USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1080 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 111 LYS NZ :NH3+ -138:sc= 2.13 (180deg=1.22) USER MOD Set 1.2: A 112 GLN : amide:sc= 0.232 K(o=2.4,f=-5!) USER MOD Set 2.1: A 65 THR OG1 : rot 180:sc= 0.074 USER MOD Set 2.2: A 67 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 11 TYR OH : rot 180:sc= 1.04 USER MOD Set 3.2: A 39 LYS NZ :NH3+ 172:sc= 1.17 (180deg=-0.159) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -166:sc= 1.28 (180deg=1.15) USER MOD Single : A 12 SER OG : rot 42:sc= 0.0435 USER MOD Single : A 13 GLN : amide:sc= -1.55! K(o=-1.6!,f=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 23:sc= 0.0348 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -5.46! C(o=-5.5!,f=-4.3!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -1.11 K(o=-1.1,f=-3.5!) USER MOD Single : A 43 ASN : amide:sc= -0.939 K(o=-0.94,f=-5.2!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 148:sc= -0.34 (180deg=-2.49!) USER MOD Single : A 50 MET CE :methyl 152:sc= -1.62 (180deg=-2.29!) USER MOD Single : A 54 GLN : amide:sc= -0.302 X(o=-0.3,f=-0.23) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot 21:sc= -0.277 USER MOD Single : A 61 ASN : amide:sc= -1.42 K(o=-1.4,f=-8.4!) USER MOD Single : A 62 HIS : no HD1:sc= -13.9! C(o=-14!,f=-19!) USER MOD Single : A 66 THR OG1 : rot -110:sc= 1.01 USER MOD Single : A 68 MET CE :methyl -149:sc= -2.29 (180deg=-5.35!) USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 LYS NZ :NH3+ -156:sc= -0.157 (180deg=-0.66) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 120:sc= 0.826 USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0.127 USER MOD Single : A 88 SER OG : rot 175:sc= -0.23 USER MOD Single : A 93 LYS NZ :NH3+ -159:sc= 0.602 (180deg=-0.000981!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0163) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.659 USER MOD Single : A 113 LYS NZ :NH3+ -161:sc= 1.13 (180deg=0.877) USER MOD Single : A 117 CYS SG : rot 80:sc= 0.903 USER MOD Single : A 118 GLN : amide:sc= -3.71! K(o=-3.7!,f=-0.83) USER MOD Single : A 127 GLN : amide:sc= -1.2! K(o=-1.2!,f=-0.033) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.662 -9.328 -5.451 1.00 0.00 N ATOM 2 CA GLY A 1 -18.138 -9.518 -6.821 1.00 0.00 C ATOM 3 C GLY A 1 -16.996 -9.436 -7.788 1.00 0.00 C ATOM 4 O GLY A 1 -16.186 -10.344 -7.861 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.465 -9.388 -4.793 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.969 -10.067 -5.219 1.00 0.00 H new ATOM 0 H3 GLY A 1 -17.213 -8.394 -5.366 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.630 -10.487 -6.911 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.882 -8.759 -7.062 1.00 0.00 H new ATOM 10 N SER A 2 -16.908 -8.361 -8.515 1.00 0.00 N ATOM 11 CA SER A 2 -15.821 -8.162 -9.433 1.00 0.00 C ATOM 12 C SER A 2 -14.819 -7.206 -8.813 1.00 0.00 C ATOM 13 O SER A 2 -14.946 -5.990 -8.928 1.00 0.00 O ATOM 14 CB SER A 2 -16.341 -7.627 -10.765 1.00 0.00 C ATOM 15 OG SER A 2 -17.320 -8.509 -11.305 1.00 0.00 O ATOM 0 H SER A 2 -17.585 -7.598 -8.490 1.00 0.00 H new ATOM 0 HA SER A 2 -15.327 -9.113 -9.631 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.773 -6.637 -10.623 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.515 -7.516 -11.467 1.00 0.00 H new ATOM 0 HG SER A 2 -17.646 -8.153 -12.158 1.00 0.00 H new ATOM 21 N GLY A 3 -13.890 -7.755 -8.079 1.00 0.00 N ATOM 22 CA GLY A 3 -12.900 -6.953 -7.426 1.00 0.00 C ATOM 23 C GLY A 3 -11.528 -7.253 -7.940 1.00 0.00 C ATOM 24 O GLY A 3 -10.543 -7.032 -7.260 1.00 0.00 O ATOM 0 H GLY A 3 -13.800 -8.758 -7.920 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -13.125 -5.898 -7.580 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -12.935 -7.133 -6.351 1.00 0.00 H new ATOM 28 N GLU A 4 -11.461 -7.760 -9.151 1.00 0.00 N ATOM 29 CA GLU A 4 -10.189 -8.080 -9.771 1.00 0.00 C ATOM 30 C GLU A 4 -9.837 -7.018 -10.787 1.00 0.00 C ATOM 31 O GLU A 4 -8.823 -7.109 -11.490 1.00 0.00 O ATOM 32 CB GLU A 4 -10.188 -9.470 -10.433 1.00 0.00 C ATOM 33 CG GLU A 4 -10.083 -10.675 -9.482 1.00 0.00 C ATOM 34 CD GLU A 4 -11.259 -10.852 -8.554 1.00 0.00 C ATOM 35 OE1 GLU A 4 -12.308 -11.365 -8.995 1.00 0.00 O ATOM 36 OE2 GLU A 4 -11.153 -10.508 -7.355 1.00 0.00 O ATOM 0 H GLU A 4 -12.276 -7.961 -9.731 1.00 0.00 H new ATOM 0 HA GLU A 4 -9.437 -8.104 -8.982 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -11.103 -9.572 -11.016 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.356 -9.514 -11.136 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.968 -11.581 -10.077 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.178 -10.570 -8.883 1.00 0.00 H new ATOM 43 N GLU A 5 -10.671 -6.015 -10.846 1.00 0.00 N ATOM 44 CA GLU A 5 -10.561 -4.937 -11.681 1.00 0.00 C ATOM 45 C GLU A 5 -11.354 -3.866 -11.053 1.00 0.00 C ATOM 46 O GLU A 5 -12.357 -4.169 -10.379 1.00 0.00 O ATOM 47 CB GLU A 5 -11.059 -5.216 -13.080 1.00 0.00 C ATOM 48 CG GLU A 5 -12.541 -5.418 -13.132 1.00 0.00 C ATOM 49 CD GLU A 5 -13.011 -6.826 -12.781 1.00 0.00 C ATOM 50 OE1 GLU A 5 -13.144 -7.168 -11.586 1.00 0.00 O ATOM 51 OE2 GLU A 5 -13.286 -7.612 -13.720 1.00 0.00 O ATOM 0 H GLU A 5 -11.496 -5.964 -10.249 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.513 -4.665 -11.803 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -10.786 -4.386 -13.732 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -10.561 -6.104 -13.469 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -13.013 -4.712 -12.449 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -12.891 -5.173 -14.135 1.00 0.00 H new ATOM 58 N ASP A 6 -10.794 -2.697 -11.150 1.00 0.00 N ATOM 59 CA ASP A 6 -11.336 -1.369 -10.699 1.00 0.00 C ATOM 60 C ASP A 6 -10.217 -0.502 -10.208 1.00 0.00 C ATOM 61 O ASP A 6 -10.340 0.702 -10.077 1.00 0.00 O ATOM 62 CB ASP A 6 -12.435 -1.523 -9.654 1.00 0.00 C ATOM 63 CG ASP A 6 -12.894 -0.279 -8.910 1.00 0.00 C ATOM 64 OD1 ASP A 6 -12.267 0.098 -7.901 1.00 0.00 O ATOM 65 OD2 ASP A 6 -13.947 0.276 -9.273 1.00 0.00 O ATOM 0 H ASP A 6 -9.872 -2.596 -11.575 1.00 0.00 H new ATOM 0 HA ASP A 6 -11.800 -0.882 -11.556 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -13.305 -1.957 -10.146 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.093 -2.247 -8.914 1.00 0.00 H new ATOM 70 N GLU A 7 -9.129 -1.100 -10.006 1.00 0.00 N ATOM 71 CA GLU A 7 -8.008 -0.431 -9.564 1.00 0.00 C ATOM 72 C GLU A 7 -7.100 -0.198 -10.701 1.00 0.00 C ATOM 73 O GLU A 7 -6.942 -1.025 -11.609 1.00 0.00 O ATOM 74 CB GLU A 7 -7.375 -1.077 -8.304 1.00 0.00 C ATOM 75 CG GLU A 7 -6.916 -2.533 -8.439 1.00 0.00 C ATOM 76 CD GLU A 7 -8.025 -3.532 -8.581 1.00 0.00 C ATOM 77 OE1 GLU A 7 -8.425 -3.812 -9.712 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.493 -4.075 -7.553 1.00 0.00 O ATOM 0 H GLU A 7 -8.994 -2.101 -10.149 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.288 0.555 -9.193 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -6.516 -0.475 -8.007 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.100 -1.022 -7.492 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.260 -2.613 -9.306 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.321 -2.794 -7.564 1.00 0.00 H new ATOM 85 N LYS A 8 -6.560 0.938 -10.658 1.00 0.00 N ATOM 86 CA LYS A 8 -5.835 1.481 -11.741 1.00 0.00 C ATOM 87 C LYS A 8 -4.331 1.554 -11.469 1.00 0.00 C ATOM 88 O LYS A 8 -3.908 1.710 -10.319 1.00 0.00 O ATOM 89 CB LYS A 8 -6.426 2.846 -12.100 1.00 0.00 C ATOM 90 CG LYS A 8 -6.299 3.893 -10.990 1.00 0.00 C ATOM 91 CD LYS A 8 -7.339 4.999 -11.110 1.00 0.00 C ATOM 92 CE LYS A 8 -7.324 5.670 -12.467 1.00 0.00 C ATOM 93 NZ LYS A 8 -8.372 6.694 -12.578 1.00 0.00 N ATOM 0 H LYS A 8 -6.604 1.550 -9.843 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.935 0.813 -12.596 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.931 3.220 -12.996 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.480 2.720 -12.347 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -6.403 3.405 -10.021 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.302 4.332 -11.021 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -8.329 4.582 -10.926 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -7.159 5.747 -10.337 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -6.349 6.127 -12.636 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.464 4.920 -13.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.491 6.963 -13.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.269 6.314 -12.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.100 7.531 -12.024 1.00 0.00 H new ATOM 107 N VAL A 9 -3.541 1.485 -12.525 1.00 0.00 N ATOM 108 CA VAL A 9 -2.112 1.481 -12.418 1.00 0.00 C ATOM 109 C VAL A 9 -1.627 2.897 -12.555 1.00 0.00 C ATOM 110 O VAL A 9 -1.829 3.541 -13.591 1.00 0.00 O ATOM 111 CB VAL A 9 -1.446 0.660 -13.562 1.00 0.00 C ATOM 112 CG1 VAL A 9 0.034 0.423 -13.282 1.00 0.00 C ATOM 113 CG2 VAL A 9 -2.170 -0.646 -13.828 1.00 0.00 C ATOM 0 H VAL A 9 -3.886 1.430 -13.483 1.00 0.00 H new ATOM 0 HA VAL A 9 -1.849 1.036 -11.459 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.526 1.258 -14.470 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.471 -0.153 -14.098 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.547 1.381 -13.199 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.144 -0.130 -12.349 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.668 -1.183 -14.633 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -2.162 -1.257 -12.925 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -3.200 -0.439 -14.117 1.00 0.00 H new ATOM 123 N LEU A 10 -1.004 3.376 -11.552 1.00 0.00 N ATOM 124 CA LEU A 10 -0.437 4.712 -11.617 1.00 0.00 C ATOM 125 C LEU A 10 1.070 4.670 -11.730 1.00 0.00 C ATOM 126 O LEU A 10 1.652 5.287 -12.610 1.00 0.00 O ATOM 127 CB LEU A 10 -0.875 5.597 -10.442 1.00 0.00 C ATOM 128 CG LEU A 10 -0.401 7.066 -10.498 1.00 0.00 C ATOM 129 CD1 LEU A 10 -0.923 7.771 -11.742 1.00 0.00 C ATOM 130 CD2 LEU A 10 -0.825 7.815 -9.247 1.00 0.00 C ATOM 0 H LEU A 10 -0.860 2.886 -10.669 1.00 0.00 H new ATOM 0 HA LEU A 10 -0.833 5.169 -12.524 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -1.964 5.587 -10.390 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.508 5.151 -9.518 1.00 0.00 H new ATOM 0 HG LEU A 10 0.688 7.060 -10.548 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.571 8.803 -11.750 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.559 7.256 -12.631 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.013 7.760 -11.736 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.481 8.848 -9.307 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.912 7.799 -9.164 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.387 7.337 -8.371 1.00 0.00 H new ATOM 142 N TYR A 11 1.691 3.920 -10.871 1.00 0.00 N ATOM 143 CA TYR A 11 3.139 3.856 -10.843 1.00 0.00 C ATOM 144 C TYR A 11 3.652 2.459 -10.605 1.00 0.00 C ATOM 145 O TYR A 11 3.067 1.687 -9.824 1.00 0.00 O ATOM 146 CB TYR A 11 3.762 4.893 -9.873 1.00 0.00 C ATOM 147 CG TYR A 11 3.163 4.950 -8.471 1.00 0.00 C ATOM 148 CD1 TYR A 11 2.081 5.767 -8.217 1.00 0.00 C ATOM 149 CD2 TYR A 11 3.683 4.214 -7.414 1.00 0.00 C ATOM 150 CE1 TYR A 11 1.520 5.856 -6.970 1.00 0.00 C ATOM 151 CE2 TYR A 11 3.117 4.298 -6.148 1.00 0.00 C ATOM 152 CZ TYR A 11 2.032 5.127 -5.939 1.00 0.00 C ATOM 153 OH TYR A 11 1.435 5.213 -4.687 1.00 0.00 O ATOM 0 H TYR A 11 1.225 3.339 -10.174 1.00 0.00 H new ATOM 0 HA TYR A 11 3.474 4.136 -11.842 1.00 0.00 H new ATOM 0 HB2 TYR A 11 4.827 4.680 -9.782 1.00 0.00 H new ATOM 0 HB3 TYR A 11 3.672 5.881 -10.324 1.00 0.00 H new ATOM 0 HD1 TYR A 11 1.665 6.353 -9.023 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.535 3.571 -7.578 1.00 0.00 H new ATOM 0 HE1 TYR A 11 0.672 6.504 -6.804 1.00 0.00 H new ATOM 0 HE2 TYR A 11 3.523 3.719 -5.332 1.00 0.00 H new ATOM 0 HH TYR A 11 1.913 4.635 -4.056 1.00 0.00 H new ATOM 163 N SER A 12 4.691 2.129 -11.334 1.00 0.00 N ATOM 164 CA SER A 12 5.342 0.884 -11.294 1.00 0.00 C ATOM 165 C SER A 12 6.856 1.082 -11.127 1.00 0.00 C ATOM 166 O SER A 12 7.490 1.810 -11.916 1.00 0.00 O ATOM 167 CB SER A 12 5.015 0.202 -12.594 1.00 0.00 C ATOM 168 OG SER A 12 5.133 1.102 -13.696 1.00 0.00 O ATOM 0 H SER A 12 5.113 2.774 -12.002 1.00 0.00 H new ATOM 0 HA SER A 12 5.013 0.279 -10.449 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.684 -0.646 -12.741 1.00 0.00 H new ATOM 0 HB3 SER A 12 4.001 -0.196 -12.553 1.00 0.00 H new ATOM 0 HG SER A 12 5.935 1.654 -13.583 1.00 0.00 H new ATOM 174 N GLN A 13 7.429 0.477 -10.104 1.00 0.00 N ATOM 175 CA GLN A 13 8.856 0.634 -9.837 1.00 0.00 C ATOM 176 C GLN A 13 9.443 -0.598 -9.187 1.00 0.00 C ATOM 177 O GLN A 13 8.760 -1.313 -8.509 1.00 0.00 O ATOM 178 CB GLN A 13 9.119 1.919 -9.030 1.00 0.00 C ATOM 179 CG GLN A 13 10.577 2.236 -8.748 1.00 0.00 C ATOM 180 CD GLN A 13 10.739 3.466 -7.903 1.00 0.00 C ATOM 181 OE1 GLN A 13 10.856 4.583 -8.410 1.00 0.00 O ATOM 182 NE2 GLN A 13 10.741 3.284 -6.612 1.00 0.00 N ATOM 0 H GLN A 13 6.936 -0.125 -9.445 1.00 0.00 H new ATOM 0 HA GLN A 13 9.373 0.743 -10.790 1.00 0.00 H new ATOM 0 HB2 GLN A 13 8.682 2.760 -9.569 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.593 1.842 -8.078 1.00 0.00 H new ATOM 0 HG2 GLN A 13 11.040 1.388 -8.244 1.00 0.00 H new ATOM 0 HG3 GLN A 13 11.106 2.374 -9.691 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.642 2.344 -6.229 1.00 0.00 H new ATOM 0 HE22 GLN A 13 10.842 4.082 -5.985 1.00 0.00 H new ATOM 191 N ARG A 14 10.728 -0.806 -9.370 1.00 0.00 N ATOM 192 CA ARG A 14 11.381 -1.969 -8.847 1.00 0.00 C ATOM 193 C ARG A 14 11.656 -1.838 -7.367 1.00 0.00 C ATOM 194 O ARG A 14 12.312 -0.898 -6.895 1.00 0.00 O ATOM 195 CB ARG A 14 12.632 -2.318 -9.640 1.00 0.00 C ATOM 196 CG ARG A 14 12.320 -2.669 -11.082 1.00 0.00 C ATOM 197 CD ARG A 14 13.556 -3.044 -11.876 1.00 0.00 C ATOM 198 NE ARG A 14 14.269 -4.203 -11.310 1.00 0.00 N ATOM 199 CZ ARG A 14 14.330 -5.419 -11.889 1.00 0.00 C ATOM 200 NH1 ARG A 14 13.540 -5.712 -12.922 1.00 0.00 N ATOM 201 NH2 ARG A 14 15.128 -6.361 -11.388 1.00 0.00 N ATOM 0 H ARG A 14 11.341 -0.173 -9.884 1.00 0.00 H new ATOM 0 HA ARG A 14 10.694 -2.807 -8.964 1.00 0.00 H new ATOM 0 HB2 ARG A 14 13.322 -1.475 -9.615 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.138 -3.159 -9.165 1.00 0.00 H new ATOM 0 HG2 ARG A 14 11.614 -3.499 -11.104 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.830 -1.821 -11.560 1.00 0.00 H new ATOM 0 HD2 ARG A 14 13.268 -3.267 -12.904 1.00 0.00 H new ATOM 0 HD3 ARG A 14 14.232 -2.190 -11.912 1.00 0.00 H new ATOM 0 HE ARG A 14 14.749 -4.076 -10.419 1.00 0.00 H new ATOM 0 HH11 ARG A 14 12.886 -5.015 -13.278 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.590 -6.633 -13.357 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.695 -6.163 -10.564 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.172 -7.280 -11.829 1.00 0.00 H new ATOM 215 N VAL A 15 11.125 -2.784 -6.669 1.00 0.00 N ATOM 216 CA VAL A 15 11.141 -2.871 -5.246 1.00 0.00 C ATOM 217 C VAL A 15 11.686 -4.257 -4.865 1.00 0.00 C ATOM 218 O VAL A 15 12.007 -5.071 -5.755 1.00 0.00 O ATOM 219 CB VAL A 15 9.673 -2.731 -4.702 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.863 -4.021 -4.896 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.631 -2.250 -3.256 1.00 0.00 C ATOM 0 H VAL A 15 10.637 -3.567 -7.104 1.00 0.00 H new ATOM 0 HA VAL A 15 11.761 -2.082 -4.822 1.00 0.00 H new ATOM 0 HB VAL A 15 9.195 -1.957 -5.302 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.855 -3.880 -4.506 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.811 -4.262 -5.958 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.347 -4.839 -4.362 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.594 -2.170 -2.929 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.158 -2.961 -2.620 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.111 -1.274 -3.183 1.00 0.00 H new ATOM 231 N LYS A 16 11.865 -4.487 -3.598 1.00 0.00 N ATOM 232 CA LYS A 16 12.189 -5.792 -3.092 1.00 0.00 C ATOM 233 C LYS A 16 11.116 -6.110 -2.078 1.00 0.00 C ATOM 234 O LYS A 16 10.885 -5.284 -1.179 1.00 0.00 O ATOM 235 CB LYS A 16 13.549 -5.789 -2.390 1.00 0.00 C ATOM 236 CG LYS A 16 14.710 -5.278 -3.226 1.00 0.00 C ATOM 237 CD LYS A 16 16.039 -5.388 -2.480 1.00 0.00 C ATOM 238 CE LYS A 16 16.444 -6.840 -2.221 1.00 0.00 C ATOM 239 NZ LYS A 16 17.740 -6.942 -1.521 1.00 0.00 N ATOM 0 H LYS A 16 11.790 -3.768 -2.878 1.00 0.00 H new ATOM 0 HA LYS A 16 12.238 -6.520 -3.902 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.474 -5.178 -1.491 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.775 -6.805 -2.067 1.00 0.00 H new ATOM 0 HG2 LYS A 16 14.767 -5.846 -4.155 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.531 -4.238 -3.499 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.819 -4.894 -3.059 1.00 0.00 H new ATOM 0 HD3 LYS A 16 15.964 -4.860 -1.530 1.00 0.00 H new ATOM 0 HE2 LYS A 16 15.673 -7.330 -1.627 1.00 0.00 H new ATOM 0 HE3 LYS A 16 16.503 -7.374 -3.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 17.973 -7.944 -1.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 18.482 -6.498 -2.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 17.678 -6.456 -0.604 1.00 0.00 H new ATOM 253 N LEU A 17 10.447 -7.255 -2.186 1.00 0.00 N ATOM 254 CA LEU A 17 9.392 -7.534 -1.272 1.00 0.00 C ATOM 255 C LEU A 17 9.869 -8.603 -0.406 1.00 0.00 C ATOM 256 O LEU A 17 10.446 -9.565 -0.864 1.00 0.00 O ATOM 257 CB LEU A 17 8.073 -7.913 -1.999 1.00 0.00 C ATOM 258 CG LEU A 17 6.763 -8.045 -1.167 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.698 -9.318 -0.349 1.00 0.00 C ATOM 260 CD2 LEU A 17 6.576 -6.830 -0.271 1.00 0.00 C ATOM 0 H LEU A 17 10.625 -7.976 -2.885 1.00 0.00 H new ATOM 0 HA LEU A 17 9.143 -6.648 -0.688 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.897 -7.166 -2.773 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.238 -8.864 -2.506 1.00 0.00 H new ATOM 0 HG LEU A 17 5.946 -8.097 -1.887 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.760 -9.346 0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.753 -10.180 -1.013 1.00 0.00 H new ATOM 0 HD13 LEU A 17 7.534 -9.345 0.350 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.656 -6.939 0.303 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.422 -6.748 0.412 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.516 -5.931 -0.885 1.00 0.00 H new ATOM 272 N PHE A 18 9.653 -8.430 0.802 1.00 0.00 N ATOM 273 CA PHE A 18 10.102 -9.324 1.818 1.00 0.00 C ATOM 274 C PHE A 18 8.946 -9.861 2.562 1.00 0.00 C ATOM 275 O PHE A 18 7.986 -9.168 2.745 1.00 0.00 O ATOM 276 CB PHE A 18 11.041 -8.601 2.786 1.00 0.00 C ATOM 277 CG PHE A 18 12.417 -8.329 2.253 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.630 -7.408 1.250 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.496 -9.019 2.749 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.892 -7.189 0.763 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.758 -8.806 2.263 1.00 0.00 C ATOM 282 CZ PHE A 18 14.957 -7.889 1.267 1.00 0.00 C ATOM 0 H PHE A 18 9.134 -7.630 1.164 1.00 0.00 H new ATOM 0 HA PHE A 18 10.642 -10.144 1.345 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.585 -7.653 3.071 1.00 0.00 H new ATOM 0 HB3 PHE A 18 11.131 -9.197 3.694 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.796 -6.855 0.845 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.346 -9.743 3.537 1.00 0.00 H new ATOM 0 HE1 PHE A 18 14.048 -6.462 -0.021 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.594 -9.360 2.664 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.950 -7.717 0.879 1.00 0.00 H new ATOM 292 N ARG A 19 9.025 -11.104 2.951 1.00 0.00 N ATOM 293 CA ARG A 19 8.096 -11.705 3.751 1.00 0.00 C ATOM 294 C ARG A 19 8.719 -12.061 5.011 1.00 0.00 C ATOM 295 O ARG A 19 9.912 -12.339 5.088 1.00 0.00 O ATOM 296 CB ARG A 19 7.517 -12.933 3.179 1.00 0.00 C ATOM 297 CG ARG A 19 8.463 -14.079 2.853 1.00 0.00 C ATOM 298 CD ARG A 19 7.690 -15.322 2.426 1.00 0.00 C ATOM 299 NE ARG A 19 6.568 -15.636 3.343 1.00 0.00 N ATOM 300 CZ ARG A 19 6.183 -16.867 3.712 1.00 0.00 C ATOM 301 NH1 ARG A 19 6.971 -17.922 3.511 1.00 0.00 N ATOM 302 NH2 ARG A 19 5.022 -17.030 4.310 1.00 0.00 N ATOM 0 H ARG A 19 9.792 -11.721 2.684 1.00 0.00 H new ATOM 0 HA ARG A 19 7.287 -10.984 3.870 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.767 -13.306 3.877 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.993 -12.661 2.263 1.00 0.00 H new ATOM 0 HG2 ARG A 19 9.143 -13.778 2.056 1.00 0.00 H new ATOM 0 HG3 ARG A 19 9.075 -14.309 3.725 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.301 -15.176 1.418 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.370 -16.173 2.385 1.00 0.00 H new ATOM 0 HE ARG A 19 6.044 -14.849 3.726 1.00 0.00 H new ATOM 0 HH11 ARG A 19 7.883 -17.801 3.070 1.00 0.00 H new ATOM 0 HH12 ARG A 19 6.663 -18.851 3.798 1.00 0.00 H new ATOM 0 HH21 ARG A 19 4.423 -16.224 4.489 1.00 0.00 H new ATOM 0 HH22 ARG A 19 4.721 -17.962 4.594 1.00 0.00 H new ATOM 316 N PHE A 20 7.948 -12.031 5.963 1.00 0.00 N ATOM 317 CA PHE A 20 8.385 -12.335 7.263 1.00 0.00 C ATOM 318 C PHE A 20 8.224 -13.792 7.399 1.00 0.00 C ATOM 319 O PHE A 20 7.110 -14.317 7.343 1.00 0.00 O ATOM 320 CB PHE A 20 7.536 -11.690 8.319 1.00 0.00 C ATOM 321 CG PHE A 20 8.190 -11.600 9.675 1.00 0.00 C ATOM 322 CD1 PHE A 20 8.953 -10.494 10.013 1.00 0.00 C ATOM 323 CD2 PHE A 20 8.040 -12.614 10.609 1.00 0.00 C ATOM 324 CE1 PHE A 20 9.554 -10.401 11.252 1.00 0.00 C ATOM 325 CE2 PHE A 20 8.640 -12.525 11.847 1.00 0.00 C ATOM 326 CZ PHE A 20 9.397 -11.418 12.170 1.00 0.00 C ATOM 0 H PHE A 20 6.959 -11.791 5.892 1.00 0.00 H new ATOM 0 HA PHE A 20 9.407 -11.979 7.397 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.269 -10.686 7.990 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.607 -12.251 8.414 1.00 0.00 H new ATOM 0 HD1 PHE A 20 9.079 -9.695 9.298 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.447 -13.483 10.364 1.00 0.00 H new ATOM 0 HE1 PHE A 20 10.146 -9.533 11.502 1.00 0.00 H new ATOM 0 HE2 PHE A 20 8.517 -13.323 12.565 1.00 0.00 H new ATOM 0 HZ PHE A 20 9.866 -11.348 13.140 1.00 0.00 H new ATOM 336 N ASP A 21 9.280 -14.426 7.536 1.00 0.00 N ATOM 337 CA ASP A 21 9.267 -15.828 7.745 1.00 0.00 C ATOM 338 C ASP A 21 9.334 -16.037 9.169 1.00 0.00 C ATOM 339 O ASP A 21 10.212 -15.586 9.790 1.00 0.00 O ATOM 340 CB ASP A 21 10.415 -16.590 7.131 1.00 0.00 C ATOM 341 CG ASP A 21 10.002 -18.027 6.825 1.00 0.00 C ATOM 342 OD1 ASP A 21 9.330 -18.654 7.663 1.00 0.00 O ATOM 343 OD2 ASP A 21 10.367 -18.552 5.750 1.00 0.00 O ATOM 0 H ASP A 21 10.210 -14.007 7.511 1.00 0.00 H new ATOM 0 HA ASP A 21 8.363 -16.203 7.265 1.00 0.00 H new ATOM 0 HB2 ASP A 21 10.738 -16.096 6.215 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.266 -16.587 7.812 1.00 0.00 H new ATOM 348 N ALA A 22 8.392 -16.645 9.651 1.00 0.00 N ATOM 349 CA ALA A 22 8.288 -17.026 11.041 1.00 0.00 C ATOM 350 C ALA A 22 9.354 -18.064 11.350 1.00 0.00 C ATOM 351 O ALA A 22 9.925 -18.090 12.436 1.00 0.00 O ATOM 352 CB ALA A 22 6.918 -17.589 11.316 1.00 0.00 C ATOM 0 H ALA A 22 7.588 -16.937 9.096 1.00 0.00 H new ATOM 0 HA ALA A 22 8.438 -16.152 11.675 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.846 -17.874 12.365 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.163 -16.835 11.092 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.752 -18.465 10.689 1.00 0.00 H new ATOM 358 N GLU A 23 9.667 -18.868 10.354 1.00 0.00 N ATOM 359 CA GLU A 23 10.669 -19.887 10.459 1.00 0.00 C ATOM 360 C GLU A 23 12.046 -19.288 10.362 1.00 0.00 C ATOM 361 O GLU A 23 13.009 -19.831 10.895 1.00 0.00 O ATOM 362 CB GLU A 23 10.452 -20.939 9.409 1.00 0.00 C ATOM 363 CG GLU A 23 9.232 -21.775 9.692 1.00 0.00 C ATOM 364 CD GLU A 23 9.407 -22.644 10.909 1.00 0.00 C ATOM 365 OE1 GLU A 23 9.234 -22.163 12.051 1.00 0.00 O ATOM 366 OE2 GLU A 23 9.744 -23.828 10.743 1.00 0.00 O ATOM 0 H GLU A 23 9.220 -18.824 9.438 1.00 0.00 H new ATOM 0 HA GLU A 23 10.586 -20.364 11.435 1.00 0.00 H new ATOM 0 HB2 GLU A 23 10.347 -20.462 8.434 1.00 0.00 H new ATOM 0 HB3 GLU A 23 11.329 -21.584 9.355 1.00 0.00 H new ATOM 0 HG2 GLU A 23 8.371 -21.122 9.835 1.00 0.00 H new ATOM 0 HG3 GLU A 23 9.015 -22.403 8.828 1.00 0.00 H new ATOM 373 N VAL A 24 12.150 -18.134 9.702 1.00 0.00 N ATOM 374 CA VAL A 24 13.437 -17.456 9.674 1.00 0.00 C ATOM 375 C VAL A 24 13.445 -16.443 10.771 1.00 0.00 C ATOM 376 O VAL A 24 14.488 -15.938 11.196 1.00 0.00 O ATOM 377 CB VAL A 24 13.697 -16.690 8.350 1.00 0.00 C ATOM 378 CG1 VAL A 24 15.129 -16.175 8.254 1.00 0.00 C ATOM 379 CG2 VAL A 24 13.421 -17.563 7.224 1.00 0.00 C ATOM 0 H VAL A 24 11.393 -17.669 9.201 1.00 0.00 H new ATOM 0 HA VAL A 24 14.207 -18.220 9.782 1.00 0.00 H new ATOM 0 HB VAL A 24 13.033 -15.825 8.333 1.00 0.00 H new ATOM 0 HG11 VAL A 24 15.263 -15.646 7.310 1.00 0.00 H new ATOM 0 HG12 VAL A 24 15.328 -15.495 9.083 1.00 0.00 H new ATOM 0 HG13 VAL A 24 15.822 -17.015 8.300 1.00 0.00 H new ATOM 0 HG21 VAL A 24 13.603 -17.025 6.294 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.072 -18.436 7.272 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.380 -17.884 7.259 1.00 0.00 H new ATOM 389 N SER A 25 12.250 -16.266 11.305 1.00 0.00 N ATOM 390 CA SER A 25 11.891 -15.161 12.145 1.00 0.00 C ATOM 391 C SER A 25 12.282 -13.898 11.491 1.00 0.00 C ATOM 392 O SER A 25 12.537 -12.890 12.169 1.00 0.00 O ATOM 393 CB SER A 25 12.529 -15.307 13.452 1.00 0.00 C ATOM 394 OG SER A 25 11.805 -16.178 14.322 1.00 0.00 O ATOM 0 H SER A 25 11.481 -16.918 11.154 1.00 0.00 H new ATOM 0 HA SER A 25 10.812 -15.145 12.298 1.00 0.00 H new ATOM 0 HB2 SER A 25 13.540 -15.692 13.318 1.00 0.00 H new ATOM 0 HB3 SER A 25 12.620 -14.326 13.919 1.00 0.00 H new ATOM 0 HG SER A 25 11.240 -16.777 13.790 1.00 0.00 H new ATOM 400 N GLN A 26 12.254 -13.869 10.165 1.00 0.00 N ATOM 401 CA GLN A 26 12.873 -12.733 9.618 1.00 0.00 C ATOM 402 C GLN A 26 12.231 -12.290 8.316 1.00 0.00 C ATOM 403 O GLN A 26 11.561 -13.072 7.667 1.00 0.00 O ATOM 404 CB GLN A 26 14.340 -13.047 9.391 1.00 0.00 C ATOM 405 CG GLN A 26 15.251 -11.875 9.100 1.00 0.00 C ATOM 406 CD GLN A 26 16.678 -12.324 8.854 1.00 0.00 C ATOM 407 OE1 GLN A 26 17.081 -12.582 7.718 1.00 0.00 O ATOM 408 NE2 GLN A 26 17.435 -12.466 9.908 1.00 0.00 N ATOM 0 H GLN A 26 11.848 -14.554 9.527 1.00 0.00 H new ATOM 0 HA GLN A 26 12.756 -11.909 10.322 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.718 -13.560 10.275 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.413 -13.748 8.560 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.883 -11.336 8.227 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.228 -11.179 9.938 1.00 0.00 H new ATOM 0 HE21 GLN A 26 17.068 -12.243 10.833 1.00 0.00 H new ATOM 0 HE22 GLN A 26 18.393 -12.800 9.806 1.00 0.00 H new ATOM 417 N TRP A 27 12.466 -11.052 7.932 1.00 0.00 N ATOM 418 CA TRP A 27 12.070 -10.542 6.697 1.00 0.00 C ATOM 419 C TRP A 27 13.046 -11.024 5.595 1.00 0.00 C ATOM 420 O TRP A 27 14.196 -10.590 5.506 1.00 0.00 O ATOM 421 CB TRP A 27 11.983 -9.013 6.801 1.00 0.00 C ATOM 422 CG TRP A 27 13.081 -8.342 7.598 1.00 0.00 C ATOM 423 CD1 TRP A 27 14.332 -8.011 7.165 1.00 0.00 C ATOM 424 CD2 TRP A 27 13.001 -7.898 8.962 1.00 0.00 C ATOM 425 NE1 TRP A 27 15.037 -7.415 8.177 1.00 0.00 N ATOM 426 CE2 TRP A 27 14.246 -7.329 9.286 1.00 0.00 C ATOM 427 CE3 TRP A 27 12.002 -7.934 9.938 1.00 0.00 C ATOM 428 CZ2 TRP A 27 14.518 -6.797 10.543 1.00 0.00 C ATOM 429 CZ3 TRP A 27 12.273 -7.405 11.184 1.00 0.00 C ATOM 430 CH2 TRP A 27 13.520 -6.845 11.477 1.00 0.00 C ATOM 0 H TRP A 27 12.957 -10.374 8.514 1.00 0.00 H new ATOM 0 HA TRP A 27 11.082 -10.909 6.418 1.00 0.00 H new ATOM 0 HB2 TRP A 27 11.987 -8.599 5.793 1.00 0.00 H new ATOM 0 HB3 TRP A 27 11.024 -8.752 7.249 1.00 0.00 H new ATOM 0 HD1 TRP A 27 14.711 -8.192 6.170 1.00 0.00 H new ATOM 0 HE1 TRP A 27 16.001 -7.087 8.112 1.00 0.00 H new ATOM 0 HE3 TRP A 27 11.037 -8.367 9.722 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 15.480 -6.363 10.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 11.508 -7.424 11.946 1.00 0.00 H new ATOM 0 HH2 TRP A 27 13.699 -6.441 12.463 1.00 0.00 H new ATOM 441 N LYS A 28 12.587 -11.951 4.822 1.00 0.00 N ATOM 442 CA LYS A 28 13.346 -12.571 3.749 1.00 0.00 C ATOM 443 C LYS A 28 12.617 -12.303 2.475 1.00 0.00 C ATOM 444 O LYS A 28 11.382 -12.312 2.469 1.00 0.00 O ATOM 445 CB LYS A 28 13.458 -14.073 4.048 1.00 0.00 C ATOM 446 CG LYS A 28 14.199 -14.923 3.030 1.00 0.00 C ATOM 447 CD LYS A 28 14.182 -16.377 3.477 1.00 0.00 C ATOM 448 CE LYS A 28 14.851 -17.300 2.477 1.00 0.00 C ATOM 449 NZ LYS A 28 14.800 -18.707 2.932 1.00 0.00 N ATOM 0 H LYS A 28 11.641 -12.322 4.910 1.00 0.00 H new ATOM 0 HA LYS A 28 14.356 -12.170 3.664 1.00 0.00 H new ATOM 0 HB2 LYS A 28 13.952 -14.191 5.012 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.450 -14.474 4.155 1.00 0.00 H new ATOM 0 HG2 LYS A 28 13.731 -14.827 2.050 1.00 0.00 H new ATOM 0 HG3 LYS A 28 15.227 -14.574 2.928 1.00 0.00 H new ATOM 0 HD2 LYS A 28 14.686 -16.464 4.440 1.00 0.00 H new ATOM 0 HD3 LYS A 28 13.150 -16.696 3.627 1.00 0.00 H new ATOM 0 HE2 LYS A 28 14.359 -17.210 1.509 1.00 0.00 H new ATOM 0 HE3 LYS A 28 15.889 -16.998 2.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 15.265 -19.316 2.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 15.291 -18.795 3.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 13.808 -19.000 3.043 1.00 0.00 H new ATOM 463 N GLU A 29 13.348 -12.025 1.399 1.00 0.00 N ATOM 464 CA GLU A 29 12.743 -11.651 0.223 1.00 0.00 C ATOM 465 C GLU A 29 11.830 -12.656 -0.354 1.00 0.00 C ATOM 466 O GLU A 29 12.059 -13.874 -0.332 1.00 0.00 O ATOM 467 CB GLU A 29 13.602 -10.891 -0.804 1.00 0.00 C ATOM 468 CG GLU A 29 15.009 -11.420 -1.038 1.00 0.00 C ATOM 469 CD GLU A 29 15.070 -12.860 -1.456 1.00 0.00 C ATOM 470 OE1 GLU A 29 14.839 -13.158 -2.648 1.00 0.00 O ATOM 471 OE2 GLU A 29 15.398 -13.707 -0.613 1.00 0.00 O ATOM 0 H GLU A 29 14.367 -12.066 1.365 1.00 0.00 H new ATOM 0 HA GLU A 29 12.086 -10.855 0.574 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.074 -10.893 -1.758 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.677 -9.852 -0.483 1.00 0.00 H new ATOM 0 HG2 GLU A 29 15.490 -10.812 -1.804 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.587 -11.296 -0.123 1.00 0.00 H new ATOM 478 N ARG A 30 10.796 -12.143 -0.805 1.00 0.00 N ATOM 479 CA ARG A 30 9.727 -12.921 -1.328 1.00 0.00 C ATOM 480 C ARG A 30 9.739 -12.747 -2.780 1.00 0.00 C ATOM 481 O ARG A 30 9.626 -13.683 -3.561 1.00 0.00 O ATOM 482 CB ARG A 30 8.405 -12.404 -0.838 1.00 0.00 C ATOM 483 CG ARG A 30 7.317 -13.468 -0.919 1.00 0.00 C ATOM 484 CD ARG A 30 5.956 -13.023 -0.397 1.00 0.00 C ATOM 485 NE ARG A 30 4.974 -14.119 -0.502 1.00 0.00 N ATOM 486 CZ ARG A 30 4.232 -14.631 0.518 1.00 0.00 C ATOM 487 NH1 ARG A 30 4.294 -14.104 1.737 1.00 0.00 N ATOM 488 NH2 ARG A 30 3.419 -15.655 0.294 1.00 0.00 N ATOM 0 H ARG A 30 10.632 -11.137 -0.836 1.00 0.00 H new ATOM 0 HA ARG A 30 9.851 -13.960 -1.021 1.00 0.00 H new ATOM 0 HB2 ARG A 30 8.507 -12.065 0.193 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.111 -11.538 -1.430 1.00 0.00 H new ATOM 0 HG2 ARG A 30 7.209 -13.780 -1.958 1.00 0.00 H new ATOM 0 HG3 ARG A 30 7.640 -14.343 -0.355 1.00 0.00 H new ATOM 0 HD2 ARG A 30 6.045 -12.706 0.642 1.00 0.00 H new ATOM 0 HD3 ARG A 30 5.608 -12.160 -0.965 1.00 0.00 H new ATOM 0 HE ARG A 30 4.838 -14.532 -1.425 1.00 0.00 H new ATOM 0 HH11 ARG A 30 4.903 -13.306 1.917 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.732 -14.498 2.492 1.00 0.00 H new ATOM 0 HH21 ARG A 30 3.351 -16.057 -0.641 1.00 0.00 H new ATOM 0 HH22 ARG A 30 2.862 -16.040 1.057 1.00 0.00 H new ATOM 502 N GLY A 31 9.894 -11.524 -3.128 1.00 0.00 N ATOM 503 CA GLY A 31 9.889 -11.130 -4.455 1.00 0.00 C ATOM 504 C GLY A 31 10.757 -9.949 -4.649 1.00 0.00 C ATOM 505 O GLY A 31 11.203 -9.328 -3.697 1.00 0.00 O ATOM 0 H GLY A 31 10.031 -10.760 -2.466 1.00 0.00 H new ATOM 0 HA2 GLY A 31 10.235 -11.950 -5.085 1.00 0.00 H new ATOM 0 HA3 GLY A 31 8.871 -10.896 -4.767 1.00 0.00 H new ATOM 509 N LEU A 32 10.984 -9.678 -5.848 1.00 0.00 N ATOM 510 CA LEU A 32 11.778 -8.585 -6.345 1.00 0.00 C ATOM 511 C LEU A 32 11.072 -8.140 -7.597 1.00 0.00 C ATOM 512 O LEU A 32 10.212 -8.872 -8.098 1.00 0.00 O ATOM 513 CB LEU A 32 13.224 -9.028 -6.766 1.00 0.00 C ATOM 514 CG LEU A 32 14.202 -9.622 -5.717 1.00 0.00 C ATOM 515 CD1 LEU A 32 14.353 -8.738 -4.507 1.00 0.00 C ATOM 516 CD2 LEU A 32 13.856 -11.047 -5.329 1.00 0.00 C ATOM 0 H LEU A 32 10.600 -10.246 -6.603 1.00 0.00 H new ATOM 0 HA LEU A 32 11.880 -7.822 -5.573 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.116 -9.767 -7.560 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.712 -8.158 -7.205 1.00 0.00 H new ATOM 0 HG LEU A 32 15.174 -9.661 -6.209 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.047 -9.199 -3.804 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.738 -7.765 -4.813 1.00 0.00 H new ATOM 0 HD13 LEU A 32 13.383 -8.609 -4.027 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.574 -11.408 -4.593 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.854 -11.075 -4.901 1.00 0.00 H new ATOM 0 HD23 LEU A 32 13.891 -11.684 -6.213 1.00 0.00 H new ATOM 528 N GLY A 33 11.378 -6.985 -8.087 1.00 0.00 N ATOM 529 CA GLY A 33 10.836 -6.604 -9.356 1.00 0.00 C ATOM 530 C GLY A 33 9.996 -5.379 -9.284 1.00 0.00 C ATOM 531 O GLY A 33 10.114 -4.597 -8.362 1.00 0.00 O ATOM 0 H GLY A 33 11.987 -6.298 -7.642 1.00 0.00 H new ATOM 0 HA2 GLY A 33 11.653 -6.437 -10.059 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.238 -7.425 -9.751 1.00 0.00 H new ATOM 535 N ASN A 34 9.127 -5.247 -10.228 1.00 0.00 N ATOM 536 CA ASN A 34 8.307 -4.097 -10.402 1.00 0.00 C ATOM 537 C ASN A 34 7.093 -4.181 -9.594 1.00 0.00 C ATOM 538 O ASN A 34 6.252 -5.090 -9.721 1.00 0.00 O ATOM 539 CB ASN A 34 7.940 -3.945 -11.832 1.00 0.00 C ATOM 540 CG ASN A 34 7.196 -2.672 -12.118 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.800 -1.647 -12.419 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.893 -2.732 -12.046 1.00 0.00 N ATOM 0 H ASN A 34 8.962 -5.969 -10.929 1.00 0.00 H new ATOM 0 HA ASN A 34 8.878 -3.229 -10.074 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.845 -3.973 -12.438 1.00 0.00 H new ATOM 0 HB3 ASN A 34 7.326 -4.793 -12.135 1.00 0.00 H new ATOM 0 HD21 ASN A 34 5.333 -1.903 -12.244 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.436 -3.608 -11.791 1.00 0.00 H new ATOM 549 N LEU A 35 7.035 -3.254 -8.764 1.00 0.00 N ATOM 550 CA LEU A 35 5.956 -3.009 -7.957 1.00 0.00 C ATOM 551 C LEU A 35 5.015 -2.111 -8.655 1.00 0.00 C ATOM 552 O LEU A 35 5.377 -1.006 -9.039 1.00 0.00 O ATOM 553 CB LEU A 35 6.382 -2.434 -6.597 1.00 0.00 C ATOM 554 CG LEU A 35 5.347 -1.615 -5.789 1.00 0.00 C ATOM 555 CD1 LEU A 35 4.166 -2.445 -5.359 1.00 0.00 C ATOM 556 CD2 LEU A 35 6.004 -0.961 -4.588 1.00 0.00 C ATOM 0 H LEU A 35 7.801 -2.596 -8.621 1.00 0.00 H new ATOM 0 HA LEU A 35 5.453 -3.954 -7.749 1.00 0.00 H new ATOM 0 HB2 LEU A 35 6.709 -3.265 -5.972 1.00 0.00 H new ATOM 0 HB3 LEU A 35 7.252 -1.799 -6.763 1.00 0.00 H new ATOM 0 HG LEU A 35 4.967 -0.838 -6.453 1.00 0.00 H new ATOM 0 HD11 LEU A 35 3.470 -1.823 -4.796 1.00 0.00 H new ATOM 0 HD12 LEU A 35 3.664 -2.846 -6.239 1.00 0.00 H new ATOM 0 HD13 LEU A 35 4.509 -3.267 -4.730 1.00 0.00 H new ATOM 0 HD21 LEU A 35 5.260 -0.390 -4.033 1.00 0.00 H new ATOM 0 HD22 LEU A 35 6.428 -1.730 -3.942 1.00 0.00 H new ATOM 0 HD23 LEU A 35 6.797 -0.293 -4.926 1.00 0.00 H new ATOM 568 N LYS A 36 3.839 -2.568 -8.841 1.00 0.00 N ATOM 569 CA LYS A 36 2.861 -1.749 -9.379 1.00 0.00 C ATOM 570 C LYS A 36 1.851 -1.461 -8.301 1.00 0.00 C ATOM 571 O LYS A 36 1.520 -2.334 -7.481 1.00 0.00 O ATOM 572 CB LYS A 36 2.179 -2.336 -10.630 1.00 0.00 C ATOM 573 CG LYS A 36 1.411 -3.624 -10.373 1.00 0.00 C ATOM 574 CD LYS A 36 0.498 -4.011 -11.532 1.00 0.00 C ATOM 575 CE LYS A 36 1.264 -4.313 -12.797 1.00 0.00 C ATOM 576 NZ LYS A 36 0.373 -4.761 -13.891 1.00 0.00 N ATOM 0 H LYS A 36 3.540 -3.518 -8.622 1.00 0.00 H new ATOM 0 HA LYS A 36 3.339 -0.832 -9.723 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.494 -1.593 -11.040 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.938 -2.524 -11.390 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.118 -4.432 -10.189 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.814 -3.511 -9.468 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -0.090 -4.884 -11.250 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.205 -3.200 -11.722 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.807 -3.422 -13.113 1.00 0.00 H new ATOM 0 HE3 LYS A 36 2.007 -5.085 -12.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.939 -4.958 -14.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.127 -5.625 -13.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.320 -4.015 -14.102 1.00 0.00 H new ATOM 590 N ILE A 37 1.369 -0.287 -8.289 1.00 0.00 N ATOM 591 CA ILE A 37 0.374 0.072 -7.367 1.00 0.00 C ATOM 592 C ILE A 37 -0.879 0.254 -8.097 1.00 0.00 C ATOM 593 O ILE A 37 -0.937 0.990 -9.104 1.00 0.00 O ATOM 594 CB ILE A 37 0.729 1.388 -6.650 1.00 0.00 C ATOM 595 CG1 ILE A 37 1.839 1.135 -5.633 1.00 0.00 C ATOM 596 CG2 ILE A 37 -0.516 2.049 -5.994 1.00 0.00 C ATOM 597 CD1 ILE A 37 1.383 0.486 -4.333 1.00 0.00 C ATOM 0 H ILE A 37 1.655 0.459 -8.923 1.00 0.00 H new ATOM 0 HA ILE A 37 0.285 -0.713 -6.617 1.00 0.00 H new ATOM 0 HB ILE A 37 1.092 2.098 -7.393 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.595 0.499 -6.093 1.00 0.00 H new ATOM 0 HG13 ILE A 37 2.320 2.085 -5.399 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.219 2.974 -5.500 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -1.258 2.270 -6.762 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.945 1.367 -5.260 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.241 0.347 -3.675 1.00 0.00 H new ATOM 0 HD12 ILE A 37 0.651 1.128 -3.843 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.930 -0.482 -4.549 1.00 0.00 H new ATOM 609 N LEU A 38 -1.867 -0.403 -7.619 1.00 0.00 N ATOM 610 CA LEU A 38 -3.149 -0.229 -8.180 1.00 0.00 C ATOM 611 C LEU A 38 -3.980 0.521 -7.174 1.00 0.00 C ATOM 612 O LEU A 38 -3.973 0.210 -6.001 1.00 0.00 O ATOM 613 CB LEU A 38 -3.788 -1.590 -8.478 1.00 0.00 C ATOM 614 CG LEU A 38 -3.001 -2.532 -9.394 1.00 0.00 C ATOM 615 CD1 LEU A 38 -3.746 -3.834 -9.611 1.00 0.00 C ATOM 616 CD2 LEU A 38 -2.724 -1.881 -10.716 1.00 0.00 C ATOM 0 H LEU A 38 -1.813 -1.064 -6.844 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.085 0.323 -9.118 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.959 -2.101 -7.530 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.766 -1.416 -8.927 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.054 -2.752 -8.901 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.163 -4.482 -10.265 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.900 -4.329 -8.652 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.712 -3.628 -10.072 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.164 -2.569 -11.350 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.666 -1.626 -11.201 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.140 -0.974 -10.560 1.00 0.00 H new ATOM 628 N LYS A 39 -4.645 1.515 -7.626 1.00 0.00 N ATOM 629 CA LYS A 39 -5.509 2.320 -6.790 1.00 0.00 C ATOM 630 C LYS A 39 -6.933 2.176 -7.282 1.00 0.00 C ATOM 631 O LYS A 39 -7.196 2.410 -8.446 1.00 0.00 O ATOM 632 CB LYS A 39 -5.077 3.798 -6.850 1.00 0.00 C ATOM 633 CG LYS A 39 -3.627 4.053 -6.432 1.00 0.00 C ATOM 634 CD LYS A 39 -3.298 5.541 -6.438 1.00 0.00 C ATOM 635 CE LYS A 39 -1.816 5.806 -6.162 1.00 0.00 C ATOM 636 NZ LYS A 39 -1.367 5.348 -4.815 1.00 0.00 N ATOM 0 H LYS A 39 -4.617 1.813 -8.601 1.00 0.00 H new ATOM 0 HA LYS A 39 -5.439 1.982 -5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.218 4.164 -7.867 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.735 4.382 -6.207 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -3.458 3.646 -5.435 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.954 3.528 -7.110 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -3.568 5.967 -7.404 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -3.902 6.048 -5.686 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -1.218 5.306 -6.924 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -1.623 6.875 -6.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -0.333 5.433 -4.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -1.812 5.936 -4.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -1.642 4.355 -4.676 1.00 0.00 H new ATOM 650 N ASN A 40 -7.831 1.743 -6.420 1.00 0.00 N ATOM 651 CA ASN A 40 -9.230 1.541 -6.810 1.00 0.00 C ATOM 652 C ASN A 40 -9.941 2.812 -7.188 1.00 0.00 C ATOM 653 O ASN A 40 -9.739 3.851 -6.579 1.00 0.00 O ATOM 654 CB ASN A 40 -10.042 0.836 -5.720 1.00 0.00 C ATOM 655 CG ASN A 40 -9.827 -0.650 -5.690 1.00 0.00 C ATOM 656 OD1 ASN A 40 -8.967 -1.177 -4.999 1.00 0.00 O ATOM 657 ND2 ASN A 40 -10.608 -1.319 -6.441 1.00 0.00 N ATOM 0 H ASN A 40 -7.627 1.522 -5.445 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.171 0.906 -7.694 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -9.776 1.255 -4.750 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -11.101 1.040 -5.876 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -10.530 -2.335 -6.482 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.312 -0.839 -7.001 1.00 0.00 H new ATOM 664 N GLU A 41 -10.823 2.698 -8.174 1.00 0.00 N ATOM 665 CA GLU A 41 -11.674 3.719 -8.625 1.00 0.00 C ATOM 666 C GLU A 41 -12.776 3.947 -7.590 1.00 0.00 C ATOM 667 O GLU A 41 -13.472 4.955 -7.617 1.00 0.00 O ATOM 668 CB GLU A 41 -12.255 3.246 -9.929 1.00 0.00 C ATOM 669 CG GLU A 41 -11.457 3.594 -11.181 1.00 0.00 C ATOM 670 CD GLU A 41 -11.520 5.075 -11.537 1.00 0.00 C ATOM 671 OE1 GLU A 41 -12.551 5.525 -12.094 1.00 0.00 O ATOM 672 OE2 GLU A 41 -10.549 5.823 -11.279 1.00 0.00 O ATOM 0 H GLU A 41 -10.947 1.827 -8.691 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.145 4.662 -8.764 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.367 2.163 -9.883 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.256 3.666 -10.032 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -10.416 3.306 -11.033 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -11.834 3.008 -12.019 1.00 0.00 H new ATOM 679 N VAL A 42 -12.890 2.996 -6.649 1.00 0.00 N ATOM 680 CA VAL A 42 -13.753 3.058 -5.545 1.00 0.00 C ATOM 681 C VAL A 42 -13.158 4.070 -4.575 1.00 0.00 C ATOM 682 O VAL A 42 -13.855 4.651 -3.729 1.00 0.00 O ATOM 683 CB VAL A 42 -13.764 1.642 -4.907 1.00 0.00 C ATOM 684 CG1 VAL A 42 -14.318 1.651 -3.541 1.00 0.00 C ATOM 685 CG2 VAL A 42 -14.531 0.664 -5.763 1.00 0.00 C ATOM 0 H VAL A 42 -12.340 2.137 -6.674 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.768 3.354 -5.810 1.00 0.00 H new ATOM 0 HB VAL A 42 -12.724 1.322 -4.846 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -14.305 0.639 -3.136 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.715 2.302 -2.908 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -15.344 2.018 -3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -14.521 -0.318 -5.291 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -15.561 1.005 -5.871 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -14.066 0.598 -6.746 1.00 0.00 H new ATOM 695 N ASN A 43 -11.831 4.270 -4.737 1.00 0.00 N ATOM 696 CA ASN A 43 -11.029 5.169 -3.923 1.00 0.00 C ATOM 697 C ASN A 43 -11.060 4.637 -2.497 1.00 0.00 C ATOM 698 O ASN A 43 -10.943 5.343 -1.515 1.00 0.00 O ATOM 699 CB ASN A 43 -11.611 6.592 -4.094 1.00 0.00 C ATOM 700 CG ASN A 43 -10.920 7.712 -3.322 1.00 0.00 C ATOM 701 OD1 ASN A 43 -9.960 8.280 -3.797 1.00 0.00 O ATOM 702 ND2 ASN A 43 -11.447 8.085 -2.184 1.00 0.00 N ATOM 0 H ASN A 43 -11.289 3.793 -5.458 1.00 0.00 H new ATOM 0 HA ASN A 43 -9.981 5.222 -4.217 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.587 6.844 -5.154 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -12.659 6.569 -3.795 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.050 8.873 -1.672 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.255 7.588 -1.809 1.00 0.00 H new ATOM 709 N GLY A 44 -11.174 3.325 -2.412 1.00 0.00 N ATOM 710 CA GLY A 44 -11.324 2.712 -1.111 1.00 0.00 C ATOM 711 C GLY A 44 -10.187 1.813 -0.743 1.00 0.00 C ATOM 712 O GLY A 44 -9.846 1.676 0.427 1.00 0.00 O ATOM 0 H GLY A 44 -11.166 2.682 -3.203 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.417 3.494 -0.358 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.251 2.139 -1.092 1.00 0.00 H new ATOM 716 N LYS A 45 -9.594 1.207 -1.730 1.00 0.00 N ATOM 717 CA LYS A 45 -8.540 0.255 -1.529 1.00 0.00 C ATOM 718 C LYS A 45 -7.476 0.541 -2.547 1.00 0.00 C ATOM 719 O LYS A 45 -7.781 1.015 -3.642 1.00 0.00 O ATOM 720 CB LYS A 45 -9.076 -1.153 -1.786 1.00 0.00 C ATOM 721 CG LYS A 45 -10.264 -1.562 -0.936 1.00 0.00 C ATOM 722 CD LYS A 45 -10.850 -2.861 -1.434 1.00 0.00 C ATOM 723 CE LYS A 45 -12.067 -3.267 -0.633 1.00 0.00 C ATOM 724 NZ LYS A 45 -12.686 -4.493 -1.172 1.00 0.00 N ATOM 0 H LYS A 45 -9.832 1.362 -2.710 1.00 0.00 H new ATOM 0 HA LYS A 45 -8.153 0.324 -0.513 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.358 -1.230 -2.836 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.269 -1.867 -1.620 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.954 -1.671 0.103 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.023 -0.780 -0.962 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -11.123 -2.759 -2.484 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.097 -3.647 -1.375 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.782 -3.429 0.407 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.796 -2.457 -0.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.517 -4.743 -0.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.980 -4.330 -2.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.998 -5.272 -1.141 1.00 0.00 H new ATOM 738 N LEU A 46 -6.251 0.349 -2.191 1.00 0.00 N ATOM 739 CA LEU A 46 -5.200 0.444 -3.076 1.00 0.00 C ATOM 740 C LEU A 46 -4.390 -0.779 -2.822 1.00 0.00 C ATOM 741 O LEU A 46 -4.351 -1.249 -1.694 1.00 0.00 O ATOM 742 CB LEU A 46 -4.290 1.604 -2.763 1.00 0.00 C ATOM 743 CG LEU A 46 -4.857 2.999 -2.368 1.00 0.00 C ATOM 744 CD1 LEU A 46 -5.867 3.516 -3.368 1.00 0.00 C ATOM 745 CD2 LEU A 46 -5.397 3.033 -0.933 1.00 0.00 C ATOM 0 H LEU A 46 -5.971 0.115 -1.238 1.00 0.00 H new ATOM 0 HA LEU A 46 -5.582 0.564 -4.090 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.638 1.285 -1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -3.657 1.755 -3.638 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.011 3.686 -2.395 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.231 4.491 -3.046 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.395 3.610 -4.346 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.703 2.820 -3.434 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.780 4.029 -0.712 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.201 2.304 -0.829 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -4.595 2.789 -0.236 1.00 0.00 H new ATOM 757 N ARG A 47 -3.738 -1.260 -3.801 1.00 0.00 N ATOM 758 CA ARG A 47 -2.905 -2.434 -3.645 1.00 0.00 C ATOM 759 C ARG A 47 -1.528 -2.108 -4.090 1.00 0.00 C ATOM 760 O ARG A 47 -1.303 -1.209 -4.897 1.00 0.00 O ATOM 761 CB ARG A 47 -3.252 -3.601 -4.536 1.00 0.00 C ATOM 762 CG ARG A 47 -4.679 -3.743 -5.023 1.00 0.00 C ATOM 763 CD ARG A 47 -4.766 -4.977 -5.899 1.00 0.00 C ATOM 764 NE ARG A 47 -6.119 -5.309 -6.324 1.00 0.00 N ATOM 765 CZ ARG A 47 -6.553 -6.551 -6.599 1.00 0.00 C ATOM 766 NH1 ARG A 47 -5.712 -7.594 -6.571 1.00 0.00 N ATOM 767 NH2 ARG A 47 -7.803 -6.730 -6.950 1.00 0.00 N ATOM 0 H ARG A 47 -3.749 -0.870 -4.743 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.034 -2.704 -2.597 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -2.607 -3.551 -5.413 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -2.993 -4.514 -4.001 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -5.361 -3.830 -4.177 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.978 -2.858 -5.584 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.145 -4.827 -6.782 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.348 -5.825 -5.356 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.786 -4.543 -6.420 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.729 -7.451 -6.339 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.055 -8.531 -6.782 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.435 -5.932 -7.012 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.144 -7.668 -7.161 1.00 0.00 H new ATOM 781 N MET A 48 -0.666 -2.871 -3.597 1.00 0.00 N ATOM 782 CA MET A 48 0.685 -2.935 -3.948 1.00 0.00 C ATOM 783 C MET A 48 0.891 -4.340 -4.390 1.00 0.00 C ATOM 784 O MET A 48 0.665 -5.281 -3.606 1.00 0.00 O ATOM 785 CB MET A 48 1.580 -2.805 -2.714 1.00 0.00 C ATOM 786 CG MET A 48 1.273 -1.698 -1.743 1.00 0.00 C ATOM 787 SD MET A 48 2.430 -1.705 -0.370 1.00 0.00 S ATOM 788 CE MET A 48 3.985 -1.480 -1.236 1.00 0.00 C ATOM 0 H MET A 48 -0.903 -3.538 -2.862 1.00 0.00 H new ATOM 0 HA MET A 48 0.918 -2.157 -4.675 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.541 -3.749 -2.170 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.607 -2.676 -3.056 1.00 0.00 H new ATOM 0 HG2 MET A 48 1.318 -0.737 -2.256 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.256 -1.811 -1.367 1.00 0.00 H new ATOM 0 HE1 MET A 48 4.675 -0.919 -0.605 1.00 0.00 H new ATOM 0 HE2 MET A 48 4.416 -2.454 -1.468 1.00 0.00 H new ATOM 0 HE3 MET A 48 3.810 -0.930 -2.161 1.00 0.00 H new ATOM 798 N LEU A 49 1.264 -4.521 -5.574 1.00 0.00 N ATOM 799 CA LEU A 49 1.734 -5.823 -5.965 1.00 0.00 C ATOM 800 C LEU A 49 3.010 -5.742 -6.700 1.00 0.00 C ATOM 801 O LEU A 49 3.235 -4.843 -7.496 1.00 0.00 O ATOM 802 CB LEU A 49 0.789 -6.645 -6.767 1.00 0.00 C ATOM 803 CG LEU A 49 0.309 -6.077 -8.095 1.00 0.00 C ATOM 804 CD1 LEU A 49 -0.172 -7.197 -8.961 1.00 0.00 C ATOM 805 CD2 LEU A 49 -0.825 -5.088 -7.875 1.00 0.00 C ATOM 0 H LEU A 49 1.266 -3.812 -6.307 1.00 0.00 H new ATOM 0 HA LEU A 49 1.855 -6.332 -5.009 1.00 0.00 H new ATOM 0 HB2 LEU A 49 1.265 -7.605 -6.965 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.088 -6.845 -6.151 1.00 0.00 H new ATOM 0 HG LEU A 49 1.137 -5.557 -8.577 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.518 -6.797 -9.914 1.00 0.00 H new ATOM 0 HD12 LEU A 49 0.644 -7.898 -9.136 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.994 -7.713 -8.465 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.155 -4.693 -8.836 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.658 -5.592 -7.385 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.476 -4.269 -7.246 1.00 0.00 H new ATOM 817 N MET A 50 3.816 -6.702 -6.479 1.00 0.00 N ATOM 818 CA MET A 50 5.034 -6.788 -6.989 1.00 0.00 C ATOM 819 C MET A 50 5.147 -8.108 -7.594 1.00 0.00 C ATOM 820 O MET A 50 4.898 -9.144 -6.978 1.00 0.00 O ATOM 821 CB MET A 50 6.060 -6.633 -5.911 1.00 0.00 C ATOM 822 CG MET A 50 5.521 -6.834 -4.487 1.00 0.00 C ATOM 823 SD MET A 50 4.765 -5.335 -3.798 1.00 0.00 S ATOM 824 CE MET A 50 3.906 -5.953 -2.364 1.00 0.00 C ATOM 0 H MET A 50 3.577 -7.492 -5.880 1.00 0.00 H new ATOM 0 HA MET A 50 5.202 -6.002 -7.725 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.864 -7.348 -6.086 1.00 0.00 H new ATOM 0 HB3 MET A 50 6.498 -5.637 -5.983 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.783 -7.636 -4.493 1.00 0.00 H new ATOM 0 HG3 MET A 50 6.336 -7.155 -3.838 1.00 0.00 H new ATOM 0 HE1 MET A 50 3.836 -5.165 -1.614 1.00 0.00 H new ATOM 0 HE2 MET A 50 2.904 -6.273 -2.650 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.453 -6.800 -1.949 1.00 0.00 H new ATOM 834 N ARG A 51 5.462 -8.024 -8.743 1.00 0.00 N ATOM 835 CA ARG A 51 5.701 -9.086 -9.666 1.00 0.00 C ATOM 836 C ARG A 51 7.108 -9.021 -10.116 1.00 0.00 C ATOM 837 O ARG A 51 7.712 -7.953 -10.214 1.00 0.00 O ATOM 838 CB ARG A 51 4.778 -8.922 -10.853 1.00 0.00 C ATOM 839 CG ARG A 51 4.905 -9.897 -12.009 1.00 0.00 C ATOM 840 CD ARG A 51 3.922 -9.597 -13.132 1.00 0.00 C ATOM 841 NE ARG A 51 4.123 -8.279 -13.755 1.00 0.00 N ATOM 842 CZ ARG A 51 4.736 -8.080 -14.938 1.00 0.00 C ATOM 843 NH1 ARG A 51 5.524 -9.019 -15.452 1.00 0.00 N ATOM 844 NH2 ARG A 51 4.627 -6.922 -15.554 1.00 0.00 N ATOM 0 H ARG A 51 5.593 -7.113 -9.182 1.00 0.00 H new ATOM 0 HA ARG A 51 5.514 -10.049 -9.191 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.753 -8.975 -10.486 1.00 0.00 H new ATOM 0 HB3 ARG A 51 4.923 -7.917 -11.249 1.00 0.00 H new ATOM 0 HG2 ARG A 51 5.922 -9.862 -12.401 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.739 -10.911 -11.645 1.00 0.00 H new ATOM 0 HD2 ARG A 51 4.011 -10.368 -13.897 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.907 -9.653 -12.739 1.00 0.00 H new ATOM 0 HE ARG A 51 3.774 -7.460 -13.257 1.00 0.00 H new ATOM 0 HH11 ARG A 51 5.667 -9.896 -14.950 1.00 0.00 H new ATOM 0 HH12 ARG A 51 5.986 -8.863 -16.348 1.00 0.00 H new ATOM 0 HH21 ARG A 51 4.077 -6.172 -15.136 1.00 0.00 H new ATOM 0 HH22 ARG A 51 5.093 -6.775 -16.450 1.00 0.00 H new ATOM 858 N ARG A 52 7.607 -10.146 -10.389 1.00 0.00 N ATOM 859 CA ARG A 52 8.877 -10.289 -10.882 1.00 0.00 C ATOM 860 C ARG A 52 8.695 -10.130 -12.345 1.00 0.00 C ATOM 861 O ARG A 52 7.866 -10.793 -12.946 1.00 0.00 O ATOM 862 CB ARG A 52 9.442 -11.639 -10.467 1.00 0.00 C ATOM 863 CG ARG A 52 9.583 -11.851 -8.956 1.00 0.00 C ATOM 864 CD ARG A 52 10.259 -13.186 -8.652 1.00 0.00 C ATOM 865 NE ARG A 52 10.427 -13.442 -7.210 1.00 0.00 N ATOM 866 CZ ARG A 52 11.603 -13.751 -6.615 1.00 0.00 C ATOM 867 NH1 ARG A 52 12.742 -13.726 -7.310 1.00 0.00 N ATOM 868 NH2 ARG A 52 11.636 -14.068 -5.326 1.00 0.00 N ATOM 0 H ARG A 52 7.109 -11.027 -10.265 1.00 0.00 H new ATOM 0 HA ARG A 52 9.601 -9.567 -10.504 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.800 -12.423 -10.869 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.422 -11.762 -10.928 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.166 -11.037 -8.524 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.599 -11.822 -8.488 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.670 -13.991 -9.090 1.00 0.00 H new ATOM 0 HD3 ARG A 52 11.237 -13.208 -9.134 1.00 0.00 H new ATOM 0 HE ARG A 52 9.598 -13.382 -6.619 1.00 0.00 H new ATOM 0 HH11 ARG A 52 12.731 -13.473 -8.298 1.00 0.00 H new ATOM 0 HH12 ARG A 52 13.623 -13.960 -6.853 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.774 -14.079 -4.781 1.00 0.00 H new ATOM 0 HH22 ARG A 52 12.524 -14.300 -4.881 1.00 0.00 H new ATOM 882 N GLU A 53 9.408 -9.199 -12.859 1.00 0.00 N ATOM 883 CA GLU A 53 9.325 -8.722 -14.247 1.00 0.00 C ATOM 884 C GLU A 53 9.336 -9.759 -15.276 1.00 0.00 C ATOM 885 O GLU A 53 8.273 -10.081 -15.827 1.00 0.00 O ATOM 886 CB GLU A 53 10.295 -7.583 -14.530 1.00 0.00 C ATOM 887 CG GLU A 53 9.787 -6.213 -14.146 1.00 0.00 C ATOM 888 CD GLU A 53 10.729 -5.123 -14.587 1.00 0.00 C ATOM 889 OE1 GLU A 53 10.905 -4.934 -15.811 1.00 0.00 O ATOM 890 OE2 GLU A 53 11.299 -4.422 -13.734 1.00 0.00 O ATOM 0 H GLU A 53 10.115 -8.701 -12.317 1.00 0.00 H new ATOM 0 HA GLU A 53 8.318 -8.311 -14.325 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.225 -7.774 -13.995 1.00 0.00 H new ATOM 0 HB3 GLU A 53 10.534 -7.582 -15.594 1.00 0.00 H new ATOM 0 HG2 GLU A 53 8.807 -6.050 -14.594 1.00 0.00 H new ATOM 0 HG3 GLU A 53 9.655 -6.164 -13.065 1.00 0.00 H new ATOM 897 N GLN A 54 10.442 -10.328 -15.532 1.00 0.00 N ATOM 898 CA GLN A 54 10.468 -11.251 -16.605 1.00 0.00 C ATOM 899 C GLN A 54 9.923 -12.595 -16.082 1.00 0.00 C ATOM 900 O GLN A 54 9.539 -13.475 -16.826 1.00 0.00 O ATOM 901 CB GLN A 54 11.880 -11.366 -17.195 1.00 0.00 C ATOM 902 CG GLN A 54 12.003 -11.733 -18.694 1.00 0.00 C ATOM 903 CD GLN A 54 11.387 -13.061 -19.099 1.00 0.00 C ATOM 904 OE1 GLN A 54 12.033 -14.109 -19.027 1.00 0.00 O ATOM 905 NE2 GLN A 54 10.175 -13.030 -19.583 1.00 0.00 N ATOM 0 H GLN A 54 11.321 -10.184 -15.036 1.00 0.00 H new ATOM 0 HA GLN A 54 9.836 -10.912 -17.426 1.00 0.00 H new ATOM 0 HB2 GLN A 54 12.388 -10.414 -17.040 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.424 -12.115 -16.620 1.00 0.00 H new ATOM 0 HG2 GLN A 54 11.537 -10.943 -19.282 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.060 -11.747 -18.960 1.00 0.00 H new ATOM 0 HE21 GLN A 54 9.667 -12.147 -19.629 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.736 -13.889 -19.915 1.00 0.00 H new ATOM 914 N VAL A 55 9.826 -12.688 -14.785 1.00 0.00 N ATOM 915 CA VAL A 55 9.346 -13.862 -14.148 1.00 0.00 C ATOM 916 C VAL A 55 7.784 -13.891 -14.160 1.00 0.00 C ATOM 917 O VAL A 55 7.160 -14.901 -13.823 1.00 0.00 O ATOM 918 CB VAL A 55 9.909 -13.797 -12.699 1.00 0.00 C ATOM 919 CG1 VAL A 55 9.205 -14.742 -11.760 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.399 -14.104 -12.708 1.00 0.00 C ATOM 0 H VAL A 55 10.083 -11.939 -14.143 1.00 0.00 H new ATOM 0 HA VAL A 55 9.667 -14.772 -14.656 1.00 0.00 H new ATOM 0 HB VAL A 55 9.734 -12.785 -12.334 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.638 -14.655 -10.764 1.00 0.00 H new ATOM 0 HG12 VAL A 55 8.145 -14.491 -11.718 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.322 -15.765 -12.118 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.786 -14.057 -11.690 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.562 -15.103 -13.112 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.917 -13.373 -13.328 1.00 0.00 H new ATOM 930 N LEU A 56 7.187 -12.795 -14.657 1.00 0.00 N ATOM 931 CA LEU A 56 5.791 -12.562 -14.892 1.00 0.00 C ATOM 932 C LEU A 56 4.867 -12.875 -13.676 1.00 0.00 C ATOM 933 O LEU A 56 3.633 -12.766 -13.733 1.00 0.00 O ATOM 934 CB LEU A 56 5.505 -13.491 -15.981 1.00 0.00 C ATOM 935 CG LEU A 56 4.096 -13.638 -16.334 1.00 0.00 C ATOM 936 CD1 LEU A 56 3.531 -12.365 -16.978 1.00 0.00 C ATOM 937 CD2 LEU A 56 3.797 -14.887 -17.118 1.00 0.00 C ATOM 0 H LEU A 56 7.743 -11.983 -14.924 1.00 0.00 H new ATOM 0 HA LEU A 56 5.597 -11.510 -15.100 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.050 -13.163 -16.866 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.897 -14.471 -15.710 1.00 0.00 H new ATOM 0 HG LEU A 56 3.561 -13.773 -15.394 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.480 -12.518 -17.225 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.622 -11.533 -16.280 1.00 0.00 H new ATOM 0 HD13 LEU A 56 4.088 -12.139 -17.887 1.00 0.00 H new ATOM 0 HD21 LEU A 56 2.732 -14.928 -17.344 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.365 -14.878 -18.048 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.077 -15.761 -16.530 1.00 0.00 H new ATOM 949 N LYS A 57 5.442 -13.079 -12.594 1.00 0.00 N ATOM 950 CA LYS A 57 4.673 -13.477 -11.467 1.00 0.00 C ATOM 951 C LYS A 57 4.793 -12.600 -10.199 1.00 0.00 C ATOM 952 O LYS A 57 5.841 -12.554 -9.545 1.00 0.00 O ATOM 953 CB LYS A 57 5.045 -14.913 -11.240 1.00 0.00 C ATOM 954 CG LYS A 57 4.310 -15.670 -10.135 1.00 0.00 C ATOM 955 CD LYS A 57 2.831 -15.850 -10.418 1.00 0.00 C ATOM 956 CE LYS A 57 2.203 -16.778 -9.388 1.00 0.00 C ATOM 957 NZ LYS A 57 0.759 -16.976 -9.608 1.00 0.00 N ATOM 0 H LYS A 57 6.445 -12.985 -12.433 1.00 0.00 H new ATOM 0 HA LYS A 57 3.613 -13.343 -11.685 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.891 -15.451 -12.175 1.00 0.00 H new ATOM 0 HB3 LYS A 57 6.112 -14.953 -11.021 1.00 0.00 H new ATOM 0 HG2 LYS A 57 4.771 -16.649 -10.006 1.00 0.00 H new ATOM 0 HG3 LYS A 57 4.431 -15.134 -9.194 1.00 0.00 H new ATOM 0 HD2 LYS A 57 2.330 -14.882 -10.398 1.00 0.00 H new ATOM 0 HD3 LYS A 57 2.693 -16.260 -11.418 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.707 -17.744 -9.420 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.362 -16.368 -8.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 0.381 -17.615 -8.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 0.270 -16.060 -9.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.605 -17.393 -10.548 1.00 0.00 H new ATOM 971 N VAL A 58 3.758 -11.777 -9.993 1.00 0.00 N ATOM 972 CA VAL A 58 3.362 -11.238 -8.692 1.00 0.00 C ATOM 973 C VAL A 58 3.619 -12.220 -7.545 1.00 0.00 C ATOM 974 O VAL A 58 3.292 -13.413 -7.611 1.00 0.00 O ATOM 975 CB VAL A 58 1.850 -10.810 -8.725 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.939 -11.960 -9.151 1.00 0.00 C ATOM 977 CG2 VAL A 58 1.405 -10.240 -7.385 1.00 0.00 C ATOM 0 H VAL A 58 3.156 -11.460 -10.753 1.00 0.00 H new ATOM 0 HA VAL A 58 3.983 -10.363 -8.500 1.00 0.00 H new ATOM 0 HB VAL A 58 1.761 -10.025 -9.476 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.096 -11.620 -9.160 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.219 -12.296 -10.149 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.043 -12.786 -8.448 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.355 -9.954 -7.442 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.534 -10.994 -6.608 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.007 -9.364 -7.144 1.00 0.00 H new ATOM 987 N CYS A 59 4.266 -11.720 -6.542 1.00 0.00 N ATOM 988 CA CYS A 59 4.556 -12.478 -5.377 1.00 0.00 C ATOM 989 C CYS A 59 3.659 -12.029 -4.226 1.00 0.00 C ATOM 990 O CYS A 59 3.312 -12.830 -3.364 1.00 0.00 O ATOM 991 CB CYS A 59 6.029 -12.312 -5.006 1.00 0.00 C ATOM 992 SG CYS A 59 7.175 -12.691 -6.362 1.00 0.00 S ATOM 0 H CYS A 59 4.611 -10.760 -6.513 1.00 0.00 H new ATOM 0 HA CYS A 59 4.362 -13.532 -5.575 1.00 0.00 H new ATOM 0 HB2 CYS A 59 6.197 -11.287 -4.677 1.00 0.00 H new ATOM 0 HB3 CYS A 59 6.256 -12.960 -4.159 1.00 0.00 H new ATOM 0 HG CYS A 59 6.547 -12.606 -7.497 1.00 0.00 H new ATOM 998 N ALA A 60 3.278 -10.741 -4.204 1.00 0.00 N ATOM 999 CA ALA A 60 2.507 -10.231 -3.165 1.00 0.00 C ATOM 1000 C ALA A 60 1.591 -9.206 -3.697 1.00 0.00 C ATOM 1001 O ALA A 60 2.005 -8.370 -4.477 1.00 0.00 O ATOM 1002 CB ALA A 60 3.352 -9.609 -2.115 1.00 0.00 C ATOM 0 H ALA A 60 3.518 -10.062 -4.926 1.00 0.00 H new ATOM 0 HA ALA A 60 1.952 -11.058 -2.722 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.716 -9.221 -1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.032 -10.356 -1.705 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.929 -8.792 -2.549 1.00 0.00 H new ATOM 1008 N ASN A 61 0.410 -9.295 -3.297 1.00 0.00 N ATOM 1009 CA ASN A 61 -0.625 -8.321 -3.540 1.00 0.00 C ATOM 1010 C ASN A 61 -1.183 -7.887 -2.220 1.00 0.00 C ATOM 1011 O ASN A 61 -2.042 -8.539 -1.645 1.00 0.00 O ATOM 1012 CB ASN A 61 -1.734 -8.930 -4.280 1.00 0.00 C ATOM 1013 CG ASN A 61 -2.856 -7.966 -4.701 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -2.886 -7.490 -5.833 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -3.766 -7.643 -3.781 1.00 0.00 N ATOM 0 H ASN A 61 0.081 -10.091 -2.751 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.199 -7.492 -4.104 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.333 -9.406 -5.175 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.168 -9.719 -3.666 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -4.511 -6.985 -4.010 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -3.717 -8.054 -2.849 1.00 0.00 H new ATOM 1022 N HIS A 62 -0.680 -6.859 -1.745 1.00 0.00 N ATOM 1023 CA HIS A 62 -1.146 -6.277 -0.473 1.00 0.00 C ATOM 1024 C HIS A 62 -1.887 -4.972 -0.676 1.00 0.00 C ATOM 1025 O HIS A 62 -1.457 -4.141 -1.433 1.00 0.00 O ATOM 1026 CB HIS A 62 0.018 -6.019 0.484 1.00 0.00 C ATOM 1027 CG HIS A 62 0.737 -7.239 0.899 1.00 0.00 C ATOM 1028 ND1 HIS A 62 0.493 -7.903 2.064 1.00 0.00 N ATOM 1029 CD2 HIS A 62 1.694 -7.917 0.287 1.00 0.00 C ATOM 1030 CE1 HIS A 62 1.263 -8.937 2.155 1.00 0.00 C ATOM 1031 NE2 HIS A 62 2.012 -8.984 1.076 1.00 0.00 N ATOM 0 H HIS A 62 0.081 -6.344 -2.187 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.826 -7.013 -0.044 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.723 -5.339 0.006 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.361 -5.513 1.372 1.00 0.00 H new ATOM 0 HD2 HIS A 62 2.142 -7.671 -0.664 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.287 -9.640 2.975 1.00 0.00 H new ATOM 0 HE2 HIS A 62 2.711 -9.696 0.865 1.00 0.00 H new ATOM 1039 N TRP A 63 -3.000 -4.827 -0.018 1.00 0.00 N ATOM 1040 CA TRP A 63 -3.721 -3.562 0.041 1.00 0.00 C ATOM 1041 C TRP A 63 -3.164 -2.711 1.154 1.00 0.00 C ATOM 1042 O TRP A 63 -2.772 -3.226 2.184 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.211 -3.783 0.316 1.00 0.00 C ATOM 1044 CG TRP A 63 -5.937 -4.474 -0.791 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.460 -3.897 -1.904 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -6.233 -5.871 -0.889 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -7.051 -4.845 -2.694 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.934 -6.062 -2.094 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -5.975 -6.977 -0.077 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.377 -7.311 -2.510 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -6.417 -8.215 -0.489 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -7.111 -8.372 -1.697 1.00 0.00 C ATOM 0 H TRP A 63 -3.447 -5.582 0.502 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.601 -3.069 -0.924 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.318 -4.369 1.229 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -5.683 -2.818 0.500 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -6.416 -2.842 -2.132 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.507 -4.668 -3.589 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -5.440 -6.864 0.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.911 -7.436 -3.440 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -6.226 -9.080 0.129 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -7.443 -9.357 -1.990 1.00 0.00 H new ATOM 1063 N ILE A 64 -3.139 -1.422 0.938 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.654 -0.482 1.899 1.00 0.00 C ATOM 1065 C ILE A 64 -3.843 0.173 2.577 1.00 0.00 C ATOM 1066 O ILE A 64 -4.739 0.704 1.912 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.606 0.533 1.254 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.435 1.869 2.034 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -1.890 0.793 -0.215 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.530 2.882 1.777 1.00 0.00 C ATOM 0 H ILE A 64 -3.463 -0.994 0.071 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.080 -0.988 2.675 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.648 0.020 1.335 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.400 1.652 3.102 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.476 2.312 1.767 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.151 1.490 -0.611 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.837 -0.145 -0.767 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.886 1.221 -0.323 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -2.335 3.783 2.358 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.553 3.132 0.716 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.491 2.461 2.071 1.00 0.00 H new ATOM 1082 N THR A 65 -3.899 0.040 3.868 1.00 0.00 N ATOM 1083 CA THR A 65 -4.996 0.544 4.635 1.00 0.00 C ATOM 1084 C THR A 65 -4.553 1.071 5.979 1.00 0.00 C ATOM 1085 O THR A 65 -3.475 0.759 6.462 1.00 0.00 O ATOM 1086 CB THR A 65 -6.123 -0.529 4.761 1.00 0.00 C ATOM 1087 OG1 THR A 65 -7.182 -0.102 5.636 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.575 -1.880 5.218 1.00 0.00 C ATOM 0 H THR A 65 -3.179 -0.425 4.422 1.00 0.00 H new ATOM 0 HA THR A 65 -5.414 1.396 4.099 1.00 0.00 H new ATOM 0 HB THR A 65 -6.540 -0.650 3.761 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.867 -0.801 5.686 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.392 -2.598 5.293 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.842 -2.239 4.495 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.099 -1.769 6.192 1.00 0.00 H new ATOM 1096 N THR A 66 -5.403 1.862 6.569 1.00 0.00 N ATOM 1097 CA THR A 66 -5.232 2.407 7.893 1.00 0.00 C ATOM 1098 C THR A 66 -5.521 1.334 8.956 1.00 0.00 C ATOM 1099 O THR A 66 -5.349 1.540 10.144 1.00 0.00 O ATOM 1100 CB THR A 66 -6.161 3.565 8.069 1.00 0.00 C ATOM 1101 OG1 THR A 66 -6.890 3.762 6.834 1.00 0.00 O ATOM 1102 CG2 THR A 66 -5.401 4.812 8.457 1.00 0.00 C ATOM 0 H THR A 66 -6.272 2.159 6.125 1.00 0.00 H new ATOM 0 HA THR A 66 -4.202 2.741 8.014 1.00 0.00 H new ATOM 0 HB THR A 66 -6.863 3.354 8.876 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.589 4.590 6.405 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.099 5.640 8.579 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.874 4.640 9.396 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.681 5.057 7.676 1.00 0.00 H new ATOM 1110 N THR A 67 -5.942 0.182 8.477 1.00 0.00 N ATOM 1111 CA THR A 67 -6.212 -1.003 9.273 1.00 0.00 C ATOM 1112 C THR A 67 -4.868 -1.734 9.523 1.00 0.00 C ATOM 1113 O THR A 67 -4.771 -2.786 10.161 1.00 0.00 O ATOM 1114 CB THR A 67 -7.206 -1.881 8.458 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.445 -1.170 8.315 1.00 0.00 O ATOM 1116 CG2 THR A 67 -7.453 -3.244 9.080 1.00 0.00 C ATOM 0 H THR A 67 -6.113 0.037 7.482 1.00 0.00 H new ATOM 0 HA THR A 67 -6.653 -0.769 10.242 1.00 0.00 H new ATOM 0 HB THR A 67 -6.754 -2.070 7.484 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.077 -1.715 7.801 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.155 -3.804 8.462 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.512 -3.790 9.146 1.00 0.00 H new ATOM 0 HG23 THR A 67 -7.870 -3.118 10.079 1.00 0.00 H new ATOM 1124 N MET A 68 -3.848 -1.101 9.080 1.00 0.00 N ATOM 1125 CA MET A 68 -2.571 -1.571 9.091 1.00 0.00 C ATOM 1126 C MET A 68 -1.719 -0.478 9.663 1.00 0.00 C ATOM 1127 O MET A 68 -2.136 0.682 9.770 1.00 0.00 O ATOM 1128 CB MET A 68 -2.192 -1.784 7.669 1.00 0.00 C ATOM 1129 CG MET A 68 -0.772 -2.227 7.423 1.00 0.00 C ATOM 1130 SD MET A 68 -0.242 -1.799 5.774 1.00 0.00 S ATOM 1131 CE MET A 68 -1.420 -2.703 4.816 1.00 0.00 C ATOM 0 H MET A 68 -3.922 -0.168 8.674 1.00 0.00 H new ATOM 0 HA MET A 68 -2.457 -2.490 9.666 1.00 0.00 H new ATOM 0 HB2 MET A 68 -2.863 -2.529 7.242 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.361 -0.854 7.125 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.111 -1.761 8.153 1.00 0.00 H new ATOM 0 HG3 MET A 68 -0.694 -3.305 7.565 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.965 -3.010 3.874 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.739 -3.586 5.370 1.00 0.00 H new ATOM 0 HE3 MET A 68 -2.285 -2.071 4.612 1.00 0.00 H new ATOM 1141 N ASN A 69 -0.597 -0.857 10.022 1.00 0.00 N ATOM 1142 CA ASN A 69 0.425 -0.024 10.560 1.00 0.00 C ATOM 1143 C ASN A 69 1.750 -0.472 9.993 1.00 0.00 C ATOM 1144 O ASN A 69 2.011 -1.672 9.898 1.00 0.00 O ATOM 1145 CB ASN A 69 0.436 -0.207 12.056 1.00 0.00 C ATOM 1146 CG ASN A 69 1.529 0.574 12.776 1.00 0.00 C ATOM 1147 OD1 ASN A 69 1.344 1.739 13.114 1.00 0.00 O ATOM 1148 ND2 ASN A 69 2.633 -0.063 13.072 1.00 0.00 N ATOM 0 H ASN A 69 -0.311 -1.834 9.956 1.00 0.00 H new ATOM 0 HA ASN A 69 0.250 1.023 10.311 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.533 0.095 12.454 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.556 -1.267 12.280 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.369 0.409 13.598 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.758 -1.031 12.777 1.00 0.00 H new ATOM 1155 N LEU A 70 2.532 0.466 9.569 1.00 0.00 N ATOM 1156 CA LEU A 70 3.801 0.256 9.146 1.00 0.00 C ATOM 1157 C LEU A 70 4.780 0.416 10.283 1.00 0.00 C ATOM 1158 O LEU A 70 4.680 1.298 11.137 1.00 0.00 O ATOM 1159 CB LEU A 70 4.087 1.026 7.877 1.00 0.00 C ATOM 1160 CG LEU A 70 3.757 2.498 7.781 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.484 3.255 8.832 1.00 0.00 C ATOM 1162 CD2 LEU A 70 4.219 2.915 6.439 1.00 0.00 C ATOM 0 H LEU A 70 2.247 1.444 9.522 1.00 0.00 H new ATOM 0 HA LEU A 70 3.935 -0.782 8.841 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.152 0.921 7.670 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.555 0.524 7.069 1.00 0.00 H new ATOM 0 HG LEU A 70 2.693 2.688 7.923 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.239 4.314 8.753 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.190 2.887 9.815 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.558 3.121 8.700 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.012 3.976 6.296 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.291 2.739 6.353 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.694 2.338 5.678 1.00 0.00 H new ATOM 1174 N LYS A 71 5.615 -0.481 10.309 1.00 0.00 N ATOM 1175 CA LYS A 71 6.567 -0.727 11.364 1.00 0.00 C ATOM 1176 C LYS A 71 7.950 -0.814 10.733 1.00 0.00 C ATOM 1177 O LYS A 71 8.100 -1.471 9.733 1.00 0.00 O ATOM 1178 CB LYS A 71 6.188 -2.095 11.962 1.00 0.00 C ATOM 1179 CG LYS A 71 6.951 -2.544 13.187 1.00 0.00 C ATOM 1180 CD LYS A 71 6.596 -1.712 14.395 1.00 0.00 C ATOM 1181 CE LYS A 71 7.174 -2.318 15.654 1.00 0.00 C ATOM 1182 NZ LYS A 71 6.638 -3.680 15.905 1.00 0.00 N ATOM 0 H LYS A 71 5.701 -1.153 9.547 1.00 0.00 H new ATOM 0 HA LYS A 71 6.565 0.052 12.126 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.127 -2.073 12.213 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.317 -2.851 11.187 1.00 0.00 H new ATOM 0 HG2 LYS A 71 6.732 -3.593 13.389 1.00 0.00 H new ATOM 0 HG3 LYS A 71 8.022 -2.473 12.997 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.974 -0.698 14.267 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.512 -1.639 14.486 1.00 0.00 H new ATOM 0 HE2 LYS A 71 8.260 -2.364 15.570 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.947 -1.675 16.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.711 -3.901 16.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.641 -3.720 15.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.186 -4.375 15.359 1.00 0.00 H new ATOM 1196 N PRO A 72 8.967 -0.157 11.271 1.00 0.00 N ATOM 1197 CA PRO A 72 10.291 -0.206 10.678 1.00 0.00 C ATOM 1198 C PRO A 72 11.011 -1.494 11.042 1.00 0.00 C ATOM 1199 O PRO A 72 10.702 -2.125 12.073 1.00 0.00 O ATOM 1200 CB PRO A 72 11.002 0.996 11.301 1.00 0.00 C ATOM 1201 CG PRO A 72 10.349 1.178 12.629 1.00 0.00 C ATOM 1202 CD PRO A 72 8.936 0.660 12.496 1.00 0.00 C ATOM 0 HA PRO A 72 10.264 -0.177 9.589 1.00 0.00 H new ATOM 0 HB2 PRO A 72 12.071 0.812 11.408 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.892 1.886 10.681 1.00 0.00 H new ATOM 0 HG2 PRO A 72 10.889 0.633 13.403 1.00 0.00 H new ATOM 0 HG3 PRO A 72 10.350 2.229 12.919 1.00 0.00 H new ATOM 0 HD2 PRO A 72 8.645 0.067 13.363 1.00 0.00 H new ATOM 0 HD3 PRO A 72 8.218 1.476 12.413 1.00 0.00 H new ATOM 1210 N LEU A 73 11.934 -1.921 10.198 1.00 0.00 N ATOM 1211 CA LEU A 73 12.733 -3.029 10.485 1.00 0.00 C ATOM 1212 C LEU A 73 13.707 -2.590 11.528 1.00 0.00 C ATOM 1213 O LEU A 73 13.930 -1.366 11.691 1.00 0.00 O ATOM 1214 CB LEU A 73 13.568 -3.385 9.276 1.00 0.00 C ATOM 1215 CG LEU A 73 12.964 -3.245 7.895 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.956 -3.708 6.840 1.00 0.00 C ATOM 1217 CD2 LEU A 73 11.685 -4.011 7.780 1.00 0.00 C ATOM 0 H LEU A 73 12.127 -1.484 9.297 1.00 0.00 H new ATOM 0 HA LEU A 73 12.109 -3.870 10.788 1.00 0.00 H new ATOM 0 HB2 LEU A 73 14.467 -2.769 9.305 1.00 0.00 H new ATOM 0 HB3 LEU A 73 13.887 -4.421 9.391 1.00 0.00 H new ATOM 0 HG LEU A 73 12.737 -2.192 7.731 1.00 0.00 H new ATOM 0 HD11 LEU A 73 13.511 -3.603 5.851 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.859 -3.100 6.898 1.00 0.00 H new ATOM 0 HD13 LEU A 73 14.211 -4.753 7.014 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.277 -3.890 6.776 1.00 0.00 H new ATOM 0 HD22 LEU A 73 11.875 -5.067 7.969 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.969 -3.635 8.511 1.00 0.00 H new ATOM 1229 N SER A 74 14.296 -3.522 12.215 1.00 0.00 N ATOM 1230 CA SER A 74 15.358 -3.190 13.099 1.00 0.00 C ATOM 1231 C SER A 74 16.453 -2.563 12.331 1.00 0.00 C ATOM 1232 O SER A 74 16.937 -3.141 11.352 1.00 0.00 O ATOM 1233 CB SER A 74 15.926 -4.400 13.745 1.00 0.00 C ATOM 1234 OG SER A 74 15.053 -4.930 14.733 1.00 0.00 O ATOM 0 H SER A 74 14.056 -4.513 12.177 1.00 0.00 H new ATOM 0 HA SER A 74 14.954 -2.520 13.858 1.00 0.00 H new ATOM 0 HB2 SER A 74 16.121 -5.159 12.987 1.00 0.00 H new ATOM 0 HB3 SER A 74 16.884 -4.152 14.202 1.00 0.00 H new ATOM 0 HG SER A 74 15.459 -5.726 15.135 1.00 0.00 H new ATOM 1240 N GLY A 75 16.783 -1.376 12.688 1.00 0.00 N ATOM 1241 CA GLY A 75 17.886 -0.790 12.080 1.00 0.00 C ATOM 1242 C GLY A 75 17.585 -0.146 10.716 1.00 0.00 C ATOM 1243 O GLY A 75 18.506 0.318 10.033 1.00 0.00 O ATOM 0 H GLY A 75 16.304 -0.810 13.389 1.00 0.00 H new ATOM 0 HA2 GLY A 75 18.293 -0.030 12.746 1.00 0.00 H new ATOM 0 HA3 GLY A 75 18.660 -1.547 11.949 1.00 0.00 H new ATOM 1247 N SER A 76 16.314 -0.110 10.296 1.00 0.00 N ATOM 1248 CA SER A 76 15.990 0.544 9.062 1.00 0.00 C ATOM 1249 C SER A 76 15.210 1.822 9.353 1.00 0.00 C ATOM 1250 O SER A 76 14.397 1.881 10.288 1.00 0.00 O ATOM 1251 CB SER A 76 15.166 -0.349 8.120 1.00 0.00 C ATOM 1252 OG SER A 76 15.251 0.140 6.778 1.00 0.00 O ATOM 0 H SER A 76 15.523 -0.521 10.792 1.00 0.00 H new ATOM 0 HA SER A 76 16.930 0.772 8.560 1.00 0.00 H new ATOM 0 HB2 SER A 76 15.533 -1.374 8.165 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.125 -0.368 8.443 1.00 0.00 H new ATOM 0 HG SER A 76 15.641 -0.551 6.202 1.00 0.00 H new ATOM 1258 N ASP A 77 15.482 2.827 8.570 1.00 0.00 N ATOM 1259 CA ASP A 77 14.833 4.098 8.621 1.00 0.00 C ATOM 1260 C ASP A 77 13.898 4.131 7.499 1.00 0.00 C ATOM 1261 O ASP A 77 12.890 4.850 7.480 1.00 0.00 O ATOM 1262 CB ASP A 77 15.809 5.212 8.231 1.00 0.00 C ATOM 1263 CG ASP A 77 17.090 5.269 9.024 1.00 0.00 C ATOM 1264 OD1 ASP A 77 18.010 4.450 8.773 1.00 0.00 O ATOM 1265 OD2 ASP A 77 17.245 6.197 9.841 1.00 0.00 O ATOM 0 H ASP A 77 16.198 2.775 7.845 1.00 0.00 H new ATOM 0 HA ASP A 77 14.408 4.230 9.616 1.00 0.00 H new ATOM 0 HB2 ASP A 77 16.061 5.096 7.177 1.00 0.00 H new ATOM 0 HB3 ASP A 77 15.298 6.169 8.333 1.00 0.00 H new ATOM 1270 N ARG A 78 14.262 3.346 6.546 1.00 0.00 N ATOM 1271 CA ARG A 78 13.828 3.528 5.282 1.00 0.00 C ATOM 1272 C ARG A 78 12.901 2.414 4.774 1.00 0.00 C ATOM 1273 O ARG A 78 11.959 2.677 4.064 1.00 0.00 O ATOM 1274 CB ARG A 78 15.098 3.717 4.488 1.00 0.00 C ATOM 1275 CG ARG A 78 15.787 2.463 3.944 1.00 0.00 C ATOM 1276 CD ARG A 78 17.143 2.824 3.372 1.00 0.00 C ATOM 1277 NE ARG A 78 17.844 1.684 2.789 1.00 0.00 N ATOM 1278 CZ ARG A 78 19.154 1.434 2.926 1.00 0.00 C ATOM 1279 NH1 ARG A 78 19.898 2.164 3.750 1.00 0.00 N ATOM 1280 NH2 ARG A 78 19.709 0.438 2.250 1.00 0.00 N ATOM 0 H ARG A 78 14.888 2.550 6.669 1.00 0.00 H new ATOM 0 HA ARG A 78 13.170 4.392 5.187 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.873 4.369 3.644 1.00 0.00 H new ATOM 0 HB3 ARG A 78 15.813 4.246 5.118 1.00 0.00 H new ATOM 0 HG2 ARG A 78 15.903 1.727 4.740 1.00 0.00 H new ATOM 0 HG3 ARG A 78 15.168 2.004 3.173 1.00 0.00 H new ATOM 0 HD2 ARG A 78 17.015 3.592 2.609 1.00 0.00 H new ATOM 0 HD3 ARG A 78 17.759 3.257 4.160 1.00 0.00 H new ATOM 0 HE ARG A 78 17.295 1.027 2.235 1.00 0.00 H new ATOM 0 HH11 ARG A 78 19.473 2.922 4.285 1.00 0.00 H new ATOM 0 HH12 ARG A 78 20.894 1.967 3.848 1.00 0.00 H new ATOM 0 HH21 ARG A 78 19.140 -0.136 1.628 1.00 0.00 H new ATOM 0 HH22 ARG A 78 20.705 0.245 2.352 1.00 0.00 H new ATOM 1294 N ALA A 79 13.132 1.215 5.195 1.00 0.00 N ATOM 1295 CA ALA A 79 12.330 0.100 4.777 1.00 0.00 C ATOM 1296 C ALA A 79 11.466 -0.294 5.964 1.00 0.00 C ATOM 1297 O ALA A 79 11.958 -0.382 7.106 1.00 0.00 O ATOM 1298 CB ALA A 79 13.245 -1.057 4.419 1.00 0.00 C ATOM 0 H ALA A 79 13.884 0.974 5.841 1.00 0.00 H new ATOM 0 HA ALA A 79 11.717 0.353 3.912 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.646 -1.910 4.100 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.910 -0.758 3.609 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.837 -1.336 5.291 1.00 0.00 H new ATOM 1304 N TRP A 80 10.205 -0.517 5.719 1.00 0.00 N ATOM 1305 CA TRP A 80 9.242 -0.746 6.758 1.00 0.00 C ATOM 1306 C TRP A 80 8.412 -1.919 6.367 1.00 0.00 C ATOM 1307 O TRP A 80 8.418 -2.338 5.196 1.00 0.00 O ATOM 1308 CB TRP A 80 8.331 0.500 7.061 1.00 0.00 C ATOM 1309 CG TRP A 80 9.060 1.742 7.583 1.00 0.00 C ATOM 1310 CD1 TRP A 80 10.143 2.363 7.034 1.00 0.00 C ATOM 1311 CD2 TRP A 80 8.710 2.533 8.734 1.00 0.00 C ATOM 1312 NE1 TRP A 80 10.513 3.442 7.789 1.00 0.00 N ATOM 1313 CE2 TRP A 80 9.652 3.575 8.828 1.00 0.00 C ATOM 1314 CE3 TRP A 80 7.710 2.455 9.694 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 9.617 4.526 9.840 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 7.673 3.403 10.698 1.00 0.00 C ATOM 1317 CH2 TRP A 80 8.621 4.421 10.763 1.00 0.00 C ATOM 0 H TRP A 80 9.812 -0.545 4.778 1.00 0.00 H new ATOM 0 HA TRP A 80 9.785 -0.937 7.684 1.00 0.00 H new ATOM 0 HB2 TRP A 80 7.800 0.770 6.148 1.00 0.00 H new ATOM 0 HB3 TRP A 80 7.579 0.208 7.793 1.00 0.00 H new ATOM 0 HD1 TRP A 80 10.640 2.047 6.129 1.00 0.00 H new ATOM 0 HE1 TRP A 80 11.310 4.050 7.600 1.00 0.00 H new ATOM 0 HE3 TRP A 80 6.973 1.666 9.656 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 10.350 5.317 9.893 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 6.895 3.354 11.446 1.00 0.00 H new ATOM 0 HH2 TRP A 80 8.565 5.144 11.564 1.00 0.00 H new ATOM 1328 N MET A 81 7.749 -2.458 7.312 1.00 0.00 N ATOM 1329 CA MET A 81 6.963 -3.574 7.161 1.00 0.00 C ATOM 1330 C MET A 81 5.658 -3.224 7.646 1.00 0.00 C ATOM 1331 O MET A 81 5.512 -2.443 8.564 1.00 0.00 O ATOM 1332 CB MET A 81 7.501 -4.800 7.880 1.00 0.00 C ATOM 1333 CG MET A 81 7.893 -4.609 9.328 1.00 0.00 C ATOM 1334 SD MET A 81 8.621 -6.092 10.049 1.00 0.00 S ATOM 1335 CE MET A 81 9.043 -5.481 11.674 1.00 0.00 C ATOM 0 H MET A 81 7.753 -2.095 8.265 1.00 0.00 H new ATOM 0 HA MET A 81 6.943 -3.859 6.109 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.746 -5.584 7.831 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.373 -5.162 7.334 1.00 0.00 H new ATOM 0 HG2 MET A 81 8.604 -3.786 9.403 1.00 0.00 H new ATOM 0 HG3 MET A 81 7.013 -4.323 9.904 1.00 0.00 H new ATOM 0 HE1 MET A 81 9.507 -6.279 12.254 1.00 0.00 H new ATOM 0 HE2 MET A 81 9.740 -4.649 11.580 1.00 0.00 H new ATOM 0 HE3 MET A 81 8.140 -5.142 12.181 1.00 0.00 H new ATOM 1345 N TRP A 82 4.753 -3.722 7.031 1.00 0.00 N ATOM 1346 CA TRP A 82 3.430 -3.416 7.278 1.00 0.00 C ATOM 1347 C TRP A 82 2.682 -4.675 7.305 1.00 0.00 C ATOM 1348 O TRP A 82 3.103 -5.656 6.660 1.00 0.00 O ATOM 1349 CB TRP A 82 2.896 -2.408 6.256 1.00 0.00 C ATOM 1350 CG TRP A 82 3.386 -2.619 4.854 1.00 0.00 C ATOM 1351 CD1 TRP A 82 2.939 -3.530 3.941 1.00 0.00 C ATOM 1352 CD2 TRP A 82 4.424 -1.876 4.208 1.00 0.00 C ATOM 1353 NE1 TRP A 82 3.654 -3.405 2.775 1.00 0.00 N ATOM 1354 CE2 TRP A 82 4.568 -2.395 2.917 1.00 0.00 C ATOM 1355 CE3 TRP A 82 5.249 -0.819 4.608 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 5.502 -1.897 2.017 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 6.175 -0.324 3.715 1.00 0.00 C ATOM 1358 CH2 TRP A 82 6.297 -0.864 2.432 1.00 0.00 C ATOM 0 H TRP A 82 4.888 -4.404 6.285 1.00 0.00 H new ATOM 0 HA TRP A 82 3.314 -2.923 8.243 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.807 -2.453 6.257 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.174 -1.404 6.577 1.00 0.00 H new ATOM 0 HD1 TRP A 82 2.144 -4.241 4.110 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.525 -3.973 1.938 1.00 0.00 H new ATOM 0 HE3 TRP A 82 5.162 -0.398 5.599 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 5.597 -2.311 1.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 6.816 0.493 4.011 1.00 0.00 H new ATOM 0 HH2 TRP A 82 7.034 -0.458 1.755 1.00 0.00 H new ATOM 1369 N LEU A 83 1.633 -4.738 8.032 1.00 0.00 N ATOM 1370 CA LEU A 83 0.976 -5.971 8.043 1.00 0.00 C ATOM 1371 C LEU A 83 -0.223 -5.926 7.150 1.00 0.00 C ATOM 1372 O LEU A 83 -1.127 -5.128 7.333 1.00 0.00 O ATOM 1373 CB LEU A 83 0.588 -6.428 9.442 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.350 -5.501 10.266 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -1.046 -6.301 11.346 1.00 0.00 C ATOM 1376 CD2 LEU A 83 0.438 -4.384 10.939 1.00 0.00 C ATOM 0 H LEU A 83 1.232 -3.990 8.598 1.00 0.00 H new ATOM 0 HA LEU A 83 1.683 -6.709 7.664 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.107 -7.402 9.356 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.504 -6.574 10.014 1.00 0.00 H new ATOM 0 HG LEU A 83 -1.077 -5.070 9.578 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.701 -5.645 11.919 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.637 -7.094 10.888 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.302 -6.741 12.010 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.242 -3.751 11.508 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.180 -4.816 11.611 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.941 -3.785 10.180 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.256 -6.824 6.247 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.298 -6.845 5.274 1.00 0.00 C ATOM 1390 C ALA A 84 -1.658 -8.210 4.873 1.00 0.00 C ATOM 1391 O ALA A 84 -0.893 -9.171 5.082 1.00 0.00 O ATOM 1392 CB ALA A 84 -0.917 -6.095 4.042 1.00 0.00 C ATOM 0 H ALA A 84 0.433 -7.570 6.152 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.153 -6.369 5.755 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.737 -6.134 3.324 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.708 -5.056 4.298 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.028 -6.546 3.602 1.00 0.00 H new ATOM 1398 N SER A 85 -2.793 -8.308 4.318 1.00 0.00 N ATOM 1399 CA SER A 85 -3.195 -9.410 3.643 1.00 0.00 C ATOM 1400 C SER A 85 -2.817 -9.341 2.213 1.00 0.00 C ATOM 1401 O SER A 85 -3.141 -8.398 1.475 1.00 0.00 O ATOM 1402 CB SER A 85 -4.643 -9.589 3.853 1.00 0.00 C ATOM 1403 OG SER A 85 -5.220 -8.381 4.376 1.00 0.00 O ATOM 0 H SER A 85 -3.490 -7.563 4.338 1.00 0.00 H new ATOM 0 HA SER A 85 -2.683 -10.291 4.030 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.125 -9.853 2.912 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.819 -10.414 4.544 1.00 0.00 H new ATOM 0 HG SER A 85 -6.182 -8.510 4.510 1.00 0.00 H new ATOM 1409 N ASP A 86 -2.074 -10.313 1.880 1.00 0.00 N ATOM 1410 CA ASP A 86 -1.708 -10.592 0.566 1.00 0.00 C ATOM 1411 C ASP A 86 -2.764 -11.474 -0.063 1.00 0.00 C ATOM 1412 O ASP A 86 -3.479 -12.182 0.638 1.00 0.00 O ATOM 1413 CB ASP A 86 -0.291 -11.198 0.454 1.00 0.00 C ATOM 1414 CG ASP A 86 -0.025 -11.991 -0.817 1.00 0.00 C ATOM 1415 OD1 ASP A 86 -0.020 -11.393 -1.887 1.00 0.00 O ATOM 1416 OD2 ASP A 86 0.183 -13.203 -0.748 1.00 0.00 O ATOM 0 H ASP A 86 -1.685 -10.970 2.557 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.655 -9.653 0.014 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.438 -10.391 0.519 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.123 -11.849 1.312 1.00 0.00 H new ATOM 1421 N PHE A 87 -2.876 -11.378 -1.346 1.00 0.00 N ATOM 1422 CA PHE A 87 -3.867 -12.036 -2.133 1.00 0.00 C ATOM 1423 C PHE A 87 -3.371 -11.875 -3.552 1.00 0.00 C ATOM 1424 O PHE A 87 -4.036 -11.318 -4.420 1.00 0.00 O ATOM 1425 CB PHE A 87 -5.148 -11.307 -1.891 1.00 0.00 C ATOM 1426 CG PHE A 87 -6.450 -11.943 -2.335 1.00 0.00 C ATOM 1427 CD1 PHE A 87 -7.122 -12.810 -1.497 1.00 0.00 C ATOM 1428 CD2 PHE A 87 -7.023 -11.627 -3.560 1.00 0.00 C ATOM 1429 CE1 PHE A 87 -8.334 -13.363 -1.868 1.00 0.00 C ATOM 1430 CE2 PHE A 87 -8.238 -12.170 -3.936 1.00 0.00 C ATOM 1431 CZ PHE A 87 -8.894 -13.041 -3.088 1.00 0.00 C ATOM 0 H PHE A 87 -2.243 -10.806 -1.905 1.00 0.00 H new ATOM 0 HA PHE A 87 -4.032 -13.090 -1.909 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -5.222 -11.119 -0.820 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -5.072 -10.336 -2.381 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.695 -13.060 -0.537 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.513 -10.948 -4.228 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -8.842 -14.046 -1.204 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -8.673 -11.914 -4.891 1.00 0.00 H new ATOM 0 HZ PHE A 87 -9.842 -13.469 -3.379 1.00 0.00 H new ATOM 1441 N SER A 88 -2.189 -12.432 -3.751 1.00 0.00 N ATOM 1442 CA SER A 88 -1.342 -12.308 -4.893 1.00 0.00 C ATOM 1443 C SER A 88 -2.079 -12.645 -6.129 1.00 0.00 C ATOM 1444 O SER A 88 -1.902 -11.984 -7.162 1.00 0.00 O ATOM 1445 CB SER A 88 -0.118 -13.225 -4.693 1.00 0.00 C ATOM 1446 OG SER A 88 0.812 -13.129 -5.754 1.00 0.00 O ATOM 0 H SER A 88 -1.772 -13.036 -3.042 1.00 0.00 H new ATOM 0 HA SER A 88 -1.004 -11.277 -4.999 1.00 0.00 H new ATOM 0 HB2 SER A 88 0.376 -12.966 -3.757 1.00 0.00 H new ATOM 0 HB3 SER A 88 -0.454 -14.258 -4.601 1.00 0.00 H new ATOM 0 HG SER A 88 1.605 -13.665 -5.543 1.00 0.00 H new ATOM 1452 N ASP A 89 -2.964 -13.615 -6.044 1.00 0.00 N ATOM 1453 CA ASP A 89 -3.775 -13.877 -7.134 1.00 0.00 C ATOM 1454 C ASP A 89 -4.972 -14.577 -6.604 1.00 0.00 C ATOM 1455 O ASP A 89 -5.652 -15.327 -7.288 1.00 0.00 O ATOM 1456 CB ASP A 89 -3.040 -14.652 -8.242 1.00 0.00 C ATOM 1457 CG ASP A 89 -3.820 -14.781 -9.548 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -3.997 -13.754 -10.263 1.00 0.00 O ATOM 1459 OD2 ASP A 89 -4.218 -15.921 -9.906 1.00 0.00 O ATOM 0 H ASP A 89 -3.113 -14.209 -5.228 1.00 0.00 H new ATOM 0 HA ASP A 89 -4.077 -12.956 -7.632 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -2.092 -14.156 -8.447 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -2.804 -15.651 -7.874 1.00 0.00 H new ATOM 1464 N GLY A 90 -5.277 -14.282 -5.353 1.00 0.00 N ATOM 1465 CA GLY A 90 -6.362 -14.971 -4.777 1.00 0.00 C ATOM 1466 C GLY A 90 -6.021 -15.733 -3.559 1.00 0.00 C ATOM 1467 O GLY A 90 -6.883 -16.137 -2.792 1.00 0.00 O ATOM 0 H GLY A 90 -4.802 -13.601 -4.760 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -7.146 -14.253 -4.535 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -6.775 -15.657 -5.516 1.00 0.00 H new ATOM 1471 N ASP A 91 -4.792 -15.911 -3.377 1.00 0.00 N ATOM 1472 CA ASP A 91 -4.290 -16.628 -2.230 1.00 0.00 C ATOM 1473 C ASP A 91 -4.036 -15.664 -1.127 1.00 0.00 C ATOM 1474 O ASP A 91 -3.148 -14.834 -1.204 1.00 0.00 O ATOM 1475 CB ASP A 91 -3.075 -17.447 -2.583 1.00 0.00 C ATOM 1476 CG ASP A 91 -2.474 -18.190 -1.415 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -3.220 -18.805 -0.627 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -1.232 -18.228 -1.292 1.00 0.00 O ATOM 0 H ASP A 91 -4.068 -15.571 -4.010 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.038 -17.344 -1.888 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.346 -18.166 -3.356 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -2.318 -16.789 -3.010 1.00 0.00 H new ATOM 1483 N ALA A 92 -4.862 -15.772 -0.145 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.922 -14.829 0.959 1.00 0.00 C ATOM 1485 C ALA A 92 -3.949 -15.173 2.059 1.00 0.00 C ATOM 1486 O ALA A 92 -4.117 -16.174 2.751 1.00 0.00 O ATOM 1487 CB ALA A 92 -6.339 -14.764 1.518 1.00 0.00 C ATOM 0 H ALA A 92 -5.539 -16.531 -0.069 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.638 -13.853 0.566 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -6.372 -14.054 2.345 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -7.025 -14.441 0.735 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.635 -15.751 1.875 1.00 0.00 H new ATOM 1493 N LYS A 93 -2.948 -14.357 2.225 1.00 0.00 N ATOM 1494 CA LYS A 93 -1.965 -14.554 3.254 1.00 0.00 C ATOM 1495 C LYS A 93 -1.800 -13.296 4.049 1.00 0.00 C ATOM 1496 O LYS A 93 -1.601 -12.253 3.496 1.00 0.00 O ATOM 1497 CB LYS A 93 -0.634 -14.795 2.634 1.00 0.00 C ATOM 1498 CG LYS A 93 -0.092 -16.203 2.688 1.00 0.00 C ATOM 1499 CD LYS A 93 -0.947 -17.174 1.919 1.00 0.00 C ATOM 1500 CE LYS A 93 -0.306 -18.538 1.893 1.00 0.00 C ATOM 1501 NZ LYS A 93 -1.134 -19.516 1.203 1.00 0.00 N ATOM 0 H LYS A 93 -2.789 -13.531 1.648 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.294 -15.390 3.871 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.689 -14.494 1.588 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.088 -14.136 3.117 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.921 -16.216 2.285 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.026 -16.525 3.727 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.935 -17.239 2.376 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.090 -16.814 0.900 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.665 -18.473 1.401 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.124 -18.873 2.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.860 -20.474 1.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -2.134 -19.353 1.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.001 -19.421 0.176 1.00 0.00 H new ATOM 1515 N LEU A 94 -1.850 -13.374 5.316 1.00 0.00 N ATOM 1516 CA LEU A 94 -1.574 -12.188 6.082 1.00 0.00 C ATOM 1517 C LEU A 94 -0.244 -12.296 6.749 1.00 0.00 C ATOM 1518 O LEU A 94 0.029 -13.237 7.498 1.00 0.00 O ATOM 1519 CB LEU A 94 -2.699 -11.708 7.016 1.00 0.00 C ATOM 1520 CG LEU A 94 -2.991 -12.533 8.291 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -4.022 -11.825 9.149 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -3.487 -13.930 7.947 1.00 0.00 C ATOM 0 H LEU A 94 -2.071 -14.213 5.853 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.530 -11.375 5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.464 -10.690 7.325 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.618 -11.660 6.433 1.00 0.00 H new ATOM 0 HG LEU A 94 -2.057 -12.627 8.845 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -4.219 -12.416 10.043 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.643 -10.845 9.438 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.946 -11.705 8.583 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.683 -14.483 8.866 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.406 -13.857 7.365 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.728 -14.452 7.364 1.00 0.00 H new ATOM 1534 N GLU A 95 0.570 -11.359 6.481 1.00 0.00 N ATOM 1535 CA GLU A 95 1.865 -11.316 6.913 1.00 0.00 C ATOM 1536 C GLU A 95 2.187 -9.962 7.220 1.00 0.00 C ATOM 1537 O GLU A 95 1.511 -9.013 6.803 1.00 0.00 O ATOM 1538 CB GLU A 95 2.811 -11.908 5.875 1.00 0.00 C ATOM 1539 CG GLU A 95 2.939 -13.422 5.931 1.00 0.00 C ATOM 1540 CD GLU A 95 3.748 -14.000 4.797 1.00 0.00 C ATOM 1541 OE1 GLU A 95 4.866 -13.535 4.525 1.00 0.00 O ATOM 1542 OE2 GLU A 95 3.290 -14.970 4.166 1.00 0.00 O ATOM 0 H GLU A 95 0.311 -10.553 5.912 1.00 0.00 H new ATOM 0 HA GLU A 95 1.981 -11.924 7.810 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.466 -11.622 4.882 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.799 -11.467 6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.401 -13.705 6.877 1.00 0.00 H new ATOM 0 HG3 GLU A 95 1.943 -13.864 5.918 1.00 0.00 H new ATOM 1549 N GLN A 96 3.176 -9.865 7.925 1.00 0.00 N ATOM 1550 CA GLN A 96 3.685 -8.667 8.257 1.00 0.00 C ATOM 1551 C GLN A 96 4.906 -8.685 7.462 1.00 0.00 C ATOM 1552 O GLN A 96 5.780 -9.473 7.712 1.00 0.00 O ATOM 1553 CB GLN A 96 4.007 -8.586 9.750 1.00 0.00 C ATOM 1554 CG GLN A 96 2.837 -8.914 10.660 1.00 0.00 C ATOM 1555 CD GLN A 96 3.200 -8.856 12.120 1.00 0.00 C ATOM 1556 OE1 GLN A 96 3.586 -9.856 12.704 1.00 0.00 O ATOM 1557 NE2 GLN A 96 3.119 -7.695 12.708 1.00 0.00 N ATOM 0 H GLN A 96 3.684 -10.662 8.310 1.00 0.00 H new ATOM 0 HA GLN A 96 3.021 -7.822 8.075 1.00 0.00 H new ATOM 0 HB2 GLN A 96 4.827 -9.270 9.971 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.360 -7.581 9.980 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.023 -8.215 10.464 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.466 -9.911 10.422 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.792 -6.881 12.187 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.383 -7.600 13.689 1.00 0.00 H new ATOM 1566 N LEU A 97 4.959 -7.897 6.518 1.00 0.00 N ATOM 1567 CA LEU A 97 6.036 -7.959 5.622 1.00 0.00 C ATOM 1568 C LEU A 97 6.569 -6.648 5.171 1.00 0.00 C ATOM 1569 O LEU A 97 5.881 -5.631 5.240 1.00 0.00 O ATOM 1570 CB LEU A 97 5.787 -8.973 4.534 1.00 0.00 C ATOM 1571 CG LEU A 97 4.547 -8.870 3.663 1.00 0.00 C ATOM 1572 CD1 LEU A 97 4.564 -7.618 2.794 1.00 0.00 C ATOM 1573 CD2 LEU A 97 4.456 -10.127 2.809 1.00 0.00 C ATOM 0 H LEU A 97 4.266 -7.175 6.319 1.00 0.00 H new ATOM 0 HA LEU A 97 6.885 -8.335 6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 97 6.651 -8.953 3.870 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.770 -9.956 5.006 1.00 0.00 H new ATOM 0 HG LEU A 97 3.668 -8.787 4.302 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.659 -7.584 2.187 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.608 -6.734 3.430 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.437 -7.639 2.142 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.571 -10.073 2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.345 -10.208 2.184 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.386 -11.002 3.455 1.00 0.00 H new ATOM 1585 N ALA A 98 7.768 -6.683 4.674 1.00 0.00 N ATOM 1586 CA ALA A 98 8.511 -5.491 4.410 1.00 0.00 C ATOM 1587 C ALA A 98 8.792 -5.303 2.956 1.00 0.00 C ATOM 1588 O ALA A 98 8.718 -6.240 2.163 1.00 0.00 O ATOM 1589 CB ALA A 98 9.833 -5.548 5.148 1.00 0.00 C ATOM 0 H ALA A 98 8.260 -7.545 4.439 1.00 0.00 H new ATOM 0 HA ALA A 98 7.903 -4.653 4.750 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.401 -4.640 4.948 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.649 -5.632 6.219 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.402 -6.414 4.809 1.00 0.00 H new ATOM 1595 N ALA A 99 9.107 -4.094 2.614 1.00 0.00 N ATOM 1596 CA ALA A 99 9.567 -3.763 1.298 1.00 0.00 C ATOM 1597 C ALA A 99 10.630 -2.723 1.450 1.00 0.00 C ATOM 1598 O ALA A 99 10.575 -1.915 2.381 1.00 0.00 O ATOM 1599 CB ALA A 99 8.445 -3.260 0.402 1.00 0.00 C ATOM 0 H ALA A 99 9.052 -3.297 3.248 1.00 0.00 H new ATOM 0 HA ALA A 99 9.958 -4.658 0.813 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.845 -3.023 -0.584 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.681 -4.032 0.307 1.00 0.00 H new ATOM 0 HB3 ALA A 99 8.004 -2.364 0.840 1.00 0.00 H new ATOM 1605 N LYS A 100 11.601 -2.742 0.591 1.00 0.00 N ATOM 1606 CA LYS A 100 12.636 -1.847 0.652 1.00 0.00 C ATOM 1607 C LYS A 100 12.926 -1.316 -0.678 1.00 0.00 C ATOM 1608 O LYS A 100 12.889 -2.018 -1.700 1.00 0.00 O ATOM 1609 CB LYS A 100 13.881 -2.430 1.275 1.00 0.00 C ATOM 1610 CG LYS A 100 14.424 -3.694 0.626 1.00 0.00 C ATOM 1611 CD LYS A 100 15.766 -4.118 1.229 1.00 0.00 C ATOM 1612 CE LYS A 100 15.664 -4.503 2.703 1.00 0.00 C ATOM 1613 NZ LYS A 100 16.995 -4.805 3.279 1.00 0.00 N ATOM 0 H LYS A 100 11.667 -3.409 -0.178 1.00 0.00 H new ATOM 0 HA LYS A 100 12.314 -1.034 1.303 1.00 0.00 H new ATOM 0 HB2 LYS A 100 14.663 -1.671 1.255 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.672 -2.645 2.323 1.00 0.00 H new ATOM 0 HG2 LYS A 100 13.702 -4.502 0.745 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.544 -3.529 -0.445 1.00 0.00 H new ATOM 0 HD2 LYS A 100 16.160 -4.963 0.665 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.480 -3.302 1.121 1.00 0.00 H new ATOM 0 HE2 LYS A 100 15.201 -3.689 3.261 1.00 0.00 H new ATOM 0 HE3 LYS A 100 15.015 -5.372 2.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 16.889 -5.063 4.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.426 -5.598 2.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.606 -3.967 3.200 1.00 0.00 H new ATOM 1627 N PHE A 101 13.128 -0.102 -0.650 1.00 0.00 N ATOM 1628 CA PHE A 101 13.508 0.673 -1.789 1.00 0.00 C ATOM 1629 C PHE A 101 14.980 1.001 -1.687 1.00 0.00 C ATOM 1630 O PHE A 101 15.518 1.069 -0.581 1.00 0.00 O ATOM 1631 CB PHE A 101 12.657 1.934 -1.874 1.00 0.00 C ATOM 1632 CG PHE A 101 11.208 1.666 -2.178 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.309 1.369 -1.164 1.00 0.00 C ATOM 1634 CD2 PHE A 101 10.748 1.710 -3.483 1.00 0.00 C ATOM 1635 CE1 PHE A 101 8.985 1.118 -1.449 1.00 0.00 C ATOM 1636 CE2 PHE A 101 9.423 1.463 -3.773 1.00 0.00 C ATOM 1637 CZ PHE A 101 8.540 1.167 -2.755 1.00 0.00 C ATOM 0 H PHE A 101 13.038 0.452 0.202 1.00 0.00 H new ATOM 0 HA PHE A 101 13.339 0.105 -2.704 1.00 0.00 H new ATOM 0 HB2 PHE A 101 12.727 2.473 -0.929 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.066 2.587 -2.645 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.651 1.334 -0.140 1.00 0.00 H new ATOM 0 HD2 PHE A 101 11.435 1.941 -4.283 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.296 0.883 -0.652 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.077 1.501 -4.795 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.501 0.974 -2.980 1.00 0.00 H new ATOM 1647 N LYS A 102 15.598 1.208 -2.837 1.00 0.00 N ATOM 1648 CA LYS A 102 17.054 1.427 -3.009 1.00 0.00 C ATOM 1649 C LYS A 102 17.662 2.403 -1.984 1.00 0.00 C ATOM 1650 O LYS A 102 18.677 2.108 -1.353 1.00 0.00 O ATOM 1651 CB LYS A 102 17.367 1.964 -4.430 1.00 0.00 C ATOM 1652 CG LYS A 102 17.088 1.032 -5.633 1.00 0.00 C ATOM 1653 CD LYS A 102 15.606 0.737 -5.865 1.00 0.00 C ATOM 1654 CE LYS A 102 15.368 0.077 -7.226 1.00 0.00 C ATOM 1655 NZ LYS A 102 16.112 -1.196 -7.406 1.00 0.00 N ATOM 0 H LYS A 102 15.093 1.232 -3.723 1.00 0.00 H new ATOM 0 HA LYS A 102 17.508 0.449 -2.851 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.793 2.879 -4.576 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.421 2.241 -4.458 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.502 1.485 -6.534 1.00 0.00 H new ATOM 0 HG3 LYS A 102 17.615 0.090 -5.479 1.00 0.00 H new ATOM 0 HD2 LYS A 102 15.236 0.084 -5.074 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.036 1.664 -5.805 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.302 -0.115 -7.346 1.00 0.00 H new ATOM 0 HE3 LYS A 102 15.658 0.772 -8.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.854 -1.623 -8.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 17.134 -1.006 -7.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.869 -1.852 -6.636 1.00 0.00 H new ATOM 1669 N THR A 103 17.042 3.540 -1.830 1.00 0.00 N ATOM 1670 CA THR A 103 17.554 4.593 -0.979 1.00 0.00 C ATOM 1671 C THR A 103 16.458 5.019 -0.048 1.00 0.00 C ATOM 1672 O THR A 103 15.286 4.748 -0.342 1.00 0.00 O ATOM 1673 CB THR A 103 17.944 5.804 -1.844 1.00 0.00 C ATOM 1674 OG1 THR A 103 16.803 6.200 -2.621 1.00 0.00 O ATOM 1675 CG2 THR A 103 19.086 5.465 -2.778 1.00 0.00 C ATOM 0 H THR A 103 16.162 3.769 -2.291 1.00 0.00 H new ATOM 0 HA THR A 103 18.422 4.234 -0.426 1.00 0.00 H new ATOM 0 HB THR A 103 18.267 6.613 -1.189 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.038 6.973 -3.176 1.00 0.00 H new ATOM 0 HG21 THR A 103 19.339 6.340 -3.376 1.00 0.00 H new ATOM 0 HG22 THR A 103 19.955 5.161 -2.195 1.00 0.00 H new ATOM 0 HG23 THR A 103 18.787 4.649 -3.437 1.00 0.00 H new ATOM 1683 N PRO A 104 16.758 5.721 1.079 1.00 0.00 N ATOM 1684 CA PRO A 104 15.724 6.210 1.966 1.00 0.00 C ATOM 1685 C PRO A 104 14.900 7.303 1.328 1.00 0.00 C ATOM 1686 O PRO A 104 14.029 7.798 1.893 1.00 0.00 O ATOM 1687 CB PRO A 104 16.445 6.710 3.226 1.00 0.00 C ATOM 1688 CG PRO A 104 17.874 6.285 3.062 1.00 0.00 C ATOM 1689 CD PRO A 104 18.102 6.067 1.582 1.00 0.00 C ATOM 0 HA PRO A 104 15.014 5.418 2.205 1.00 0.00 H new ATOM 0 HB2 PRO A 104 16.366 7.793 3.320 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.008 6.279 4.126 1.00 0.00 H new ATOM 0 HG2 PRO A 104 18.550 7.048 3.448 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.071 5.371 3.622 1.00 0.00 H new ATOM 0 HD2 PRO A 104 18.494 6.962 1.099 1.00 0.00 H new ATOM 0 HD3 PRO A 104 18.819 5.266 1.399 1.00 0.00 H new ATOM 1697 N GLU A 105 15.240 7.710 0.192 1.00 0.00 N ATOM 1698 CA GLU A 105 14.395 8.620 -0.519 1.00 0.00 C ATOM 1699 C GLU A 105 13.187 7.876 -1.003 1.00 0.00 C ATOM 1700 O GLU A 105 12.067 8.228 -0.709 1.00 0.00 O ATOM 1701 CB GLU A 105 15.082 9.385 -1.629 1.00 0.00 C ATOM 1702 CG GLU A 105 14.168 10.431 -2.251 1.00 0.00 C ATOM 1703 CD GLU A 105 14.873 11.346 -3.191 1.00 0.00 C ATOM 1704 OE1 GLU A 105 15.744 12.119 -2.723 1.00 0.00 O ATOM 1705 OE2 GLU A 105 14.570 11.331 -4.414 1.00 0.00 O ATOM 0 H GLU A 105 16.097 7.442 -0.292 1.00 0.00 H new ATOM 0 HA GLU A 105 14.097 9.402 0.179 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.975 9.871 -1.235 1.00 0.00 H new ATOM 0 HB3 GLU A 105 15.412 8.688 -2.399 1.00 0.00 H new ATOM 0 HG2 GLU A 105 13.360 9.928 -2.782 1.00 0.00 H new ATOM 0 HG3 GLU A 105 13.709 11.020 -1.457 1.00 0.00 H new ATOM 1712 N LEU A 106 13.456 6.769 -1.673 1.00 0.00 N ATOM 1713 CA LEU A 106 12.425 5.975 -2.261 1.00 0.00 C ATOM 1714 C LEU A 106 11.720 5.246 -1.193 1.00 0.00 C ATOM 1715 O LEU A 106 10.507 5.176 -1.166 1.00 0.00 O ATOM 1716 CB LEU A 106 12.972 5.040 -3.367 1.00 0.00 C ATOM 1717 CG LEU A 106 13.263 5.683 -4.749 1.00 0.00 C ATOM 1718 CD1 LEU A 106 12.025 6.376 -5.296 1.00 0.00 C ATOM 1719 CD2 LEU A 106 14.433 6.651 -4.702 1.00 0.00 C ATOM 0 H LEU A 106 14.399 6.407 -1.817 1.00 0.00 H new ATOM 0 HA LEU A 106 11.711 6.625 -2.767 1.00 0.00 H new ATOM 0 HB2 LEU A 106 13.894 4.587 -3.003 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.255 4.232 -3.513 1.00 0.00 H new ATOM 0 HG LEU A 106 13.540 4.871 -5.421 1.00 0.00 H new ATOM 0 HD11 LEU A 106 12.254 6.819 -6.265 1.00 0.00 H new ATOM 0 HD12 LEU A 106 11.221 5.648 -5.410 1.00 0.00 H new ATOM 0 HD13 LEU A 106 11.711 7.158 -4.605 1.00 0.00 H new ATOM 0 HD21 LEU A 106 14.596 7.074 -5.693 1.00 0.00 H new ATOM 0 HD22 LEU A 106 14.214 7.453 -3.997 1.00 0.00 H new ATOM 0 HD23 LEU A 106 15.330 6.122 -4.381 1.00 0.00 H new ATOM 1731 N ALA A 107 12.498 4.793 -0.267 1.00 0.00 N ATOM 1732 CA ALA A 107 12.031 4.053 0.842 1.00 0.00 C ATOM 1733 C ALA A 107 11.331 4.964 1.846 1.00 0.00 C ATOM 1734 O ALA A 107 10.195 4.683 2.228 1.00 0.00 O ATOM 1735 CB ALA A 107 13.230 3.369 1.450 1.00 0.00 C ATOM 0 H ALA A 107 13.508 4.936 -0.268 1.00 0.00 H new ATOM 0 HA ALA A 107 11.292 3.313 0.536 1.00 0.00 H new ATOM 0 HB1 ALA A 107 12.916 2.783 2.314 1.00 0.00 H new ATOM 0 HB2 ALA A 107 13.686 2.710 0.711 1.00 0.00 H new ATOM 0 HB3 ALA A 107 13.956 4.119 1.765 1.00 0.00 H new ATOM 1741 N GLU A 108 11.951 6.104 2.222 1.00 0.00 N ATOM 1742 CA GLU A 108 11.292 6.930 3.266 1.00 0.00 C ATOM 1743 C GLU A 108 10.055 7.632 2.732 1.00 0.00 C ATOM 1744 O GLU A 108 8.992 7.590 3.346 1.00 0.00 O ATOM 1745 CB GLU A 108 12.234 7.918 3.968 1.00 0.00 C ATOM 1746 CG GLU A 108 11.583 8.720 5.079 1.00 0.00 C ATOM 1747 CD GLU A 108 12.503 9.745 5.669 1.00 0.00 C ATOM 1748 OE1 GLU A 108 13.296 9.401 6.571 1.00 0.00 O ATOM 1749 OE2 GLU A 108 12.440 10.928 5.248 1.00 0.00 O ATOM 0 H GLU A 108 12.835 6.456 1.856 1.00 0.00 H new ATOM 0 HA GLU A 108 10.979 6.223 4.034 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.078 7.366 4.381 1.00 0.00 H new ATOM 0 HB3 GLU A 108 12.637 8.608 3.226 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.694 9.217 4.690 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.251 8.041 5.864 1.00 0.00 H new ATOM 1756 N GLU A 109 10.183 8.232 1.574 1.00 0.00 N ATOM 1757 CA GLU A 109 9.084 8.973 0.970 1.00 0.00 C ATOM 1758 C GLU A 109 7.910 8.110 0.615 1.00 0.00 C ATOM 1759 O GLU A 109 6.762 8.577 0.682 1.00 0.00 O ATOM 1760 CB GLU A 109 9.532 9.774 -0.220 1.00 0.00 C ATOM 1761 CG GLU A 109 10.207 11.066 0.160 1.00 0.00 C ATOM 1762 CD GLU A 109 9.245 11.974 0.891 1.00 0.00 C ATOM 1763 OE1 GLU A 109 8.353 12.582 0.229 1.00 0.00 O ATOM 1764 OE2 GLU A 109 9.315 12.072 2.116 1.00 0.00 O ATOM 0 H GLU A 109 11.040 8.226 1.022 1.00 0.00 H new ATOM 0 HA GLU A 109 8.745 9.665 1.741 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.218 9.174 -0.817 1.00 0.00 H new ATOM 0 HB3 GLU A 109 8.669 9.993 -0.849 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.071 10.859 0.791 1.00 0.00 H new ATOM 0 HG3 GLU A 109 10.578 11.566 -0.735 1.00 0.00 H new ATOM 1771 N PHE A 110 8.169 6.873 0.224 1.00 0.00 N ATOM 1772 CA PHE A 110 7.086 5.954 -0.051 1.00 0.00 C ATOM 1773 C PHE A 110 6.328 5.715 1.235 1.00 0.00 C ATOM 1774 O PHE A 110 5.134 5.850 1.272 1.00 0.00 O ATOM 1775 CB PHE A 110 7.607 4.631 -0.584 1.00 0.00 C ATOM 1776 CG PHE A 110 6.539 3.741 -1.159 1.00 0.00 C ATOM 1777 CD1 PHE A 110 6.182 3.856 -2.488 1.00 0.00 C ATOM 1778 CD2 PHE A 110 5.902 2.790 -0.377 1.00 0.00 C ATOM 1779 CE1 PHE A 110 5.210 3.044 -3.029 1.00 0.00 C ATOM 1780 CE2 PHE A 110 4.929 1.977 -0.913 1.00 0.00 C ATOM 1781 CZ PHE A 110 4.583 2.104 -2.243 1.00 0.00 C ATOM 0 H PHE A 110 9.105 6.490 0.093 1.00 0.00 H new ATOM 0 HA PHE A 110 6.436 6.388 -0.811 1.00 0.00 H new ATOM 0 HB2 PHE A 110 8.354 4.829 -1.353 1.00 0.00 H new ATOM 0 HB3 PHE A 110 8.113 4.100 0.222 1.00 0.00 H new ATOM 0 HD1 PHE A 110 6.671 4.591 -3.110 1.00 0.00 H new ATOM 0 HD2 PHE A 110 6.172 2.686 0.664 1.00 0.00 H new ATOM 0 HE1 PHE A 110 4.940 3.145 -4.070 1.00 0.00 H new ATOM 0 HE2 PHE A 110 4.437 1.241 -0.294 1.00 0.00 H new ATOM 0 HZ PHE A 110 3.821 1.466 -2.667 1.00 0.00 H new ATOM 1791 N LYS A 111 7.081 5.449 2.291 1.00 0.00 N ATOM 1792 CA LYS A 111 6.571 5.152 3.640 1.00 0.00 C ATOM 1793 C LYS A 111 5.686 6.288 4.132 1.00 0.00 C ATOM 1794 O LYS A 111 4.571 6.082 4.583 1.00 0.00 O ATOM 1795 CB LYS A 111 7.790 5.037 4.555 1.00 0.00 C ATOM 1796 CG LYS A 111 7.577 4.416 5.933 1.00 0.00 C ATOM 1797 CD LYS A 111 6.887 5.335 6.949 1.00 0.00 C ATOM 1798 CE LYS A 111 7.717 6.570 7.263 1.00 0.00 C ATOM 1799 NZ LYS A 111 7.085 7.397 8.307 1.00 0.00 N ATOM 0 H LYS A 111 8.100 5.431 2.241 1.00 0.00 H new ATOM 0 HA LYS A 111 5.981 4.236 3.634 1.00 0.00 H new ATOM 0 HB2 LYS A 111 8.548 4.451 4.035 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.201 6.037 4.696 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.982 3.510 5.820 1.00 0.00 H new ATOM 0 HG3 LYS A 111 8.544 4.114 6.334 1.00 0.00 H new ATOM 0 HD2 LYS A 111 5.916 5.641 6.559 1.00 0.00 H new ATOM 0 HD3 LYS A 111 6.700 4.781 7.869 1.00 0.00 H new ATOM 0 HE2 LYS A 111 8.712 6.267 7.590 1.00 0.00 H new ATOM 0 HE3 LYS A 111 7.846 7.162 6.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 7.163 8.401 8.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 6.081 7.139 8.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.564 7.235 9.216 1.00 0.00 H new ATOM 1813 N GLN A 112 6.228 7.461 4.061 1.00 0.00 N ATOM 1814 CA GLN A 112 5.543 8.700 4.478 1.00 0.00 C ATOM 1815 C GLN A 112 4.217 8.869 3.767 1.00 0.00 C ATOM 1816 O GLN A 112 3.173 9.077 4.390 1.00 0.00 O ATOM 1817 CB GLN A 112 6.373 9.860 4.062 1.00 0.00 C ATOM 1818 CG GLN A 112 7.757 9.971 4.708 1.00 0.00 C ATOM 1819 CD GLN A 112 7.733 10.260 6.206 1.00 0.00 C ATOM 1820 OE1 GLN A 112 6.820 9.869 6.927 1.00 0.00 O ATOM 1821 NE2 GLN A 112 8.724 10.951 6.675 1.00 0.00 N ATOM 0 H GLN A 112 7.173 7.616 3.710 1.00 0.00 H new ATOM 0 HA GLN A 112 5.390 8.645 5.556 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.503 9.817 2.981 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.819 10.773 4.281 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.299 9.041 4.539 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.316 10.761 4.207 1.00 0.00 H new ATOM 0 HE21 GLN A 112 9.469 11.262 6.052 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.759 11.183 7.668 1.00 0.00 H new ATOM 1830 N LYS A 113 4.269 8.756 2.450 1.00 0.00 N ATOM 1831 CA LYS A 113 3.129 8.944 1.627 1.00 0.00 C ATOM 1832 C LYS A 113 2.156 7.814 1.853 1.00 0.00 C ATOM 1833 O LYS A 113 0.954 7.988 1.759 1.00 0.00 O ATOM 1834 CB LYS A 113 3.575 8.952 0.174 1.00 0.00 C ATOM 1835 CG LYS A 113 3.475 10.295 -0.580 1.00 0.00 C ATOM 1836 CD LYS A 113 4.641 11.284 -0.299 1.00 0.00 C ATOM 1837 CE LYS A 113 4.704 11.793 1.138 1.00 0.00 C ATOM 1838 NZ LYS A 113 5.793 12.786 1.334 1.00 0.00 N ATOM 0 H LYS A 113 5.120 8.529 1.936 1.00 0.00 H new ATOM 0 HA LYS A 113 2.642 9.888 1.870 1.00 0.00 H new ATOM 0 HB2 LYS A 113 4.612 8.618 0.136 1.00 0.00 H new ATOM 0 HB3 LYS A 113 2.982 8.214 -0.367 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.437 10.094 -1.651 1.00 0.00 H new ATOM 0 HG3 LYS A 113 2.535 10.777 -0.313 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.584 10.792 -0.539 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.547 12.138 -0.970 1.00 0.00 H new ATOM 0 HE2 LYS A 113 3.749 12.246 1.403 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.856 10.951 1.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.014 12.864 2.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 6.641 12.477 0.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.487 13.713 0.974 1.00 0.00 H new ATOM 1852 N PHE A 114 2.713 6.688 2.189 1.00 0.00 N ATOM 1853 CA PHE A 114 1.962 5.431 2.403 1.00 0.00 C ATOM 1854 C PHE A 114 0.991 5.589 3.575 1.00 0.00 C ATOM 1855 O PHE A 114 -0.219 5.395 3.411 1.00 0.00 O ATOM 1856 CB PHE A 114 2.965 4.288 2.675 1.00 0.00 C ATOM 1857 CG PHE A 114 2.425 2.883 2.763 1.00 0.00 C ATOM 1858 CD1 PHE A 114 1.954 2.374 3.956 1.00 0.00 C ATOM 1859 CD2 PHE A 114 2.447 2.060 1.660 1.00 0.00 C ATOM 1860 CE1 PHE A 114 1.513 1.071 4.049 1.00 0.00 C ATOM 1861 CE2 PHE A 114 2.000 0.761 1.742 1.00 0.00 C ATOM 1862 CZ PHE A 114 1.535 0.263 2.939 1.00 0.00 C ATOM 0 H PHE A 114 3.718 6.589 2.331 1.00 0.00 H new ATOM 0 HA PHE A 114 1.379 5.194 1.513 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.717 4.308 1.887 1.00 0.00 H new ATOM 0 HB3 PHE A 114 3.478 4.509 3.611 1.00 0.00 H new ATOM 0 HD1 PHE A 114 1.930 3.007 4.831 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.819 2.438 0.719 1.00 0.00 H new ATOM 0 HE1 PHE A 114 1.152 0.687 4.992 1.00 0.00 H new ATOM 0 HE2 PHE A 114 2.014 0.130 0.865 1.00 0.00 H new ATOM 0 HZ PHE A 114 1.189 -0.758 3.004 1.00 0.00 H new ATOM 1872 N GLU A 115 1.517 6.023 4.723 1.00 0.00 N ATOM 1873 CA GLU A 115 0.709 6.238 5.936 1.00 0.00 C ATOM 1874 C GLU A 115 -0.322 7.309 5.656 1.00 0.00 C ATOM 1875 O GLU A 115 -1.480 7.187 6.056 1.00 0.00 O ATOM 1876 CB GLU A 115 1.582 6.795 7.046 1.00 0.00 C ATOM 1877 CG GLU A 115 2.830 6.039 7.355 1.00 0.00 C ATOM 1878 CD GLU A 115 3.655 6.747 8.396 1.00 0.00 C ATOM 1879 OE1 GLU A 115 4.451 7.646 8.041 1.00 0.00 O ATOM 1880 OE2 GLU A 115 3.514 6.453 9.579 1.00 0.00 O ATOM 0 H GLU A 115 2.507 6.235 4.843 1.00 0.00 H new ATOM 0 HA GLU A 115 0.257 5.288 6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.858 7.816 6.783 1.00 0.00 H new ATOM 0 HB3 GLU A 115 0.983 6.851 7.955 1.00 0.00 H new ATOM 0 HG2 GLU A 115 2.574 5.040 7.708 1.00 0.00 H new ATOM 0 HG3 GLU A 115 3.417 5.915 6.445 1.00 0.00 H new ATOM 1887 N GLU A 116 0.105 8.374 4.976 1.00 0.00 N ATOM 1888 CA GLU A 116 -0.759 9.476 4.724 1.00 0.00 C ATOM 1889 C GLU A 116 -1.948 9.045 3.898 1.00 0.00 C ATOM 1890 O GLU A 116 -3.080 9.375 4.230 1.00 0.00 O ATOM 1891 CB GLU A 116 -0.053 10.657 4.076 1.00 0.00 C ATOM 1892 CG GLU A 116 -0.825 11.962 4.265 1.00 0.00 C ATOM 1893 CD GLU A 116 -0.842 12.388 5.735 1.00 0.00 C ATOM 1894 OE1 GLU A 116 -1.474 11.711 6.577 1.00 0.00 O ATOM 1895 OE2 GLU A 116 -0.195 13.394 6.087 1.00 0.00 O ATOM 0 H GLU A 116 1.047 8.476 4.599 1.00 0.00 H new ATOM 0 HA GLU A 116 -1.107 9.823 5.697 1.00 0.00 H new ATOM 0 HB2 GLU A 116 0.945 10.761 4.503 1.00 0.00 H new ATOM 0 HB3 GLU A 116 0.075 10.463 3.011 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -0.370 12.747 3.661 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.847 11.838 3.908 1.00 0.00 H new ATOM 1902 N CYS A 117 -1.697 8.251 2.859 1.00 0.00 N ATOM 1903 CA CYS A 117 -2.700 7.734 2.053 1.00 0.00 C ATOM 1904 C CYS A 117 -3.647 6.874 2.855 1.00 0.00 C ATOM 1905 O CYS A 117 -4.846 6.899 2.613 1.00 0.00 O ATOM 1906 CB CYS A 117 -2.074 6.959 0.969 1.00 0.00 C ATOM 1907 SG CYS A 117 -1.158 7.942 -0.231 1.00 0.00 S ATOM 0 H CYS A 117 -0.757 7.968 2.583 1.00 0.00 H new ATOM 0 HA CYS A 117 -3.287 8.549 1.629 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -1.398 6.226 1.409 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -2.850 6.402 0.444 1.00 0.00 H new ATOM 0 HG CYS A 117 0.013 8.235 0.251 1.00 0.00 H new ATOM 1913 N GLN A 118 -3.106 6.150 3.843 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.925 5.321 4.692 1.00 0.00 C ATOM 1915 C GLN A 118 -4.994 6.169 5.364 1.00 0.00 C ATOM 1916 O GLN A 118 -6.150 5.826 5.329 1.00 0.00 O ATOM 1917 CB GLN A 118 -3.077 4.665 5.798 1.00 0.00 C ATOM 1918 CG GLN A 118 -2.030 3.694 5.349 1.00 0.00 C ATOM 1919 CD GLN A 118 -1.146 3.209 6.498 1.00 0.00 C ATOM 1920 OE1 GLN A 118 0.010 2.900 6.316 1.00 0.00 O ATOM 1921 NE2 GLN A 118 -1.693 3.138 7.686 1.00 0.00 N ATOM 0 H GLN A 118 -2.110 6.131 4.062 1.00 0.00 H new ATOM 0 HA GLN A 118 -4.379 4.550 4.069 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.588 5.456 6.367 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.750 4.149 6.483 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.512 2.837 4.880 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.406 4.164 4.589 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -2.669 3.404 7.815 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -1.143 2.817 8.482 1.00 0.00 H new ATOM 1930 N ARG A 119 -4.602 7.278 5.989 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.603 8.142 6.638 1.00 0.00 C ATOM 1932 C ARG A 119 -6.448 8.926 5.682 1.00 0.00 C ATOM 1933 O ARG A 119 -7.669 9.015 5.796 1.00 0.00 O ATOM 1934 CB ARG A 119 -5.033 9.088 7.707 1.00 0.00 C ATOM 1935 CG ARG A 119 -4.455 8.440 8.959 1.00 0.00 C ATOM 1936 CD ARG A 119 -3.059 7.908 8.735 1.00 0.00 C ATOM 1937 NE ARG A 119 -2.128 8.990 8.350 1.00 0.00 N ATOM 1938 CZ ARG A 119 -0.826 9.021 8.644 1.00 0.00 C ATOM 1939 NH1 ARG A 119 -0.278 8.036 9.349 1.00 0.00 N ATOM 1940 NH2 ARG A 119 -0.080 10.028 8.201 1.00 0.00 N ATOM 0 H ARG A 119 -3.636 7.597 6.063 1.00 0.00 H new ATOM 0 HA ARG A 119 -6.242 7.416 7.142 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -4.252 9.691 7.245 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -5.825 9.772 8.013 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -4.438 9.170 9.769 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -5.105 7.625 9.277 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -2.702 7.424 9.644 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -3.078 7.147 7.955 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.510 9.773 7.819 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -0.852 7.255 9.666 1.00 0.00 H new ATOM 0 HH12 ARG A 119 0.717 8.061 9.573 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.503 10.769 7.642 1.00 0.00 H new ATOM 0 HH22 ARG A 119 0.916 10.060 8.421 1.00 0.00 H new ATOM 1954 N LEU A 120 -5.776 9.500 4.809 1.00 0.00 N ATOM 1955 CA LEU A 120 -6.311 10.476 3.910 1.00 0.00 C ATOM 1956 C LEU A 120 -7.159 9.991 2.775 1.00 0.00 C ATOM 1957 O LEU A 120 -8.302 10.433 2.671 1.00 0.00 O ATOM 1958 CB LEU A 120 -5.251 11.506 3.450 1.00 0.00 C ATOM 1959 CG LEU A 120 -5.072 12.747 4.320 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -4.542 12.395 5.686 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -4.178 13.766 3.633 1.00 0.00 C ATOM 0 H LEU A 120 -4.783 9.318 4.665 1.00 0.00 H new ATOM 0 HA LEU A 120 -7.041 10.981 4.543 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -4.290 10.997 3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -5.510 11.832 2.443 1.00 0.00 H new ATOM 0 HG LEU A 120 -6.055 13.197 4.458 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -4.427 13.304 6.277 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -5.240 11.723 6.185 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -3.574 11.903 5.585 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -4.066 14.641 4.273 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -3.199 13.324 3.447 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -4.627 14.064 2.686 1.00 0.00 H new ATOM 1973 N LEU A 121 -6.699 8.963 2.046 1.00 0.00 N ATOM 1974 CA LEU A 121 -7.282 8.558 0.718 1.00 0.00 C ATOM 1975 C LEU A 121 -8.730 8.144 0.860 1.00 0.00 C ATOM 1976 O LEU A 121 -9.527 8.178 -0.051 1.00 0.00 O ATOM 1977 CB LEU A 121 -6.368 7.533 0.004 1.00 0.00 C ATOM 1978 CG LEU A 121 -6.600 7.288 -1.499 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -5.318 6.781 -2.125 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -7.706 6.270 -1.734 1.00 0.00 C ATOM 0 H LEU A 121 -5.917 8.379 2.342 1.00 0.00 H new ATOM 0 HA LEU A 121 -7.308 9.421 0.052 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.335 7.857 0.135 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.470 6.578 0.519 1.00 0.00 H new ATOM 0 HG LEU A 121 -6.902 8.231 -1.954 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -5.477 6.606 -3.189 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -4.530 7.523 -1.993 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.022 5.849 -1.644 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -7.843 6.122 -2.805 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -7.434 5.323 -1.268 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -8.635 6.635 -1.297 1.00 0.00 H new ATOM 1992 N LEU A 122 -9.014 7.839 2.032 1.00 0.00 N ATOM 1993 CA LEU A 122 -10.272 7.434 2.518 1.00 0.00 C ATOM 1994 C LEU A 122 -11.349 8.506 2.396 1.00 0.00 C ATOM 1995 O LEU A 122 -12.506 8.219 2.054 1.00 0.00 O ATOM 1996 CB LEU A 122 -10.017 7.387 3.950 1.00 0.00 C ATOM 1997 CG LEU A 122 -9.130 6.245 4.468 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -9.202 6.175 5.978 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -9.515 4.904 3.849 1.00 0.00 C ATOM 0 H LEU A 122 -8.310 7.862 2.770 1.00 0.00 H new ATOM 0 HA LEU A 122 -10.610 6.539 1.996 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -9.557 8.331 4.242 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.977 7.328 4.462 1.00 0.00 H new ATOM 0 HG LEU A 122 -8.103 6.457 4.170 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.570 5.362 6.335 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.856 7.117 6.403 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.232 5.995 6.285 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.864 4.122 4.241 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.551 4.673 4.097 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.405 4.958 2.766 1.00 0.00 H new ATOM 2011 N ASP A 123 -10.983 9.708 2.689 1.00 0.00 N ATOM 2012 CA ASP A 123 -11.930 10.794 2.737 1.00 0.00 C ATOM 2013 C ASP A 123 -11.792 11.645 1.531 1.00 0.00 C ATOM 2014 O ASP A 123 -12.776 12.105 0.942 1.00 0.00 O ATOM 2015 CB ASP A 123 -11.681 11.638 3.979 1.00 0.00 C ATOM 2016 CG ASP A 123 -12.651 12.785 4.114 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -13.778 12.577 4.582 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -12.290 13.922 3.789 1.00 0.00 O ATOM 0 H ASP A 123 -10.022 9.976 2.903 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.938 10.380 2.771 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -11.751 11.004 4.863 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -10.665 12.030 3.948 1.00 0.00 H new ATOM 2023 N ILE A 124 -10.583 11.820 1.152 1.00 0.00 N ATOM 2024 CA ILE A 124 -10.236 12.673 0.097 1.00 0.00 C ATOM 2025 C ILE A 124 -10.320 11.949 -1.245 1.00 0.00 C ATOM 2026 O ILE A 124 -10.113 10.742 -1.310 1.00 0.00 O ATOM 2027 CB ILE A 124 -8.830 13.288 0.366 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -7.726 12.212 0.553 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -8.886 14.186 1.594 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -7.117 11.680 -0.738 1.00 0.00 C ATOM 0 H ILE A 124 -9.786 11.355 1.586 1.00 0.00 H new ATOM 0 HA ILE A 124 -10.951 13.494 0.041 1.00 0.00 H new ATOM 0 HB ILE A 124 -8.563 13.870 -0.516 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.929 12.634 1.165 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.147 11.375 1.110 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -7.900 14.613 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -9.604 14.989 1.425 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -9.194 13.600 2.460 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.357 10.935 -0.502 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -7.897 11.223 -1.347 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.660 12.501 -1.290 1.00 0.00 H new ATOM 2042 N PRO A 125 -10.719 12.648 -2.298 1.00 0.00 N ATOM 2043 CA PRO A 125 -10.731 12.088 -3.641 1.00 0.00 C ATOM 2044 C PRO A 125 -9.305 11.840 -4.144 1.00 0.00 C ATOM 2045 O PRO A 125 -8.371 12.612 -3.827 1.00 0.00 O ATOM 2046 CB PRO A 125 -11.403 13.189 -4.486 1.00 0.00 C ATOM 2047 CG PRO A 125 -12.090 14.059 -3.499 1.00 0.00 C ATOM 2048 CD PRO A 125 -11.245 14.012 -2.272 1.00 0.00 C ATOM 0 HA PRO A 125 -11.246 11.129 -3.689 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -10.667 13.750 -5.063 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -12.110 12.764 -5.199 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -12.183 15.079 -3.873 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -13.099 13.701 -3.295 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -10.447 14.754 -2.301 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -11.828 14.205 -1.371 1.00 0.00 H new ATOM 2056 N LEU A 126 -9.136 10.772 -4.901 1.00 0.00 N ATOM 2057 CA LEU A 126 -7.868 10.417 -5.503 1.00 0.00 C ATOM 2058 C LEU A 126 -7.477 11.459 -6.537 1.00 0.00 C ATOM 2059 O LEU A 126 -6.290 11.744 -6.760 1.00 0.00 O ATOM 2060 CB LEU A 126 -7.991 9.057 -6.156 1.00 0.00 C ATOM 2061 CG LEU A 126 -6.705 8.458 -6.714 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -5.590 8.501 -5.675 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -6.972 7.044 -7.058 1.00 0.00 C ATOM 0 H LEU A 126 -9.888 10.118 -5.117 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.096 10.381 -4.735 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -8.403 8.362 -5.424 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -8.715 9.131 -6.968 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.391 9.031 -7.587 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.683 8.068 -6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -5.399 9.535 -5.389 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.890 7.930 -4.796 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.066 6.590 -7.461 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -7.282 6.504 -6.163 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.765 6.995 -7.804 1.00 0.00 H new ATOM 2075 N GLN A 127 -8.483 12.027 -7.146 1.00 0.00 N ATOM 2076 CA GLN A 127 -8.333 13.088 -8.114 1.00 0.00 C ATOM 2077 C GLN A 127 -8.702 14.397 -7.444 1.00 0.00 C ATOM 2078 O GLN A 127 -8.926 14.435 -6.236 1.00 0.00 O ATOM 2079 CB GLN A 127 -9.280 12.859 -9.279 1.00 0.00 C ATOM 2080 CG GLN A 127 -9.087 11.548 -10.006 1.00 0.00 C ATOM 2081 CD GLN A 127 -10.116 11.332 -11.095 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -9.839 10.690 -12.099 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -11.306 11.843 -10.908 1.00 0.00 N ATOM 0 H GLN A 127 -9.454 11.761 -6.981 1.00 0.00 H new ATOM 0 HA GLN A 127 -7.306 13.111 -8.479 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -10.305 12.906 -8.910 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -9.160 13.675 -9.992 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -8.089 11.522 -10.443 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -9.143 10.728 -9.290 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -11.506 12.373 -10.060 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -12.034 11.711 -11.610 1.00 0.00 H new ATOM 2092 N THR A 128 -8.759 15.449 -8.201 1.00 0.00 N ATOM 2093 CA THR A 128 -9.205 16.705 -7.686 1.00 0.00 C ATOM 2094 C THR A 128 -10.749 16.713 -7.721 1.00 0.00 C ATOM 2095 O THR A 128 -11.342 16.331 -8.741 1.00 0.00 O ATOM 2096 CB THR A 128 -8.643 17.851 -8.548 1.00 0.00 C ATOM 2097 OG1 THR A 128 -7.208 17.713 -8.629 1.00 0.00 O ATOM 2098 CG2 THR A 128 -8.982 19.206 -7.947 1.00 0.00 C ATOM 0 H THR A 128 -8.499 15.461 -9.187 1.00 0.00 H new ATOM 0 HA THR A 128 -8.855 16.846 -6.663 1.00 0.00 H new ATOM 0 HB THR A 128 -9.091 17.794 -9.540 1.00 0.00 H new ATOM 0 HG1 THR A 128 -6.840 18.437 -9.177 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.573 19.996 -8.577 1.00 0.00 H new ATOM 0 HG22 THR A 128 -10.065 19.316 -7.885 1.00 0.00 H new ATOM 0 HG23 THR A 128 -8.552 19.279 -6.948 1.00 0.00 H new ATOM 2106 N PRO A 129 -11.415 17.090 -6.607 1.00 0.00 N ATOM 2107 CA PRO A 129 -12.870 17.122 -6.540 1.00 0.00 C ATOM 2108 C PRO A 129 -13.460 18.098 -7.549 1.00 0.00 C ATOM 2109 O PRO A 129 -12.887 19.160 -7.829 1.00 0.00 O ATOM 2110 CB PRO A 129 -13.169 17.578 -5.118 1.00 0.00 C ATOM 2111 CG PRO A 129 -11.940 18.261 -4.691 1.00 0.00 C ATOM 2112 CD PRO A 129 -10.814 17.519 -5.340 1.00 0.00 C ATOM 0 HA PRO A 129 -13.308 16.153 -6.778 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -14.028 18.248 -5.087 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -13.401 16.733 -4.469 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -11.947 19.307 -4.998 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -11.842 18.248 -3.605 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -9.944 18.156 -5.497 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -10.484 16.672 -4.738 1.00 0.00 H new ATOM 2120 N LYS A 130 -14.574 17.735 -8.086 1.00 0.00 N ATOM 2121 CA LYS A 130 -15.229 18.511 -9.098 1.00 0.00 C ATOM 2122 C LYS A 130 -16.451 19.170 -8.516 1.00 0.00 C ATOM 2123 O LYS A 130 -17.490 18.486 -8.328 1.00 0.00 O ATOM 2124 CB LYS A 130 -15.590 17.648 -10.315 1.00 0.00 C ATOM 2125 CG LYS A 130 -14.387 17.018 -11.025 1.00 0.00 C ATOM 2126 CD LYS A 130 -13.399 18.069 -11.544 1.00 0.00 C ATOM 2127 CE LYS A 130 -14.020 18.968 -12.608 1.00 0.00 C ATOM 2128 NZ LYS A 130 -13.080 20.002 -13.073 1.00 0.00 N ATOM 2129 OXT LYS A 130 -16.385 20.367 -8.226 1.00 0.00 O ATOM 0 H LYS A 130 -15.068 16.879 -7.835 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.544 19.284 -9.446 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -16.264 16.854 -9.994 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -16.138 18.261 -11.030 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -13.872 16.348 -10.337 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -14.738 16.410 -11.859 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -13.052 18.681 -10.712 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -12.524 17.569 -11.959 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -14.339 18.360 -13.455 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -14.913 19.445 -12.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.541 20.591 -13.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -12.795 20.598 -12.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -12.239 19.548 -13.483 1.00 0.00 H new TER 2143 LYS A 130