.00 H new ATOM 0 HG2 GLU A 126 16.632 1.204 -12.154 1.00 0.00 H new ATOM 0 HG3 GLU A 126 17.317 2.769 -12.543 1.00 0.00 H new ATOM 1963 N SER A 127 14.288 2.361 -11.097 1.00 0.00 N ATOM 1964 CA SER A 127 13.026 1.655 -11.289 1.00 0.00 C ATOM 1965 C SER A 127 13.248 0.147 -11.340 1.00 0.00 C ATOM 1966 O SER A 127 12.427 -0.630 -10.852 1.00 0.00 O ATOM 1967 CB SER A 127 12.344 2.135 -12.555 1.00 0.00 C ATOM 1968 OG SER A 127 11.925 3.468 -12.456 1.00 0.00 O ATOM 0 H SER A 127 14.492 3.061 -11.810 1.00 0.00 H new ATOM 0 HA SER A 127 12.379 1.872 -10.439 1.00 0.00 H new ATOM 0 HB2 SER A 127 13.029 2.033 -13.396 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.484 1.500 -12.766 1.00 0.00 H new ATOM 0 HG SER A 127 10.949 3.499 -12.375 1.00 0.00 H new ATOM 1974 N ARG A 128 14.364 -0.259 -11.937 1.00 0.00 N ATOM 1975 CA ARG A 128 14.692 -1.675 -12.062 1.00 0.00 C ATOM 1976 C ARG A 128 14.818 -2.327 -10.689 1.00 0.00 C ATOM 1977 O ARG A 128 14.386 -3.461 -10.489 1.00 0.00 O ATOM 1978 CB ARG A 128 15.936 -1.905 -12.909 1.00 0.00 C ATOM 1979 CG ARG A 128 15.766 -1.606 -14.389 1.00 0.00 C ATOM 1980 CD ARG A 128 17.003 -1.770 -15.193 1.00 0.00 C ATOM 1981 NE ARG A 128 16.857 -1.434 -16.600 1.00 0.00 N ATOM 1982 CZ ARG A 128 17.867 -1.420 -17.492 1.00 0.00 C ATOM 1983 NH1 ARG A 128 19.101 -1.686 -17.123 1.00 0.00 N ATOM 1984 NH2 ARG A 128 17.588 -1.109 -18.746 1.00 0.00 N ATOM 0 H ARG A 128 15.056 0.372 -12.342 1.00 0.00 H new ATOM 0 HA ARG A 128 13.866 -2.155 -12.588 1.00 0.00 H new ATOM 0 HB2 ARG A 128 16.743 -1.286 -12.518 1.00 0.00 H new ATOM 0 HB3 ARG A 128 16.248 -2.943 -12.796 1.00 0.00 H new ATOM 0 HG2 ARG A 128 14.995 -2.261 -14.793 1.00 0.00 H new ATOM 0 HG3 ARG A 128 15.407 -0.583 -14.502 1.00 0.00 H new ATOM 0 HD2 ARG A 128 17.786 -1.146 -14.763 1.00 0.00 H new ATOM 0 HD3 ARG A 128 17.339 -2.804 -15.112 1.00 0.00 H new ATOM 0 HE ARG A 128 15.925 -1.192 -16.935 1.00 0.00 H new ATOM 0 HH11 ARG A 128 19.305 -1.907 -16.149 1.00 0.00 H new ATOM 0 HH12 ARG A 128 19.854 -1.671 -17.811 1.00 0.00 H new ATOM 0 HH21 ARG A 128 16.629 -0.888 -19.015 1.00 0.00 H new ATOM 0 HH22 ARG A 128 18.331 -1.090 -19.444 1.00 0.00 H new ATOM 1998 N GLN A 129 15.415 -1.602 -9.748 1.00 0.00 N ATOM 1999 CA GLN A 129 15.655 -2.133 -8.411 1.00 0.00 C ATOM 2000 C GLN A 129 14.343 -2.342 -7.664 1.00 0.00 C ATOM 2001 O GLN A 129 14.117 -3.394 -7.066 1.00 0.00 O ATOM 2002 CB GLN A 129 16.562 -1.192 -7.614 1.00 0.00 C ATOM 2003 CG GLN A 129 17.991 -1.122 -8.125 1.00 0.00 C ATOM 2004 CD GLN A 129 18.770 0.024 -7.510 1.00 0.00 C ATOM 2005 OE1 GLN A 129 18.081 0.863 -6.744 1.00 0.00 O flip ATOM 2006 NE2 GLN A 129 19.979 0.153 -7.718 1.00 0.00 N flip ATOM 0 H GLN A 129 15.741 -0.646 -9.887 1.00 0.00 H new ATOM 0 HA GLN A 129 16.151 -3.098 -8.519 1.00 0.00 H new ATOM 0 HB2 GLN A 129 16.132 -0.190 -7.632 1.00 0.00 H new ATOM 0 HB3 GLN A 129 16.576 -1.515 -6.573 1.00 0.00 H new ATOM 0 HG2 GLN A 129 18.499 -2.061 -7.906 1.00 0.00 H new ATOM 0 HG3 GLN A 129 17.981 -1.010 -9.209 1.00 0.00 H new ATOM 0 HE21 GLN A 129 20.468 -0.515 -8.313 1.00 0.00 H new ATOM 0 HE22 GLN A 129 20.489 0.928 -7.295 1.00 0.00 H new ATOM 2015 N ALA A 130 13.478 -1.334 -7.704 1.00 0.00 N ATOM 2016 CA ALA A 130 12.217 -1.381 -6.974 1.00 0.00 C ATOM 2017 C ALA A 130 11.308 -2.478 -7.519 1.00 0.00 C ATOM 2018 O ALA A 130 10.663 -3.195 -6.756 1.00 0.00 O ATOM 2019 CB ALA A 130 11.516 -0.032 -7.044 1.00 0.00 C ATOM 0 H ALA A 130 13.627 -0.475 -8.234 1.00 0.00 H new ATOM 0 HA ALA A 130 12.438 -1.611 -5.932 1.00 0.00 H new ATOM 0 HB1 ALA A 130 10.576 -0.082 -6.495 1.00 0.00 H new ATOM 0 HB2 ALA A 130 12.154 0.733 -6.602 1.00 0.00 H new ATOM 0 HB3 ALA A 130 11.315 0.220 -8.085 1.00 0.00 H new ATOM 2025 N GLN A 131 11.263 -2.602 -8.840 1.00 0.00 N ATOM 2026 CA GLN A 131 10.425 -3.605 -9.487 1.00 0.00 C ATOM 2027 C GLN A 131 10.923 -5.012 -9.177 1.00 0.00 C ATOM 2028 O GLN A 131 10.136 -5.903 -8.858 1.00 0.00 O ATOM 2029 CB GLN A 131 10.395 -3.386 -11.002 1.00 0.00 C ATOM 2030 CG GLN A 131 9.547 -4.392 -11.760 1.00 0.00 C ATOM 2031 CD GLN A 131 9.577 -4.161 -13.259 1.00 0.00 C ATOM 2032 OE1 GLN A 131 8.798 -3.367 -13.795 1.00 0.00 O ATOM 2033 NE2 GLN A 131 10.475 -4.859 -13.947 1.00 0.00 N ATOM 0 H GLN A 131 11.797 -2.020 -9.485 1.00 0.00 H new ATOM 0 HA GLN A 131 9.414 -3.499 -9.094 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.018 -2.384 -11.205 1.00 0.00 H new ATOM 0 HB3 GLN A 131 11.415 -3.427 -11.384 1.00 0.00 H new ATOM 0 HG2 GLN A 131 9.903 -5.399 -11.543 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.517 -4.335 -11.407 1.00 0.00 H new ATOM 0 HE21 GLN A 131 11.099 -5.504 -13.463 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.540 -4.749 -14.959 1.00 0.00 H new ATOM 2042 N ASP A 132 12.234 -5.205 -9.273 1.00 0.00 N ATOM 2043 CA ASP A 132 12.835 -6.509 -9.021 1.00 0.00 C ATOM 2044 C ASP A 132 12.677 -6.906 -7.556 1.00 0.00 C ATOM 2045 O ASP A 132 12.503 -8.082 -7.235 1.00 0.00 O ATOM 2046 CB ASP A 132 14.315 -6.504 -9.410 1.00 0.00 C ATOM 2047 CG ASP A 132 14.570 -6.530 -10.912 1.00 0.00 C ATOM 2048 OD1 ASP A 132 13.643 -6.770 -11.648 1.00 0.00 O ATOM 2049 OD2 ASP A 132 15.646 -6.158 -11.317 1.00 0.00 O ATOM 0 H ASP A 132 12.901 -4.475 -9.524 1.00 0.00 H new ATOM 0 HA ASP A 132 12.315 -7.244 -9.635 1.00 0.00 H new ATOM 0 HB2 ASP A 132 14.786 -5.616 -8.989 1.00 0.00 H new ATOM 0 HB3 ASP A 132 14.801 -7.368 -8.956 1.00 0.00 H new ATOM 2054 N LEU A 133 12.740 -5.917 -6.671 1.00 0.00 N ATOM 2055 CA LEU A 133 12.444 -6.135 -5.258 1.00 0.00 C ATOM 2056 C LEU A 133 11.018 -6.645 -5.075 1.00 0.00 C ATOM 2057 O LEU A 133 10.777 -7.583 -4.314 1.00 0.00 O ATOM 2058 CB LEU A 133 12.656 -4.840 -4.465 1.00 0.00 C ATOM 2059 CG LEU A 133 12.400 -4.949 -2.957 1.00 0.00 C ATOM 2060 CD1 LEU A 133 13.388 -5.922 -2.328 1.00 0.00 C ATOM 2061 CD2 LEU A 133 12.518 -3.573 -2.319 1.00 0.00 C ATOM 0 H LEU A 133 12.993 -4.957 -6.906 1.00 0.00 H new ATOM 0 HA LEU A 133 13.127 -6.894 -4.877 1.00 0.00 H new ATOM 0 HB2 LEU A 133 13.680 -4.501 -4.620 1.00 0.00 H new ATOM 0 HB3 LEU A 133 12.001 -4.071 -4.874 1.00 0.00 H new ATOM 0 HG LEU A 133 11.392 -5.329 -2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 133 13.198 -5.992 -1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 133 13.270 -6.905 -2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 133 14.405 -5.566 -2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 133 12.336 -3.652 -1.247 1.00 0.00 H new ATOM 0 HD22 LEU A 133 13.520 -3.178 -2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.783 -2.902 -2.763 1.00 0.00 H new ATOM 2073 N ALA A 134 10.076 -6.023 -5.776 1.00 0.00 N ATOM 2074 CA ALA A 134 8.695 -6.488 -5.781 1.00 0.00 C ATOM 2075 C ALA A 134 8.593 -7.901 -6.345 1.00 0.00 C ATOM 2076 O ALA A 134 7.802 -8.715 -5.865 1.00 0.00 O ATOM 2077 CB ALA A 134 7.820 -5.535 -6.581 1.00 0.00 C ATOM 0 H ALA A 134 10.244 -5.195 -6.348 1.00 0.00 H new ATOM 0 HA ALA A 134 8.342 -6.510 -4.750 1.00 0.00 H new ATOM 0 HB1 ALA A 134 6.791 -5.895 -6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.859 -4.542 -6.133 1.00 0.00 H new ATOM 0 HB3 ALA A 134 8.182 -5.484 -7.608 1.00 0.00 H new ATOM 2083 N ARG A 135 9.394 -8.186 -7.365 1.00 0.00 N ATOM 2084 CA ARG A 135 9.369 -9.491 -8.014 1.00 0.00 C ATOM 2085 C ARG A 135 9.812 -10.588 -7.049 1.00 0.00 C ATOM 2086 O ARG A 135 9.273 -11.694 -7.064 1.00 0.00 O ATOM 2087 CB ARG A 135 10.187 -9.510 -9.298 1.00 0.00 C ATOM 2088 CG ARG A 135 9.597 -8.705 -10.444 1.00 0.00 C ATOM 2089 CD ARG A 135 10.509 -8.529 -11.603 1.00 0.00 C ATOM 2090 NE ARG A 135 10.763 -9.744 -12.359 1.00 0.00 N ATOM 2091 CZ ARG A 135 11.884 -9.985 -13.067 1.00 0.00 C ATOM 2092 NH1 ARG A 135 12.839 -9.085 -13.149 1.00 0.00 N ATOM 2093 NH2 ARG A 135 11.989 -11.143 -13.696 1.00 0.00 N ATOM 0 H ARG A 135 10.069 -7.531 -7.760 1.00 0.00 H new ATOM 0 HA ARG A 135 8.337 -9.692 -8.300 1.00 0.00 H new ATOM 0 HB2 ARG A 135 11.185 -9.129 -9.082 1.00 0.00 H new ATOM 0 HB3 ARG A 135 10.304 -10.544 -9.622 1.00 0.00 H new ATOM 0 HG2 ARG A 135 8.686 -9.196 -10.785 1.00 0.00 H new ATOM 0 HG3 ARG A 135 9.309 -7.722 -10.071 1.00 0.00 H new ATOM 0 HD2 ARG A 135 10.085 -7.781 -12.273 1.00 0.00 H new ATOM 0 HD3 ARG A 135 11.459 -8.133 -11.245 1.00 0.00 H new ATOM 0 HE ARG A 135 10.042 -10.465 -12.353 1.00 0.00 H new ATOM 0 HH11 ARG A 135 12.737 -8.189 -12.673 1.00 0.00 H new ATOM 0 HH12 ARG A 135 13.681 -9.283 -13.689 1.00 0.00 H new ATOM 0 HH21 ARG A 135 11.233 -11.826 -13.637 1.00 0.00 H new ATOM 0 HH22 ARG A 135 12.826 -11.354 -14.240 1.00 0.00 H new ATOM 2107 N SER A 136 10.796 -10.273 -6.214 1.00 0.00 N ATOM 2108 CA SER A 136 11.326 -11.239 -5.259 1.00 0.00 C ATOM 2109 C SER A 136 10.273 -11.610 -4.221 1.00 0.00 C ATOM 2110 O SER A 136 10.328 -12.685 -3.622 1.00 0.00 O ATOM 2111 CB SER A 136 12.564 -10.682 -4.583 1.00 0.00 C ATOM 2112 OG SER A 136 12.259 -9.627 -3.713 1.00 0.00 O ATOM 0 H SER A 136 11.243 -9.357 -6.179 1.00 0.00 H new ATOM 0 HA SER A 136 11.600 -12.144 -5.802 1.00 0.00 H new ATOM 0 HB2 SER A 136 13.062 -11.477 -4.028 1.00 0.00 H new ATOM 0 HB3 SER A 136 13.266 -10.335 -5.341 1.00 0.00 H new ATOM 0 HG SER A 136 11.686 -8.979 -4.173 1.00 0.00 H new ATOM 2118 N TYR A 137 9.313 -10.714 -4.013 1.00 0.00 N ATOM 2119 CA TYR A 137 8.233 -10.958 -3.063 1.00 0.00 C ATOM 2120 C TYR A 137 6.992 -11.486 -3.774 1.00 0.00 C ATOM 2121 O TYR A 137 5.979 -11.784 -3.141 1.00 0.00 O ATOM 2122 CB TYR A 137 7.897 -9.677 -2.295 1.00 0.00 C ATOM 2123 CG TYR A 137 9.028 -9.169 -1.428 1.00 0.00 C ATOM 2124 CD1 TYR A 137 9.584 -9.970 -0.442 1.00 0.00 C ATOM 2125 CD2 TYR A 137 9.534 -7.888 -1.597 1.00 0.00 C ATOM 2126 CE1 TYR A 137 10.616 -9.510 0.353 1.00 0.00 C ATOM 2127 CE2 TYR A 137 10.567 -7.418 -0.809 1.00 0.00 C ATOM 2128 CZ TYR A 137 11.105 -8.233 0.166 1.00 0.00 C ATOM 2129 OH TYR A 137 12.133 -7.770 0.955 1.00 0.00 O ATOM 0 H TYR A 137 9.261 -9.813 -4.489 1.00 0.00 H new ATOM 0 HA TYR A 137 8.570 -11.715 -2.355 1.00 0.00 H new ATOM 0 HB2 TYR A 137 7.621 -8.900 -3.007 1.00 0.00 H new ATOM 0 HB3 TYR A 137 7.025 -9.859 -1.668 1.00 0.00 H new ATOM 0 HD1 TYR A 137 9.204 -10.970 -0.293 1.00 0.00 H new ATOM 0 HD2 TYR A 137 9.113 -7.247 -2.358 1.00 0.00 H new ATOM 0 HE1 TYR A 137 11.038 -10.146 1.117 1.00 0.00 H new ATOM 0 HE2 TYR A 137 10.951 -6.419 -0.955 1.00 0.00 H new ATOM 0 HH TYR A 137 12.359 -6.853 0.693 1.00 0.00 H new ATOM 2139 N GLY A 138 7.077 -11.596 -5.097 1.00 0.00 N ATOM 2140 CA GLY A 138 5.978 -12.148 -5.867 1.00 0.00 C ATOM 2141 C GLY A 138 4.810 -11.188 -5.982 1.00 0.00 C ATOM 2142 O GLY A 138 3.668 -11.609 -6.161 1.00 0.00 O ATOM 0 H GLY A 138 7.887 -11.313 -5.648 1.00 0.00 H new ATOM 0 HA2 GLY A 138 6.332 -12.406 -6.865 1.00 0.00 H new ATOM 0 HA3 GLY A 138 5.639 -13.073 -5.400 1.00 0.00 H new ATOM 2146 N ILE A 139 5.098 -9.894 -5.877 1.00 0.00 N ATOM 2147 CA ILE A 139 4.052 -8.880 -5.858 1.00 0.00 C ATOM 2148 C ILE A 139 4.328 -7.788 -6.886 1.00 0.00 C ATOM 2149 O ILE A 139 5.457 -7.599 -7.340 1.00 0.00 O ATOM 2150 CB ILE A 139 3.911 -8.240 -4.465 1.00 0.00 C ATOM 2151 CG1 ILE A 139 5.230 -7.586 -4.042 1.00 0.00 C ATOM 2152 CG2 ILE A 139 3.478 -9.279 -3.443 1.00 0.00 C ATOM 2153 CD1 ILE A 139 5.152 -6.848 -2.725 1.00 0.00 C ATOM 0 H ILE A 139 6.046 -9.525 -5.804 1.00 0.00 H new ATOM 0 HA ILE A 139 3.119 -9.384 -6.110 1.00 0.00 H new ATOM 0 HB ILE A 139 3.144 -7.468 -4.515 1.00 0.00 H new ATOM 0 HG12 ILE A 139 5.999 -8.355 -3.972 1.00 0.00 H new ATOM 0 HG13 ILE A 139 5.545 -6.890 -4.819 1.00 0.00 H new ATOM 0 HG21 ILE A 139 3.383 -8.809 -2.464 1.00 0.00 H new ATOM 0 HG22 ILE A 139 2.517 -9.701 -3.738 1.00 0.00 H new ATOM 0 HG23 ILE A 139 4.223 -10.073 -3.394 1.00 0.00 H new ATOM 0 HD11 ILE A 139 6.124 -6.413 -2.494 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.407 -6.055 -2.796 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.869 -7.543 -1.935 1.00 0.00 H new ATOM 2165 N PRO A 140 3.273 -7.049 -7.262 1.00 0.00 N ATOM 2166 CA PRO A 140 3.363 -6.003 -8.285 1.00 0.00 C ATOM 2167 C PRO A 140 3.989 -4.719 -7.747 1.00 0.00 C ATOM 2168 O PRO A 140 3.897 -4.425 -6.555 1.00 0.00 O ATOM 2169 CB PRO A 140 1.911 -5.788 -8.722 1.00 0.00 C ATOM 2170 CG PRO A 140 1.106 -6.123 -7.513 1.00 0.00 C ATOM 2171 CD PRO A 140 1.839 -7.258 -6.848 1.00 0.00 C ATOM 0 HA PRO A 140 4.011 -6.293 -9.112 1.00 0.00 H new ATOM 0 HB2 PRO A 140 1.740 -4.760 -9.041 1.00 0.00 H new ATOM 0 HB3 PRO A 140 1.650 -6.430 -9.563 1.00 0.00 H new ATOM 0 HG2 PRO A 140 1.022 -5.265 -6.846 1.00 0.00 H new ATOM 0 HG3 PRO A 140 0.092 -6.416 -7.785 1.00 0.00 H new ATOM 0 HD2 PRO A 140 1.727 -7.227 -5.764 1.00 0.00 H new ATOM 0 HD3 PRO A 140 1.464 -8.226 -7.180 1.00 0.00 H new ATOM 2179 N TYR A 141 4.625 -3.960 -8.633 1.00 0.00 N ATOM 2180 CA TYR A 141 5.151 -2.648 -8.277 1.00 0.00 C ATOM 2181 C TYR A 141 4.520 -1.556 -9.136 1.00 0.00 C ATOM 2182 O TYR A 141 4.478 -1.664 -10.362 1.00 0.00 O ATOM 2183 CB TYR A 141 6.674 -2.623 -8.427 1.00 0.00 C ATOM 2184 CG TYR A 141 7.278 -1.241 -8.314 1.00 0.00 C ATOM 2185 CD1 TYR A 141 7.210 -0.529 -7.125 1.00 0.00 C ATOM 2186 CD2 TYR A 141 7.916 -0.653 -9.396 1.00 0.00 C ATOM 2187 CE1 TYR A 141 7.759 0.734 -7.017 1.00 0.00 C ATOM 2188 CE2 TYR A 141 8.471 0.608 -9.298 1.00 0.00 C ATOM 2189 CZ TYR A 141 8.390 1.299 -8.107 1.00 0.00 C ATOM 2190 OH TYR A 141 8.941 2.555 -8.004 1.00 0.00 O ATOM 0 H TYR A 141 4.788 -4.231 -9.603 1.00 0.00 H new ATOM 0 HA TYR A 141 4.897 -2.454 -7.235 1.00 0.00 H new ATOM 0 HB2 TYR A 141 7.115 -3.265 -7.665 1.00 0.00 H new ATOM 0 HB3 TYR A 141 6.941 -3.048 -9.395 1.00 0.00 H new ATOM 0 HD1 TYR A 141 6.720 -0.970 -6.270 1.00 0.00 H new ATOM 0 HD2 TYR A 141 7.980 -1.190 -10.331 1.00 0.00 H new ATOM 0 HE1 TYR A 141 7.695 1.276 -6.085 1.00 0.00 H new ATOM 0 HE2 TYR A 141 8.966 1.051 -10.150 1.00 0.00 H new ATOM 0 HH TYR A 141 9.545 2.710 -8.760 1.00 0.00 H new ATOM 2200 N ILE A 142 4.031 -0.507 -8.484 1.00 0.00 N ATOM 2201 CA ILE A 142 3.344 0.573 -9.180 1.00 0.00 C ATOM 2202 C ILE A 142 4.056 1.905 -8.964 1.00 0.00 C ATOM 2203 O ILE A 142 4.267 2.330 -7.829 1.00 0.00 O ATOM 2204 CB ILE A 142 1.881 0.701 -8.721 1.00 0.00 C ATOM 2205 CG1 ILE A 142 1.111 -0.586 -9.028 1.00 0.00 C ATOM 2206 CG2 ILE A 142 1.216 1.895 -9.388 1.00 0.00 C ATOM 2207 CD1 ILE A 142 -0.281 -0.620 -8.437 1.00 0.00 C ATOM 0 H ILE A 142 4.098 -0.382 -7.474 1.00 0.00 H new ATOM 0 HA ILE A 142 3.359 0.324 -10.241 1.00 0.00 H new ATOM 0 HB ILE A 142 1.869 0.861 -7.643 1.00 0.00 H new ATOM 0 HG12 ILE A 142 1.040 -0.707 -10.109 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.678 -1.437 -8.649 1.00 0.00 H new ATOM 0 HG21 ILE A 142 0.182 1.970 -9.052 1.00 0.00 H new ATOM 0 HG22 ILE A 142 1.752 2.806 -9.121 1.00 0.00 H new ATOM 0 HG23 ILE A 142 1.237 1.766 -10.470 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -0.764 -1.562 -8.697 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -0.218 -0.532 -7.352 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -0.866 0.209 -8.835 1.00 0.00 H new ATOM 2219 N GLU A 143 4.422 2.559 -10.062 1.00 0.00 N ATOM 2220 CA GLU A 143 4.938 3.921 -10.002 1.00 0.00 C ATOM 2221 C GLU A 143 3.803 4.937 -10.099 1.00 0.00 C ATOM 2222 O GLU A 143 2.949 4.851 -10.981 1.00 0.00 O ATOM 2223 CB GLU A 143 5.956 4.159 -11.120 1.00 0.00 C ATOM 2224 CG GLU A 143 7.211 3.303 -11.019 1.00 0.00 C ATOM 2225 CD GLU A 143 8.119 3.525 -12.197 1.00 0.00 C ATOM 2226 OE1 GLU A 143 7.792 4.336 -13.029 1.00 0.00 O ATOM 2227 OE2 GLU A 143 9.191 2.968 -12.206 1.00 0.00 O ATOM 0 H GLU A 143 4.371 2.168 -11.003 1.00 0.00 H new ATOM 0 HA GLU A 143 5.436 4.051 -9.041 1.00 0.00 H new ATOM 0 HB2 GLU A 143 5.476 3.967 -12.079 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.246 5.210 -11.114 1.00 0.00 H new ATOM 0 HG2 GLU A 143 7.743 3.540 -10.097 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.933 2.251 -10.965 1.00 0.00 H new ATOM 2234 N THR A 144 3.801 5.902 -9.182 1.00 0.00 N ATOM 2235 CA THR A 144 2.725 6.881 -9.108 1.00 0.00 C ATOM 2236 C THR A 144 3.270 8.276 -8.815 1.00 0.00 C ATOM 2237 O THR A 144 4.405 8.426 -8.362 1.00 0.00 O ATOM 2238 CB THR A 144 1.693 6.507 -8.028 1.00 0.00 C ATOM 2239 OG1 THR A 144 0.571 7.395 -8.105 1.00 0.00 O ATOM 2240 CG2 THR A 144 2.314 6.599 -6.642 1.00 0.00 C ATOM 0 H THR A 144 4.532 6.025 -8.482 1.00 0.00 H new ATOM 0 HA THR A 144 2.233 6.882 -10.081 1.00 0.00 H new ATOM 0 HB THR A 144 1.365 5.482 -8.201 1.00 0.00 H new ATOM 0 HG1 THR A 144 0.492 7.744 -9.017 1.00 0.00 H new ATOM 0 HG21 THR A 144 1.570 6.331 -5.892 1.00 0.00 H new ATOM 0 HG22 THR A 144 3.159 5.914 -6.576 1.00 0.00 H new ATOM 0 HG23 THR A 144 2.658 7.618 -6.464 1.00 0.00 H new ATOM 2248 N SER A 145 2.456 9.292 -9.079 1.00 0.00 N ATOM 2249 CA SER A 145 2.786 10.657 -8.687 1.00 0.00 C ATOM 2250 C SER A 145 1.580 11.348 -8.057 1.00 0.00 C ATOM 2251 O SER A 145 0.527 11.473 -8.680 1.00 0.00 O ATOM 2252 CB SER A 145 3.280 11.441 -9.887 1.00 0.00 C ATOM 2253 OG SER A 145 3.585 12.769 -9.558 1.00 0.00 O ATOM 0 H SER A 145 1.563 9.196 -9.563 1.00 0.00 H new ATOM 0 HA SER A 145 3.581 10.618 -7.942 1.00 0.00 H new ATOM 0 HB2 SER A 145 4.166 10.956 -10.297 1.00 0.00 H new ATOM 0 HB3 SER A 145 2.519 11.427 -10.668 1.00 0.00 H new ATOM 0 HG SER A 145 4.163 13.153 -10.250 1.00 0.00 H new ATOM 2259 N ALA A 146 1.745 11.795 -6.815 1.00 0.00 N ATOM 2260 CA ALA A 146 0.674 12.480 -6.103 1.00 0.00 C ATOM 2261 C ALA A 146 0.120 13.638 -6.925 1.00 0.00 C ATOM 2262 O ALA A 146 -1.027 14.050 -6.742 1.00 0.00 O ATOM 2263 CB ALA A 146 1.171 12.977 -4.754 1.00 0.00 C ATOM 0 H ALA A 146 2.609 11.695 -6.283 1.00 0.00 H new ATOM 0 HA ALA A 146 -0.134 11.767 -5.940 1.00 0.00 H new ATOM 0 HB1 ALA A 146 0.361 13.487 -4.233 1.00 0.00 H new ATOM 0 HB2 ALA A 146 1.511 12.131 -4.157 1.00 0.00 H new ATOM 0 HB3 ALA A 146 1.999 13.670 -4.904 1.00 0.00 H new ATOM 2269 N LYS A 147 0.939 14.161 -7.829 1.00 0.00 N ATOM 2270 CA LYS A 147 0.577 15.347 -8.596 1.00 0.00 C ATOM 2271 C LYS A 147 -0.716 15.120 -9.373 1.00 0.00 C ATOM 2272 O LYS A 147 -1.730 15.769 -9.115 1.00 0.00 O ATOM 2273 CB LYS A 147 1.707 15.733 -9.552 1.00 0.00 C ATOM 2274 CG LYS A 147 1.479 17.041 -10.299 1.00 0.00 C ATOM 2275 CD LYS A 147 2.665 17.384 -11.189 1.00 0.00 C ATOM 2276 CE LYS A 147 2.423 18.671 -11.964 1.00 0.00 C ATOM 2277 NZ LYS A 147 3.583 19.029 -12.823 1.00 0.00 N ATOM 0 H LYS A 147 1.860 13.782 -8.049 1.00 0.00 H new ATOM 0 HA LYS A 147 0.416 16.166 -7.895 1.00 0.00 H new ATOM 0 HB2 LYS A 147 2.635 15.809 -8.986 1.00 0.00 H new ATOM 0 HB3 LYS A 147 1.841 14.932 -10.279 1.00 0.00 H new ATOM 0 HG2 LYS A 147 0.577 16.963 -10.906 1.00 0.00 H new ATOM 0 HG3 LYS A 147 1.313 17.847 -9.584 1.00 0.00 H new ATOM 0 HD2 LYS A 147 3.562 17.488 -10.578 1.00 0.00 H new ATOM 0 HD3 LYS A 147 2.847 16.566 -11.886 1.00 0.00 H new ATOM 0 HE2 LYS A 147 1.533 18.559 -12.584 1.00 0.00 H new ATOM 0 HE3 LYS A 147 2.225 19.484 -11.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 3.378 19.911 -13.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 4.427 19.161 -12.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 3.757 18.265 -13.507 1.00 0.00 H new ATOM 2291 N THR A 148 -0.674 14.191 -10.325 1.00 0.00 N ATOM 2292 CA THR A 148 -1.860 13.825 -11.087 1.00 0.00 C ATOM 2293 C THR A 148 -1.906 12.324 -11.345 1.00 0.00 C ATOM 2294 O THR A 148 -2.967 11.703 -11.273 1.00 0.00 O ATOM 2295 CB THR A 148 -1.920 14.572 -12.432 1.00 0.00 C ATOM 2296 OG1 THR A 148 -0.742 14.281 -13.196 1.00 0.00 O ATOM 2297 CG2 THR A 148 -2.017 16.072 -12.206 1.00 0.00 C ATOM 0 H THR A 148 0.169 13.679 -10.585 1.00 0.00 H new ATOM 0 HA THR A 148 -2.722 14.113 -10.486 1.00 0.00 H new ATOM 0 HB THR A 148 -2.805 14.240 -12.975 1.00 0.00 H new ATOM 0 HG1 THR A 148 -0.782 14.756 -14.052 1.00 0.00 H new ATOM 0 HG21 THR A 148 -2.058 16.583 -13.168 1.00 0.00 H new ATOM 0 HG22 THR A 148 -2.919 16.297 -11.637 1.00 0.00 H new ATOM 0 HG23 THR A 148 -1.143 16.414 -11.651 1.00 0.00 H new ATOM 2305 N ARG A 149 -0.749 11.745 -11.647 1.00 0.00 N ATOM 2306 CA ARG A 149 -0.680 10.352 -12.074 1.00 0.00 C ATOM 2307 C ARG A 149 -1.120 9.417 -10.950 1.00 0.00 C ATOM 2308 O ARG A 149 -0.365 9.159 -10.013 1.00 0.00 O ATOM 2309 CB ARG A 149 0.697 9.979 -12.604 1.00 0.00 C ATOM 2310 CG ARG A 149 0.882 8.504 -12.922 1.00 0.00 C ATOM 2311 CD ARG A 149 2.279 8.119 -13.250 1.00 0.00 C ATOM 2312 NE ARG A 149 2.564 6.701 -13.103 1.00 0.00 N ATOM 2313 CZ ARG A 149 2.437 5.789 -14.087 1.00 0.00 C ATOM 2314 NH1 ARG A 149 1.996 6.132 -15.276 1.00 0.00 N ATOM 2315 NH2 ARG A 149 2.745 4.532 -13.816 1.00 0.00 N ATOM 0 H ARG A 149 0.154 12.218 -11.604 1.00 0.00 H new ATOM 0 HA ARG A 149 -1.375 10.233 -12.905 1.00 0.00 H new ATOM 0 HB2 ARG A 149 0.892 10.558 -13.507 1.00 0.00 H new ATOM 0 HB3 ARG A 149 1.446 10.274 -11.869 1.00 0.00 H new ATOM 0 HG2 ARG A 149 0.546 7.916 -12.068 1.00 0.00 H new ATOM 0 HG3 ARG A 149 0.239 8.242 -13.762 1.00 0.00 H new ATOM 0 HD2 ARG A 149 2.492 8.415 -14.277 1.00 0.00 H new ATOM 0 HD3 ARG A 149 2.958 8.681 -12.609 1.00 0.00 H new ATOM 0 HE ARG A 149 2.882 6.373 -12.191 1.00 0.00 H new ATOM 0 HH11 ARG A 149 1.743 7.102 -15.466 1.00 0.00 H new ATOM 0 HH12 ARG A 149 1.906 5.429 -16.009 1.00 0.00 H new ATOM 0 HH21 ARG A 149 3.068 4.276 -12.883 1.00 0.00 H new ATOM 0 HH22 ARG A 149 2.659 3.818 -14.540 1.00 0.00 H new ATOM 2329 N GLN A 150 -2.347 8.916 -11.053 1.00 0.00 N ATOM 2330 CA GLN A 150 -2.914 8.067 -10.011 1.00 0.00 C ATOM 2331 C GLN A 150 -2.493 6.614 -10.205 1.00 0.00 C ATOM 2332 O GLN A 150 -2.932 5.950 -11.142 1.00 0.00 O ATOM 2333 CB GLN A 150 -4.441 8.169 -10.008 1.00 0.00 C ATOM 2334 CG GLN A 150 -4.971 9.580 -9.814 1.00 0.00 C ATOM 2335 CD GLN A 150 -4.560 10.174 -8.480 1.00 0.00 C ATOM 2336 OE1 GLN A 150 -3.782 11.248 -8.527 1.00 0.00 O flip ATOM 2337 NE2 GLN A 150 -4.942 9.675 -7.418 1.00 0.00 N flip ATOM 0 H GLN A 150 -2.967 9.083 -11.846 1.00 0.00 H new ATOM 0 HA GLN A 150 -2.533 8.415 -9.051 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -4.822 7.776 -10.951 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -4.835 7.533 -9.215 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -4.606 10.216 -10.620 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -6.059 9.569 -9.884 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -5.540 8.849 -7.429 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -4.660 10.089 -6.529 1.00 0.00 H new ATOM 2346 N GLY A 151 -1.637 6.126 -9.312 1.00 0.00 N ATOM 2347 CA GLY A 151 -1.430 4.695 -9.187 1.00 0.00 C ATOM 2348 C GLY A 151 -1.994 4.139 -7.895 1.00 0.00 C ATOM 2349 O GLY A 151 -2.005 2.926 -7.686 1.00 0.00 O ATOM 0 H GLY A 151 -1.083 6.696 -8.673 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -1.897 4.188 -10.032 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.363 4.480 -9.236 1.00 0.00 H new ATOM 2353 N VAL A 152 -2.463 5.028 -7.024 1.00 0.00 N ATOM 2354 CA VAL A 152 -2.947 4.626 -5.708 1.00 0.00 C ATOM 2355 C VAL A 152 -4.244 3.833 -5.818 1.00 0.00 C ATOM 2356 O VAL A 152 -4.410 2.802 -5.168 1.00 0.00 O ATOM 2357 CB VAL A 152 -3.178 5.845 -4.796 1.00 0.00 C ATOM 2358 CG1 VAL A 152 -3.852 5.420 -3.499 1.00 0.00 C ATOM 2359 CG2 VAL A 152 -1.861 6.549 -4.503 1.00 0.00 C ATOM 0 H VAL A 152 -2.518 6.030 -7.206 1.00 0.00 H new ATOM 0 HA VAL A 152 -2.175 3.995 -5.267 1.00 0.00 H new ATOM 0 HB VAL A 152 -3.835 6.543 -5.315 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -4.008 6.294 -2.866 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -4.814 4.958 -3.723 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -3.218 4.703 -2.977 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -2.043 7.408 -3.857 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -1.182 5.858 -4.004 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -1.413 6.886 -5.438 1.00 0.00 H new ATOM 2369 N GLU A 153 -5.163 4.322 -6.647 1.00 0.00 N ATOM 2370 CA GLU A 153 -6.436 3.645 -6.860 1.00 0.00 C ATOM 2371 C GLU A 153 -6.221 2.260 -7.464 1.00 0.00 C ATOM 2372 O GLU A 153 -6.842 1.283 -7.041 1.00 0.00 O ATOM 2373 CB GLU A 153 -7.344 4.481 -7.764 1.00 0.00 C ATOM 2374 CG GLU A 153 -8.743 3.910 -7.950 1.00 0.00 C ATOM 2375 CD GLU A 153 -9.603 4.830 -8.771 1.00 0.00 C ATOM 2376 OE1 GLU A 153 -9.103 5.829 -9.230 1.00 0.00 O ATOM 2377 OE2 GLU A 153 -10.730 4.480 -9.034 1.00 0.00 O ATOM 0 H GLU A 153 -5.049 5.184 -7.181 1.00 0.00 H new ATOM 0 HA GLU A 153 -6.921 3.526 -5.891 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -7.427 5.485 -7.347 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -6.872 4.580 -8.742 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -8.679 2.937 -8.437 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -9.205 3.749 -6.976 1.00 0.00 H new ATOM 2384 N ASP A 154 -5.339 2.183 -8.455 1.00 0.00 N ATOM 2385 CA ASP A 154 -4.955 0.903 -9.039 1.00 0.00 C ATOM 2386 C ASP A 154 -4.319 -0.005 -7.990 1.00 0.00 C ATOM 2387 O ASP A 154 -4.541 -1.214 -7.986 1.00 0.00 O ATOM 2388 CB ASP A 154 -3.992 1.113 -10.210 1.00 0.00 C ATOM 2389 CG ASP A 154 -4.643 1.674 -11.467 1.00 0.00 C ATOM 2390 OD1 ASP A 154 -5.849 1.683 -11.534 1.00 0.00 O ATOM 2391 OD2 ASP A 154 -3.941 2.228 -12.278 1.00 0.00 O ATOM 0 H ASP A 154 -4.877 2.992 -8.870 1.00 0.00 H new ATOM 0 HA ASP A 154 -5.858 0.419 -9.411 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -3.197 1.789 -9.894 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -3.522 0.160 -10.453 1.00 0.00 H new ATOM 2396 N ALA A 155 -3.526 0.590 -7.104 1.00 0.00 N ATOM 2397 CA ALA A 155 -2.903 -0.156 -6.018 1.00 0.00 C ATOM 2398 C ALA A 155 -3.952 -0.726 -5.069 1.00 0.00 C ATOM 2399 O ALA A 155 -3.833 -1.860 -4.604 1.00 0.00 O ATOM 2400 CB ALA A 155 -1.930 0.735 -5.258 1.00 0.00 C ATOM 0 H ALA A 155 -3.300 1.585 -7.117 1.00 0.00 H new ATOM 0 HA ALA A 155 -2.353 -0.991 -6.452 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -1.471 0.166 -4.449 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -1.155 1.090 -5.937 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -2.466 1.588 -4.843 1.00 0.00 H new ATOM 2406 N PHE A 156 -4.980 0.066 -4.786 1.00 0.00 N ATOM 2407 CA PHE A 156 -6.087 -0.385 -3.951 1.00 0.00 C ATOM 2408 C PHE A 156 -6.808 -1.566 -4.596 1.00 0.00 C ATOM 2409 O PHE A 156 -7.027 -2.596 -3.958 1.00 0.00 O ATOM 2410 CB PHE A 156 -7.069 0.760 -3.697 1.00 0.00 C ATOM 2411 CG PHE A 156 -6.536 1.823 -2.780 1.00 0.00 C ATOM 2412 CD1 PHE A 156 -5.474 1.557 -1.928 1.00 0.00 C ATOM 2413 CD2 PHE A 156 -7.096 3.092 -2.766 1.00 0.00 C ATOM 2414 CE1 PHE A 156 -4.983 2.534 -1.084 1.00 0.00 C ATOM 2415 CE2 PHE A 156 -6.606 4.071 -1.924 1.00 0.00 C ATOM 2416 CZ PHE A 156 -5.549 3.792 -1.081 1.00 0.00 C ATOM 0 H PHE A 156 -5.070 1.025 -5.123 1.00 0.00 H new ATOM 0 HA PHE A 156 -5.678 -0.713 -2.995 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -7.336 1.216 -4.650 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -7.986 0.352 -3.271 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -5.026 0.574 -1.925 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -7.925 3.317 -3.421 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -4.156 2.313 -0.426 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -7.050 5.055 -1.925 1.00 0.00 H new ATOM 0 HZ PHE A 156 -5.166 4.556 -0.421 1.00 0.00 H new ATOM 2426 N TYR A 157 -7.175 -1.407 -5.861 1.00 0.00 N ATOM 2427 CA TYR A 157 -8.017 -2.384 -6.543 1.00 0.00 C ATOM 2428 C TYR A 157 -7.260 -3.687 -6.772 1.00 0.00 C ATOM 2429 O TYR A 157 -7.781 -4.776 -6.522 1.00 0.00 O ATOM 2430 CB TYR A 157 -8.519 -1.824 -7.876 1.00 0.00 C ATOM 2431 CG TYR A 157 -9.451 -0.642 -7.732 1.00 0.00 C ATOM 2432 CD1 TYR A 157 -9.702 -0.078 -6.490 1.00 0.00 C ATOM 2433 CD2 TYR A 157 -10.079 -0.093 -8.841 1.00 0.00 C ATOM 2434 CE1 TYR A 157 -10.554 1.001 -6.354 1.00 0.00 C ATOM 2435 CE2 TYR A 157 -10.933 0.986 -8.716 1.00 0.00 C ATOM 2436 CZ TYR A 157 -11.167 1.530 -7.470 1.00 0.00 C ATOM 2437 OH TYR A 157 -12.016 2.606 -7.341 1.00 0.00 O ATOM 0 H TYR A 157 -6.903 -0.610 -6.437 1.00 0.00 H new ATOM 0 HA TYR A 157 -8.876 -2.592 -5.905 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.662 -1.527 -8.480 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -9.033 -2.616 -8.421 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -9.223 -0.490 -5.614 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.897 -0.516 -9.818 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.739 1.428 -5.379 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -11.415 1.401 -9.589 1.00 0.00 H new ATOM 0 HH TYR A 157 -11.695 3.345 -7.899 1.00 0.00 H new ATOM 2447 N THR A 158 -6.025 -3.572 -7.249 1.00 0.00 N ATOM 2448 CA THR A 158 -5.222 -4.741 -7.585 1.00 0.00 C ATOM 2449 C THR A 158 -5.003 -5.627 -6.365 1.00 0.00 C ATOM 2450 O THR A 158 -5.149 -6.848 -6.437 1.00 0.00 O ATOM 2451 CB THR A 158 -3.855 -4.340 -8.169 1.00 0.00 C ATOM 2452 OG1 THR A 158 -4.047 -3.625 -9.396 1.00 0.00 O ATOM 2453 CG2 THR A 158 -3.005 -5.573 -8.432 1.00 0.00 C ATOM 0 H THR A 158 -5.558 -2.680 -7.412 1.00 0.00 H new ATOM 0 HA THR A 158 -5.778 -5.298 -8.339 1.00 0.00 H new ATOM 0 HB THR A 158 -3.341 -3.705 -7.448 1.00 0.00 H new ATOM 0 HG1 THR A 158 -4.266 -2.690 -9.199 1.00 0.00 H new ATOM 0 HG21 THR A 158 -2.043 -5.270 -8.845 1.00 0.00 H new ATOM 0 HG22 THR A 158 -2.846 -6.111 -7.498 1.00 0.00 H new ATOM 0 HG23 THR A 158 -3.516 -6.223 -9.143 1.00 0.00 H new ATOM 2461 N LEU A 159 -4.653 -5.006 -5.244 1.00 0.00 N ATOM 2462 CA LEU A 159 -4.405 -5.741 -4.008 1.00 0.00 C ATOM 2463 C LEU A 159 -5.682 -6.408 -3.504 1.00 0.00 C ATOM 2464 O LEU A 159 -5.658 -7.547 -3.041 1.00 0.00 O ATOM 2465 CB LEU A 159 -3.832 -4.803 -2.938 1.00 0.00 C ATOM 2466 CG LEU A 159 -3.553 -5.456 -1.578 1.00 0.00 C ATOM 2467 CD1 LEU A 159 -2.718 -6.716 -1.766 1.00 0.00 C ATOM 2468 CD2 LEU A 159 -2.835 -4.464 -0.674 1.00 0.00 C ATOM 0 H LEU A 159 -4.535 -3.996 -5.165 1.00 0.00 H new ATOM 0 HA LEU A 159 -3.675 -6.523 -4.216 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -2.903 -4.373 -3.314 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -4.528 -3.978 -2.791 1.00 0.00 H new ATOM 0 HG LEU A 159 -4.496 -5.738 -1.110 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -2.525 -7.173 -0.795 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -3.260 -7.421 -2.397 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -1.771 -6.458 -2.240 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -2.637 -4.929 0.292 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -1.892 -4.169 -1.134 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -3.461 -3.583 -0.531 1.00 0.00 H new ATOM 2480 N VAL A 160 -6.796 -5.688 -3.600 1.00 0.00 N ATOM 2481 CA VAL A 160 -8.099 -6.251 -3.270 1.00 0.00 C ATOM 2482 C VAL A 160 -8.434 -7.431 -4.176 1.00 0.00 C ATOM 2483 O VAL A 160 -8.984 -8.436 -3.725 1.00 0.00 O ATOM 2484 CB VAL A 160 -9.217 -5.197 -3.383 1.00 0.00 C ATOM 2485 CG1 VAL A 160 -10.584 -5.862 -3.348 1.00 0.00 C ATOM 2486 CG2 VAL A 160 -9.096 -4.171 -2.266 1.00 0.00 C ATOM 0 H VAL A 160 -6.821 -4.715 -3.903 1.00 0.00 H new ATOM 0 HA VAL A 160 -8.040 -6.594 -2.237 1.00 0.00 H new ATOM 0 HB VAL A 160 -9.109 -4.683 -4.338 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -11.361 -5.102 -3.429 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -10.671 -6.559 -4.181 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -10.702 -6.402 -2.409 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -9.893 -3.434 -2.361 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -9.178 -4.672 -1.301 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -8.130 -3.671 -2.334 1.00 0.00 H new ATOM 2496 N ARG A 161 -8.095 -7.303 -5.454 1.00 0.00 N ATOM 2497 CA ARG A 161 -8.295 -8.386 -6.409 1.00 0.00 C ATOM 2498 C ARG A 161 -7.467 -9.609 -6.025 1.00 0.00 C ATOM 2499 O ARG A 161 -7.929 -10.743 -6.140 1.00 0.00 O ATOM 2500 CB ARG A 161 -8.019 -7.950 -7.841 1.00 0.00 C ATOM 2501 CG ARG A 161 -9.062 -7.018 -8.438 1.00 0.00 C ATOM 2502 CD ARG A 161 -8.717 -6.497 -9.785 1.00 0.00 C ATOM 2503 NE ARG A 161 -9.679 -5.553 -10.330 1.00 0.00 N ATOM 2504 CZ ARG A 161 -9.541 -4.911 -11.506 1.00 0.00 C ATOM 2505 NH1 ARG A 161 -8.466 -5.078 -12.245 1.00 0.00 N ATOM 2506 NH2 ARG A 161 -10.502 -4.089 -11.887 1.00 0.00 N ATOM 0 H ARG A 161 -7.681 -6.460 -5.852 1.00 0.00 H new ATOM 0 HA ARG A 161 -9.348 -8.665 -6.367 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -7.049 -7.455 -7.874 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -7.945 -8.838 -8.468 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -10.013 -7.547 -8.499 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -9.209 -6.176 -7.762 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -7.741 -6.014 -9.735 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -8.622 -7.337 -10.473 1.00 0.00 H new ATOM 0 HE ARG A 161 -10.519 -5.363 -9.783 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -7.722 -5.701 -11.930 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -8.376 -4.585 -13.133 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -11.322 -3.954 -11.295 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -10.424 -3.589 -12.773 1.00 0.00 H new ATOM 2520 N GLU A 162 -6.242 -9.369 -5.569 1.00 0.00 N ATOM 2521 CA GLU A 162 -5.365 -10.449 -5.131 1.00 0.00 C ATOM 2522 C GLU A 162 -5.907 -11.113 -3.868 1.00 0.00 C ATOM 2523 O GLU A 162 -5.873 -12.336 -3.734 1.00 0.00 O ATOM 2524 CB GLU A 162 -3.949 -9.924 -4.886 1.00 0.00 C ATOM 2525 CG GLU A 162 -2.943 -10.994 -4.484 1.00 0.00 C ATOM 2526 CD GLU A 162 -2.698 -11.963 -5.608 1.00 0.00 C ATOM 2527 OE1 GLU A 162 -3.123 -11.691 -6.704 1.00 0.00 O ATOM 2528 OE2 GLU A 162 -1.993 -12.921 -5.396 1.00 0.00 O ATOM 0 H GLU A 162 -5.834 -8.437 -5.493 1.00 0.00 H new ATOM 0 HA GLU A 162 -5.329 -11.197 -5.923 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -3.595 -9.432 -5.792 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -3.986 -9.165 -4.104 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -2.003 -10.523 -4.196 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -3.311 -11.532 -3.610 1.00 0.00 H new ATOM 2535 N ILE A 163 -6.405 -10.296 -2.945 1.00 0.00 N ATOM 2536 CA ILE A 163 -6.985 -10.807 -1.709 1.00 0.00 C ATOM 2537 C ILE A 163 -8.168 -11.726 -1.994 1.00 0.00 C ATOM 2538 O ILE A 163 -8.339 -12.756 -1.342 1.00 0.00 O ATOM 2539 CB ILE A 163 -7.447 -9.663 -0.788 1.00 0.00 C ATOM 2540 CG1 ILE A 163 -6.239 -8.888 -0.253 1.00 0.00 C ATOM 2541 CG2 ILE A 163 -8.284 -10.208 0.359 1.00 0.00 C ATOM 2542 CD1 ILE A 163 -6.595 -7.559 0.373 1.00 0.00 C ATOM 0 H ILE A 163 -6.418 -9.280 -3.030 1.00 0.00 H new ATOM 0 HA ILE A 163 -6.202 -11.374 -1.205 1.00 0.00 H new ATOM 0 HB ILE A 163 -8.066 -8.979 -1.369 1.00 0.00 H new ATOM 0 HG12 ILE A 163 -5.724 -9.501 0.487 1.00 0.00 H new ATOM 0 HG13 ILE A 163 -5.537 -8.718 -1.070 1.00 0.00 H new ATOM 0 HG21 ILE A 163 -8.602 -9.386 1.000 1.00 0.00 H new ATOM 0 HG22 ILE A 163 -9.161 -10.717 -0.040 1.00 0.00 H new ATOM 0 HG23 ILE A 163 -7.689 -10.912 0.941 1.00 0.00 H new ATOM 0 HD11 ILE A 163 -5.688 -7.070 0.728 1.00 0.00 H new ATOM 0 HD12 ILE A 163 -7.082 -6.926 -0.369 1.00 0.00 H new ATOM 0 HD13 ILE A 163 -7.272 -7.722 1.212 1.00 0.00 H new ATOM 2554 N ARG A 164 -8.982 -11.348 -2.977 1.00 0.00 N ATOM 2555 CA ARG A 164 -10.146 -12.140 -3.351 1.00 0.00 C ATOM 2556 C ARG A 164 -9.727 -13.521 -3.845 1.00 0.00 C ATOM 2557 O ARG A 164 -10.494 -14.481 -3.755 1.00 0.00 O ATOM 2558 CB ARG A 164 -11.026 -11.424 -4.366 1.00 0.00 C ATOM 2559 CG ARG A 164 -12.152 -12.268 -4.943 1.00 0.00 C ATOM 2560 CD ARG A 164 -13.086 -12.819 -3.928 1.00 0.00 C ATOM 2561 NE ARG A 164 -13.891 -11.821 -3.243 1.00 0.00 N ATOM 2562 CZ ARG A 164 -14.662 -12.067 -2.167 1.00 0.00 C ATOM 2563 NH1 ARG A 164 -14.768 -13.280 -1.672 1.00 0.00 N ATOM 2564 NH2 ARG A 164 -15.331 -11.059 -1.635 1.00 0.00 N ATOM 0 H ARG A 164 -8.855 -10.499 -3.527 1.00 0.00 H new ATOM 0 HA ARG A 164 -10.752 -12.273 -2.454 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -11.458 -10.542 -3.893 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -10.399 -11.072 -5.185 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -12.719 -11.662 -5.650 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -11.719 -13.094 -5.507 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -13.751 -13.532 -4.415 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -12.511 -13.374 -3.187 1.00 0.00 H new ATOM 0 HE ARG A 164 -13.870 -10.867 -3.603 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -14.262 -14.053 -2.104 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -15.357 -13.448 -0.856 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -15.255 -10.126 -2.040 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -15.923 -11.214 -0.819 1.00 0.00 H new ATOM 2578 N GLN A 165 -8.509 -13.613 -4.367 1.00 0.00 N ATOM 2579 CA GLN A 165 -8.031 -14.848 -4.977 1.00 0.00 C ATOM 2580 C GLN A 165 -7.338 -15.733 -3.946 1.00 0.00 C ATOM 2581 O GLN A 165 -6.738 -16.751 -4.288 1.00 0.00 O ATOM 2582 CB GLN A 165 -7.068 -14.541 -6.128 1.00 0.00 C ATOM 2583 CG GLN A 165 -7.701 -13.784 -7.283 1.00 0.00 C ATOM 2584 CD GLN A 165 -8.981 -14.436 -7.771 1.00 0.00 C ATOM 2585 OE1 GLN A 165 -8.965 -15.552 -8.298 1.00 0.00 O ATOM 2586 NE2 GLN A 165 -10.100 -13.741 -7.600 1.00 0.00 N ATOM 0 H GLN A 165 -7.835 -12.848 -4.380 1.00 0.00 H new ATOM 0 HA GLN A 165 -8.896 -15.383 -5.370 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -6.231 -13.959 -5.742 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -6.658 -15.478 -6.504 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -7.914 -12.762 -6.970 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -6.990 -13.724 -8.107 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -10.067 -12.822 -7.159 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -10.992 -14.127 -7.909 1.00 0.00 H new ATOM 2595 N HIS A 166 -7.427 -15.336 -2.678 1.00 0.00 N ATOM 2596 CA HIS A 166 -6.896 -16.144 -1.587 1.00 0.00 C ATOM 2597 C HIS A 166 -7.918 -16.275 -0.462 1.00 0.00 C ATOM 2598 O HIS A 166 -8.240 -17.396 -0.067 1.00 0.00 O ATOM 2599 CB HIS A 166 -5.594 -15.541 -1.049 1.00 0.00 C ATOM 2600 CG HIS A 166 -4.506 -15.447 -2.072 1.00 0.00 C ATOM 2601 ND1 HIS A 166 -3.868 -16.558 -2.583 1.00 0.00 N ATOM 2602 CD2 HIS A 166 -3.943 -14.376 -2.681 1.00 0.00 C ATOM 2603 CE1 HIS A 166 -2.958 -16.173 -3.463 1.00 0.00 C ATOM 2604 NE2 HIS A 166 -2.984 -14.855 -3.539 1.00 0.00 N ATOM 2605 OXT HIS A 166 -8.401 -15.291 0.029 1.00 0.00 O ATOM 0 H HIS A 166 -7.861 -14.461 -2.383 1.00 0.00 H new ATOM 0 HA HIS A 166 -6.683 -17.138 -1.979 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -5.800 -14.545 -0.658 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -5.243 -16.145 -0.213 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -4.200 -13.339 -2.522 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -2.305 -16.826 -4.024 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -2.388 -14.285 -4.139 1.00 0.00 H new