USER MOD reduce.3.24.130724 H: found=0, std=0, add=952, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 62 THR OG1 : rot 180:sc= -0.251 USER MOD Set 1.2: B 64 GLN : amide:sc= 0.0682 K(o=-3.4,f=-6!) USER MOD Set 1.3: B 78 ASN : amide:sc= -3.2 K(o=-3.4,f=-6.1!) USER MOD Set 2.1: A 62 THR OG1 : rot 180:sc= -0.27 USER MOD Set 2.2: A 64 GLN : amide:sc= 0.0724 K(o=-3.5,f=-6!) USER MOD Set 2.3: A 78 ASN : amide:sc= -3.28 K(o=-3.5,f=-6!) USER MOD Single : A 32 SER OG : rot 180:sc= 0.00496 USER MOD Single : A 37 HIS : no HD1:sc= -0.391 X(o=-0.39,f=0.052) USER MOD Single : A 38 TYR OH : rot 180:sc= -0.0173 USER MOD Single : A 41 GLN :FLIP amide:sc= -0.313 F(o=-2.1,f=-0.31) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 158:sc= -0.015 (180deg=-0.172) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 60 MET CE :methyl 145:sc= -4.67 (180deg=-8.75!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0224) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 95:sc= 0.312 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0.00547 USER MOD Single : B 37 HIS : no HD1:sc= -0.366 X(o=-0.37,f=0.059) USER MOD Single : B 38 TYR OH : rot 180:sc= -0.018 USER MOD Single : B 41 GLN :FLIP amide:sc= -0.278 F(o=-2.1,f=-0.28) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 158:sc=-0.00501 (180deg=-0.164) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 60 MET CE :methyl 142:sc= -4.62! (180deg=-8.77!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 68 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0226) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 95:sc= 0.302 USER MOD Single : B 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 31 4.403 0.213 2.725 1.00 0.00 N ATOM 2 CA ARG A 31 4.834 1.028 1.556 1.00 0.00 C ATOM 3 C ARG A 31 6.294 0.703 1.217 1.00 0.00 C ATOM 4 O ARG A 31 7.162 1.555 1.273 1.00 0.00 O ATOM 5 CB ARG A 31 4.697 2.516 1.892 1.00 0.00 C ATOM 6 CG ARG A 31 4.330 3.293 0.626 1.00 0.00 C ATOM 7 CD ARG A 31 3.709 4.636 1.014 1.00 0.00 C ATOM 8 NE ARG A 31 2.235 4.464 1.204 1.00 0.00 N ATOM 9 CZ ARG A 31 1.421 5.500 1.236 1.00 0.00 C ATOM 10 NH1 ARG A 31 1.864 6.729 1.105 1.00 0.00 N ATOM 11 NH2 ARG A 31 0.142 5.298 1.403 1.00 0.00 N ATOM 0 HA ARG A 31 4.205 0.795 0.696 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.931 2.659 2.654 1.00 0.00 H new ATOM 0 HB3 ARG A 31 5.632 2.894 2.305 1.00 0.00 H new ATOM 0 HG2 ARG A 31 5.218 3.454 0.015 1.00 0.00 H new ATOM 0 HG3 ARG A 31 3.628 2.716 0.023 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.164 5.008 1.932 1.00 0.00 H new ATOM 0 HD3 ARG A 31 3.903 5.377 0.238 1.00 0.00 H new ATOM 0 HE ARG A 31 1.852 3.525 1.311 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.861 6.901 0.975 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.211 7.512 1.134 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.215 4.348 1.507 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.500 6.090 1.430 1.00 0.00 H new ATOM 27 N SER A 32 6.568 -0.527 0.868 1.00 0.00 N ATOM 28 CA SER A 32 7.965 -0.920 0.525 1.00 0.00 C ATOM 29 C SER A 32 8.436 -0.138 -0.704 1.00 0.00 C ATOM 30 O SER A 32 9.618 0.071 -0.896 1.00 0.00 O ATOM 31 CB SER A 32 8.013 -2.415 0.221 1.00 0.00 C ATOM 32 OG SER A 32 7.276 -3.119 1.212 1.00 0.00 O ATOM 0 H SER A 32 5.881 -1.278 0.806 1.00 0.00 H new ATOM 0 HA SER A 32 8.618 -0.696 1.368 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.596 -2.611 -0.767 1.00 0.00 H new ATOM 0 HB3 SER A 32 9.046 -2.762 0.205 1.00 0.00 H new ATOM 0 HG SER A 32 7.303 -4.079 1.019 1.00 0.00 H new ATOM 38 N ASP A 33 7.520 0.294 -1.540 1.00 0.00 N ATOM 39 CA ASP A 33 7.913 1.058 -2.755 1.00 0.00 C ATOM 40 C ASP A 33 8.098 2.548 -2.424 1.00 0.00 C ATOM 41 O ASP A 33 8.268 3.359 -3.312 1.00 0.00 O ATOM 42 CB ASP A 33 6.835 0.910 -3.830 1.00 0.00 C ATOM 43 CG ASP A 33 5.476 1.314 -3.254 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.149 2.487 -3.326 1.00 0.00 O ATOM 45 OD2 ASP A 33 4.785 0.442 -2.753 1.00 0.00 O ATOM 0 H ASP A 33 6.517 0.147 -1.428 1.00 0.00 H new ATOM 0 HA ASP A 33 8.858 0.658 -3.122 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.077 1.534 -4.690 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.799 -0.120 -4.184 1.00 0.00 H new ATOM 50 N ALA A 34 8.076 2.916 -1.163 1.00 0.00 N ATOM 51 CA ALA A 34 8.266 4.345 -0.796 1.00 0.00 C ATOM 52 C ALA A 34 9.754 4.629 -0.520 1.00 0.00 C ATOM 53 O ALA A 34 10.119 5.729 -0.154 1.00 0.00 O ATOM 54 CB ALA A 34 7.451 4.658 0.459 1.00 0.00 C ATOM 0 H ALA A 34 7.934 2.283 -0.376 1.00 0.00 H new ATOM 0 HA ALA A 34 7.931 4.972 -1.622 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.588 5.705 0.730 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.395 4.469 0.264 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.787 4.023 1.279 1.00 0.00 H new ATOM 60 N GLU A 35 10.612 3.646 -0.687 1.00 0.00 N ATOM 61 CA GLU A 35 12.068 3.858 -0.431 1.00 0.00 C ATOM 62 C GLU A 35 12.748 4.562 -1.626 1.00 0.00 C ATOM 63 O GLU A 35 13.545 5.455 -1.413 1.00 0.00 O ATOM 64 CB GLU A 35 12.749 2.508 -0.172 1.00 0.00 C ATOM 65 CG GLU A 35 12.015 1.760 0.945 1.00 0.00 C ATOM 66 CD GLU A 35 12.724 2.004 2.280 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.944 2.003 2.289 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.034 2.187 3.269 1.00 0.00 O ATOM 0 H GLU A 35 10.361 2.705 -0.991 1.00 0.00 H new ATOM 0 HA GLU A 35 12.171 4.498 0.446 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.749 1.910 -1.083 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.791 2.664 0.107 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.981 2.098 1.004 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.989 0.693 0.725 1.00 0.00 H new ATOM 75 N PRO A 36 12.440 4.163 -2.852 1.00 0.00 N ATOM 76 CA PRO A 36 13.046 4.771 -4.080 1.00 0.00 C ATOM 77 C PRO A 36 12.287 6.036 -4.495 1.00 0.00 C ATOM 78 O PRO A 36 12.879 7.017 -4.900 1.00 0.00 O ATOM 79 CB PRO A 36 12.894 3.678 -5.129 1.00 0.00 C ATOM 80 CG PRO A 36 11.739 2.794 -4.699 1.00 0.00 C ATOM 81 CD PRO A 36 11.463 3.073 -3.222 1.00 0.00 C ATOM 0 HA PRO A 36 14.081 5.080 -3.935 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.701 4.112 -6.110 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.812 3.096 -5.213 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.854 3.003 -5.299 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.985 1.743 -4.850 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.433 3.393 -3.065 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.616 2.181 -2.615 1.00 0.00 H new ATOM 89 N HIS A 37 10.977 6.011 -4.407 1.00 0.00 N ATOM 90 CA HIS A 37 10.140 7.196 -4.799 1.00 0.00 C ATOM 91 C HIS A 37 10.070 7.335 -6.331 1.00 0.00 C ATOM 92 O HIS A 37 9.407 8.221 -6.839 1.00 0.00 O ATOM 93 CB HIS A 37 10.706 8.490 -4.190 1.00 0.00 C ATOM 94 CG HIS A 37 9.580 9.435 -3.872 1.00 0.00 C ATOM 95 ND1 HIS A 37 9.281 9.818 -2.574 1.00 0.00 N ATOM 96 CD2 HIS A 37 8.672 10.085 -4.672 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.234 10.661 -2.630 1.00 0.00 C ATOM 98 NE2 HIS A 37 7.823 10.858 -3.886 1.00 0.00 N ATOM 0 H HIS A 37 10.443 5.208 -4.075 1.00 0.00 H new ATOM 0 HA HIS A 37 9.134 7.032 -4.412 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.269 8.262 -3.285 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.401 8.958 -4.887 1.00 0.00 H new ATOM 0 HD2 HIS A 37 8.624 10.008 -5.748 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.781 11.122 -1.765 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.053 11.448 -4.201 1.00 0.00 H new ATOM 106 N TYR A 38 10.723 6.469 -7.074 1.00 0.00 N ATOM 107 CA TYR A 38 10.660 6.559 -8.564 1.00 0.00 C ATOM 108 C TYR A 38 10.040 5.272 -9.115 1.00 0.00 C ATOM 109 O TYR A 38 9.319 5.293 -10.093 1.00 0.00 O ATOM 110 CB TYR A 38 12.064 6.758 -9.156 1.00 0.00 C ATOM 111 CG TYR A 38 13.062 5.835 -8.493 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.266 4.544 -8.995 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.791 6.277 -7.382 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.196 3.695 -8.385 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.723 5.428 -6.774 1.00 0.00 C ATOM 116 CZ TYR A 38 14.926 4.137 -7.275 1.00 0.00 C ATOM 117 OH TYR A 38 15.844 3.300 -6.675 1.00 0.00 O ATOM 0 H TYR A 38 11.295 5.707 -6.710 1.00 0.00 H new ATOM 0 HA TYR A 38 10.048 7.416 -8.844 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.042 6.567 -10.229 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.376 7.794 -9.023 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.706 4.203 -9.853 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.634 7.273 -6.994 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.351 2.698 -8.771 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.286 5.769 -5.918 1.00 0.00 H new ATOM 0 HH TYR A 38 16.264 3.762 -5.920 1.00 0.00 H new ATOM 127 N LEU A 39 10.298 4.153 -8.480 1.00 0.00 N ATOM 128 CA LEU A 39 9.713 2.856 -8.944 1.00 0.00 C ATOM 129 C LEU A 39 8.180 2.982 -9.105 1.00 0.00 C ATOM 130 O LEU A 39 7.651 2.647 -10.149 1.00 0.00 O ATOM 131 CB LEU A 39 10.036 1.760 -7.915 1.00 0.00 C ATOM 132 CG LEU A 39 10.799 0.603 -8.585 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.984 0.033 -9.756 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.146 1.117 -9.103 1.00 0.00 C ATOM 0 H LEU A 39 10.893 4.083 -7.655 1.00 0.00 H new ATOM 0 HA LEU A 39 10.144 2.596 -9.911 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.634 2.178 -7.105 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.114 1.387 -7.470 1.00 0.00 H new ATOM 0 HG LEU A 39 10.961 -0.187 -7.851 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.536 -0.784 -10.220 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.028 -0.338 -9.387 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.809 0.817 -10.493 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.689 0.300 -9.578 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.977 1.912 -9.830 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.732 1.506 -8.270 1.00 0.00 H new ATOM 146 N PRO A 40 7.497 3.470 -8.080 1.00 0.00 N ATOM 147 CA PRO A 40 6.010 3.651 -8.115 1.00 0.00 C ATOM 148 C PRO A 40 5.635 4.843 -9.007 1.00 0.00 C ATOM 149 O PRO A 40 4.506 4.972 -9.444 1.00 0.00 O ATOM 150 CB PRO A 40 5.631 3.880 -6.658 1.00 0.00 C ATOM 151 CG PRO A 40 6.868 4.389 -5.951 1.00 0.00 C ATOM 152 CD PRO A 40 8.078 3.921 -6.757 1.00 0.00 C ATOM 0 HA PRO A 40 5.481 2.797 -8.538 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.818 4.602 -6.580 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.280 2.955 -6.201 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.850 5.477 -5.881 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.913 4.005 -4.932 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.800 4.726 -6.894 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.600 3.107 -6.254 1.00 0.00 H new ATOM 160 N GLN A 41 6.582 5.699 -9.304 1.00 0.00 N ATOM 161 CA GLN A 41 6.303 6.860 -10.193 1.00 0.00 C ATOM 162 C GLN A 41 6.233 6.339 -11.635 1.00 0.00 C ATOM 163 O GLN A 41 5.492 6.844 -12.457 1.00 0.00 O ATOM 164 CB GLN A 41 7.446 7.886 -10.036 1.00 0.00 C ATOM 165 CG GLN A 41 7.426 8.939 -11.162 1.00 0.00 C ATOM 166 CD GLN A 41 6.078 9.663 -11.200 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.446 9.910 -10.088 1.00 0.00 O flip ATOM 168 NE2 GLN A 41 5.593 10.008 -12.259 1.00 0.00 N flip ATOM 0 H GLN A 41 7.542 5.639 -8.964 1.00 0.00 H new ATOM 0 HA GLN A 41 5.361 7.345 -9.936 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.358 8.384 -9.070 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.404 7.367 -10.040 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.228 9.661 -11.006 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.613 8.457 -12.121 1.00 0.00 H new ATOM 0 HE21 GLN A 41 6.085 9.816 -13.132 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.694 10.489 -12.275 1.00 0.00 H new ATOM 177 N LEU A 42 7.018 5.339 -11.941 1.00 0.00 N ATOM 178 CA LEU A 42 7.033 4.782 -13.313 1.00 0.00 C ATOM 179 C LEU A 42 5.799 3.909 -13.538 1.00 0.00 C ATOM 180 O LEU A 42 5.165 3.978 -14.575 1.00 0.00 O ATOM 181 CB LEU A 42 8.299 3.928 -13.503 1.00 0.00 C ATOM 182 CG LEU A 42 9.629 4.748 -13.424 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.423 6.237 -13.082 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.537 4.127 -12.357 1.00 0.00 C ATOM 0 H LEU A 42 7.654 4.884 -11.286 1.00 0.00 H new ATOM 0 HA LEU A 42 7.027 5.603 -14.030 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.318 3.148 -12.742 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.248 3.428 -14.470 1.00 0.00 H new ATOM 0 HG LEU A 42 10.077 4.706 -14.417 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.390 6.739 -13.045 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.801 6.703 -13.846 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.932 6.323 -12.113 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.466 4.693 -12.296 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.033 4.152 -11.391 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.758 3.094 -12.624 1.00 0.00 H new ATOM 196 N ARG A 43 5.451 3.082 -12.580 1.00 0.00 N ATOM 197 CA ARG A 43 4.256 2.205 -12.752 1.00 0.00 C ATOM 198 C ARG A 43 3.013 3.079 -12.935 1.00 0.00 C ATOM 199 O ARG A 43 2.190 2.831 -13.799 1.00 0.00 O ATOM 200 CB ARG A 43 4.096 1.292 -11.526 1.00 0.00 C ATOM 201 CG ARG A 43 3.739 2.103 -10.277 1.00 0.00 C ATOM 202 CD ARG A 43 3.705 1.177 -9.060 1.00 0.00 C ATOM 203 NE ARG A 43 3.000 1.860 -7.932 1.00 0.00 N ATOM 204 CZ ARG A 43 1.686 1.979 -7.913 1.00 0.00 C ATOM 205 NH1 ARG A 43 0.937 1.502 -8.882 1.00 0.00 N ATOM 206 NH2 ARG A 43 1.115 2.584 -6.908 1.00 0.00 N ATOM 0 H ARG A 43 5.942 2.979 -11.692 1.00 0.00 H new ATOM 0 HA ARG A 43 4.384 1.577 -13.634 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.318 0.553 -11.718 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.022 0.743 -11.354 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.471 2.896 -10.124 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.770 2.585 -10.408 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.195 0.247 -9.312 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.720 0.913 -8.762 1.00 0.00 H new ATOM 0 HE ARG A 43 3.547 2.242 -7.160 1.00 0.00 H new ATOM 0 HH11 ARG A 43 1.369 1.026 -9.674 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -0.077 1.608 -8.842 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.683 2.959 -6.149 1.00 0.00 H new ATOM 0 HH22 ARG A 43 0.100 2.682 -6.882 1.00 0.00 H new ATOM 220 N LYS A 44 2.875 4.108 -12.138 1.00 0.00 N ATOM 221 CA LYS A 44 1.700 4.991 -12.284 1.00 0.00 C ATOM 222 C LYS A 44 1.794 5.697 -13.642 1.00 0.00 C ATOM 223 O LYS A 44 0.796 5.995 -14.265 1.00 0.00 O ATOM 224 CB LYS A 44 1.660 6.007 -11.133 1.00 0.00 C ATOM 225 CG LYS A 44 2.828 6.990 -11.232 1.00 0.00 C ATOM 226 CD LYS A 44 2.683 8.055 -10.144 1.00 0.00 C ATOM 227 CE LYS A 44 2.993 7.444 -8.776 1.00 0.00 C ATOM 228 NZ LYS A 44 2.065 8.010 -7.757 1.00 0.00 N ATOM 0 H LYS A 44 3.527 4.367 -11.398 1.00 0.00 H new ATOM 0 HA LYS A 44 0.779 4.410 -12.243 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.717 6.553 -11.157 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.701 5.483 -10.178 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.774 6.462 -11.116 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.842 7.458 -12.216 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.360 8.886 -10.343 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.671 8.460 -10.151 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.887 6.360 -8.818 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.026 7.653 -8.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 2.276 7.595 -6.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.187 9.042 -7.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.084 7.789 -8.021 1.00 0.00 H new ATOM 242 N ASP A 45 2.998 5.945 -14.107 1.00 0.00 N ATOM 243 CA ASP A 45 3.168 6.605 -15.424 1.00 0.00 C ATOM 244 C ASP A 45 2.640 5.676 -16.516 1.00 0.00 C ATOM 245 O ASP A 45 1.909 6.097 -17.387 1.00 0.00 O ATOM 246 CB ASP A 45 4.649 6.898 -15.670 1.00 0.00 C ATOM 247 CG ASP A 45 5.080 8.115 -14.850 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.255 8.991 -14.642 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.230 8.152 -14.444 1.00 0.00 O ATOM 0 H ASP A 45 3.866 5.715 -13.623 1.00 0.00 H new ATOM 0 HA ASP A 45 2.614 7.544 -15.438 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.251 6.032 -15.396 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.821 7.083 -16.730 1.00 0.00 H new ATOM 254 N ILE A 46 2.995 4.406 -16.473 1.00 0.00 N ATOM 255 CA ILE A 46 2.495 3.457 -17.516 1.00 0.00 C ATOM 256 C ILE A 46 0.960 3.430 -17.476 1.00 0.00 C ATOM 257 O ILE A 46 0.310 3.230 -18.484 1.00 0.00 O ATOM 258 CB ILE A 46 3.098 2.047 -17.300 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.812 1.193 -18.541 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.523 1.352 -16.054 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.538 -0.150 -18.429 1.00 0.00 C ATOM 0 H ILE A 46 3.604 3.994 -15.766 1.00 0.00 H new ATOM 0 HA ILE A 46 2.811 3.793 -18.504 1.00 0.00 H new ATOM 0 HB ILE A 46 4.171 2.158 -17.143 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.739 1.029 -18.641 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.139 1.719 -19.438 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.976 0.367 -15.945 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.741 1.951 -15.170 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.444 1.245 -16.163 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.330 -0.751 -19.314 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.612 0.022 -18.351 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.190 -0.679 -17.542 1.00 0.00 H new ATOM 273 N LEU A 47 0.382 3.661 -16.318 1.00 0.00 N ATOM 274 CA LEU A 47 -1.100 3.682 -16.210 1.00 0.00 C ATOM 275 C LEU A 47 -1.620 4.892 -16.983 1.00 0.00 C ATOM 276 O LEU A 47 -2.528 4.786 -17.789 1.00 0.00 O ATOM 277 CB LEU A 47 -1.508 3.799 -14.741 1.00 0.00 C ATOM 278 CG LEU A 47 -1.435 2.426 -14.072 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.518 2.593 -12.553 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.604 1.565 -14.553 1.00 0.00 C ATOM 0 H LEU A 47 0.881 3.835 -15.446 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.519 2.763 -16.620 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.851 4.500 -14.226 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.520 4.197 -14.666 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.493 1.943 -14.333 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.466 1.614 -12.076 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.687 3.209 -12.209 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.460 3.075 -12.291 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.554 0.585 -14.077 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.545 2.049 -14.290 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.547 1.446 -15.635 1.00 0.00 H new ATOM 292 N GLU A 48 -1.030 6.040 -16.755 1.00 0.00 N ATOM 293 CA GLU A 48 -1.465 7.263 -17.483 1.00 0.00 C ATOM 294 C GLU A 48 -1.118 7.093 -18.946 1.00 0.00 C ATOM 295 O GLU A 48 -1.871 7.471 -19.824 1.00 0.00 O ATOM 296 CB GLU A 48 -0.732 8.497 -16.962 1.00 0.00 C ATOM 297 CG GLU A 48 -0.837 8.570 -15.446 1.00 0.00 C ATOM 298 CD GLU A 48 -2.300 8.750 -15.033 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.735 9.887 -14.948 1.00 0.00 O ATOM 300 OE2 GLU A 48 -2.959 7.749 -14.808 1.00 0.00 O ATOM 0 H GLU A 48 -0.265 6.179 -16.094 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.537 7.398 -17.337 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.316 8.459 -17.260 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.157 9.396 -17.407 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.434 7.661 -15.001 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.239 9.401 -15.071 1.00 0.00 H new ATOM 307 N VAL A 49 0.030 6.521 -19.218 1.00 0.00 N ATOM 308 CA VAL A 49 0.439 6.320 -20.632 1.00 0.00 C ATOM 309 C VAL A 49 -0.629 5.474 -21.333 1.00 0.00 C ATOM 310 O VAL A 49 -1.205 5.886 -22.316 1.00 0.00 O ATOM 311 CB VAL A 49 1.803 5.620 -20.702 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.239 5.493 -22.165 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.846 6.444 -19.934 1.00 0.00 C ATOM 0 H VAL A 49 0.695 6.188 -18.521 1.00 0.00 H new ATOM 0 HA VAL A 49 0.531 7.286 -21.128 1.00 0.00 H new ATOM 0 HB VAL A 49 1.721 4.629 -20.256 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.208 4.996 -22.214 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.502 4.907 -22.715 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.318 6.486 -22.609 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.814 5.945 -19.985 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.925 7.436 -20.379 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.541 6.537 -18.892 1.00 0.00 H new ATOM 323 N ILE A 50 -0.933 4.310 -20.803 1.00 0.00 N ATOM 324 CA ILE A 50 -2.002 3.459 -21.421 1.00 0.00 C ATOM 325 C ILE A 50 -3.295 4.285 -21.527 1.00 0.00 C ATOM 326 O ILE A 50 -4.133 4.034 -22.371 1.00 0.00 O ATOM 327 CB ILE A 50 -2.245 2.214 -20.558 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.939 1.426 -20.414 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.297 1.322 -21.225 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.977 0.607 -19.122 1.00 0.00 C ATOM 0 H ILE A 50 -0.489 3.915 -19.974 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.688 3.138 -22.414 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.598 2.524 -19.574 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.803 0.767 -21.271 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.090 2.109 -20.399 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.468 0.438 -20.610 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.230 1.876 -21.331 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.943 1.016 -22.209 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.048 0.046 -19.019 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.093 1.277 -18.270 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.817 -0.086 -19.155 1.00 0.00 H new ATOM 342 N CYS A 51 -3.444 5.280 -20.683 1.00 0.00 N ATOM 343 CA CYS A 51 -4.657 6.137 -20.737 1.00 0.00 C ATOM 344 C CYS A 51 -4.558 7.071 -21.948 1.00 0.00 C ATOM 345 O CYS A 51 -5.493 7.219 -22.706 1.00 0.00 O ATOM 346 CB CYS A 51 -4.754 6.968 -19.453 1.00 0.00 C ATOM 347 SG CYS A 51 -6.441 7.597 -19.269 1.00 0.00 S ATOM 0 H CYS A 51 -2.771 5.531 -19.959 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.545 5.512 -20.828 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.486 6.358 -18.591 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.047 7.797 -19.489 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.525 8.301 -18.179 1.00 0.00 H new ATOM 353 N LYS A 52 -3.425 7.698 -22.139 1.00 0.00 N ATOM 354 CA LYS A 52 -3.259 8.628 -23.304 1.00 0.00 C ATOM 355 C LYS A 52 -3.566 7.889 -24.611 1.00 0.00 C ATOM 356 O LYS A 52 -3.995 8.480 -25.583 1.00 0.00 O ATOM 357 CB LYS A 52 -1.815 9.140 -23.376 1.00 0.00 C ATOM 358 CG LYS A 52 -1.403 9.795 -22.057 1.00 0.00 C ATOM 359 CD LYS A 52 0.109 9.625 -21.871 1.00 0.00 C ATOM 360 CE LYS A 52 0.830 10.877 -22.374 1.00 0.00 C ATOM 361 NZ LYS A 52 0.650 11.982 -21.392 1.00 0.00 N ATOM 0 H LYS A 52 -2.605 7.608 -21.539 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.945 9.464 -23.170 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.142 8.313 -23.602 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.720 9.859 -24.189 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.666 10.853 -22.063 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.939 9.338 -21.225 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.340 9.458 -20.819 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.457 8.748 -22.417 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.891 10.668 -22.512 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.434 11.172 -23.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.407 12.685 -21.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.273 12.436 -21.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.691 11.598 -20.426 1.00 0.00 H new ATOM 375 N TYR A 53 -3.324 6.605 -24.638 1.00 0.00 N ATOM 376 CA TYR A 53 -3.566 5.815 -25.870 1.00 0.00 C ATOM 377 C TYR A 53 -4.870 5.012 -25.736 1.00 0.00 C ATOM 378 O TYR A 53 -5.437 4.578 -26.721 1.00 0.00 O ATOM 379 CB TYR A 53 -2.403 4.834 -26.062 1.00 0.00 C ATOM 380 CG TYR A 53 -1.087 5.567 -26.273 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.556 6.382 -25.264 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.382 5.405 -27.473 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.668 7.030 -25.449 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.844 6.060 -27.660 1.00 0.00 C ATOM 385 CZ TYR A 53 1.369 6.872 -26.644 1.00 0.00 C ATOM 386 OH TYR A 53 2.577 7.512 -26.827 1.00 0.00 O ATOM 0 H TYR A 53 -2.965 6.069 -23.848 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.645 6.491 -26.721 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.324 4.186 -25.189 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.605 4.192 -26.919 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -1.096 6.510 -24.338 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.783 4.776 -28.254 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.072 7.654 -24.665 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.384 5.939 -28.587 1.00 0.00 H new ATOM 0 HH TYR A 53 2.932 7.293 -27.714 1.00 0.00 H new ATOM 396 N VAL A 54 -5.342 4.792 -24.527 1.00 0.00 N ATOM 397 CA VAL A 54 -6.600 3.993 -24.334 1.00 0.00 C ATOM 398 C VAL A 54 -7.294 4.478 -23.040 1.00 0.00 C ATOM 399 O VAL A 54 -7.349 5.665 -22.789 1.00 0.00 O ATOM 400 CB VAL A 54 -6.269 2.481 -24.250 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.503 1.671 -24.657 1.00 0.00 C ATOM 402 CG2 VAL A 54 -5.112 2.111 -25.190 1.00 0.00 C ATOM 0 H VAL A 54 -4.911 5.131 -23.667 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.269 4.138 -25.182 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.976 2.255 -23.225 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.275 0.607 -24.599 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.328 1.902 -23.984 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.786 1.927 -25.678 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.904 1.044 -25.108 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.387 2.349 -26.217 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.223 2.677 -24.912 1.00 0.00 H new ATOM 412 N GLN A 55 -7.832 3.597 -22.214 1.00 0.00 N ATOM 413 CA GLN A 55 -8.499 4.058 -20.961 1.00 0.00 C ATOM 414 C GLN A 55 -8.735 2.860 -20.040 1.00 0.00 C ATOM 415 O GLN A 55 -9.524 1.981 -20.332 1.00 0.00 O ATOM 416 CB GLN A 55 -9.837 4.721 -21.306 1.00 0.00 C ATOM 417 CG GLN A 55 -9.764 6.223 -21.016 1.00 0.00 C ATOM 418 CD GLN A 55 -11.071 6.890 -21.446 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.570 6.638 -22.524 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.652 7.738 -20.641 1.00 0.00 N ATOM 0 H GLN A 55 -7.833 2.588 -22.360 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.862 4.782 -20.453 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -10.074 4.556 -22.357 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.639 4.268 -20.723 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.590 6.391 -19.953 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.924 6.667 -21.550 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.234 7.950 -19.735 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.524 8.188 -20.918 1.00 0.00 H new ATOM 429 N ILE A 56 -8.054 2.828 -18.930 1.00 0.00 N ATOM 430 CA ILE A 56 -8.215 1.701 -17.963 1.00 0.00 C ATOM 431 C ILE A 56 -8.193 2.252 -16.541 1.00 0.00 C ATOM 432 O ILE A 56 -7.801 3.380 -16.308 1.00 0.00 O ATOM 433 CB ILE A 56 -7.074 0.687 -18.124 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.749 1.416 -18.378 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.379 -0.249 -19.292 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.618 0.689 -17.651 1.00 0.00 C ATOM 0 H ILE A 56 -7.384 3.542 -18.646 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.164 1.202 -18.160 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.986 0.105 -17.206 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.542 1.454 -19.448 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.816 2.446 -18.029 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.567 -0.968 -19.404 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.310 -0.781 -19.098 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.477 0.333 -20.208 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.677 1.208 -17.832 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.824 0.674 -16.581 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.546 -0.334 -18.021 1.00 0.00 H new ATOM 448 N ASP A 57 -8.601 1.457 -15.591 1.00 0.00 N ATOM 449 CA ASP A 57 -8.598 1.914 -14.173 1.00 0.00 C ATOM 450 C ASP A 57 -7.367 1.321 -13.474 1.00 0.00 C ATOM 451 O ASP A 57 -6.810 0.353 -13.953 1.00 0.00 O ATOM 452 CB ASP A 57 -9.873 1.423 -13.480 1.00 0.00 C ATOM 453 CG ASP A 57 -11.095 1.869 -14.285 1.00 0.00 C ATOM 454 OD1 ASP A 57 -11.263 1.381 -15.390 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.844 2.691 -13.782 1.00 0.00 O ATOM 0 H ASP A 57 -8.938 0.505 -15.737 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.563 3.002 -14.126 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -9.858 0.337 -13.394 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.926 1.822 -12.467 1.00 0.00 H new ATOM 460 N PRO A 58 -6.966 1.899 -12.361 1.00 0.00 N ATOM 461 CA PRO A 58 -5.782 1.412 -11.584 1.00 0.00 C ATOM 462 C PRO A 58 -6.140 0.111 -10.873 1.00 0.00 C ATOM 463 O PRO A 58 -5.303 -0.752 -10.682 1.00 0.00 O ATOM 464 CB PRO A 58 -5.490 2.541 -10.607 1.00 0.00 C ATOM 465 CG PRO A 58 -6.779 3.318 -10.436 1.00 0.00 C ATOM 466 CD PRO A 58 -7.611 3.095 -11.700 1.00 0.00 C ATOM 0 HA PRO A 58 -4.911 1.188 -12.200 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.148 2.145 -9.651 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.698 3.186 -10.987 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.320 2.976 -9.554 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.573 4.379 -10.293 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.657 2.902 -11.460 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.590 3.969 -12.350 1.00 0.00 H new ATOM 474 N GLU A 59 -7.387 -0.049 -10.516 1.00 0.00 N ATOM 475 CA GLU A 59 -7.819 -1.311 -9.858 1.00 0.00 C ATOM 476 C GLU A 59 -7.722 -2.464 -10.872 1.00 0.00 C ATOM 477 O GLU A 59 -7.769 -3.623 -10.504 1.00 0.00 O ATOM 478 CB GLU A 59 -9.266 -1.171 -9.381 1.00 0.00 C ATOM 479 CG GLU A 59 -9.336 -0.127 -8.264 1.00 0.00 C ATOM 480 CD GLU A 59 -10.610 -0.339 -7.447 1.00 0.00 C ATOM 481 OE1 GLU A 59 -11.667 -0.437 -8.048 1.00 0.00 O ATOM 482 OE2 GLU A 59 -10.508 -0.400 -6.233 1.00 0.00 O ATOM 0 H GLU A 59 -8.124 0.643 -10.653 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.177 -1.518 -9.002 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.907 -0.874 -10.211 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.636 -2.131 -9.020 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.460 -0.209 -7.620 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.327 0.877 -8.689 1.00 0.00 H new ATOM 489 N MET A 60 -7.583 -2.158 -12.147 1.00 0.00 N ATOM 490 CA MET A 60 -7.478 -3.229 -13.176 1.00 0.00 C ATOM 491 C MET A 60 -6.005 -3.604 -13.372 1.00 0.00 C ATOM 492 O MET A 60 -5.691 -4.701 -13.793 1.00 0.00 O ATOM 493 CB MET A 60 -8.062 -2.719 -14.497 1.00 0.00 C ATOM 494 CG MET A 60 -9.589 -2.820 -14.448 1.00 0.00 C ATOM 495 SD MET A 60 -10.309 -1.728 -15.698 1.00 0.00 S ATOM 496 CE MET A 60 -9.930 -2.754 -17.138 1.00 0.00 C ATOM 0 H MET A 60 -7.539 -1.206 -12.511 1.00 0.00 H new ATOM 0 HA MET A 60 -8.033 -4.109 -12.850 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.760 -1.686 -14.667 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.674 -3.305 -15.330 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.901 -3.849 -14.626 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.950 -2.544 -13.457 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.732 -2.663 -17.871 1.00 0.00 H new ATOM 0 HE2 MET A 60 -8.992 -2.423 -17.584 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.838 -3.795 -16.829 1.00 0.00 H new ATOM 506 N VAL A 61 -5.102 -2.703 -13.068 1.00 0.00 N ATOM 507 CA VAL A 61 -3.652 -3.005 -13.235 1.00 0.00 C ATOM 508 C VAL A 61 -3.066 -3.440 -11.887 1.00 0.00 C ATOM 509 O VAL A 61 -3.084 -2.693 -10.927 1.00 0.00 O ATOM 510 CB VAL A 61 -2.926 -1.754 -13.733 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.469 -2.097 -14.049 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.615 -1.237 -15.000 1.00 0.00 C ATOM 0 H VAL A 61 -5.311 -1.771 -12.711 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.526 -3.808 -13.961 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.957 -0.985 -12.961 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.954 -1.204 -14.404 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.978 -2.465 -13.148 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.435 -2.866 -14.821 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.099 -0.345 -15.357 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.584 -2.007 -15.771 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.653 -0.990 -14.775 1.00 0.00 H new ATOM 522 N THR A 62 -2.552 -4.644 -11.809 1.00 0.00 N ATOM 523 CA THR A 62 -1.974 -5.134 -10.528 1.00 0.00 C ATOM 524 C THR A 62 -0.488 -4.780 -10.456 1.00 0.00 C ATOM 525 O THR A 62 0.148 -4.517 -11.459 1.00 0.00 O ATOM 526 CB THR A 62 -2.129 -6.655 -10.438 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.396 -7.032 -10.959 1.00 0.00 O ATOM 528 CG2 THR A 62 -2.028 -7.093 -8.976 1.00 0.00 C ATOM 0 H THR A 62 -2.510 -5.307 -12.583 1.00 0.00 H new ATOM 0 HA THR A 62 -2.502 -4.660 -9.701 1.00 0.00 H new ATOM 0 HB THR A 62 -1.340 -7.136 -11.016 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.496 -8.005 -10.904 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.138 -8.176 -8.912 1.00 0.00 H new ATOM 0 HG22 THR A 62 -1.057 -6.803 -8.576 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.817 -6.613 -8.397 1.00 0.00 H new ATOM 536 N VAL A 63 0.067 -4.779 -9.272 1.00 0.00 N ATOM 537 CA VAL A 63 1.512 -4.454 -9.110 1.00 0.00 C ATOM 538 C VAL A 63 2.100 -5.361 -8.030 1.00 0.00 C ATOM 539 O VAL A 63 1.544 -5.495 -6.955 1.00 0.00 O ATOM 540 CB VAL A 63 1.661 -2.994 -8.689 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.143 -2.615 -8.669 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.923 -2.100 -9.686 1.00 0.00 C ATOM 0 H VAL A 63 -0.425 -4.992 -8.404 1.00 0.00 H new ATOM 0 HA VAL A 63 2.038 -4.610 -10.052 1.00 0.00 H new ATOM 0 HB VAL A 63 1.238 -2.859 -7.693 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.248 -1.573 -8.368 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.672 -3.252 -7.960 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.567 -2.750 -9.664 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.028 -1.057 -9.387 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.347 -2.237 -10.681 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.133 -2.368 -9.702 1.00 0.00 H new ATOM 552 N GLN A 64 3.211 -5.992 -8.308 1.00 0.00 N ATOM 553 CA GLN A 64 3.829 -6.901 -7.303 1.00 0.00 C ATOM 554 C GLN A 64 5.353 -6.849 -7.419 1.00 0.00 C ATOM 555 O GLN A 64 5.902 -6.892 -8.503 1.00 0.00 O ATOM 556 CB GLN A 64 3.332 -8.331 -7.548 1.00 0.00 C ATOM 557 CG GLN A 64 3.572 -8.727 -9.013 1.00 0.00 C ATOM 558 CD GLN A 64 2.253 -8.668 -9.789 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.820 -7.609 -10.196 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.591 -9.772 -10.010 1.00 0.00 N ATOM 0 H GLN A 64 3.717 -5.915 -9.191 1.00 0.00 H new ATOM 0 HA GLN A 64 3.545 -6.583 -6.300 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.851 -9.024 -6.886 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.270 -8.401 -7.313 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.301 -8.056 -9.466 1.00 0.00 H new ATOM 0 HG3 GLN A 64 3.990 -9.732 -9.064 1.00 0.00 H new ATOM 0 HE21 GLN A 64 1.954 -10.662 -9.668 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.711 -9.744 -10.524 1.00 0.00 H new ATOM 569 N LEU A 65 6.043 -6.744 -6.309 1.00 0.00 N ATOM 570 CA LEU A 65 7.525 -6.677 -6.353 1.00 0.00 C ATOM 571 C LEU A 65 8.129 -7.995 -5.871 1.00 0.00 C ATOM 572 O LEU A 65 7.540 -8.715 -5.088 1.00 0.00 O ATOM 573 CB LEU A 65 8.005 -5.540 -5.454 1.00 0.00 C ATOM 574 CG LEU A 65 7.420 -5.708 -4.049 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.467 -5.297 -3.010 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.182 -4.821 -3.904 1.00 0.00 C ATOM 0 H LEU A 65 5.636 -6.702 -5.375 1.00 0.00 H new ATOM 0 HA LEU A 65 7.843 -6.498 -7.380 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.094 -5.537 -5.407 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.701 -4.580 -5.872 1.00 0.00 H new ATOM 0 HG LEU A 65 7.141 -6.750 -3.892 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.052 -5.416 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.350 -5.927 -3.114 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.745 -4.255 -3.166 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.764 -4.940 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.461 -3.779 -4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.437 -5.112 -4.645 1.00 0.00 H new ATOM 588 N GLU A 66 9.310 -8.305 -6.338 1.00 0.00 N ATOM 589 CA GLU A 66 9.987 -9.565 -5.923 1.00 0.00 C ATOM 590 C GLU A 66 11.494 -9.312 -5.862 1.00 0.00 C ATOM 591 O GLU A 66 11.960 -8.246 -6.211 1.00 0.00 O ATOM 592 CB GLU A 66 9.687 -10.672 -6.945 1.00 0.00 C ATOM 593 CG GLU A 66 8.262 -11.199 -6.758 1.00 0.00 C ATOM 594 CD GLU A 66 8.092 -11.774 -5.347 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.795 -12.718 -5.025 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.263 -11.260 -4.616 1.00 0.00 O ATOM 0 H GLU A 66 9.838 -7.732 -6.996 1.00 0.00 H new ATOM 0 HA GLU A 66 9.624 -9.880 -4.945 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.808 -10.284 -7.957 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.401 -11.487 -6.828 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.545 -10.394 -6.920 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.051 -11.969 -7.500 1.00 0.00 H new ATOM 603 N GLN A 67 12.256 -10.279 -5.418 1.00 0.00 N ATOM 604 CA GLN A 67 13.736 -10.091 -5.331 1.00 0.00 C ATOM 605 C GLN A 67 14.438 -11.424 -5.600 1.00 0.00 C ATOM 606 O GLN A 67 13.871 -12.482 -5.400 1.00 0.00 O ATOM 607 CB GLN A 67 14.106 -9.599 -3.929 1.00 0.00 C ATOM 608 CG GLN A 67 14.057 -8.069 -3.887 1.00 0.00 C ATOM 609 CD GLN A 67 13.937 -7.604 -2.434 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.905 -7.177 -1.838 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.778 -7.668 -1.836 1.00 0.00 N ATOM 0 H GLN A 67 11.917 -11.191 -5.112 1.00 0.00 H new ATOM 0 HA GLN A 67 14.051 -9.357 -6.072 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.417 -10.014 -3.194 1.00 0.00 H new ATOM 0 HB3 GLN A 67 15.104 -9.948 -3.663 1.00 0.00 H new ATOM 0 HG2 GLN A 67 14.957 -7.653 -4.340 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.210 -7.705 -4.468 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.965 -8.027 -2.337 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.686 -7.359 -0.868 1.00 0.00 H new ATOM 620 N LYS A 68 15.668 -11.379 -6.046 1.00 0.00 N ATOM 621 CA LYS A 68 16.416 -12.640 -6.324 1.00 0.00 C ATOM 622 C LYS A 68 17.501 -12.837 -5.262 1.00 0.00 C ATOM 623 O LYS A 68 17.710 -11.990 -4.414 1.00 0.00 O ATOM 624 CB LYS A 68 17.072 -12.563 -7.703 1.00 0.00 C ATOM 625 CG LYS A 68 16.056 -12.941 -8.789 1.00 0.00 C ATOM 626 CD LYS A 68 16.151 -11.955 -9.959 1.00 0.00 C ATOM 627 CE LYS A 68 17.534 -12.052 -10.608 1.00 0.00 C ATOM 628 NZ LYS A 68 17.594 -13.264 -11.474 1.00 0.00 N ATOM 0 H LYS A 68 16.187 -10.520 -6.230 1.00 0.00 H new ATOM 0 HA LYS A 68 15.720 -13.478 -6.300 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.448 -11.555 -7.880 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.929 -13.235 -7.745 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.247 -13.955 -9.140 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.048 -12.931 -8.375 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.378 -12.174 -10.695 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.976 -10.939 -9.605 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.733 -11.159 -11.200 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.305 -12.103 -9.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.509 -13.293 -11.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.490 -14.116 -10.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.825 -13.230 -12.173 1.00 0.00 H new ATOM 642 N ASP A 69 18.191 -13.948 -5.307 1.00 0.00 N ATOM 643 CA ASP A 69 19.265 -14.211 -4.309 1.00 0.00 C ATOM 644 C ASP A 69 20.553 -13.465 -4.692 1.00 0.00 C ATOM 645 O ASP A 69 21.504 -13.443 -3.933 1.00 0.00 O ATOM 646 CB ASP A 69 19.547 -15.714 -4.254 1.00 0.00 C ATOM 647 CG ASP A 69 18.583 -16.380 -3.272 1.00 0.00 C ATOM 648 OD1 ASP A 69 18.713 -16.133 -2.084 1.00 0.00 O ATOM 649 OD2 ASP A 69 17.730 -17.126 -3.724 1.00 0.00 O ATOM 0 H ASP A 69 18.054 -14.687 -5.997 1.00 0.00 H new ATOM 0 HA ASP A 69 18.932 -13.857 -3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 69 19.433 -16.152 -5.245 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.577 -15.890 -3.944 1.00 0.00 H new ATOM 654 N GLY A 70 20.603 -12.862 -5.861 1.00 0.00 N ATOM 655 CA GLY A 70 21.837 -12.131 -6.277 1.00 0.00 C ATOM 656 C GLY A 70 21.680 -10.636 -5.989 1.00 0.00 C ATOM 657 O GLY A 70 22.215 -9.803 -6.696 1.00 0.00 O ATOM 0 H GLY A 70 19.842 -12.847 -6.540 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.701 -12.524 -5.741 1.00 0.00 H new ATOM 0 HA3 GLY A 70 22.022 -12.288 -7.340 1.00 0.00 H new ATOM 661 N ASP A 71 20.948 -10.294 -4.959 1.00 0.00 N ATOM 662 CA ASP A 71 20.744 -8.853 -4.610 1.00 0.00 C ATOM 663 C ASP A 71 20.086 -8.131 -5.787 1.00 0.00 C ATOM 664 O ASP A 71 20.541 -7.092 -6.231 1.00 0.00 O ATOM 665 CB ASP A 71 22.094 -8.203 -4.286 1.00 0.00 C ATOM 666 CG ASP A 71 22.497 -8.553 -2.852 1.00 0.00 C ATOM 667 OD1 ASP A 71 22.478 -9.728 -2.522 1.00 0.00 O ATOM 668 OD2 ASP A 71 22.817 -7.640 -2.108 1.00 0.00 O ATOM 0 H ASP A 71 20.479 -10.955 -4.340 1.00 0.00 H new ATOM 0 HA ASP A 71 20.096 -8.779 -3.736 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.855 -8.552 -4.984 1.00 0.00 H new ATOM 0 HB3 ASP A 71 22.026 -7.121 -4.402 1.00 0.00 H new ATOM 673 N ILE A 72 19.023 -8.690 -6.299 1.00 0.00 N ATOM 674 CA ILE A 72 18.324 -8.066 -7.458 1.00 0.00 C ATOM 675 C ILE A 72 16.834 -7.927 -7.136 1.00 0.00 C ATOM 676 O ILE A 72 16.321 -8.582 -6.248 1.00 0.00 O ATOM 677 CB ILE A 72 18.510 -8.952 -8.694 1.00 0.00 C ATOM 678 CG1 ILE A 72 20.001 -9.334 -8.820 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.040 -8.185 -9.933 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.283 -10.031 -10.161 1.00 0.00 C ATOM 0 H ILE A 72 18.606 -9.558 -5.962 1.00 0.00 H new ATOM 0 HA ILE A 72 18.741 -7.079 -7.656 1.00 0.00 H new ATOM 0 HB ILE A 72 17.921 -9.864 -8.602 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.617 -8.439 -8.735 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.281 -9.993 -7.998 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.169 -8.809 -10.818 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.987 -7.925 -9.822 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.629 -7.274 -10.042 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.340 -10.288 -10.222 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.684 -10.939 -10.232 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.025 -9.361 -10.981 1.00 0.00 H new ATOM 692 N SER A 73 16.139 -7.076 -7.848 1.00 0.00 N ATOM 693 CA SER A 73 14.682 -6.886 -7.585 1.00 0.00 C ATOM 694 C SER A 73 13.881 -7.311 -8.815 1.00 0.00 C ATOM 695 O SER A 73 14.422 -7.491 -9.890 1.00 0.00 O ATOM 696 CB SER A 73 14.406 -5.414 -7.281 1.00 0.00 C ATOM 697 OG SER A 73 14.762 -5.139 -5.933 1.00 0.00 O ATOM 0 H SER A 73 16.520 -6.504 -8.602 1.00 0.00 H new ATOM 0 HA SER A 73 14.386 -7.495 -6.731 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.977 -4.778 -7.957 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.352 -5.188 -7.444 1.00 0.00 H new ATOM 0 HG SER A 73 14.588 -4.195 -5.735 1.00 0.00 H new ATOM 703 N ILE A 74 12.597 -7.485 -8.656 1.00 0.00 N ATOM 704 CA ILE A 74 11.739 -7.914 -9.795 1.00 0.00 C ATOM 705 C ILE A 74 10.335 -7.317 -9.614 1.00 0.00 C ATOM 706 O ILE A 74 9.479 -7.911 -8.987 1.00 0.00 O ATOM 707 CB ILE A 74 11.674 -9.452 -9.805 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.073 -10.013 -10.114 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.662 -9.938 -10.858 1.00 0.00 C ATOM 710 CD1 ILE A 74 13.033 -11.547 -10.201 1.00 0.00 C ATOM 0 H ILE A 74 12.102 -7.346 -7.775 1.00 0.00 H new ATOM 0 HA ILE A 74 12.150 -7.565 -10.743 1.00 0.00 H new ATOM 0 HB ILE A 74 11.347 -9.807 -8.828 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.437 -9.599 -11.054 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.774 -9.705 -9.338 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.627 -11.027 -10.853 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.674 -9.542 -10.623 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.967 -9.589 -11.844 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.032 -11.925 -10.420 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.690 -11.957 -9.251 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.349 -11.849 -10.994 1.00 0.00 H new ATOM 722 N LEU A 75 10.100 -6.147 -10.155 1.00 0.00 N ATOM 723 CA LEU A 75 8.763 -5.508 -10.015 1.00 0.00 C ATOM 724 C LEU A 75 7.870 -5.893 -11.190 1.00 0.00 C ATOM 725 O LEU A 75 8.036 -5.414 -12.295 1.00 0.00 O ATOM 726 CB LEU A 75 8.920 -3.988 -9.960 1.00 0.00 C ATOM 727 CG LEU A 75 7.605 -3.354 -9.489 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.906 -2.204 -8.524 1.00 0.00 C ATOM 729 CD2 LEU A 75 6.834 -2.816 -10.698 1.00 0.00 C ATOM 0 H LEU A 75 10.782 -5.608 -10.689 1.00 0.00 H new ATOM 0 HA LEU A 75 8.300 -5.856 -9.092 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.729 -3.720 -9.281 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.189 -3.604 -10.944 1.00 0.00 H new ATOM 0 HG LEU A 75 7.004 -4.107 -8.980 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.971 -1.755 -8.190 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.453 -2.586 -7.662 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.509 -1.451 -9.032 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.900 -2.366 -10.363 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.436 -2.065 -11.209 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.616 -3.634 -11.384 1.00 0.00 H new ATOM 741 N GLU A 76 6.915 -6.751 -10.948 1.00 0.00 N ATOM 742 CA GLU A 76 5.987 -7.181 -12.030 1.00 0.00 C ATOM 743 C GLU A 76 4.654 -6.454 -11.852 1.00 0.00 C ATOM 744 O GLU A 76 4.220 -6.216 -10.743 1.00 0.00 O ATOM 745 CB GLU A 76 5.749 -8.693 -11.934 1.00 0.00 C ATOM 746 CG GLU A 76 7.087 -9.438 -11.852 1.00 0.00 C ATOM 747 CD GLU A 76 6.858 -10.832 -11.266 1.00 0.00 C ATOM 748 OE1 GLU A 76 6.019 -11.544 -11.794 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.524 -11.164 -10.300 1.00 0.00 O ATOM 0 H GLU A 76 6.738 -7.175 -10.038 1.00 0.00 H new ATOM 0 HA GLU A 76 6.420 -6.943 -13.002 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.145 -8.918 -11.055 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.187 -9.035 -12.803 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.533 -9.517 -12.843 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.788 -8.881 -11.231 1.00 0.00 H new ATOM 756 N LEU A 77 3.999 -6.107 -12.929 1.00 0.00 N ATOM 757 CA LEU A 77 2.688 -5.406 -12.810 1.00 0.00 C ATOM 758 C LEU A 77 1.709 -5.989 -13.828 1.00 0.00 C ATOM 759 O LEU A 77 2.016 -6.116 -14.997 1.00 0.00 O ATOM 760 CB LEU A 77 2.866 -3.901 -13.056 1.00 0.00 C ATOM 761 CG LEU A 77 3.647 -3.663 -14.351 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.272 -2.295 -14.925 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.148 -3.691 -14.054 1.00 0.00 C ATOM 0 H LEU A 77 4.315 -6.279 -13.884 1.00 0.00 H new ATOM 0 HA LEU A 77 2.295 -5.549 -11.804 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.891 -3.418 -13.117 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.394 -3.448 -12.217 1.00 0.00 H new ATOM 0 HG LEU A 77 3.403 -4.444 -15.072 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.827 -2.123 -15.847 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.203 -2.269 -15.135 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.519 -1.517 -14.203 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.705 -3.522 -14.976 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.391 -2.909 -13.334 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.419 -4.662 -13.640 1.00 0.00 H new ATOM 775 N ASN A 78 0.535 -6.348 -13.388 1.00 0.00 N ATOM 776 CA ASN A 78 -0.471 -6.923 -14.315 1.00 0.00 C ATOM 777 C ASN A 78 -1.302 -5.788 -14.897 1.00 0.00 C ATOM 778 O ASN A 78 -1.600 -4.827 -14.217 1.00 0.00 O ATOM 779 CB ASN A 78 -1.393 -7.865 -13.544 1.00 0.00 C ATOM 780 CG ASN A 78 -0.582 -8.832 -12.668 1.00 0.00 C ATOM 781 OD1 ASN A 78 -1.049 -9.263 -11.632 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.617 -9.200 -13.038 1.00 0.00 N ATOM 0 H ASN A 78 0.230 -6.266 -12.418 1.00 0.00 H new ATOM 0 HA ASN A 78 0.031 -7.473 -15.111 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.072 -7.285 -12.919 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.008 -8.431 -14.243 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.154 -9.845 -12.458 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.015 -8.842 -13.906 1.00 0.00 H new ATOM 789 N VAL A 79 -1.677 -5.889 -16.144 1.00 0.00 N ATOM 790 CA VAL A 79 -2.493 -4.807 -16.765 1.00 0.00 C ATOM 791 C VAL A 79 -3.784 -5.403 -17.326 1.00 0.00 C ATOM 792 O VAL A 79 -3.853 -5.781 -18.481 1.00 0.00 O ATOM 793 CB VAL A 79 -1.697 -4.144 -17.887 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.443 -2.899 -18.361 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.313 -3.742 -17.363 1.00 0.00 C ATOM 0 H VAL A 79 -1.454 -6.672 -16.758 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.739 -4.058 -16.012 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.581 -4.841 -18.717 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.880 -2.421 -19.162 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.428 -3.184 -18.730 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.554 -2.203 -17.530 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.256 -3.269 -18.163 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.427 -3.042 -16.535 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.217 -4.629 -17.017 1.00 0.00 H new ATOM 805 N THR A 80 -4.806 -5.490 -16.513 1.00 0.00 N ATOM 806 CA THR A 80 -6.100 -6.062 -16.983 1.00 0.00 C ATOM 807 C THR A 80 -6.808 -5.058 -17.895 1.00 0.00 C ATOM 808 O THR A 80 -7.520 -4.187 -17.431 1.00 0.00 O ATOM 809 CB THR A 80 -6.993 -6.369 -15.775 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.315 -7.262 -14.902 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.303 -7.010 -16.245 1.00 0.00 C ATOM 0 H THR A 80 -4.798 -5.187 -15.539 1.00 0.00 H new ATOM 0 HA THR A 80 -5.906 -6.980 -17.537 1.00 0.00 H new ATOM 0 HB THR A 80 -7.217 -5.441 -15.249 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.851 -6.751 -14.206 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.933 -7.226 -15.382 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.825 -6.324 -16.913 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.085 -7.937 -16.775 1.00 0.00 H new ATOM 819 N LEU A 81 -6.634 -5.188 -19.184 1.00 0.00 N ATOM 820 CA LEU A 81 -7.312 -4.261 -20.128 1.00 0.00 C ATOM 821 C LEU A 81 -8.743 -4.777 -20.359 1.00 0.00 C ATOM 822 O LEU A 81 -8.944 -5.972 -20.438 1.00 0.00 O ATOM 823 CB LEU A 81 -6.549 -4.243 -21.453 1.00 0.00 C ATOM 824 CG LEU A 81 -5.293 -3.380 -21.309 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.168 -3.970 -22.160 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.596 -1.956 -21.781 1.00 0.00 C ATOM 0 H LEU A 81 -6.049 -5.900 -19.622 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.339 -3.250 -19.721 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.274 -5.258 -21.740 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.185 -3.848 -22.245 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.985 -3.359 -20.264 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.274 -3.355 -22.057 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -3.952 -4.984 -21.825 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.476 -3.991 -23.205 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.702 -1.341 -21.679 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.904 -1.977 -22.826 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.398 -1.535 -21.175 1.00 0.00 H new ATOM 838 N PRO A 82 -9.706 -3.881 -20.450 1.00 0.00 N ATOM 839 CA PRO A 82 -11.144 -4.246 -20.658 1.00 0.00 C ATOM 840 C PRO A 82 -11.426 -4.556 -22.129 1.00 0.00 C ATOM 841 O PRO A 82 -10.522 -4.689 -22.932 1.00 0.00 O ATOM 842 CB PRO A 82 -11.898 -3.007 -20.195 1.00 0.00 C ATOM 843 CG PRO A 82 -10.946 -1.831 -20.309 1.00 0.00 C ATOM 844 CD PRO A 82 -9.524 -2.388 -20.371 1.00 0.00 C ATOM 0 HA PRO A 82 -11.438 -5.143 -20.113 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.784 -2.845 -20.808 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.240 -3.127 -19.167 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.167 -1.246 -21.202 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.058 -1.164 -19.454 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -8.986 -2.007 -21.239 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -8.948 -2.105 -19.490 1.00 0.00 H new ATOM 852 N GLU A 83 -12.681 -4.689 -22.482 1.00 0.00 N ATOM 853 CA GLU A 83 -13.051 -5.010 -23.894 1.00 0.00 C ATOM 854 C GLU A 83 -12.442 -3.982 -24.855 1.00 0.00 C ATOM 855 O GLU A 83 -11.885 -2.983 -24.440 1.00 0.00 O ATOM 856 CB GLU A 83 -14.576 -4.992 -24.029 1.00 0.00 C ATOM 857 CG GLU A 83 -15.122 -6.414 -23.877 1.00 0.00 C ATOM 858 CD GLU A 83 -16.531 -6.359 -23.281 1.00 0.00 C ATOM 859 OE1 GLU A 83 -16.640 -6.353 -22.067 1.00 0.00 O ATOM 860 OE2 GLU A 83 -17.477 -6.323 -24.052 1.00 0.00 O ATOM 0 H GLU A 83 -13.472 -4.588 -21.845 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.664 -5.997 -24.147 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.011 -4.342 -23.270 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -14.860 -4.584 -24.999 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -15.145 -6.912 -24.846 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.466 -7.000 -23.233 1.00 0.00 H new ATOM 867 N ALA A 84 -12.548 -4.230 -26.134 1.00 0.00 N ATOM 868 CA ALA A 84 -11.984 -3.289 -27.141 1.00 0.00 C ATOM 869 C ALA A 84 -12.331 -3.789 -28.545 1.00 0.00 C ATOM 870 O ALA A 84 -13.202 -4.621 -28.717 1.00 0.00 O ATOM 871 CB ALA A 84 -10.462 -3.222 -26.980 1.00 0.00 C ATOM 0 H ALA A 84 -13.006 -5.053 -26.526 1.00 0.00 H new ATOM 0 HA ALA A 84 -12.406 -2.295 -26.993 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.048 -2.533 -27.717 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.217 -2.871 -25.978 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.036 -4.214 -27.131 1.00 0.00 H new ATOM 877 N GLU A 85 -11.654 -3.290 -29.551 1.00 0.00 N ATOM 878 CA GLU A 85 -11.937 -3.734 -30.949 1.00 0.00 C ATOM 879 C GLU A 85 -11.704 -5.243 -31.065 1.00 0.00 C ATOM 880 O GLU A 85 -10.655 -5.746 -30.710 1.00 0.00 O ATOM 881 CB GLU A 85 -11.007 -2.999 -31.914 1.00 0.00 C ATOM 882 CG GLU A 85 -11.673 -2.896 -33.288 1.00 0.00 C ATOM 883 CD GLU A 85 -10.612 -2.605 -34.351 1.00 0.00 C ATOM 884 OE1 GLU A 85 -9.716 -3.418 -34.504 1.00 0.00 O ATOM 885 OE2 GLU A 85 -10.715 -1.573 -34.995 1.00 0.00 O ATOM 0 H GLU A 85 -10.915 -2.592 -29.462 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.974 -3.508 -31.199 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -10.782 -2.003 -31.532 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -10.059 -3.530 -31.997 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.192 -3.825 -33.522 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -12.423 -2.105 -33.282 1.00 0.00 H new ATOM 892 N GLU A 86 -12.678 -5.966 -31.558 1.00 0.00 N ATOM 893 CA GLU A 86 -12.528 -7.440 -31.699 1.00 0.00 C ATOM 894 C GLU A 86 -11.791 -7.760 -33.004 1.00 0.00 C ATOM 895 O GLU A 86 -12.289 -8.477 -33.854 1.00 0.00 O ATOM 896 CB GLU A 86 -13.915 -8.092 -31.711 1.00 0.00 C ATOM 897 CG GLU A 86 -13.806 -9.533 -31.207 1.00 0.00 C ATOM 898 CD GLU A 86 -13.677 -9.532 -29.683 1.00 0.00 C ATOM 899 OE1 GLU A 86 -12.573 -9.339 -29.201 1.00 0.00 O ATOM 900 OE2 GLU A 86 -14.684 -9.728 -29.022 1.00 0.00 O ATOM 0 H GLU A 86 -13.575 -5.593 -31.870 1.00 0.00 H new ATOM 0 HA GLU A 86 -11.952 -7.831 -30.860 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -14.600 -7.526 -31.080 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -14.326 -8.079 -32.720 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -14.686 -10.102 -31.508 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -12.941 -10.022 -31.655 1.00 0.00 H new ATOM 907 N LEU A 87 -10.604 -7.233 -33.166 1.00 0.00 N ATOM 908 CA LEU A 87 -9.824 -7.501 -34.410 1.00 0.00 C ATOM 909 C LEU A 87 -8.483 -8.139 -34.043 1.00 0.00 C ATOM 910 O LEU A 87 -7.494 -7.457 -33.852 1.00 0.00 O ATOM 911 CB LEU A 87 -9.577 -6.184 -35.152 1.00 0.00 C ATOM 912 CG LEU A 87 -9.459 -6.459 -36.652 1.00 0.00 C ATOM 913 CD1 LEU A 87 -10.855 -6.548 -37.267 1.00 0.00 C ATOM 914 CD2 LEU A 87 -8.681 -5.322 -37.318 1.00 0.00 C ATOM 0 H LEU A 87 -10.141 -6.627 -32.488 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.386 -8.179 -35.052 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.394 -5.488 -34.962 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.665 -5.713 -34.785 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.933 -7.401 -36.808 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.770 -6.744 -38.336 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.411 -7.357 -36.793 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -11.382 -5.606 -37.112 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.596 -5.517 -38.387 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.207 -4.380 -37.161 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.685 -5.258 -36.881 1.00 0.00 H new ATOM 926 N LYS A 88 -8.445 -9.443 -33.944 1.00 0.00 N ATOM 927 CA LYS A 88 -7.172 -10.137 -33.589 1.00 0.00 C ATOM 928 C LYS A 88 -6.413 -10.495 -34.869 1.00 0.00 C ATOM 929 O LYS A 88 -5.204 -10.648 -34.793 1.00 0.00 O ATOM 930 CB LYS A 88 -7.487 -11.415 -32.809 1.00 0.00 C ATOM 931 CG LYS A 88 -6.281 -11.799 -31.949 1.00 0.00 C ATOM 932 CD LYS A 88 -6.404 -13.263 -31.521 1.00 0.00 C ATOM 933 CE LYS A 88 -5.077 -13.733 -30.924 1.00 0.00 C ATOM 934 NZ LYS A 88 -5.091 -13.517 -29.450 1.00 0.00 N ATOM 935 OXT LYS A 88 -7.052 -10.610 -35.901 1.00 0.00 O ATOM 0 H LYS A 88 -9.244 -10.059 -34.094 1.00 0.00 H new ATOM 0 HA LYS A 88 -6.559 -9.478 -32.974 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -8.363 -11.262 -32.178 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -7.728 -12.224 -33.498 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.359 -11.649 -32.510 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -6.228 -11.156 -31.071 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -7.204 -13.373 -30.789 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -6.669 -13.882 -32.378 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -4.920 -14.788 -31.146 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -4.249 -13.186 -31.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.189 -13.837 -29.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -5.222 -12.505 -29.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.872 -14.058 -29.027 1.00 0.00 H new TER 949 LYS A 88 ATOM 950 N ARG B 31 3.701 -11.591 -33.328 1.00 0.00 N ATOM 951 CA ARG B 31 3.535 -10.175 -32.892 1.00 0.00 C ATOM 952 C ARG B 31 2.067 -9.922 -32.533 1.00 0.00 C ATOM 953 O ARG B 31 1.397 -9.105 -33.138 1.00 0.00 O ATOM 954 CB ARG B 31 3.960 -9.240 -34.028 1.00 0.00 C ATOM 955 CG ARG B 31 4.571 -7.968 -33.439 1.00 0.00 C ATOM 956 CD ARG B 31 5.433 -7.278 -34.496 1.00 0.00 C ATOM 957 NE ARG B 31 6.820 -7.836 -34.446 1.00 0.00 N ATOM 958 CZ ARG B 31 7.832 -7.217 -35.023 1.00 0.00 C ATOM 959 NH1 ARG B 31 7.669 -6.087 -35.670 1.00 0.00 N ATOM 960 NH2 ARG B 31 9.023 -7.744 -34.950 1.00 0.00 N ATOM 0 HA ARG B 31 4.157 -9.985 -32.018 1.00 0.00 H new ATOM 0 HB2 ARG B 31 4.683 -9.739 -34.673 1.00 0.00 H new ATOM 0 HB3 ARG B 31 3.100 -8.989 -34.648 1.00 0.00 H new ATOM 0 HG2 ARG B 31 3.782 -7.295 -33.102 1.00 0.00 H new ATOM 0 HG3 ARG B 31 5.175 -8.213 -32.565 1.00 0.00 H new ATOM 0 HD2 ARG B 31 5.004 -7.429 -35.487 1.00 0.00 H new ATOM 0 HD3 ARG B 31 5.455 -6.203 -34.318 1.00 0.00 H new ATOM 0 HE ARG B 31 6.987 -8.714 -33.955 1.00 0.00 H new ATOM 0 HH11 ARG B 31 6.742 -5.666 -35.736 1.00 0.00 H new ATOM 0 HH12 ARG B 31 8.469 -5.630 -36.107 1.00 0.00 H new ATOM 0 HH21 ARG B 31 9.162 -8.623 -34.452 1.00 0.00 H new ATOM 0 HH22 ARG B 31 9.815 -7.277 -35.391 1.00 0.00 H new ATOM 976 N SER B 32 1.563 -10.619 -31.546 1.00 0.00 N ATOM 977 CA SER B 32 0.142 -10.428 -31.137 1.00 0.00 C ATOM 978 C SER B 32 -0.066 -8.996 -30.638 1.00 0.00 C ATOM 979 O SER B 32 -1.161 -8.469 -30.690 1.00 0.00 O ATOM 980 CB SER B 32 -0.202 -11.407 -30.018 1.00 0.00 C ATOM 981 OG SER B 32 0.299 -12.696 -30.350 1.00 0.00 O ATOM 0 H SER B 32 2.078 -11.314 -31.005 1.00 0.00 H new ATOM 0 HA SER B 32 -0.505 -10.609 -31.995 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.230 -11.068 -29.077 1.00 0.00 H new ATOM 0 HB3 SER B 32 -1.282 -11.450 -29.876 1.00 0.00 H new ATOM 0 HG SER B 32 0.081 -13.327 -29.632 1.00 0.00 H new ATOM 987 N ASP B 33 0.977 -8.363 -30.154 1.00 0.00 N ATOM 988 CA ASP B 33 0.841 -6.968 -29.651 1.00 0.00 C ATOM 989 C ASP B 33 0.952 -5.960 -30.805 1.00 0.00 C ATOM 990 O ASP B 33 1.021 -4.768 -30.578 1.00 0.00 O ATOM 991 CB ASP B 33 1.934 -6.680 -28.622 1.00 0.00 C ATOM 992 CG ASP B 33 3.305 -6.991 -29.227 1.00 0.00 C ATOM 993 OD1 ASP B 33 3.877 -6.102 -29.836 1.00 0.00 O ATOM 994 OD2 ASP B 33 3.759 -8.112 -29.072 1.00 0.00 O ATOM 0 H ASP B 33 1.916 -8.757 -30.088 1.00 0.00 H new ATOM 0 HA ASP B 33 -0.140 -6.865 -29.187 1.00 0.00 H new ATOM 0 HB2 ASP B 33 1.890 -5.636 -28.313 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.774 -7.284 -27.729 1.00 0.00 H new ATOM 999 N ALA B 34 0.964 -6.416 -32.037 1.00 0.00 N ATOM 1000 CA ALA B 34 1.056 -5.475 -33.186 1.00 0.00 C ATOM 1001 C ALA B 34 -0.353 -5.101 -33.678 1.00 0.00 C ATOM 1002 O ALA B 34 -0.502 -4.379 -34.646 1.00 0.00 O ATOM 1003 CB ALA B 34 1.830 -6.141 -34.324 1.00 0.00 C ATOM 0 H ALA B 34 0.914 -7.403 -32.290 1.00 0.00 H new ATOM 0 HA ALA B 34 1.573 -4.570 -32.866 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.899 -5.454 -35.168 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.833 -6.397 -33.981 1.00 0.00 H new ATOM 0 HB3 ALA B 34 1.311 -7.047 -34.636 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.386 -5.588 -33.027 1.00 0.00 N ATOM 1010 CA GLU B 35 -2.778 -5.266 -33.460 1.00 0.00 C ATOM 1011 C GLU B 35 -3.208 -3.869 -32.957 1.00 0.00 C ATOM 1012 O GLU B 35 -3.812 -3.129 -33.709 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.747 -6.327 -32.924 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.268 -7.724 -33.334 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.000 -8.166 -34.602 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -5.190 -7.914 -34.694 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -3.358 -8.751 -35.460 1.00 0.00 O ATOM 0 H GLU B 35 -1.320 -6.197 -32.211 1.00 0.00 H new ATOM 0 HA GLU B 35 -2.803 -5.262 -34.550 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.811 -6.259 -31.838 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.749 -6.147 -33.314 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.192 -7.714 -33.508 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.454 -8.434 -32.528 1.00 0.00 H new ATOM 1024 N PRO B 36 -2.907 -3.527 -31.712 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.284 -2.202 -31.122 1.00 0.00 C ATOM 1026 C PRO B 36 -2.248 -1.131 -31.478 1.00 0.00 C ATOM 1027 O PRO B 36 -2.587 -0.002 -31.768 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.294 -2.472 -29.624 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.386 -3.659 -29.370 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.160 -4.367 -30.706 1.00 0.00 C ATOM 0 HA PRO B 36 -4.238 -1.827 -31.493 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.945 -1.598 -29.074 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.306 -2.683 -29.279 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.437 -3.331 -28.946 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.839 -4.339 -28.649 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.099 -4.426 -30.949 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.539 -5.389 -30.683 1.00 0.00 H new ATOM 1038 N HIS B 37 -0.982 -1.480 -31.442 1.00 0.00 N ATOM 1039 CA HIS B 37 0.112 -0.501 -31.763 1.00 0.00 C ATOM 1040 C HIS B 37 0.318 0.493 -30.604 1.00 0.00 C ATOM 1041 O HIS B 37 1.187 1.342 -30.668 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.207 0.272 -33.053 1.00 0.00 C ATOM 1043 CG HIS B 37 1.069 0.585 -33.786 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.352 0.058 -35.036 1.00 0.00 N ATOM 1045 CD2 HIS B 37 2.148 1.370 -33.459 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.554 0.528 -35.413 1.00 0.00 C ATOM 1047 NE2 HIS B 37 3.084 1.332 -34.488 1.00 0.00 N ATOM 0 H HIS B 37 -0.655 -2.415 -31.200 1.00 0.00 H new ATOM 0 HA HIS B 37 1.030 -1.070 -31.908 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.867 -0.319 -33.688 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -0.736 1.195 -32.814 1.00 0.00 H new ATOM 0 HD2 HIS B 37 2.254 1.931 -32.542 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.033 0.285 -36.350 1.00 0.00 H new ATOM 0 HE2 HIS B 37 3.982 1.815 -34.527 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.450 0.390 -29.542 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.267 1.323 -28.389 1.00 0.00 C ATOM 1057 C TYR B 38 0.104 0.510 -27.145 1.00 0.00 C ATOM 1058 O TYR B 38 0.878 0.947 -26.318 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.551 2.124 -28.127 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.765 1.224 -28.189 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.203 0.554 -27.040 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.459 1.072 -29.395 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.334 -0.270 -27.099 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.590 0.249 -29.453 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.028 -0.422 -28.305 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.142 -1.234 -28.361 1.00 0.00 O ATOM 0 H TYR B 38 -1.193 -0.299 -29.427 1.00 0.00 H new ATOM 0 HA TYR B 38 0.530 2.028 -28.624 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.495 2.600 -27.148 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.645 2.921 -28.864 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.669 0.673 -26.109 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.122 1.590 -30.281 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.671 -0.788 -26.213 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.125 0.132 -30.384 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.506 -1.228 -29.271 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.429 -0.683 -27.018 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.101 -1.548 -25.842 1.00 0.00 C ATOM 1078 C LEU B 39 1.431 -1.679 -25.679 1.00 0.00 C ATOM 1079 O LEU B 39 1.948 -1.440 -24.603 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.721 -2.940 -26.050 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.663 -3.288 -24.883 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.907 -3.218 -23.549 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.831 -2.297 -24.861 1.00 0.00 C ATOM 0 H LEU B 39 -1.082 -1.096 -27.684 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.509 -1.093 -24.940 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.272 -2.963 -26.990 1.00 0.00 H new ATOM 0 HB3 LEU B 39 0.068 -3.689 -26.125 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.040 -4.301 -25.021 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.585 -3.466 -22.733 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.080 -3.928 -23.562 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.518 -2.210 -23.404 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.500 -2.541 -24.036 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.447 -1.285 -24.730 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.378 -2.359 -25.802 1.00 0.00 H new ATOM 1095 N PRO B 40 2.128 -2.045 -26.744 1.00 0.00 N ATOM 1096 CA PRO B 40 3.619 -2.198 -26.718 1.00 0.00 C ATOM 1097 C PRO B 40 4.300 -0.822 -26.673 1.00 0.00 C ATOM 1098 O PRO B 40 5.458 -0.704 -26.317 1.00 0.00 O ATOM 1099 CB PRO B 40 3.935 -2.954 -28.001 1.00 0.00 C ATOM 1100 CG PRO B 40 2.788 -2.711 -28.957 1.00 0.00 C ATOM 1101 CD PRO B 40 1.565 -2.346 -28.117 1.00 0.00 C ATOM 0 HA PRO B 40 3.983 -2.729 -25.838 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.874 -2.607 -28.431 1.00 0.00 H new ATOM 0 HB3 PRO B 40 4.050 -4.019 -27.801 1.00 0.00 H new ATOM 0 HG2 PRO B 40 3.031 -1.907 -29.652 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.591 -3.601 -29.555 1.00 0.00 H new ATOM 0 HD2 PRO B 40 1.042 -1.483 -28.530 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.848 -3.166 -28.082 1.00 0.00 H new ATOM 1109 N GLN B 41 3.578 0.222 -27.003 1.00 0.00 N ATOM 1110 CA GLN B 41 4.158 1.591 -26.946 1.00 0.00 C ATOM 1111 C GLN B 41 4.217 2.017 -25.474 1.00 0.00 C ATOM 1112 O GLN B 41 5.105 2.737 -25.055 1.00 0.00 O ATOM 1113 CB GLN B 41 3.250 2.543 -27.756 1.00 0.00 C ATOM 1114 CG GLN B 41 3.571 4.022 -27.466 1.00 0.00 C ATOM 1115 CD GLN B 41 5.043 4.324 -27.764 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.633 3.730 -28.762 1.00 0.00 O flip ATOM 1117 NE2 GLN B 41 5.662 5.113 -27.080 1.00 0.00 N flip ATOM 0 H GLN B 41 2.606 0.179 -27.311 1.00 0.00 H new ATOM 0 HA GLN B 41 5.162 1.619 -27.371 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.374 2.346 -28.821 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.206 2.343 -27.514 1.00 0.00 H new ATOM 0 HG2 GLN B 41 2.933 4.664 -28.073 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.352 4.249 -26.423 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.203 5.580 -26.298 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.641 5.309 -27.287 1.00 0.00 H new ATOM 1126 N LEU B 42 3.261 1.581 -24.695 1.00 0.00 N ATOM 1127 CA LEU B 42 3.224 1.956 -23.262 1.00 0.00 C ATOM 1128 C LEU B 42 4.258 1.144 -22.482 1.00 0.00 C ATOM 1129 O LEU B 42 4.962 1.673 -21.642 1.00 0.00 O ATOM 1130 CB LEU B 42 1.822 1.668 -22.696 1.00 0.00 C ATOM 1131 CG LEU B 42 0.694 2.544 -23.334 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.186 3.463 -24.471 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.398 1.625 -23.894 1.00 0.00 C ATOM 0 H LEU B 42 2.499 0.975 -25.000 1.00 0.00 H new ATOM 0 HA LEU B 42 3.453 3.017 -23.165 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.585 0.616 -22.854 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.834 1.834 -21.619 1.00 0.00 H new ATOM 0 HG LEU B 42 0.319 3.189 -22.539 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.347 4.038 -24.863 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.945 4.144 -24.086 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.614 2.857 -25.269 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.188 2.229 -24.340 1.00 0.00 H new ATOM 0 HD22 LEU B 42 0.031 0.970 -24.653 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.815 1.021 -23.088 1.00 0.00 H new ATOM 1145 N ARG B 43 4.355 -0.138 -22.744 1.00 0.00 N ATOM 1146 CA ARG B 43 5.346 -0.976 -22.007 1.00 0.00 C ATOM 1147 C ARG B 43 6.755 -0.450 -22.284 1.00 0.00 C ATOM 1148 O ARG B 43 7.565 -0.310 -21.386 1.00 0.00 O ATOM 1149 CB ARG B 43 5.222 -2.443 -22.448 1.00 0.00 C ATOM 1150 CG ARG B 43 5.656 -2.619 -23.907 1.00 0.00 C ATOM 1151 CD ARG B 43 5.408 -4.065 -24.341 1.00 0.00 C ATOM 1152 NE ARG B 43 6.162 -4.342 -25.603 1.00 0.00 N ATOM 1153 CZ ARG B 43 7.466 -4.540 -25.596 1.00 0.00 C ATOM 1154 NH1 ARG B 43 8.161 -4.501 -24.483 1.00 0.00 N ATOM 1155 NH2 ARG B 43 8.080 -4.778 -26.723 1.00 0.00 N ATOM 0 H ARG B 43 3.792 -0.636 -23.434 1.00 0.00 H new ATOM 0 HA ARG B 43 5.149 -0.921 -20.936 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.836 -3.073 -21.804 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.191 -2.776 -22.329 1.00 0.00 H new ATOM 0 HG2 ARG B 43 5.100 -1.935 -24.548 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.712 -2.371 -24.016 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.726 -4.751 -23.556 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.342 -4.232 -24.497 1.00 0.00 H new ATOM 0 HE ARG B 43 5.657 -4.379 -26.488 1.00 0.00 H new ATOM 0 HH11 ARG B 43 7.693 -4.314 -23.596 1.00 0.00 H new ATOM 0 HH12 ARG B 43 9.169 -4.658 -24.505 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.552 -4.809 -27.595 1.00 0.00 H new ATOM 0 HH22 ARG B 43 9.088 -4.933 -26.732 1.00 0.00 H new ATOM 1169 N LYS B 44 7.052 -0.143 -23.524 1.00 0.00 N ATOM 1170 CA LYS B 44 8.395 0.384 -23.842 1.00 0.00 C ATOM 1171 C LYS B 44 8.548 1.752 -23.168 1.00 0.00 C ATOM 1172 O LYS B 44 9.628 2.140 -22.769 1.00 0.00 O ATOM 1173 CB LYS B 44 8.570 0.493 -25.363 1.00 0.00 C ATOM 1174 CG LYS B 44 7.646 1.567 -25.943 1.00 0.00 C ATOM 1175 CD LYS B 44 7.938 1.729 -27.435 1.00 0.00 C ATOM 1176 CE LYS B 44 7.409 0.513 -28.201 1.00 0.00 C ATOM 1177 NZ LYS B 44 8.363 0.161 -29.290 1.00 0.00 N ATOM 0 H LYS B 44 6.419 -0.238 -24.318 1.00 0.00 H new ATOM 0 HA LYS B 44 9.167 -0.290 -23.469 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.607 0.734 -25.598 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.353 -0.469 -25.828 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.603 1.287 -25.793 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.799 2.514 -25.425 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.469 2.639 -27.810 1.00 0.00 H new ATOM 0 HD3 LYS B 44 9.011 1.833 -27.596 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.285 -0.332 -27.524 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.427 0.732 -28.620 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 8.005 -0.665 -29.811 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 8.459 0.966 -29.941 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.291 -0.065 -28.879 1.00 0.00 H new ATOM 1191 N ASP B 45 7.459 2.474 -23.022 1.00 0.00 N ATOM 1192 CA ASP B 45 7.525 3.800 -22.360 1.00 0.00 C ATOM 1193 C ASP B 45 7.919 3.603 -20.897 1.00 0.00 C ATOM 1194 O ASP B 45 8.783 4.289 -20.390 1.00 0.00 O ATOM 1195 CB ASP B 45 6.162 4.486 -22.437 1.00 0.00 C ATOM 1196 CG ASP B 45 5.942 5.047 -23.844 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.917 5.434 -24.468 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.800 5.082 -24.274 1.00 0.00 O ATOM 0 H ASP B 45 6.530 2.193 -23.336 1.00 0.00 H new ATOM 0 HA ASP B 45 8.264 4.425 -22.862 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.373 3.775 -22.192 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.107 5.290 -21.703 1.00 0.00 H new ATOM 1203 N ILE B 46 7.301 2.661 -20.211 1.00 0.00 N ATOM 1204 CA ILE B 46 7.660 2.426 -18.778 1.00 0.00 C ATOM 1205 C ILE B 46 9.148 2.057 -18.687 1.00 0.00 C ATOM 1206 O ILE B 46 9.809 2.354 -17.710 1.00 0.00 O ATOM 1207 CB ILE B 46 6.758 1.327 -18.165 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.943 1.328 -16.642 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.084 -0.070 -18.723 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.942 0.366 -15.996 1.00 0.00 C ATOM 0 H ILE B 46 6.571 2.053 -20.582 1.00 0.00 H new ATOM 0 HA ILE B 46 7.492 3.336 -18.201 1.00 0.00 H new ATOM 0 HB ILE B 46 5.724 1.550 -18.430 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.961 1.031 -16.390 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.799 2.335 -16.250 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.426 -0.808 -18.264 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.936 -0.074 -19.803 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.121 -0.319 -18.498 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.078 0.371 -14.915 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.927 0.683 -16.235 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.107 -0.642 -16.378 1.00 0.00 H new ATOM 1222 N LEU B 47 9.680 1.435 -19.715 1.00 0.00 N ATOM 1223 CA LEU B 47 11.120 1.073 -19.709 1.00 0.00 C ATOM 1224 C LEU B 47 11.938 2.363 -19.761 1.00 0.00 C ATOM 1225 O LEU B 47 12.857 2.561 -18.986 1.00 0.00 O ATOM 1226 CB LEU B 47 11.441 0.216 -20.936 1.00 0.00 C ATOM 1227 CG LEU B 47 11.032 -1.234 -20.674 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.042 -2.013 -21.991 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.023 -1.872 -19.699 1.00 0.00 C ATOM 0 H LEU B 47 9.171 1.165 -20.556 1.00 0.00 H new ATOM 0 HA LEU B 47 11.361 0.507 -18.809 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.913 0.601 -21.808 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.507 0.269 -21.160 1.00 0.00 H new ATOM 0 HG LEU B 47 10.030 -1.258 -20.245 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.751 -3.047 -21.805 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.339 -1.558 -22.688 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.044 -1.990 -22.420 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.734 -2.906 -19.511 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.024 -1.848 -20.130 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.019 -1.317 -18.761 1.00 0.00 H new ATOM 1241 N GLU B 48 11.591 3.250 -20.660 1.00 0.00 N ATOM 1242 CA GLU B 48 12.324 4.541 -20.761 1.00 0.00 C ATOM 1243 C GLU B 48 12.052 5.341 -19.506 1.00 0.00 C ATOM 1244 O GLU B 48 12.928 5.992 -18.968 1.00 0.00 O ATOM 1245 CB GLU B 48 11.834 5.354 -21.958 1.00 0.00 C ATOM 1246 CG GLU B 48 11.847 4.500 -23.215 1.00 0.00 C ATOM 1247 CD GLU B 48 13.283 4.088 -23.552 1.00 0.00 C ATOM 1248 OE1 GLU B 48 13.942 4.834 -24.257 1.00 0.00 O ATOM 1249 OE2 GLU B 48 13.697 3.034 -23.100 1.00 0.00 O ATOM 0 H GLU B 48 10.829 3.132 -21.328 1.00 0.00 H new ATOM 0 HA GLU B 48 13.387 4.334 -20.883 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.825 5.720 -21.769 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.470 6.228 -22.097 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.230 3.613 -23.069 1.00 0.00 H new ATOM 0 HG3 GLU B 48 11.414 5.056 -24.047 1.00 0.00 H new ATOM 1256 N VAL B 49 10.830 5.298 -19.030 1.00 0.00 N ATOM 1257 CA VAL B 49 10.489 6.058 -17.802 1.00 0.00 C ATOM 1258 C VAL B 49 11.399 5.582 -16.666 1.00 0.00 C ATOM 1259 O VAL B 49 12.117 6.358 -16.074 1.00 0.00 O ATOM 1260 CB VAL B 49 9.015 5.841 -17.430 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.665 6.692 -16.206 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.119 6.253 -18.606 1.00 0.00 C ATOM 0 H VAL B 49 10.061 4.769 -19.442 1.00 0.00 H new ATOM 0 HA VAL B 49 10.639 7.124 -17.975 1.00 0.00 H new ATOM 0 HB VAL B 49 8.854 4.787 -17.202 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.619 6.537 -15.943 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.297 6.400 -15.367 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.830 7.745 -16.436 1.00 0.00 H new ATOM 0 HG21 VAL B 49 7.074 6.098 -18.339 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.282 7.306 -18.836 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.364 5.648 -19.479 1.00 0.00 H new ATOM 1272 N ILE B 50 11.412 4.297 -16.388 1.00 0.00 N ATOM 1273 CA ILE B 50 12.317 3.769 -15.315 1.00 0.00 C ATOM 1274 C ILE B 50 13.759 4.202 -15.624 1.00 0.00 C ATOM 1275 O ILE B 50 14.582 4.325 -14.737 1.00 0.00 O ATOM 1276 CB ILE B 50 12.229 2.238 -15.262 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.779 1.815 -15.007 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.112 1.709 -14.127 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.552 0.408 -15.566 1.00 0.00 C ATOM 0 H ILE B 50 10.838 3.595 -16.855 1.00 0.00 H new ATOM 0 HA ILE B 50 12.013 4.168 -14.347 1.00 0.00 H new ATOM 0 HB ILE B 50 12.570 1.828 -16.213 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.567 1.832 -13.938 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.095 2.520 -15.479 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.047 0.621 -14.092 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.146 2.005 -14.302 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.772 2.123 -13.178 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.520 0.107 -15.385 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.747 0.407 -16.638 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.226 -0.292 -15.073 1.00 0.00 H new ATOM 1291 N CYS B 51 14.057 4.452 -16.878 1.00 0.00 N ATOM 1292 CA CYS B 51 15.424 4.897 -17.254 1.00 0.00 C ATOM 1293 C CYS B 51 15.611 6.358 -16.832 1.00 0.00 C ATOM 1294 O CYS B 51 16.606 6.720 -16.242 1.00 0.00 O ATOM 1295 CB CYS B 51 15.605 4.771 -18.770 1.00 0.00 C ATOM 1296 SG CYS B 51 17.370 4.796 -19.170 1.00 0.00 S ATOM 0 H CYS B 51 13.404 4.364 -17.656 1.00 0.00 H new ATOM 0 HA CYS B 51 16.164 4.274 -16.752 1.00 0.00 H new ATOM 0 HB2 CYS B 51 15.154 3.845 -19.125 1.00 0.00 H new ATOM 0 HB3 CYS B 51 15.094 5.589 -19.277 1.00 0.00 H new ATOM 0 HG CYS B 51 17.525 4.687 -20.456 1.00 0.00 H new ATOM 1302 N LYS B 52 14.652 7.200 -17.126 1.00 0.00 N ATOM 1303 CA LYS B 52 14.768 8.646 -16.744 1.00 0.00 C ATOM 1304 C LYS B 52 15.002 8.771 -15.235 1.00 0.00 C ATOM 1305 O LYS B 52 15.613 9.713 -14.767 1.00 0.00 O ATOM 1306 CB LYS B 52 13.474 9.394 -17.087 1.00 0.00 C ATOM 1307 CG LYS B 52 13.119 9.218 -18.564 1.00 0.00 C ATOM 1308 CD LYS B 52 11.597 9.297 -18.720 1.00 0.00 C ATOM 1309 CE LYS B 52 11.195 10.723 -19.100 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.535 10.971 -20.529 1.00 0.00 N ATOM 0 H LYS B 52 13.792 6.951 -17.614 1.00 0.00 H new ATOM 0 HA LYS B 52 15.604 9.075 -17.295 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.659 9.023 -16.466 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.590 10.454 -16.860 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.600 9.992 -19.162 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.486 8.259 -18.928 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.263 8.597 -19.486 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.110 9.007 -17.789 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.126 10.866 -18.939 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.712 11.440 -18.462 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 10.955 11.754 -20.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.542 11.220 -20.608 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 11.346 10.113 -21.085 1.00 0.00 H new ATOM 1324 N TYR B 53 14.496 7.836 -14.475 1.00 0.00 N ATOM 1325 CA TYR B 53 14.650 7.890 -13.001 1.00 0.00 C ATOM 1326 C TYR B 53 15.743 6.908 -12.546 1.00 0.00 C ATOM 1327 O TYR B 53 16.271 7.027 -11.457 1.00 0.00 O ATOM 1328 CB TYR B 53 13.322 7.483 -12.352 1.00 0.00 C ATOM 1329 CG TYR B 53 12.210 8.458 -12.703 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.794 8.615 -14.033 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.572 9.186 -11.691 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.751 9.490 -14.350 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.529 10.067 -12.011 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.118 10.215 -13.343 1.00 0.00 C ATOM 1335 OH TYR B 53 9.089 11.080 -13.656 1.00 0.00 O ATOM 0 H TYR B 53 13.977 7.029 -14.822 1.00 0.00 H new ATOM 0 HA TYR B 53 14.929 8.901 -12.705 1.00 0.00 H new ATOM 0 HB2 TYR B 53 13.047 6.481 -12.681 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.442 7.441 -11.269 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.283 8.056 -14.817 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.883 9.069 -10.664 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.436 9.604 -15.377 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.042 10.632 -11.230 1.00 0.00 H new ATOM 0 HH TYR B 53 8.758 11.505 -12.837 1.00 0.00 H new ATOM 1345 N VAL B 54 16.071 5.926 -13.358 1.00 0.00 N ATOM 1346 CA VAL B 54 17.115 4.923 -12.956 1.00 0.00 C ATOM 1347 C VAL B 54 17.804 4.394 -14.237 1.00 0.00 C ATOM 1348 O VAL B 54 18.091 5.162 -15.132 1.00 0.00 O ATOM 1349 CB VAL B 54 16.465 3.762 -12.160 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.525 3.107 -11.270 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.325 4.270 -11.267 1.00 0.00 C ATOM 0 H VAL B 54 15.662 5.776 -14.280 1.00 0.00 H new ATOM 0 HA VAL B 54 17.857 5.392 -12.310 1.00 0.00 H new ATOM 0 HB VAL B 54 16.060 3.045 -12.874 1.00 0.00 H new ATOM 0 HG11 VAL B 54 17.073 2.290 -10.708 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.332 2.718 -11.891 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.925 3.847 -10.577 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.889 3.433 -10.722 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.716 5.000 -10.559 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.559 4.738 -11.886 1.00 0.00 H new ATOM 1361 N GLN B 55 18.084 3.107 -14.348 1.00 0.00 N ATOM 1362 CA GLN B 55 18.745 2.590 -15.582 1.00 0.00 C ATOM 1363 C GLN B 55 18.657 1.063 -15.605 1.00 0.00 C ATOM 1364 O GLN B 55 19.259 0.381 -14.798 1.00 0.00 O ATOM 1365 CB GLN B 55 20.213 3.026 -15.601 1.00 0.00 C ATOM 1366 CG GLN B 55 20.440 4.046 -16.720 1.00 0.00 C ATOM 1367 CD GLN B 55 21.887 4.542 -16.675 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.393 4.872 -15.622 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.576 4.607 -17.780 1.00 0.00 N ATOM 0 H GLN B 55 17.881 2.404 -13.637 1.00 0.00 H new ATOM 0 HA GLN B 55 18.242 2.993 -16.461 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.484 3.462 -14.639 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.857 2.159 -15.751 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.230 3.592 -17.688 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.753 4.885 -16.606 1.00 0.00 H new ATOM 0 HE21 GLN B 55 22.150 4.329 -18.664 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.541 4.935 -17.760 1.00 0.00 H new ATOM 1378 N ILE B 56 17.908 0.531 -16.530 1.00 0.00 N ATOM 1379 CA ILE B 56 17.759 -0.952 -16.635 1.00 0.00 C ATOM 1380 C ILE B 56 17.755 -1.352 -18.107 1.00 0.00 C ATOM 1381 O ILE B 56 17.595 -0.525 -18.985 1.00 0.00 O ATOM 1382 CB ILE B 56 16.443 -1.408 -15.990 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.323 -0.407 -16.305 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.623 -1.518 -14.477 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.016 -1.163 -16.545 1.00 0.00 C ATOM 0 H ILE B 56 17.386 1.064 -17.226 1.00 0.00 H new ATOM 0 HA ILE B 56 18.592 -1.426 -16.115 1.00 0.00 H new ATOM 0 HB ILE B 56 16.170 -2.382 -16.395 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.204 0.294 -15.478 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.583 0.180 -17.186 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.687 -1.842 -14.022 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.405 -2.245 -14.255 1.00 0.00 H new ATOM 0 HG23 ILE B 56 16.906 -0.546 -14.073 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.220 -0.452 -16.769 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.140 -1.846 -17.386 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.755 -1.731 -15.652 1.00 0.00 H new ATOM 1397 N ASP B 57 17.918 -2.617 -18.378 1.00 0.00 N ATOM 1398 CA ASP B 57 17.913 -3.093 -19.790 1.00 0.00 C ATOM 1399 C ASP B 57 16.539 -3.705 -20.092 1.00 0.00 C ATOM 1400 O ASP B 57 15.824 -4.062 -19.176 1.00 0.00 O ATOM 1401 CB ASP B 57 19.004 -4.153 -19.971 1.00 0.00 C ATOM 1402 CG ASP B 57 20.345 -3.591 -19.499 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.482 -3.359 -18.309 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.214 -3.404 -20.334 1.00 0.00 O ATOM 0 H ASP B 57 18.055 -3.346 -17.678 1.00 0.00 H new ATOM 0 HA ASP B 57 18.107 -2.264 -20.470 1.00 0.00 H new ATOM 0 HB2 ASP B 57 18.753 -5.049 -19.403 1.00 0.00 H new ATOM 0 HB3 ASP B 57 19.070 -4.447 -21.018 1.00 0.00 H new ATOM 1409 N PRO B 58 16.192 -3.822 -21.358 1.00 0.00 N ATOM 1410 CA PRO B 58 14.880 -4.408 -21.780 1.00 0.00 C ATOM 1411 C PRO B 58 14.904 -5.917 -21.566 1.00 0.00 C ATOM 1412 O PRO B 58 13.893 -6.527 -21.270 1.00 0.00 O ATOM 1413 CB PRO B 58 14.767 -4.039 -23.252 1.00 0.00 C ATOM 1414 CG PRO B 58 16.177 -3.805 -23.755 1.00 0.00 C ATOM 1415 CD PRO B 58 17.029 -3.414 -22.547 1.00 0.00 C ATOM 0 HA PRO B 58 14.027 -4.037 -21.212 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.284 -4.838 -23.815 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.157 -3.145 -23.380 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.571 -4.704 -24.229 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.191 -3.016 -24.507 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.990 -3.929 -22.554 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.240 -2.345 -22.538 1.00 0.00 H new ATOM 1423 N GLU B 59 16.061 -6.517 -21.671 1.00 0.00 N ATOM 1424 CA GLU B 59 16.169 -7.981 -21.429 1.00 0.00 C ATOM 1425 C GLU B 59 15.902 -8.266 -19.942 1.00 0.00 C ATOM 1426 O GLU B 59 15.674 -9.398 -19.555 1.00 0.00 O ATOM 1427 CB GLU B 59 17.576 -8.458 -21.796 1.00 0.00 C ATOM 1428 CG GLU B 59 17.787 -8.313 -23.304 1.00 0.00 C ATOM 1429 CD GLU B 59 18.927 -9.229 -23.750 1.00 0.00 C ATOM 1430 OE1 GLU B 59 19.979 -9.177 -23.133 1.00 0.00 O ATOM 1431 OE2 GLU B 59 18.730 -9.968 -24.701 1.00 0.00 O ATOM 0 H GLU B 59 16.936 -6.053 -21.915 1.00 0.00 H new ATOM 0 HA GLU B 59 15.439 -8.509 -22.042 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.322 -7.874 -21.256 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.708 -9.498 -21.498 1.00 0.00 H new ATOM 0 HG2 GLU B 59 16.871 -8.569 -23.836 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.020 -7.277 -23.551 1.00 0.00 H new ATOM 1438 N MET B 60 15.919 -7.247 -19.103 1.00 0.00 N ATOM 1439 CA MET B 60 15.662 -7.457 -17.653 1.00 0.00 C ATOM 1440 C MET B 60 14.160 -7.324 -17.378 1.00 0.00 C ATOM 1441 O MET B 60 13.649 -7.866 -16.415 1.00 0.00 O ATOM 1442 CB MET B 60 16.432 -6.407 -16.846 1.00 0.00 C ATOM 1443 CG MET B 60 17.893 -6.839 -16.718 1.00 0.00 C ATOM 1444 SD MET B 60 18.915 -5.404 -16.302 1.00 0.00 S ATOM 1445 CE MET B 60 18.429 -5.280 -14.564 1.00 0.00 C ATOM 0 H MET B 60 16.101 -6.280 -19.372 1.00 0.00 H new ATOM 0 HA MET B 60 15.994 -8.453 -17.360 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.370 -5.436 -17.338 1.00 0.00 H new ATOM 0 HB3 MET B 60 15.987 -6.293 -15.858 1.00 0.00 H new ATOM 0 HG2 MET B 60 17.991 -7.604 -15.947 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.235 -7.283 -17.653 1.00 0.00 H new ATOM 0 HE1 MET B 60 19.294 -5.000 -13.963 1.00 0.00 H new ATOM 0 HE2 MET B 60 17.653 -4.523 -14.456 1.00 0.00 H new ATOM 0 HE3 MET B 60 18.047 -6.242 -14.224 1.00 0.00 H new ATOM 1455 N VAL B 61 13.449 -6.607 -18.215 1.00 0.00 N ATOM 1456 CA VAL B 61 11.983 -6.439 -18.004 1.00 0.00 C ATOM 1457 C VAL B 61 11.225 -7.444 -18.876 1.00 0.00 C ATOM 1458 O VAL B 61 11.335 -7.430 -20.088 1.00 0.00 O ATOM 1459 CB VAL B 61 11.575 -5.014 -18.388 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.105 -4.787 -18.034 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.444 -4.012 -17.622 1.00 0.00 C ATOM 0 H VAL B 61 13.825 -6.132 -19.035 1.00 0.00 H new ATOM 0 HA VAL B 61 11.741 -6.615 -16.956 1.00 0.00 H new ATOM 0 HB VAL B 61 11.714 -4.874 -19.460 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.817 -3.772 -18.308 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.485 -5.500 -18.578 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.963 -4.927 -16.962 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.155 -2.997 -17.894 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.304 -4.154 -16.550 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.492 -4.171 -17.876 1.00 0.00 H new ATOM 1471 N THR B 62 10.464 -8.322 -18.269 1.00 0.00 N ATOM 1472 CA THR B 62 9.708 -9.336 -19.055 1.00 0.00 C ATOM 1473 C THR B 62 8.328 -8.785 -19.424 1.00 0.00 C ATOM 1474 O THR B 62 7.835 -7.857 -18.814 1.00 0.00 O ATOM 1475 CB THR B 62 9.529 -10.609 -18.222 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.721 -10.866 -17.491 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.237 -11.788 -19.151 1.00 0.00 C ATOM 0 H THR B 62 10.336 -8.377 -17.259 1.00 0.00 H new ATOM 0 HA THR B 62 10.266 -9.565 -19.963 1.00 0.00 H new ATOM 0 HB THR B 62 8.698 -10.478 -17.529 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.608 -11.679 -16.956 1.00 0.00 H new ATOM 0 HG21 THR B 62 9.109 -12.695 -18.559 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.325 -11.591 -19.714 1.00 0.00 H new ATOM 0 HG23 THR B 62 10.069 -11.921 -19.843 1.00 0.00 H new ATOM 1485 N VAL B 63 7.706 -9.363 -20.418 1.00 0.00 N ATOM 1486 CA VAL B 63 6.355 -8.898 -20.841 1.00 0.00 C ATOM 1487 C VAL B 63 5.513 -10.116 -21.220 1.00 0.00 C ATOM 1488 O VAL B 63 5.952 -10.971 -21.968 1.00 0.00 O ATOM 1489 CB VAL B 63 6.490 -7.973 -22.047 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.125 -7.375 -22.391 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.469 -6.845 -21.717 1.00 0.00 C ATOM 0 H VAL B 63 8.080 -10.143 -20.958 1.00 0.00 H new ATOM 0 HA VAL B 63 5.875 -8.355 -20.026 1.00 0.00 H new ATOM 0 HB VAL B 63 6.862 -8.542 -22.899 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.224 -6.715 -23.253 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.425 -8.177 -22.627 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.752 -6.807 -21.539 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.566 -6.184 -22.578 1.00 0.00 H new ATOM 0 HG22 VAL B 63 7.096 -6.278 -20.864 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.443 -7.269 -21.473 1.00 0.00 H new ATOM 1501 N GLN B 64 4.316 -10.210 -20.703 1.00 0.00 N ATOM 1502 CA GLN B 64 3.451 -11.380 -21.024 1.00 0.00 C ATOM 1503 C GLN B 64 1.984 -10.947 -21.067 1.00 0.00 C ATOM 1504 O GLN B 64 1.517 -10.228 -20.206 1.00 0.00 O ATOM 1505 CB GLN B 64 3.650 -12.458 -19.951 1.00 0.00 C ATOM 1506 CG GLN B 64 3.435 -11.856 -18.554 1.00 0.00 C ATOM 1507 CD GLN B 64 4.787 -11.634 -17.871 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.461 -10.659 -18.134 1.00 0.00 O ATOM 1509 NE2 GLN B 64 5.213 -12.507 -16.998 1.00 0.00 N ATOM 0 H GLN B 64 3.901 -9.525 -20.071 1.00 0.00 H new ATOM 0 HA GLN B 64 3.724 -11.782 -22.000 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.951 -13.278 -20.114 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.654 -12.876 -20.025 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.898 -10.911 -18.634 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.818 -12.523 -17.952 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.646 -13.326 -16.777 1.00 0.00 H new ATOM 0 HE22 GLN B 64 6.112 -12.370 -16.537 1.00 0.00 H new ATOM 1518 N LEU B 65 1.257 -11.371 -22.072 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.170 -10.979 -22.180 1.00 0.00 C ATOM 1520 C LEU B 65 -1.073 -12.164 -21.836 1.00 0.00 C ATOM 1521 O LEU B 65 -0.705 -13.311 -22.004 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.459 -10.518 -23.605 1.00 0.00 C ATOM 1523 CG LEU B 65 -0.023 -11.598 -24.600 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.029 -11.665 -25.751 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.361 -11.252 -25.151 1.00 0.00 C ATOM 0 H LEU B 65 1.598 -11.973 -22.821 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.370 -10.168 -21.480 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.523 -10.312 -23.721 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.070 -9.587 -23.810 1.00 0.00 H new ATOM 0 HG LEU B 65 0.017 -12.564 -24.096 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.720 -12.433 -26.460 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.016 -11.910 -25.358 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.069 -10.700 -26.256 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.673 -12.020 -25.859 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.321 -10.287 -25.656 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.077 -11.203 -24.331 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.256 -11.881 -21.361 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.213 -12.965 -21.003 1.00 0.00 C ATOM 1539 C GLU B 66 -4.632 -12.485 -21.305 1.00 0.00 C ATOM 1540 O GLU B 66 -4.837 -11.349 -21.683 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.084 -13.293 -19.508 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.820 -14.118 -19.249 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.874 -15.432 -20.037 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.781 -16.209 -19.792 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -1.007 -15.636 -20.871 1.00 0.00 O ATOM 0 H GLU B 66 -2.603 -10.935 -21.204 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.994 -13.862 -21.583 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -3.049 -12.370 -18.929 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.962 -13.846 -19.174 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.938 -13.547 -19.540 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.726 -14.328 -18.184 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.610 -13.339 -21.149 1.00 0.00 N ATOM 1553 CA GLN B 67 -7.019 -12.929 -21.433 1.00 0.00 C ATOM 1554 C GLN B 67 -7.967 -13.665 -20.483 1.00 0.00 C ATOM 1555 O GLN B 67 -7.654 -14.729 -19.984 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.373 -13.290 -22.879 1.00 0.00 C ATOM 1557 CG GLN B 67 -7.005 -12.132 -23.809 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.890 -12.646 -25.245 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.785 -12.458 -26.044 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.816 -13.293 -25.609 1.00 0.00 N ATOM 0 H GLN B 67 -5.495 -14.303 -20.837 1.00 0.00 H new ATOM 0 HA GLN B 67 -7.119 -11.853 -21.288 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.840 -14.192 -23.179 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.438 -13.508 -22.959 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -7.763 -11.350 -23.751 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -6.062 -11.685 -23.495 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -5.064 -13.451 -24.938 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.729 -13.640 -26.564 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.126 -13.107 -20.237 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.104 -13.771 -19.323 1.00 0.00 C ATOM 1571 C LYS B 68 -11.276 -14.318 -20.141 1.00 0.00 C ATOM 1572 O LYS B 68 -11.360 -14.110 -21.337 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.629 -12.761 -18.303 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.644 -12.635 -17.134 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.446 -11.158 -16.776 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.770 -10.558 -16.293 1.00 0.00 C ATOM 1577 NZ LYS B 68 -11.024 -10.984 -14.888 1.00 0.00 N ATOM 0 H LYS B 68 -9.437 -12.219 -20.631 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.607 -14.588 -18.800 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.768 -11.790 -18.779 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.605 -13.078 -17.935 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -10.021 -13.181 -16.269 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.688 -13.085 -17.402 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.688 -11.061 -15.999 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.083 -10.609 -17.645 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.732 -9.470 -16.354 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.586 -10.885 -16.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.878 -10.510 -14.531 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.161 -12.014 -14.857 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.210 -10.725 -14.294 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.182 -15.013 -19.501 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.353 -15.578 -20.225 1.00 0.00 C ATOM 1593 C ASP B 69 -14.425 -14.497 -20.444 1.00 0.00 C ATOM 1594 O ASP B 69 -15.400 -14.723 -21.137 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.952 -16.723 -19.407 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.221 -18.026 -19.740 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -13.378 -18.502 -20.852 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -12.516 -18.524 -18.878 1.00 0.00 O ATOM 0 H ASP B 69 -12.157 -15.213 -18.501 1.00 0.00 H new ATOM 0 HA ASP B 69 -13.020 -15.946 -21.195 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -13.866 -16.507 -18.342 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -15.015 -16.824 -19.627 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.263 -13.329 -19.860 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.282 -12.251 -20.040 1.00 0.00 C ATOM 1605 C GLY B 70 -14.833 -11.286 -21.139 1.00 0.00 C ATOM 1606 O GLY B 70 -15.129 -10.107 -21.096 1.00 0.00 O ATOM 0 H GLY B 70 -13.470 -13.080 -19.269 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.245 -12.689 -20.301 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.421 -11.710 -19.104 1.00 0.00 H new ATOM 1610 N ASP B 71 -14.118 -11.779 -22.120 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.638 -10.902 -23.233 1.00 0.00 C ATOM 1612 C ASP B 71 -12.762 -9.786 -22.661 1.00 0.00 C ATOM 1613 O ASP B 71 -12.954 -8.617 -22.945 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.839 -10.298 -23.970 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.406 -11.328 -24.949 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -15.660 -12.444 -24.524 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -15.577 -10.985 -26.107 1.00 0.00 O ATOM 0 H ASP B 71 -13.844 -12.758 -22.198 1.00 0.00 H new ATOM 0 HA ASP B 71 -13.052 -11.494 -23.936 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.606 -9.999 -23.255 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.536 -9.399 -24.506 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.809 -10.147 -21.846 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.915 -9.128 -21.229 1.00 0.00 C ATOM 1624 C ILE B 72 -9.454 -9.524 -21.466 1.00 0.00 C ATOM 1625 O ILE B 72 -9.155 -10.666 -21.761 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.197 -9.054 -19.725 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.723 -8.962 -19.502 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.490 -7.827 -19.144 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.052 -8.660 -18.033 1.00 0.00 C ATOM 0 H ILE B 72 -11.610 -11.111 -21.580 1.00 0.00 H new ATOM 0 HA ILE B 72 -11.100 -8.153 -21.679 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.822 -9.946 -19.223 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.140 -8.182 -20.139 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.194 -9.900 -19.798 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.686 -7.767 -18.073 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.416 -7.912 -19.312 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.864 -6.927 -19.632 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.133 -8.601 -17.907 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.656 -9.454 -17.401 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.601 -7.710 -17.747 1.00 0.00 H new ATOM 1641 N SER B 73 -8.546 -8.588 -21.343 1.00 0.00 N ATOM 1642 CA SER B 73 -7.104 -8.903 -21.564 1.00 0.00 C ATOM 1643 C SER B 73 -6.329 -8.682 -20.267 1.00 0.00 C ATOM 1644 O SER B 73 -6.820 -8.077 -19.332 1.00 0.00 O ATOM 1645 CB SER B 73 -6.545 -7.990 -22.654 1.00 0.00 C ATOM 1646 OG SER B 73 -6.927 -8.491 -23.928 1.00 0.00 O ATOM 0 H SER B 73 -8.743 -7.618 -21.098 1.00 0.00 H new ATOM 0 HA SER B 73 -7.003 -9.943 -21.874 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.920 -6.975 -22.522 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.459 -7.940 -22.581 1.00 0.00 H new ATOM 0 HG SER B 73 -6.571 -7.906 -24.629 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.125 -9.184 -20.204 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.300 -9.031 -18.973 1.00 0.00 C ATOM 1654 C ILE B 74 -2.818 -8.969 -19.371 1.00 0.00 C ATOM 1655 O ILE B 74 -2.153 -9.982 -19.468 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.562 -10.241 -18.056 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -6.023 -10.201 -17.575 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.605 -10.217 -16.851 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.304 -11.356 -16.603 1.00 0.00 C ATOM 0 H ILE B 74 -4.674 -9.698 -20.961 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.561 -8.115 -18.443 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.387 -11.161 -18.613 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.224 -9.249 -17.084 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.695 -10.267 -18.431 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.802 -11.078 -16.212 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.574 -10.256 -17.204 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.759 -9.300 -16.282 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.342 -11.310 -16.274 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -6.124 -12.306 -17.105 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.646 -11.272 -15.738 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.303 -7.787 -19.605 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.874 -7.654 -20.001 1.00 0.00 C ATOM 1673 C LEU B 75 -0.003 -7.453 -18.763 1.00 0.00 C ATOM 1674 O LEU B 75 0.013 -6.395 -18.165 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.709 -6.465 -20.948 1.00 0.00 C ATOM 1676 CG LEU B 75 0.674 -6.525 -21.608 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.559 -6.130 -23.083 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.625 -5.559 -20.895 1.00 0.00 C ATOM 0 H LEU B 75 -2.816 -6.908 -19.538 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.561 -8.566 -20.510 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.488 -6.482 -21.710 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.821 -5.530 -20.398 1.00 0.00 H new ATOM 0 HG LEU B 75 1.064 -7.540 -21.534 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.543 -6.174 -23.549 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -0.115 -6.819 -23.593 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.166 -5.116 -23.159 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.608 -5.603 -21.365 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.233 -4.544 -20.966 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.712 -5.842 -19.846 1.00 0.00 H new ATOM 1690 N GLU B 76 0.729 -8.468 -18.388 1.00 0.00 N ATOM 1691 CA GLU B 76 1.618 -8.365 -17.199 1.00 0.00 C ATOM 1692 C GLU B 76 3.059 -8.184 -17.675 1.00 0.00 C ATOM 1693 O GLU B 76 3.455 -8.742 -18.680 1.00 0.00 O ATOM 1694 CB GLU B 76 1.523 -9.654 -16.370 1.00 0.00 C ATOM 1695 CG GLU B 76 0.055 -10.000 -16.094 1.00 0.00 C ATOM 1696 CD GLU B 76 -0.058 -11.481 -15.731 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.645 -11.905 -14.828 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.846 -12.167 -16.362 1.00 0.00 O ATOM 0 H GLU B 76 0.748 -9.372 -18.861 1.00 0.00 H new ATOM 0 HA GLU B 76 1.313 -7.516 -16.586 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.003 -10.474 -16.904 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.058 -9.530 -15.428 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.328 -9.384 -15.280 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.553 -9.782 -16.972 1.00 0.00 H new ATOM 1705 N LEU B 77 3.846 -7.420 -16.965 1.00 0.00 N ATOM 1706 CA LEU B 77 5.265 -7.219 -17.381 1.00 0.00 C ATOM 1707 C LEU B 77 6.167 -7.284 -16.149 1.00 0.00 C ATOM 1708 O LEU B 77 5.922 -6.633 -15.153 1.00 0.00 O ATOM 1709 CB LEU B 77 5.427 -5.861 -18.077 1.00 0.00 C ATOM 1710 CG LEU B 77 4.807 -4.750 -17.229 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.502 -3.424 -17.543 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.317 -4.628 -17.556 1.00 0.00 C ATOM 0 H LEU B 77 3.568 -6.927 -16.116 1.00 0.00 H new ATOM 0 HA LEU B 77 5.548 -8.004 -18.082 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.484 -5.654 -18.242 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.950 -5.888 -19.057 1.00 0.00 H new ATOM 0 HG LEU B 77 4.930 -4.989 -16.173 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.061 -2.630 -16.939 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.564 -3.507 -17.314 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.376 -3.189 -18.600 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.875 -3.836 -16.951 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.195 -4.389 -18.612 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.818 -5.572 -17.338 1.00 0.00 H new ATOM 1724 N ASN B 78 7.204 -8.072 -16.210 1.00 0.00 N ATOM 1725 CA ASN B 78 8.127 -8.190 -15.055 1.00 0.00 C ATOM 1726 C ASN B 78 9.219 -7.139 -15.194 1.00 0.00 C ATOM 1727 O ASN B 78 9.665 -6.849 -16.286 1.00 0.00 O ATOM 1728 CB ASN B 78 8.774 -9.574 -15.059 1.00 0.00 C ATOM 1729 CG ASN B 78 7.716 -10.673 -15.254 1.00 0.00 C ATOM 1730 OD1 ASN B 78 8.009 -11.716 -15.804 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.494 -10.489 -14.824 1.00 0.00 N ATOM 0 H ASN B 78 7.451 -8.643 -17.019 1.00 0.00 H new ATOM 0 HA ASN B 78 7.575 -8.045 -14.126 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.515 -9.631 -15.856 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.303 -9.735 -14.120 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.793 -11.219 -14.951 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.242 -9.615 -14.362 1.00 0.00 H new ATOM 1738 N VAL B 79 9.649 -6.564 -14.103 1.00 0.00 N ATOM 1739 CA VAL B 79 10.718 -5.527 -14.181 1.00 0.00 C ATOM 1740 C VAL B 79 11.889 -5.936 -13.287 1.00 0.00 C ATOM 1741 O VAL B 79 11.957 -5.567 -12.129 1.00 0.00 O ATOM 1742 CB VAL B 79 10.161 -4.182 -13.721 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.185 -3.088 -14.018 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.861 -3.883 -14.477 1.00 0.00 C ATOM 0 H VAL B 79 9.307 -6.767 -13.164 1.00 0.00 H new ATOM 0 HA VAL B 79 11.064 -5.437 -15.211 1.00 0.00 H new ATOM 0 HB VAL B 79 9.958 -4.215 -12.651 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.793 -2.125 -13.692 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.111 -3.302 -13.485 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.382 -3.055 -15.090 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.462 -2.923 -14.149 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.063 -3.846 -15.547 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.132 -4.667 -14.272 1.00 0.00 H new ATOM 1754 N THR B 80 12.810 -6.697 -13.821 1.00 0.00 N ATOM 1755 CA THR B 80 13.983 -7.143 -13.015 1.00 0.00 C ATOM 1756 C THR B 80 14.950 -5.974 -12.820 1.00 0.00 C ATOM 1757 O THR B 80 15.796 -5.716 -13.655 1.00 0.00 O ATOM 1758 CB THR B 80 14.704 -8.282 -13.747 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.792 -9.348 -13.973 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.878 -8.784 -12.899 1.00 0.00 C ATOM 0 H THR B 80 12.799 -7.029 -14.785 1.00 0.00 H new ATOM 0 HA THR B 80 13.638 -7.494 -12.042 1.00 0.00 H new ATOM 0 HB THR B 80 15.083 -7.915 -14.701 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.399 -9.259 -14.866 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.386 -9.593 -13.424 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.578 -7.967 -12.727 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.505 -9.150 -11.942 1.00 0.00 H new ATOM 1768 N LEU B 81 14.843 -5.280 -11.716 1.00 0.00 N ATOM 1769 CA LEU B 81 15.766 -4.147 -11.452 1.00 0.00 C ATOM 1770 C LEU B 81 17.067 -4.717 -10.862 1.00 0.00 C ATOM 1771 O LEU B 81 17.016 -5.646 -10.083 1.00 0.00 O ATOM 1772 CB LEU B 81 15.118 -3.193 -10.448 1.00 0.00 C ATOM 1773 CG LEU B 81 14.066 -2.338 -11.158 1.00 0.00 C ATOM 1774 CD1 LEU B 81 12.904 -2.059 -10.203 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.696 -1.012 -11.592 1.00 0.00 C ATOM 0 H LEU B 81 14.152 -5.454 -10.986 1.00 0.00 H new ATOM 0 HA LEU B 81 15.979 -3.603 -12.372 1.00 0.00 H new ATOM 0 HB2 LEU B 81 14.656 -3.759 -9.639 1.00 0.00 H new ATOM 0 HB3 LEU B 81 15.877 -2.554 -9.997 1.00 0.00 H new ATOM 0 HG LEU B 81 13.697 -2.871 -12.034 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.155 -1.450 -10.709 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.455 -3.002 -9.891 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.273 -1.526 -9.327 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.948 -0.402 -12.098 1.00 0.00 H new ATOM 0 HD22 LEU B 81 15.065 -0.480 -10.715 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.524 -1.208 -12.273 1.00 0.00 H new ATOM 1787 N PRO B 82 18.202 -4.167 -11.248 1.00 0.00 N ATOM 1788 CA PRO B 82 19.541 -4.635 -10.765 1.00 0.00 C ATOM 1789 C PRO B 82 19.853 -4.074 -9.376 1.00 0.00 C ATOM 1790 O PRO B 82 18.999 -3.514 -8.715 1.00 0.00 O ATOM 1791 CB PRO B 82 20.506 -4.099 -11.814 1.00 0.00 C ATOM 1792 CG PRO B 82 19.835 -2.912 -12.478 1.00 0.00 C ATOM 1793 CD PRO B 82 18.336 -3.009 -12.202 1.00 0.00 C ATOM 0 HA PRO B 82 19.600 -5.718 -10.656 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.448 -3.800 -11.353 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.741 -4.869 -12.549 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.236 -1.978 -12.085 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.027 -2.916 -13.551 1.00 0.00 H new ATOM 0 HD2 PRO B 82 17.953 -2.087 -11.764 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.774 -3.184 -13.119 1.00 0.00 H new ATOM 1801 N GLU B 83 21.073 -4.236 -8.927 1.00 0.00 N ATOM 1802 CA GLU B 83 21.464 -3.736 -7.574 1.00 0.00 C ATOM 1803 C GLU B 83 21.155 -2.240 -7.445 1.00 0.00 C ATOM 1804 O GLU B 83 20.795 -1.584 -8.405 1.00 0.00 O ATOM 1805 CB GLU B 83 22.963 -3.966 -7.368 1.00 0.00 C ATOM 1806 CG GLU B 83 23.184 -5.282 -6.618 1.00 0.00 C ATOM 1807 CD GLU B 83 24.527 -5.886 -7.031 1.00 0.00 C ATOM 1808 OE1 GLU B 83 24.550 -6.619 -8.007 1.00 0.00 O ATOM 1809 OE2 GLU B 83 25.510 -5.607 -6.365 1.00 0.00 O ATOM 0 H GLU B 83 21.821 -4.697 -9.445 1.00 0.00 H new ATOM 0 HA GLU B 83 20.895 -4.277 -6.818 1.00 0.00 H new ATOM 0 HB2 GLU B 83 23.472 -3.995 -8.331 1.00 0.00 H new ATOM 0 HB3 GLU B 83 23.394 -3.138 -6.805 1.00 0.00 H new ATOM 0 HG2 GLU B 83 23.168 -5.107 -5.542 1.00 0.00 H new ATOM 0 HG3 GLU B 83 22.376 -5.979 -6.840 1.00 0.00 H new ATOM 1816 N ALA B 84 21.295 -1.705 -6.259 1.00 0.00 N ATOM 1817 CA ALA B 84 21.015 -0.258 -6.040 1.00 0.00 C ATOM 1818 C ALA B 84 21.344 0.102 -4.589 1.00 0.00 C ATOM 1819 O ALA B 84 22.029 -0.632 -3.902 1.00 0.00 O ATOM 1820 CB ALA B 84 19.535 0.023 -6.316 1.00 0.00 C ATOM 0 H ALA B 84 21.594 -2.215 -5.428 1.00 0.00 H new ATOM 0 HA ALA B 84 21.627 0.342 -6.714 1.00 0.00 H new ATOM 0 HB1 ALA B 84 19.330 1.081 -6.156 1.00 0.00 H new ATOM 0 HB2 ALA B 84 19.301 -0.240 -7.348 1.00 0.00 H new ATOM 0 HB3 ALA B 84 18.920 -0.572 -5.641 1.00 0.00 H new ATOM 1826 N GLU B 85 20.862 1.226 -4.119 1.00 0.00 N ATOM 1827 CA GLU B 85 21.141 1.640 -2.712 1.00 0.00 C ATOM 1828 C GLU B 85 20.601 0.579 -1.748 1.00 0.00 C ATOM 1829 O GLU B 85 19.447 0.200 -1.812 1.00 0.00 O ATOM 1830 CB GLU B 85 20.457 2.979 -2.430 1.00 0.00 C ATOM 1831 CG GLU B 85 21.224 3.724 -1.335 1.00 0.00 C ATOM 1832 CD GLU B 85 20.326 4.801 -0.724 1.00 0.00 C ATOM 1833 OE1 GLU B 85 19.290 4.445 -0.187 1.00 0.00 O ATOM 1834 OE2 GLU B 85 20.689 5.963 -0.803 1.00 0.00 O ATOM 0 H GLU B 85 20.285 1.876 -4.653 1.00 0.00 H new ATOM 0 HA GLU B 85 22.217 1.743 -2.572 1.00 0.00 H new ATOM 0 HB2 GLU B 85 20.423 3.580 -3.338 1.00 0.00 H new ATOM 0 HB3 GLU B 85 19.426 2.814 -2.118 1.00 0.00 H new ATOM 0 HG2 GLU B 85 21.548 3.025 -0.564 1.00 0.00 H new ATOM 0 HG3 GLU B 85 22.123 4.179 -1.751 1.00 0.00 H new ATOM 1841 N GLU B 86 21.432 0.097 -0.858 1.00 0.00 N ATOM 1842 CA GLU B 86 20.983 -0.940 0.111 1.00 0.00 C ATOM 1843 C GLU B 86 20.287 -0.267 1.300 1.00 0.00 C ATOM 1844 O GLU B 86 20.681 -0.433 2.441 1.00 0.00 O ATOM 1845 CB GLU B 86 22.198 -1.736 0.600 1.00 0.00 C ATOM 1846 CG GLU B 86 21.750 -3.134 1.032 1.00 0.00 C ATOM 1847 CD GLU B 86 21.518 -4.002 -0.206 1.00 0.00 C ATOM 1848 OE1 GLU B 86 20.450 -3.898 -0.786 1.00 0.00 O ATOM 1849 OE2 GLU B 86 22.412 -4.755 -0.553 1.00 0.00 O ATOM 0 H GLU B 86 22.407 0.381 -0.763 1.00 0.00 H new ATOM 0 HA GLU B 86 20.280 -1.616 -0.376 1.00 0.00 H new ATOM 0 HB2 GLU B 86 22.942 -1.810 -0.194 1.00 0.00 H new ATOM 0 HB3 GLU B 86 22.673 -1.220 1.435 1.00 0.00 H new ATOM 0 HG2 GLU B 86 22.507 -3.589 1.671 1.00 0.00 H new ATOM 0 HG3 GLU B 86 20.834 -3.068 1.620 1.00 0.00 H new ATOM 1856 N LEU B 87 19.254 0.492 1.038 1.00 0.00 N ATOM 1857 CA LEU B 87 18.523 1.179 2.143 1.00 0.00 C ATOM 1858 C LEU B 87 17.055 0.749 2.128 1.00 0.00 C ATOM 1859 O LEU B 87 16.222 1.380 1.503 1.00 0.00 O ATOM 1860 CB LEU B 87 18.614 2.694 1.951 1.00 0.00 C ATOM 1861 CG LEU B 87 18.545 3.386 3.313 1.00 0.00 C ATOM 1862 CD1 LEU B 87 19.931 3.382 3.960 1.00 0.00 C ATOM 1863 CD2 LEU B 87 18.074 4.830 3.128 1.00 0.00 C ATOM 0 H LEU B 87 18.885 0.666 0.103 1.00 0.00 H new ATOM 0 HA LEU B 87 18.971 0.907 3.099 1.00 0.00 H new ATOM 0 HB2 LEU B 87 19.545 2.952 1.447 1.00 0.00 H new ATOM 0 HB3 LEU B 87 17.800 3.040 1.314 1.00 0.00 H new ATOM 0 HG LEU B 87 17.843 2.853 3.955 1.00 0.00 H new ATOM 0 HD11 LEU B 87 19.881 3.875 4.931 1.00 0.00 H new ATOM 0 HD12 LEU B 87 20.268 2.354 4.093 1.00 0.00 H new ATOM 0 HD13 LEU B 87 20.634 3.914 3.318 1.00 0.00 H new ATOM 0 HD21 LEU B 87 18.025 5.324 4.098 1.00 0.00 H new ATOM 0 HD22 LEU B 87 18.776 5.362 2.485 1.00 0.00 H new ATOM 0 HD23 LEU B 87 17.086 4.834 2.668 1.00 0.00 H new ATOM 1875 N LYS B 88 16.735 -0.321 2.811 1.00 0.00 N ATOM 1876 CA LYS B 88 15.322 -0.801 2.844 1.00 0.00 C ATOM 1877 C LYS B 88 14.595 -0.169 4.032 1.00 0.00 C ATOM 1878 O LYS B 88 13.380 -0.076 3.976 1.00 0.00 O ATOM 1879 CB LYS B 88 15.304 -2.324 2.987 1.00 0.00 C ATOM 1880 CG LYS B 88 13.988 -2.875 2.435 1.00 0.00 C ATOM 1881 CD LYS B 88 13.767 -4.295 2.958 1.00 0.00 C ATOM 1882 CE LYS B 88 12.331 -4.732 2.660 1.00 0.00 C ATOM 1883 NZ LYS B 88 12.289 -5.431 1.344 1.00 0.00 N ATOM 1884 OXT LYS B 88 15.266 0.213 4.977 1.00 0.00 O ATOM 0 H LYS B 88 17.394 -0.884 3.348 1.00 0.00 H new ATOM 0 HA LYS B 88 14.821 -0.517 1.919 1.00 0.00 H new ATOM 0 HB2 LYS B 88 16.146 -2.760 2.450 1.00 0.00 H new ATOM 0 HB3 LYS B 88 15.416 -2.602 4.035 1.00 0.00 H new ATOM 0 HG2 LYS B 88 13.159 -2.233 2.734 1.00 0.00 H new ATOM 0 HG3 LYS B 88 14.012 -2.878 1.345 1.00 0.00 H new ATOM 0 HD2 LYS B 88 14.472 -4.981 2.488 1.00 0.00 H new ATOM 0 HD3 LYS B 88 13.954 -4.332 4.031 1.00 0.00 H new ATOM 0 HE2 LYS B 88 11.970 -5.394 3.447 1.00 0.00 H new ATOM 0 HE3 LYS B 88 11.671 -3.865 2.645 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 11.314 -5.729 1.140 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 12.617 -4.786 0.597 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 12.907 -6.267 1.375 1.00 0.00 H new TER 1898 LYS B 88