USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1272 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 118 MET CE :methyl -147:sc= -0.582 (180deg=-1.08) USER MOD Set 1.2: A 119 LYS NZ :NH3+ -165:sc= -0.001 (180deg=-0.305) USER MOD Set 2.1: A 107 ASN : amide:sc= -12.5! C(o=-13!,f=-3.3!) USER MOD Set 2.2: A 112 THR OG1 : rot 180:sc= -0.107 USER MOD Set 3.1: A 48 GLN : amide:sc= -3.56! C(o=-6.5!,f=-7!) USER MOD Set 3.2: A 50 GLN : amide:sc= -2.97 K(o=-6.5,f=-3.8) USER MOD Set 4.1: A 42 THR OG1 : rot 81:sc= 0.205 USER MOD Set 4.2: A 55 ASN : amide:sc= -5.13! C(o=-4.9!,f=-9.3!) USER MOD Single : A 1 THR N :NH3+ 151:sc= 0.00836 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.0132 USER MOD Single : A 4 TYR OH : rot -79:sc= -3.33! USER MOD Single : A 9 SER OG : rot -71:sc= -1.05 USER MOD Single : A 10 ASN : amide:sc= -3.52! C(o=-3.5!,f=-4.1!) USER MOD Single : A 13 SER OG : rot 60:sc= 0.486 USER MOD Single : A 17 GLN : amide:sc= -11.9! C(o=-12!,f=-11!) USER MOD Single : A 19 ASN : amide:sc= -2.58! K(o=-2.6!,f=-0.34) USER MOD Single : A 23 LYS NZ :NH3+ -165:sc= -0.0374 (180deg=-0.324) USER MOD Single : A 31 SER OG : rot 27:sc= -2.17 USER MOD Single : A 32 HIS : no HD1:sc= -1.96 K(o=-2,f=-0.22) USER MOD Single : A 35 THR OG1 : rot -179:sc= -3.21! USER MOD Single : A 37 SER OG : rot 180:sc= -0.35 USER MOD Single : A 38 SER OG : rot -60:sc= 0.203 USER MOD Single : A 40 TYR OH : rot 125:sc= -9.99! USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.385 USER MOD Single : A 63 SER OG : rot 107:sc= 0.375 USER MOD Single : A 71 ASN : amide:sc= -2.49! C(o=-2.5!,f=-3.5!) USER MOD Single : A 72 HIS : no HD1:sc= -0.328 X(o=-0.33,f=0.049) USER MOD Single : A 73 THR OG1 : rot 83:sc= -4.57! USER MOD Single : A 74 GLN : amide:sc= -1.16! K(o=-1.2!,f=0.1) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 GLN : amide:sc= -1.29 K(o=-1.3,f=-3.8!) USER MOD Single : A 85 LYS NZ :NH3+ -168:sc= -0.0314 (180deg=-0.252) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.567 USER MOD Single : A 99 MET CE :methyl -175:sc= -0.677 (180deg=-0.956) USER MOD Single : A 103 ASN : amide:sc= -4.63! K(o=-4.6!,f=-1.4) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.192 USER MOD Single : A 115 HIS : no HE2:sc= -5.92! C(o=-5.9!,f=-6.8!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -1.36 K(o=-1.4,f=-0.69) USER MOD Single : A 124 MET CE :methyl 142:sc= -0.28 (180deg=-2.19!) USER MOD Single : A 142 MET CE :methyl -124:sc= 0 (180deg=-2.21!) USER MOD Single : A 145 GLN : amide:sc= -10.1! K(o=-10!,f=-3.9) USER MOD Single : A 148 HIS : no HD1:sc= -4.18! K(o=-4.2!,f=-1.6) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -113:sc= 0.91 (180deg=-0.446) USER MOD Single : A 156 ASN : amide:sc= -0.91 K(o=-0.91,f=-2.2!) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 3.601 -10.262 -14.793 1.00 0.82 N ATOM 2 CA THR A 1 2.752 -10.474 -13.592 1.00 0.59 C ATOM 3 C THR A 1 2.448 -9.151 -12.894 1.00 0.52 C ATOM 4 O THR A 1 3.341 -8.511 -12.339 1.00 0.52 O ATOM 5 CB THR A 1 3.484 -11.421 -12.639 1.00 0.64 C ATOM 6 OG1 THR A 1 3.750 -12.661 -13.272 1.00 0.92 O ATOM 7 CG2 THR A 1 2.713 -11.710 -11.369 1.00 0.62 C ATOM 0 H1 THR A 1 4.184 -11.107 -14.960 1.00 0.82 H new ATOM 0 H2 THR A 1 2.995 -10.090 -15.621 1.00 0.82 H new ATOM 0 H3 THR A 1 4.219 -9.440 -14.640 1.00 0.82 H new ATOM 0 HA THR A 1 1.801 -10.911 -13.896 1.00 0.59 H new ATOM 0 HB THR A 1 4.407 -10.906 -12.373 1.00 0.64 H new ATOM 0 HG1 THR A 1 4.220 -13.253 -12.648 1.00 0.92 H new ATOM 0 HG21 THR A 1 3.290 -12.388 -10.739 1.00 0.62 H new ATOM 0 HG22 THR A 1 2.535 -10.779 -10.832 1.00 0.62 H new ATOM 0 HG23 THR A 1 1.758 -12.172 -11.620 1.00 0.62 H new ATOM 17 N VAL A 2 1.181 -8.748 -12.924 1.00 0.54 N ATOM 18 CA VAL A 2 0.760 -7.502 -12.295 1.00 0.54 C ATOM 19 C VAL A 2 0.649 -7.664 -10.782 1.00 0.44 C ATOM 20 O VAL A 2 -0.303 -8.261 -10.279 1.00 0.45 O ATOM 21 CB VAL A 2 -0.592 -7.020 -12.852 1.00 0.65 C ATOM 22 CG1 VAL A 2 -0.998 -5.698 -12.215 1.00 1.49 C ATOM 23 CG2 VAL A 2 -0.529 -6.893 -14.368 1.00 1.42 C ATOM 0 H VAL A 2 0.429 -9.267 -13.377 1.00 0.54 H new ATOM 0 HA VAL A 2 1.522 -6.757 -12.523 1.00 0.54 H new ATOM 0 HB VAL A 2 -1.350 -7.762 -12.602 1.00 0.65 H new ATOM 0 HG11 VAL A 2 -1.956 -5.376 -12.623 1.00 1.49 H new ATOM 0 HG12 VAL A 2 -1.088 -5.826 -11.136 1.00 1.49 H new ATOM 0 HG13 VAL A 2 -0.241 -4.943 -12.429 1.00 1.49 H new ATOM 0 HG21 VAL A 2 -1.493 -6.551 -14.745 1.00 1.42 H new ATOM 0 HG22 VAL A 2 0.243 -6.174 -14.641 1.00 1.42 H new ATOM 0 HG23 VAL A 2 -0.292 -7.863 -14.805 1.00 1.42 H new ATOM 33 N ALA A 3 1.632 -7.132 -10.063 1.00 0.43 N ATOM 34 CA ALA A 3 1.651 -7.220 -8.608 1.00 0.40 C ATOM 35 C ALA A 3 0.776 -6.143 -7.972 1.00 0.33 C ATOM 36 O ALA A 3 0.795 -4.980 -8.385 1.00 0.37 O ATOM 37 CB ALA A 3 3.077 -7.116 -8.093 1.00 0.48 C ATOM 0 H ALA A 3 2.427 -6.635 -10.465 1.00 0.43 H new ATOM 0 HA ALA A 3 1.242 -8.190 -8.326 1.00 0.40 H new ATOM 0 HB1 ALA A 3 3.077 -7.183 -7.005 1.00 0.48 H new ATOM 0 HB2 ALA A 3 3.673 -7.929 -8.507 1.00 0.48 H new ATOM 0 HB3 ALA A 3 3.505 -6.161 -8.397 1.00 0.48 H new ATOM 43 N TYR A 4 0.016 -6.540 -6.955 1.00 0.38 N ATOM 44 CA TYR A 4 -0.861 -5.617 -6.248 1.00 0.48 C ATOM 45 C TYR A 4 -0.125 -5.019 -5.062 1.00 0.46 C ATOM 46 O TYR A 4 0.211 -5.726 -4.116 1.00 0.72 O ATOM 47 CB TYR A 4 -2.129 -6.335 -5.786 1.00 0.79 C ATOM 48 CG TYR A 4 -2.868 -7.035 -6.908 1.00 2.03 C ATOM 49 CD1 TYR A 4 -2.273 -8.071 -7.621 1.00 3.01 C ATOM 50 CD2 TYR A 4 -4.158 -6.659 -7.255 1.00 2.70 C ATOM 51 CE1 TYR A 4 -2.941 -8.709 -8.645 1.00 4.21 C ATOM 52 CE2 TYR A 4 -4.832 -7.294 -8.279 1.00 3.83 C ATOM 53 CZ TYR A 4 -4.219 -8.317 -8.971 1.00 4.50 C ATOM 54 OH TYR A 4 -4.887 -8.952 -9.991 1.00 5.73 O ATOM 0 H TYR A 4 -0.009 -7.497 -6.603 1.00 0.38 H new ATOM 0 HA TYR A 4 -1.152 -4.814 -6.925 1.00 0.48 H new ATOM 0 HB2 TYR A 4 -1.865 -7.067 -5.023 1.00 0.79 H new ATOM 0 HB3 TYR A 4 -2.796 -5.612 -5.317 1.00 0.79 H new ATOM 0 HD1 TYR A 4 -1.270 -8.381 -7.368 1.00 3.01 H new ATOM 0 HD2 TYR A 4 -4.642 -5.858 -6.716 1.00 2.70 H new ATOM 0 HE1 TYR A 4 -2.464 -9.512 -9.188 1.00 4.21 H new ATOM 0 HE2 TYR A 4 -5.836 -6.991 -8.537 1.00 3.83 H new ATOM 0 HH TYR A 4 -4.572 -8.607 -10.853 1.00 5.73 H new ATOM 64 N ILE A 5 0.147 -3.720 -5.142 1.00 0.40 N ATOM 65 CA ILE A 5 0.880 -3.012 -4.095 1.00 0.45 C ATOM 66 C ILE A 5 0.036 -1.927 -3.434 1.00 0.44 C ATOM 67 O ILE A 5 -0.624 -1.137 -4.107 1.00 0.57 O ATOM 68 CB ILE A 5 2.155 -2.364 -4.677 1.00 0.55 C ATOM 69 CG1 ILE A 5 2.035 -2.290 -6.199 1.00 0.52 C ATOM 70 CG2 ILE A 5 3.390 -3.151 -4.271 1.00 0.93 C ATOM 71 CD1 ILE A 5 3.019 -1.345 -6.840 1.00 0.79 C ATOM 0 H ILE A 5 -0.131 -3.131 -5.927 1.00 0.40 H new ATOM 0 HA ILE A 5 1.143 -3.752 -3.339 1.00 0.45 H new ATOM 0 HB ILE A 5 2.259 -1.355 -4.278 1.00 0.55 H new ATOM 0 HG12 ILE A 5 2.179 -3.287 -6.615 1.00 0.52 H new ATOM 0 HG13 ILE A 5 1.023 -1.979 -6.460 1.00 0.52 H new ATOM 0 HG21 ILE A 5 4.277 -2.678 -4.691 1.00 0.93 H new ATOM 0 HG22 ILE A 5 3.469 -3.169 -3.184 1.00 0.93 H new ATOM 0 HG23 ILE A 5 3.311 -4.171 -4.646 1.00 0.93 H new ATOM 0 HD11 ILE A 5 2.873 -1.346 -7.920 1.00 0.79 H new ATOM 0 HD12 ILE A 5 2.861 -0.338 -6.453 1.00 0.79 H new ATOM 0 HD13 ILE A 5 4.035 -1.667 -6.611 1.00 0.79 H new ATOM 83 N ALA A 6 0.084 -1.883 -2.109 1.00 0.48 N ATOM 84 CA ALA A 6 -0.653 -0.883 -1.349 1.00 0.51 C ATOM 85 C ALA A 6 0.305 0.150 -0.772 1.00 0.46 C ATOM 86 O ALA A 6 1.297 -0.203 -0.132 1.00 0.58 O ATOM 87 CB ALA A 6 -1.460 -1.539 -0.242 1.00 0.71 C ATOM 0 H ALA A 6 0.627 -2.530 -1.537 1.00 0.48 H new ATOM 0 HA ALA A 6 -1.346 -0.378 -2.022 1.00 0.51 H new ATOM 0 HB1 ALA A 6 -2.003 -0.775 0.314 1.00 0.71 H new ATOM 0 HB2 ALA A 6 -2.169 -2.244 -0.677 1.00 0.71 H new ATOM 0 HB3 ALA A 6 -0.788 -2.070 0.433 1.00 0.71 H new ATOM 93 N ILE A 7 0.012 1.423 -1.009 1.00 0.44 N ATOM 94 CA ILE A 7 0.860 2.502 -0.519 1.00 0.43 C ATOM 95 C ILE A 7 0.214 3.207 0.671 1.00 0.49 C ATOM 96 O ILE A 7 -0.982 3.501 0.654 1.00 0.58 O ATOM 97 CB ILE A 7 1.151 3.520 -1.641 1.00 0.47 C ATOM 98 CG1 ILE A 7 2.175 4.558 -1.178 1.00 1.19 C ATOM 99 CG2 ILE A 7 -0.135 4.199 -2.095 1.00 1.41 C ATOM 100 CD1 ILE A 7 2.629 5.484 -2.285 1.00 1.42 C ATOM 0 H ILE A 7 -0.804 1.733 -1.536 1.00 0.44 H new ATOM 0 HA ILE A 7 1.802 2.062 -0.191 1.00 0.43 H new ATOM 0 HB ILE A 7 1.572 2.982 -2.490 1.00 0.47 H new ATOM 0 HG12 ILE A 7 1.742 5.151 -0.372 1.00 1.19 H new ATOM 0 HG13 ILE A 7 3.043 4.044 -0.765 1.00 1.19 H new ATOM 0 HG21 ILE A 7 0.091 4.913 -2.887 1.00 1.41 H new ATOM 0 HG22 ILE A 7 -0.830 3.448 -2.471 1.00 1.41 H new ATOM 0 HG23 ILE A 7 -0.587 4.722 -1.252 1.00 1.41 H new ATOM 0 HD11 ILE A 7 3.354 6.195 -1.890 1.00 1.42 H new ATOM 0 HD12 ILE A 7 3.090 4.900 -3.082 1.00 1.42 H new ATOM 0 HD13 ILE A 7 1.770 6.025 -2.682 1.00 1.42 H new ATOM 112 N GLY A 8 1.005 3.462 1.710 1.00 0.57 N ATOM 113 CA GLY A 8 0.473 4.116 2.890 1.00 0.69 C ATOM 114 C GLY A 8 1.483 4.993 3.608 1.00 0.68 C ATOM 115 O GLY A 8 2.526 4.519 4.060 1.00 0.77 O ATOM 0 H GLY A 8 1.997 3.229 1.755 1.00 0.57 H new ATOM 0 HA2 GLY A 8 -0.384 4.725 2.602 1.00 0.69 H new ATOM 0 HA3 GLY A 8 0.107 3.357 3.582 1.00 0.69 H new ATOM 119 N SER A 9 1.150 6.275 3.724 1.00 0.70 N ATOM 120 CA SER A 9 2.000 7.247 4.406 1.00 0.75 C ATOM 121 C SER A 9 1.265 7.804 5.626 1.00 0.87 C ATOM 122 O SER A 9 0.038 7.907 5.618 1.00 0.92 O ATOM 123 CB SER A 9 2.378 8.373 3.444 1.00 0.76 C ATOM 124 OG SER A 9 1.230 8.896 2.801 1.00 1.67 O ATOM 0 H SER A 9 0.287 6.669 3.350 1.00 0.70 H new ATOM 0 HA SER A 9 2.915 6.759 4.741 1.00 0.75 H new ATOM 0 HB2 SER A 9 2.887 9.167 3.990 1.00 0.76 H new ATOM 0 HB3 SER A 9 3.079 7.999 2.698 1.00 0.76 H new ATOM 0 HG SER A 9 0.888 8.240 2.158 1.00 1.67 H new ATOM 130 N ASN A 10 2.003 8.146 6.680 1.00 1.03 N ATOM 131 CA ASN A 10 1.377 8.661 7.901 1.00 1.23 C ATOM 132 C ASN A 10 1.995 9.976 8.369 1.00 1.30 C ATOM 133 O ASN A 10 3.036 9.986 9.027 1.00 2.00 O ATOM 134 CB ASN A 10 1.469 7.615 9.013 1.00 1.55 C ATOM 135 CG ASN A 10 2.892 7.155 9.265 1.00 2.18 C ATOM 136 OD1 ASN A 10 3.556 6.632 8.369 1.00 2.66 O ATOM 137 ND2 ASN A 10 3.368 7.347 10.489 1.00 3.02 N ATOM 0 H ASN A 10 3.020 8.078 6.717 1.00 1.03 H new ATOM 0 HA ASN A 10 0.332 8.865 7.666 1.00 1.23 H new ATOM 0 HB2 ASN A 10 1.057 8.031 9.933 1.00 1.55 H new ATOM 0 HB3 ASN A 10 0.854 6.754 8.749 1.00 1.55 H new ATOM 0 HD21 ASN A 10 4.319 7.057 10.718 1.00 3.02 H new ATOM 0 HD22 ASN A 10 2.783 7.784 11.201 1.00 3.02 H new ATOM 144 N LEU A 11 1.326 11.083 8.041 1.00 1.21 N ATOM 145 CA LEU A 11 1.775 12.423 8.427 1.00 1.31 C ATOM 146 C LEU A 11 0.640 13.432 8.278 1.00 1.49 C ATOM 147 O LEU A 11 -0.474 13.076 7.894 1.00 1.96 O ATOM 148 CB LEU A 11 2.955 12.873 7.559 1.00 1.36 C ATOM 149 CG LEU A 11 4.302 12.221 7.872 1.00 1.66 C ATOM 150 CD1 LEU A 11 5.356 12.671 6.872 1.00 2.11 C ATOM 151 CD2 LEU A 11 4.737 12.556 9.292 1.00 2.45 C ATOM 0 H LEU A 11 0.460 11.077 7.502 1.00 1.21 H new ATOM 0 HA LEU A 11 2.090 12.378 9.470 1.00 1.31 H new ATOM 0 HB2 LEU A 11 2.710 12.673 6.516 1.00 1.36 H new ATOM 0 HB3 LEU A 11 3.064 13.953 7.660 1.00 1.36 H new ATOM 0 HG LEU A 11 4.190 11.140 7.791 1.00 1.66 H new ATOM 0 HD11 LEU A 11 6.309 12.197 7.110 1.00 2.11 H new ATOM 0 HD12 LEU A 11 5.049 12.384 5.866 1.00 2.11 H new ATOM 0 HD13 LEU A 11 5.467 13.754 6.923 1.00 2.11 H new ATOM 0 HD21 LEU A 11 5.698 12.084 9.499 1.00 2.45 H new ATOM 0 HD22 LEU A 11 4.833 13.637 9.398 1.00 2.45 H new ATOM 0 HD23 LEU A 11 3.992 12.187 9.997 1.00 2.45 H new ATOM 163 N ALA A 12 0.938 14.700 8.551 1.00 1.57 N ATOM 164 CA ALA A 12 -0.051 15.760 8.404 1.00 1.79 C ATOM 165 C ALA A 12 -0.175 16.104 6.927 1.00 1.71 C ATOM 166 O ALA A 12 -1.236 16.499 6.443 1.00 2.29 O ATOM 167 CB ALA A 12 0.346 16.984 9.215 1.00 2.08 C ATOM 0 H ALA A 12 1.853 15.016 8.874 1.00 1.57 H new ATOM 0 HA ALA A 12 -1.015 15.419 8.782 1.00 1.79 H new ATOM 0 HB1 ALA A 12 -0.406 17.763 9.090 1.00 2.08 H new ATOM 0 HB2 ALA A 12 0.418 16.715 10.269 1.00 2.08 H new ATOM 0 HB3 ALA A 12 1.311 17.353 8.868 1.00 2.08 H new ATOM 173 N SER A 13 0.934 15.906 6.225 1.00 1.54 N ATOM 174 CA SER A 13 1.019 16.137 4.791 1.00 1.42 C ATOM 175 C SER A 13 1.789 14.979 4.154 1.00 1.10 C ATOM 176 O SER A 13 2.886 15.161 3.624 1.00 1.17 O ATOM 177 CB SER A 13 1.717 17.468 4.500 1.00 1.72 C ATOM 178 OG SER A 13 3.027 17.486 5.039 1.00 2.45 O ATOM 0 H SER A 13 1.806 15.578 6.640 1.00 1.54 H new ATOM 0 HA SER A 13 0.015 16.189 4.369 1.00 1.42 H new ATOM 0 HB2 SER A 13 1.761 17.631 3.423 1.00 1.72 H new ATOM 0 HB3 SER A 13 1.135 18.287 4.923 1.00 1.72 H new ATOM 0 HG SER A 13 3.556 16.766 4.637 1.00 2.45 H new ATOM 184 N PRO A 14 1.230 13.755 4.241 1.00 0.96 N ATOM 185 CA PRO A 14 1.867 12.537 3.718 1.00 0.92 C ATOM 186 C PRO A 14 2.091 12.548 2.210 1.00 0.86 C ATOM 187 O PRO A 14 2.659 11.601 1.664 1.00 0.90 O ATOM 188 CB PRO A 14 0.886 11.423 4.095 1.00 1.18 C ATOM 189 CG PRO A 14 0.054 11.990 5.189 1.00 1.23 C ATOM 190 CD PRO A 14 -0.057 13.454 4.893 1.00 1.14 C ATOM 0 HA PRO A 14 2.867 12.420 4.136 1.00 0.92 H new ATOM 0 HB2 PRO A 14 0.272 11.134 3.242 1.00 1.18 H new ATOM 0 HB3 PRO A 14 1.414 10.528 4.425 1.00 1.18 H new ATOM 0 HG2 PRO A 14 -0.929 11.520 5.218 1.00 1.23 H new ATOM 0 HG3 PRO A 14 0.517 11.821 6.161 1.00 1.23 H new ATOM 0 HD2 PRO A 14 -0.902 13.671 4.239 1.00 1.14 H new ATOM 0 HD3 PRO A 14 -0.197 14.041 5.801 1.00 1.14 H new ATOM 198 N LEU A 15 1.661 13.608 1.534 1.00 0.89 N ATOM 199 CA LEU A 15 1.849 13.694 0.089 1.00 0.90 C ATOM 200 C LEU A 15 3.336 13.655 -0.263 1.00 0.84 C ATOM 201 O LEU A 15 3.707 13.487 -1.427 1.00 0.84 O ATOM 202 CB LEU A 15 1.183 14.947 -0.499 1.00 1.07 C ATOM 203 CG LEU A 15 1.408 16.252 0.267 1.00 1.33 C ATOM 204 CD1 LEU A 15 1.237 17.445 -0.660 1.00 1.67 C ATOM 205 CD2 LEU A 15 0.434 16.358 1.432 1.00 1.72 C ATOM 0 H LEU A 15 1.187 14.408 1.954 1.00 0.89 H new ATOM 0 HA LEU A 15 1.362 12.827 -0.358 1.00 0.90 H new ATOM 0 HB2 LEU A 15 1.545 15.081 -1.519 1.00 1.07 H new ATOM 0 HB3 LEU A 15 0.110 14.767 -0.562 1.00 1.07 H new ATOM 0 HG LEU A 15 2.426 16.251 0.657 1.00 1.33 H new ATOM 0 HD11 LEU A 15 1.400 18.366 -0.101 1.00 1.67 H new ATOM 0 HD12 LEU A 15 1.960 17.381 -1.473 1.00 1.67 H new ATOM 0 HD13 LEU A 15 0.228 17.444 -1.072 1.00 1.67 H new ATOM 0 HD21 LEU A 15 0.607 17.292 1.967 1.00 1.72 H new ATOM 0 HD22 LEU A 15 -0.588 16.340 1.054 1.00 1.72 H new ATOM 0 HD23 LEU A 15 0.585 15.518 2.110 1.00 1.72 H new ATOM 217 N GLU A 16 4.185 13.783 0.757 1.00 0.86 N ATOM 218 CA GLU A 16 5.631 13.735 0.568 1.00 0.88 C ATOM 219 C GLU A 16 6.112 12.292 0.467 1.00 0.76 C ATOM 220 O GLU A 16 6.803 11.922 -0.481 1.00 0.75 O ATOM 221 CB GLU A 16 6.355 14.441 1.719 1.00 1.05 C ATOM 222 CG GLU A 16 6.416 15.957 1.585 1.00 1.40 C ATOM 223 CD GLU A 16 5.049 16.606 1.493 1.00 1.82 C ATOM 224 OE1 GLU A 16 4.366 16.406 0.468 1.00 2.49 O ATOM 225 OE2 GLU A 16 4.663 17.313 2.447 1.00 2.16 O ATOM 0 H GLU A 16 3.893 13.921 1.724 1.00 0.86 H new ATOM 0 HA GLU A 16 5.863 14.253 -0.363 1.00 0.88 H new ATOM 0 HB2 GLU A 16 5.856 14.190 2.655 1.00 1.05 H new ATOM 0 HB3 GLU A 16 7.371 14.053 1.786 1.00 1.05 H new ATOM 0 HG2 GLU A 16 6.949 16.369 2.441 1.00 1.40 H new ATOM 0 HG3 GLU A 16 6.993 16.213 0.696 1.00 1.40 H new ATOM 232 N GLN A 17 5.735 11.474 1.451 1.00 0.73 N ATOM 233 CA GLN A 17 6.125 10.070 1.466 1.00 0.71 C ATOM 234 C GLN A 17 5.547 9.339 0.263 1.00 0.57 C ATOM 235 O GLN A 17 6.207 8.488 -0.333 1.00 0.51 O ATOM 236 CB GLN A 17 5.665 9.400 2.761 1.00 0.86 C ATOM 237 CG GLN A 17 6.327 9.962 4.006 1.00 1.20 C ATOM 238 CD GLN A 17 7.834 9.828 3.964 1.00 1.35 C ATOM 239 OE1 GLN A 17 8.504 10.448 3.140 1.00 2.20 O ATOM 240 NE2 GLN A 17 8.374 9.003 4.852 1.00 1.36 N ATOM 0 H GLN A 17 5.162 11.762 2.244 1.00 0.73 H new ATOM 0 HA GLN A 17 7.212 10.019 1.413 1.00 0.71 H new ATOM 0 HB2 GLN A 17 4.585 9.510 2.853 1.00 0.86 H new ATOM 0 HB3 GLN A 17 5.872 8.332 2.701 1.00 0.86 H new ATOM 0 HG2 GLN A 17 6.061 11.013 4.114 1.00 1.20 H new ATOM 0 HG3 GLN A 17 5.943 9.444 4.885 1.00 1.20 H new ATOM 0 HE21 GLN A 17 7.779 8.509 5.517 1.00 1.36 H new ATOM 0 HE22 GLN A 17 9.384 8.863 4.869 1.00 1.36 H new ATOM 249 N VAL A 18 4.313 9.679 -0.089 1.00 0.57 N ATOM 250 CA VAL A 18 3.646 9.057 -1.225 1.00 0.53 C ATOM 251 C VAL A 18 4.463 9.236 -2.501 1.00 0.49 C ATOM 252 O VAL A 18 4.815 8.259 -3.160 1.00 0.51 O ATOM 253 CB VAL A 18 2.233 9.633 -1.444 1.00 0.62 C ATOM 254 CG1 VAL A 18 1.570 8.989 -2.652 1.00 1.10 C ATOM 255 CG2 VAL A 18 1.386 9.435 -0.200 1.00 1.25 C ATOM 0 H VAL A 18 3.755 10.382 0.396 1.00 0.57 H new ATOM 0 HA VAL A 18 3.557 7.995 -0.995 1.00 0.53 H new ATOM 0 HB VAL A 18 2.322 10.702 -1.637 1.00 0.62 H new ATOM 0 HG11 VAL A 18 0.574 9.410 -2.788 1.00 1.10 H new ATOM 0 HG12 VAL A 18 2.170 9.181 -3.542 1.00 1.10 H new ATOM 0 HG13 VAL A 18 1.491 7.914 -2.493 1.00 1.10 H new ATOM 0 HG21 VAL A 18 0.391 9.846 -0.368 1.00 1.25 H new ATOM 0 HG22 VAL A 18 1.306 8.370 0.020 1.00 1.25 H new ATOM 0 HG23 VAL A 18 1.852 9.946 0.643 1.00 1.25 H new ATOM 265 N ASN A 19 4.766 10.488 -2.841 1.00 0.52 N ATOM 266 CA ASN A 19 5.547 10.786 -4.038 1.00 0.57 C ATOM 267 C ASN A 19 6.882 10.048 -4.013 1.00 0.50 C ATOM 268 O ASN A 19 7.362 9.574 -5.043 1.00 0.52 O ATOM 269 CB ASN A 19 5.791 12.291 -4.155 1.00 0.72 C ATOM 270 CG ASN A 19 4.507 13.098 -4.268 1.00 1.26 C ATOM 271 OD1 ASN A 19 4.544 14.323 -4.373 1.00 1.96 O ATOM 272 ND2 ASN A 19 3.363 12.418 -4.248 1.00 1.71 N ATOM 0 H ASN A 19 4.483 11.309 -2.306 1.00 0.52 H new ATOM 0 HA ASN A 19 4.978 10.448 -4.904 1.00 0.57 H new ATOM 0 HB2 ASN A 19 6.351 12.631 -3.284 1.00 0.72 H new ATOM 0 HB3 ASN A 19 6.413 12.485 -5.029 1.00 0.72 H new ATOM 0 HD21 ASN A 19 2.474 12.913 -4.321 1.00 1.71 H new ATOM 0 HD22 ASN A 19 3.375 11.402 -4.159 1.00 1.71 H new ATOM 279 N ALA A 20 7.470 9.952 -2.826 1.00 0.49 N ATOM 280 CA ALA A 20 8.747 9.270 -2.648 1.00 0.49 C ATOM 281 C ALA A 20 8.651 7.822 -3.115 1.00 0.42 C ATOM 282 O ALA A 20 9.365 7.396 -4.026 1.00 0.48 O ATOM 283 CB ALA A 20 9.175 9.331 -1.189 1.00 0.57 C ATOM 0 H ALA A 20 7.080 10.341 -1.967 1.00 0.49 H new ATOM 0 HA ALA A 20 9.498 9.776 -3.254 1.00 0.49 H new ATOM 0 HB1 ALA A 20 10.129 8.819 -1.068 1.00 0.57 H new ATOM 0 HB2 ALA A 20 9.281 10.372 -0.884 1.00 0.57 H new ATOM 0 HB3 ALA A 20 8.422 8.846 -0.568 1.00 0.57 H new ATOM 289 N ALA A 21 7.748 7.079 -2.490 1.00 0.41 N ATOM 290 CA ALA A 21 7.528 5.685 -2.839 1.00 0.45 C ATOM 291 C ALA A 21 7.052 5.582 -4.280 1.00 0.36 C ATOM 292 O ALA A 21 7.268 4.573 -4.951 1.00 0.40 O ATOM 293 CB ALA A 21 6.508 5.072 -1.898 1.00 0.64 C ATOM 0 H ALA A 21 7.154 7.422 -1.735 1.00 0.41 H new ATOM 0 HA ALA A 21 8.465 5.137 -2.741 1.00 0.45 H new ATOM 0 HB1 ALA A 21 6.348 4.027 -2.165 1.00 0.64 H new ATOM 0 HB2 ALA A 21 6.876 5.132 -0.874 1.00 0.64 H new ATOM 0 HB3 ALA A 21 5.566 5.615 -1.978 1.00 0.64 H new ATOM 299 N LEU A 22 6.410 6.649 -4.744 1.00 0.40 N ATOM 300 CA LEU A 22 5.901 6.712 -6.104 1.00 0.47 C ATOM 301 C LEU A 22 7.046 6.808 -7.106 1.00 0.44 C ATOM 302 O LEU A 22 6.915 6.378 -8.253 1.00 0.53 O ATOM 303 CB LEU A 22 4.955 7.907 -6.259 1.00 0.64 C ATOM 304 CG LEU A 22 3.530 7.682 -5.744 1.00 1.16 C ATOM 305 CD1 LEU A 22 2.684 8.926 -5.962 1.00 1.74 C ATOM 306 CD2 LEU A 22 2.895 6.478 -6.428 1.00 1.73 C ATOM 0 H LEU A 22 6.230 7.487 -4.191 1.00 0.40 H new ATOM 0 HA LEU A 22 5.347 5.796 -6.307 1.00 0.47 H new ATOM 0 HB2 LEU A 22 5.384 8.760 -5.733 1.00 0.64 H new ATOM 0 HB3 LEU A 22 4.905 8.176 -7.314 1.00 0.64 H new ATOM 0 HG LEU A 22 3.580 7.480 -4.674 1.00 1.16 H new ATOM 0 HD11 LEU A 22 1.675 8.749 -5.591 1.00 1.74 H new ATOM 0 HD12 LEU A 22 3.126 9.765 -5.425 1.00 1.74 H new ATOM 0 HD13 LEU A 22 2.644 9.157 -7.027 1.00 1.74 H new ATOM 0 HD21 LEU A 22 1.883 6.335 -6.048 1.00 1.73 H new ATOM 0 HD22 LEU A 22 2.858 6.648 -7.504 1.00 1.73 H new ATOM 0 HD23 LEU A 22 3.489 5.587 -6.222 1.00 1.73 H new ATOM 318 N LYS A 23 8.173 7.357 -6.664 1.00 0.43 N ATOM 319 CA LYS A 23 9.342 7.487 -7.525 1.00 0.52 C ATOM 320 C LYS A 23 9.944 6.117 -7.809 1.00 0.47 C ATOM 321 O LYS A 23 10.133 5.741 -8.965 1.00 0.56 O ATOM 322 CB LYS A 23 10.392 8.401 -6.886 1.00 0.61 C ATOM 323 CG LYS A 23 9.946 9.849 -6.761 1.00 1.13 C ATOM 324 CD LYS A 23 11.051 10.721 -6.187 1.00 1.51 C ATOM 325 CE LYS A 23 10.624 12.178 -6.104 1.00 2.12 C ATOM 326 NZ LYS A 23 10.287 12.736 -7.442 1.00 2.74 N ATOM 0 H LYS A 23 8.301 7.718 -5.718 1.00 0.43 H new ATOM 0 HA LYS A 23 9.023 7.936 -8.466 1.00 0.52 H new ATOM 0 HB2 LYS A 23 10.639 8.019 -5.895 1.00 0.61 H new ATOM 0 HB3 LYS A 23 11.305 8.361 -7.480 1.00 0.61 H new ATOM 0 HG2 LYS A 23 9.653 10.227 -7.741 1.00 1.13 H new ATOM 0 HG3 LYS A 23 9.065 9.906 -6.121 1.00 1.13 H new ATOM 0 HD2 LYS A 23 11.320 10.362 -5.193 1.00 1.51 H new ATOM 0 HD3 LYS A 23 11.942 10.637 -6.809 1.00 1.51 H new ATOM 0 HE2 LYS A 23 9.759 12.266 -5.446 1.00 2.12 H new ATOM 0 HE3 LYS A 23 11.426 12.766 -5.657 1.00 2.12 H new ATOM 0 HZ1 LYS A 23 10.249 13.774 -7.386 1.00 2.74 H new ATOM 0 HZ2 LYS A 23 11.014 12.453 -8.130 1.00 2.74 H new ATOM 0 HZ3 LYS A 23 9.362 12.372 -7.747 1.00 2.74 H new ATOM 340 N ALA A 24 10.237 5.370 -6.747 1.00 0.40 N ATOM 341 CA ALA A 24 10.807 4.041 -6.890 1.00 0.43 C ATOM 342 C ALA A 24 9.800 3.079 -7.507 1.00 0.38 C ATOM 343 O ALA A 24 10.181 2.098 -8.141 1.00 0.46 O ATOM 344 CB ALA A 24 11.279 3.522 -5.542 1.00 0.51 C ATOM 0 H ALA A 24 10.088 5.665 -5.782 1.00 0.40 H new ATOM 0 HA ALA A 24 11.664 4.109 -7.560 1.00 0.43 H new ATOM 0 HB1 ALA A 24 11.704 2.526 -5.664 1.00 0.51 H new ATOM 0 HB2 ALA A 24 12.038 4.193 -5.139 1.00 0.51 H new ATOM 0 HB3 ALA A 24 10.435 3.475 -4.854 1.00 0.51 H new ATOM 350 N LEU A 25 8.511 3.363 -7.319 1.00 0.43 N ATOM 351 CA LEU A 25 7.459 2.513 -7.866 1.00 0.40 C ATOM 352 C LEU A 25 7.192 2.859 -9.325 1.00 0.37 C ATOM 353 O LEU A 25 6.742 2.016 -10.097 1.00 0.45 O ATOM 354 CB LEU A 25 6.160 2.663 -7.067 1.00 0.47 C ATOM 355 CG LEU A 25 5.199 1.485 -7.162 1.00 0.56 C ATOM 356 CD1 LEU A 25 5.850 0.228 -6.608 1.00 0.96 C ATOM 357 CD2 LEU A 25 3.914 1.801 -6.417 1.00 1.04 C ATOM 0 H LEU A 25 8.174 4.171 -6.795 1.00 0.43 H new ATOM 0 HA LEU A 25 7.802 1.481 -7.796 1.00 0.40 H new ATOM 0 HB2 LEU A 25 6.414 2.821 -6.019 1.00 0.47 H new ATOM 0 HB3 LEU A 25 5.644 3.560 -7.408 1.00 0.47 H new ATOM 0 HG LEU A 25 4.956 1.309 -8.210 1.00 0.56 H new ATOM 0 HD11 LEU A 25 5.152 -0.606 -6.682 1.00 0.96 H new ATOM 0 HD12 LEU A 25 6.749 0.001 -7.181 1.00 0.96 H new ATOM 0 HD13 LEU A 25 6.116 0.387 -5.563 1.00 0.96 H new ATOM 0 HD21 LEU A 25 3.233 0.953 -6.490 1.00 1.04 H new ATOM 0 HD22 LEU A 25 4.140 1.995 -5.369 1.00 1.04 H new ATOM 0 HD23 LEU A 25 3.446 2.682 -6.857 1.00 1.04 H new ATOM 369 N GLY A 26 7.489 4.102 -9.701 1.00 0.43 N ATOM 370 CA GLY A 26 7.281 4.526 -11.068 1.00 0.53 C ATOM 371 C GLY A 26 8.312 3.910 -11.971 1.00 0.56 C ATOM 372 O GLY A 26 8.026 3.537 -13.108 1.00 0.82 O ATOM 0 H GLY A 26 7.869 4.818 -9.082 1.00 0.43 H new ATOM 0 HA2 GLY A 26 6.282 4.238 -11.397 1.00 0.53 H new ATOM 0 HA3 GLY A 26 7.336 5.613 -11.131 1.00 0.53 H new ATOM 376 N ASP A 27 9.516 3.785 -11.434 1.00 0.59 N ATOM 377 CA ASP A 27 10.616 3.189 -12.157 1.00 0.76 C ATOM 378 C ASP A 27 11.291 2.125 -11.303 1.00 0.56 C ATOM 379 O ASP A 27 12.098 2.434 -10.426 1.00 0.81 O ATOM 380 CB ASP A 27 11.628 4.264 -12.535 1.00 1.35 C ATOM 381 CG ASP A 27 11.127 5.192 -13.626 1.00 2.02 C ATOM 382 OD1 ASP A 27 9.993 4.982 -14.107 1.00 2.42 O ATOM 383 OD2 ASP A 27 11.862 6.130 -13.996 1.00 2.61 O ATOM 0 H ASP A 27 9.752 4.093 -10.491 1.00 0.59 H new ATOM 0 HA ASP A 27 10.230 2.722 -13.063 1.00 0.76 H new ATOM 0 HB2 ASP A 27 11.873 4.851 -11.650 1.00 1.35 H new ATOM 0 HB3 ASP A 27 12.550 3.787 -12.867 1.00 1.35 H new ATOM 388 N ILE A 28 10.961 0.872 -11.574 1.00 0.51 N ATOM 389 CA ILE A 28 11.536 -0.250 -10.847 1.00 0.51 C ATOM 390 C ILE A 28 12.405 -1.083 -11.779 1.00 0.49 C ATOM 391 O ILE A 28 12.073 -1.234 -12.955 1.00 0.48 O ATOM 392 CB ILE A 28 10.434 -1.147 -10.249 1.00 0.71 C ATOM 393 CG1 ILE A 28 9.298 -0.282 -9.695 1.00 0.82 C ATOM 394 CG2 ILE A 28 10.996 -2.044 -9.155 1.00 0.83 C ATOM 395 CD1 ILE A 28 8.199 -1.067 -9.014 1.00 1.26 C ATOM 0 H ILE A 28 10.293 0.605 -12.297 1.00 0.51 H new ATOM 0 HA ILE A 28 12.141 0.152 -10.034 1.00 0.51 H new ATOM 0 HB ILE A 28 10.042 -1.785 -11.041 1.00 0.71 H new ATOM 0 HG12 ILE A 28 9.713 0.432 -8.984 1.00 0.82 H new ATOM 0 HG13 ILE A 28 8.865 0.296 -10.511 1.00 0.82 H new ATOM 0 HG21 ILE A 28 10.198 -2.667 -8.750 1.00 0.83 H new ATOM 0 HG22 ILE A 28 11.777 -2.680 -9.572 1.00 0.83 H new ATOM 0 HG23 ILE A 28 11.416 -1.428 -8.359 1.00 0.83 H new ATOM 0 HD11 ILE A 28 7.434 -0.381 -8.650 1.00 1.26 H new ATOM 0 HD12 ILE A 28 7.754 -1.763 -9.726 1.00 1.26 H new ATOM 0 HD13 ILE A 28 8.616 -1.624 -8.175 1.00 1.26 H new ATOM 407 N PRO A 29 13.525 -1.636 -11.276 1.00 0.68 N ATOM 408 CA PRO A 29 14.435 -2.461 -12.063 1.00 0.83 C ATOM 409 C PRO A 29 13.770 -3.198 -13.229 1.00 0.70 C ATOM 410 O PRO A 29 14.314 -3.232 -14.332 1.00 0.88 O ATOM 411 CB PRO A 29 14.913 -3.446 -11.011 1.00 1.07 C ATOM 412 CG PRO A 29 15.026 -2.630 -9.764 1.00 1.14 C ATOM 413 CD PRO A 29 14.016 -1.510 -9.886 1.00 0.87 C ATOM 0 HA PRO A 29 15.210 -1.872 -12.554 1.00 0.83 H new ATOM 0 HB2 PRO A 29 14.208 -4.268 -10.886 1.00 1.07 H new ATOM 0 HB3 PRO A 29 15.871 -3.887 -11.286 1.00 1.07 H new ATOM 0 HG2 PRO A 29 14.824 -3.239 -8.883 1.00 1.14 H new ATOM 0 HG3 PRO A 29 16.034 -2.232 -9.652 1.00 1.14 H new ATOM 0 HD2 PRO A 29 13.207 -1.619 -9.163 1.00 0.87 H new ATOM 0 HD3 PRO A 29 14.473 -0.536 -9.709 1.00 0.87 H new ATOM 421 N GLU A 30 12.605 -3.797 -12.980 1.00 0.54 N ATOM 422 CA GLU A 30 11.895 -4.542 -14.023 1.00 0.58 C ATOM 423 C GLU A 30 10.374 -4.436 -13.879 1.00 0.60 C ATOM 424 O GLU A 30 9.643 -5.293 -14.378 1.00 1.01 O ATOM 425 CB GLU A 30 12.308 -6.016 -13.988 1.00 0.62 C ATOM 426 CG GLU A 30 13.756 -6.263 -14.380 1.00 0.63 C ATOM 427 CD GLU A 30 14.034 -5.922 -15.830 1.00 1.39 C ATOM 428 OE1 GLU A 30 13.369 -6.501 -16.714 1.00 2.35 O ATOM 429 OE2 GLU A 30 14.921 -5.081 -16.085 1.00 1.66 O ATOM 0 H GLU A 30 12.136 -3.782 -12.075 1.00 0.54 H new ATOM 0 HA GLU A 30 12.171 -4.098 -14.979 1.00 0.58 H new ATOM 0 HB2 GLU A 30 12.143 -6.405 -12.983 1.00 0.62 H new ATOM 0 HB3 GLU A 30 11.660 -6.580 -14.658 1.00 0.62 H new ATOM 0 HG2 GLU A 30 14.408 -5.669 -13.740 1.00 0.63 H new ATOM 0 HG3 GLU A 30 14.003 -7.310 -14.203 1.00 0.63 H new ATOM 436 N SER A 31 9.897 -3.395 -13.202 1.00 0.36 N ATOM 437 CA SER A 31 8.464 -3.209 -13.010 1.00 0.34 C ATOM 438 C SER A 31 7.992 -1.890 -13.625 1.00 0.36 C ATOM 439 O SER A 31 8.772 -1.182 -14.265 1.00 0.46 O ATOM 440 CB SER A 31 8.129 -3.256 -11.522 1.00 0.37 C ATOM 441 OG SER A 31 6.734 -3.186 -11.308 1.00 0.83 O ATOM 0 H SER A 31 10.479 -2.672 -12.780 1.00 0.36 H new ATOM 0 HA SER A 31 7.940 -4.019 -13.518 1.00 0.34 H new ATOM 0 HB2 SER A 31 8.520 -4.176 -11.088 1.00 0.37 H new ATOM 0 HB3 SER A 31 8.620 -2.428 -11.010 1.00 0.37 H new ATOM 0 HG SER A 31 6.265 -3.540 -12.092 1.00 0.83 H new ATOM 447 N HIS A 32 6.711 -1.567 -13.433 1.00 0.33 N ATOM 448 CA HIS A 32 6.129 -0.343 -13.973 1.00 0.39 C ATOM 449 C HIS A 32 4.695 -0.179 -13.469 1.00 0.34 C ATOM 450 O HIS A 32 3.939 -1.150 -13.403 1.00 0.36 O ATOM 451 CB HIS A 32 6.151 -0.379 -15.502 1.00 0.51 C ATOM 452 CG HIS A 32 5.743 0.908 -16.162 1.00 0.94 C ATOM 453 ND1 HIS A 32 5.645 1.045 -17.532 1.00 1.83 N ATOM 454 CD2 HIS A 32 5.417 2.116 -15.642 1.00 1.60 C ATOM 455 CE1 HIS A 32 5.279 2.282 -17.824 1.00 2.29 C ATOM 456 NE2 HIS A 32 5.132 2.949 -16.696 1.00 2.07 N ATOM 0 H HIS A 32 6.056 -2.142 -12.904 1.00 0.33 H new ATOM 0 HA HIS A 32 6.720 0.508 -13.635 1.00 0.39 H new ATOM 0 HB2 HIS A 32 7.157 -0.639 -15.832 1.00 0.51 H new ATOM 0 HB3 HIS A 32 5.488 -1.174 -15.844 1.00 0.51 H new ATOM 0 HD2 HIS A 32 5.387 2.375 -14.594 1.00 1.60 H new ATOM 0 HE1 HIS A 32 5.127 2.678 -18.817 1.00 2.29 H new ATOM 0 HE2 HIS A 32 4.852 3.927 -16.619 1.00 2.07 H new ATOM 465 N ILE A 33 4.336 1.043 -13.103 1.00 0.36 N ATOM 466 CA ILE A 33 3.003 1.332 -12.587 1.00 0.36 C ATOM 467 C ILE A 33 1.949 1.387 -13.692 1.00 0.38 C ATOM 468 O ILE A 33 2.243 1.744 -14.832 1.00 0.50 O ATOM 469 CB ILE A 33 3.013 2.655 -11.809 1.00 0.53 C ATOM 470 CG1 ILE A 33 3.898 2.497 -10.575 1.00 0.58 C ATOM 471 CG2 ILE A 33 1.601 3.073 -11.417 1.00 0.93 C ATOM 472 CD1 ILE A 33 3.981 3.732 -9.718 1.00 1.05 C ATOM 0 H ILE A 33 4.952 1.855 -13.154 1.00 0.36 H new ATOM 0 HA ILE A 33 2.733 0.513 -11.920 1.00 0.36 H new ATOM 0 HB ILE A 33 3.416 3.443 -12.446 1.00 0.53 H new ATOM 0 HG12 ILE A 33 3.518 1.673 -9.971 1.00 0.58 H new ATOM 0 HG13 ILE A 33 4.903 2.221 -10.894 1.00 0.58 H new ATOM 0 HG21 ILE A 33 1.639 4.013 -10.867 1.00 0.93 H new ATOM 0 HG22 ILE A 33 0.997 3.202 -12.315 1.00 0.93 H new ATOM 0 HG23 ILE A 33 1.155 2.303 -10.788 1.00 0.93 H new ATOM 0 HD11 ILE A 33 4.628 3.538 -8.862 1.00 1.05 H new ATOM 0 HD12 ILE A 33 4.391 4.555 -10.304 1.00 1.05 H new ATOM 0 HD13 ILE A 33 2.984 3.998 -9.366 1.00 1.05 H new ATOM 484 N LEU A 34 0.714 1.027 -13.334 1.00 0.38 N ATOM 485 CA LEU A 34 -0.397 1.028 -14.282 1.00 0.50 C ATOM 486 C LEU A 34 -1.620 1.746 -13.705 1.00 0.46 C ATOM 487 O LEU A 34 -2.071 2.752 -14.253 1.00 0.60 O ATOM 488 CB LEU A 34 -0.761 -0.410 -14.664 1.00 0.65 C ATOM 489 CG LEU A 34 0.324 -1.176 -15.423 1.00 1.01 C ATOM 490 CD1 LEU A 34 -0.109 -2.612 -15.667 1.00 1.69 C ATOM 491 CD2 LEU A 34 0.644 -0.487 -16.742 1.00 1.34 C ATOM 0 H LEU A 34 0.460 0.731 -12.391 1.00 0.38 H new ATOM 0 HA LEU A 34 -0.080 1.568 -15.174 1.00 0.50 H new ATOM 0 HB2 LEU A 34 -1.004 -0.960 -13.755 1.00 0.65 H new ATOM 0 HB3 LEU A 34 -1.664 -0.390 -15.275 1.00 0.65 H new ATOM 0 HG LEU A 34 1.226 -1.186 -14.812 1.00 1.01 H new ATOM 0 HD11 LEU A 34 0.675 -3.142 -16.208 1.00 1.69 H new ATOM 0 HD12 LEU A 34 -0.288 -3.106 -14.712 1.00 1.69 H new ATOM 0 HD13 LEU A 34 -1.026 -2.620 -16.257 1.00 1.69 H new ATOM 0 HD21 LEU A 34 1.418 -1.047 -17.267 1.00 1.34 H new ATOM 0 HD22 LEU A 34 -0.254 -0.445 -17.358 1.00 1.34 H new ATOM 0 HD23 LEU A 34 0.998 0.525 -16.547 1.00 1.34 H new ATOM 503 N THR A 35 -2.155 1.224 -12.601 1.00 0.46 N ATOM 504 CA THR A 35 -3.329 1.818 -11.956 1.00 0.43 C ATOM 505 C THR A 35 -2.996 2.315 -10.555 1.00 0.43 C ATOM 506 O THR A 35 -2.425 1.586 -9.749 1.00 0.52 O ATOM 507 CB THR A 35 -4.471 0.803 -11.883 1.00 0.49 C ATOM 508 OG1 THR A 35 -4.028 -0.406 -11.296 1.00 0.68 O ATOM 509 CG2 THR A 35 -5.069 0.468 -13.232 1.00 0.72 C ATOM 0 H THR A 35 -1.795 0.392 -12.134 1.00 0.46 H new ATOM 0 HA THR A 35 -3.642 2.669 -12.560 1.00 0.43 H new ATOM 0 HB THR A 35 -5.240 1.280 -11.276 1.00 0.49 H new ATOM 0 HG1 THR A 35 -4.768 -1.048 -11.271 1.00 0.68 H new ATOM 0 HG21 THR A 35 -5.873 -0.257 -13.104 1.00 0.72 H new ATOM 0 HG22 THR A 35 -5.467 1.374 -13.689 1.00 0.72 H new ATOM 0 HG23 THR A 35 -4.298 0.045 -13.877 1.00 0.72 H new ATOM 517 N VAL A 36 -3.360 3.560 -10.267 1.00 0.40 N ATOM 518 CA VAL A 36 -3.103 4.142 -8.955 1.00 0.46 C ATOM 519 C VAL A 36 -4.001 5.350 -8.698 1.00 0.48 C ATOM 520 O VAL A 36 -3.836 6.402 -9.319 1.00 0.56 O ATOM 521 CB VAL A 36 -1.620 4.547 -8.797 1.00 0.58 C ATOM 522 CG1 VAL A 36 -1.196 5.502 -9.903 1.00 1.32 C ATOM 523 CG2 VAL A 36 -1.372 5.160 -7.427 1.00 1.45 C ATOM 0 H VAL A 36 -3.832 4.183 -10.922 1.00 0.40 H new ATOM 0 HA VAL A 36 -3.332 3.374 -8.216 1.00 0.46 H new ATOM 0 HB VAL A 36 -1.013 3.646 -8.881 1.00 0.58 H new ATOM 0 HG11 VAL A 36 -0.148 5.772 -9.769 1.00 1.32 H new ATOM 0 HG12 VAL A 36 -1.325 5.018 -10.871 1.00 1.32 H new ATOM 0 HG13 VAL A 36 -1.810 6.401 -9.862 1.00 1.32 H new ATOM 0 HG21 VAL A 36 -0.322 5.438 -7.337 1.00 1.45 H new ATOM 0 HG22 VAL A 36 -1.994 6.047 -7.308 1.00 1.45 H new ATOM 0 HG23 VAL A 36 -1.623 4.435 -6.653 1.00 1.45 H new ATOM 533 N SER A 37 -4.955 5.200 -7.783 1.00 0.45 N ATOM 534 CA SER A 37 -5.866 6.295 -7.464 1.00 0.54 C ATOM 535 C SER A 37 -6.624 6.041 -6.163 1.00 0.57 C ATOM 536 O SER A 37 -6.477 4.988 -5.540 1.00 1.08 O ATOM 537 CB SER A 37 -6.858 6.504 -8.611 1.00 0.65 C ATOM 538 OG SER A 37 -7.728 7.592 -8.347 1.00 1.28 O ATOM 0 H SER A 37 -5.116 4.342 -7.255 1.00 0.45 H new ATOM 0 HA SER A 37 -5.266 7.195 -7.330 1.00 0.54 H new ATOM 0 HB2 SER A 37 -6.313 6.687 -9.537 1.00 0.65 H new ATOM 0 HB3 SER A 37 -7.442 5.596 -8.759 1.00 0.65 H new ATOM 0 HG SER A 37 -8.349 7.703 -9.097 1.00 1.28 H new ATOM 544 N SER A 38 -7.436 7.022 -5.772 1.00 0.59 N ATOM 545 CA SER A 38 -8.242 6.948 -4.558 1.00 0.59 C ATOM 546 C SER A 38 -7.383 7.011 -3.298 1.00 0.52 C ATOM 547 O SER A 38 -7.369 6.079 -2.494 1.00 0.63 O ATOM 548 CB SER A 38 -9.097 5.679 -4.548 1.00 0.78 C ATOM 549 OG SER A 38 -9.933 5.636 -3.405 1.00 1.68 O ATOM 0 H SER A 38 -7.553 7.892 -6.291 1.00 0.59 H new ATOM 0 HA SER A 38 -8.899 7.818 -4.558 1.00 0.59 H new ATOM 0 HB2 SER A 38 -9.707 5.641 -5.450 1.00 0.78 H new ATOM 0 HB3 SER A 38 -8.451 4.801 -4.563 1.00 0.78 H new ATOM 0 HG SER A 38 -9.381 5.643 -2.595 1.00 1.68 H new ATOM 555 N PHE A 39 -6.701 8.134 -3.108 1.00 0.44 N ATOM 556 CA PHE A 39 -5.884 8.336 -1.920 1.00 0.50 C ATOM 557 C PHE A 39 -6.711 9.111 -0.915 1.00 0.57 C ATOM 558 O PHE A 39 -7.461 10.007 -1.305 1.00 0.75 O ATOM 559 CB PHE A 39 -4.594 9.091 -2.262 1.00 0.59 C ATOM 560 CG PHE A 39 -4.820 10.459 -2.840 1.00 0.59 C ATOM 561 CD1 PHE A 39 -4.962 11.562 -2.013 1.00 0.83 C ATOM 562 CD2 PHE A 39 -4.878 10.641 -4.211 1.00 0.65 C ATOM 563 CE1 PHE A 39 -5.162 12.821 -2.546 1.00 1.19 C ATOM 564 CE2 PHE A 39 -5.078 11.898 -4.750 1.00 0.98 C ATOM 565 CZ PHE A 39 -5.221 12.989 -3.916 1.00 1.26 C ATOM 0 H PHE A 39 -6.698 8.917 -3.761 1.00 0.44 H new ATOM 0 HA PHE A 39 -5.588 7.374 -1.502 1.00 0.50 H new ATOM 0 HB2 PHE A 39 -3.990 9.185 -1.359 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -4.016 8.499 -2.972 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -4.916 11.436 -0.941 1.00 0.83 H new ATOM 0 HD2 PHE A 39 -4.766 9.791 -4.867 1.00 0.65 H new ATOM 0 HE1 PHE A 39 -5.272 13.673 -1.892 1.00 1.19 H new ATOM 0 HE2 PHE A 39 -5.122 12.026 -5.821 1.00 0.98 H new ATOM 0 HZ PHE A 39 -5.379 13.972 -4.334 1.00 1.26 H new ATOM 575 N TYR A 40 -6.635 8.763 0.364 1.00 0.65 N ATOM 576 CA TYR A 40 -7.462 9.470 1.323 1.00 0.81 C ATOM 577 C TYR A 40 -7.006 9.397 2.767 1.00 0.71 C ATOM 578 O TYR A 40 -5.895 8.971 3.076 1.00 0.71 O ATOM 579 CB TYR A 40 -8.887 8.966 1.222 1.00 1.01 C ATOM 580 CG TYR A 40 -9.069 7.467 1.252 1.00 1.49 C ATOM 581 CD1 TYR A 40 -8.130 6.682 1.899 1.00 1.73 C ATOM 582 CD2 TYR A 40 -10.134 6.834 0.622 1.00 2.39 C ATOM 583 CE1 TYR A 40 -8.237 5.316 1.915 1.00 2.61 C ATOM 584 CE2 TYR A 40 -10.251 5.462 0.644 1.00 3.35 C ATOM 585 CZ TYR A 40 -9.512 4.738 1.323 1.00 3.41 C ATOM 586 OH TYR A 40 -9.386 3.349 1.293 1.00 4.43 O ATOM 0 H TYR A 40 -6.037 8.030 0.745 1.00 0.65 H new ATOM 0 HA TYR A 40 -7.378 10.522 1.051 1.00 0.81 H new ATOM 0 HB2 TYR A 40 -9.462 9.397 2.042 1.00 1.01 H new ATOM 0 HB3 TYR A 40 -9.319 9.345 0.296 1.00 1.01 H new ATOM 0 HD1 TYR A 40 -7.298 7.155 2.400 1.00 1.73 H new ATOM 0 HD2 TYR A 40 -10.878 7.425 0.109 1.00 2.39 H new ATOM 0 HE1 TYR A 40 -7.461 4.687 2.324 1.00 2.61 H new ATOM 0 HE2 TYR A 40 -11.020 4.999 0.044 1.00 3.35 H new ATOM 0 HH TYR A 40 -10.140 2.942 1.768 1.00 4.43 H new ATOM 596 N ARG A 41 -7.902 9.859 3.644 1.00 0.70 N ATOM 597 CA ARG A 41 -7.638 9.902 5.080 1.00 0.67 C ATOM 598 C ARG A 41 -7.997 8.586 5.765 1.00 0.64 C ATOM 599 O ARG A 41 -8.832 7.824 5.280 1.00 0.70 O ATOM 600 CB ARG A 41 -8.432 11.047 5.714 1.00 0.79 C ATOM 601 CG ARG A 41 -8.158 11.237 7.197 1.00 0.95 C ATOM 602 CD ARG A 41 -9.090 12.272 7.805 1.00 1.52 C ATOM 603 NE ARG A 41 -10.490 11.861 7.726 1.00 2.11 N ATOM 604 CZ ARG A 41 -11.500 12.576 8.213 1.00 2.49 C ATOM 605 NH1 ARG A 41 -11.266 13.737 8.812 1.00 2.37 N ATOM 606 NH2 ARG A 41 -12.744 12.131 8.103 1.00 3.51 N ATOM 0 H ARG A 41 -8.822 10.210 3.379 1.00 0.70 H new ATOM 0 HA ARG A 41 -6.569 10.066 5.217 1.00 0.67 H new ATOM 0 HB2 ARG A 41 -8.198 11.973 5.189 1.00 0.79 H new ATOM 0 HB3 ARG A 41 -9.497 10.861 5.572 1.00 0.79 H new ATOM 0 HG2 ARG A 41 -8.280 10.286 7.716 1.00 0.95 H new ATOM 0 HG3 ARG A 41 -7.123 11.548 7.340 1.00 0.95 H new ATOM 0 HD2 ARG A 41 -8.819 12.436 8.848 1.00 1.52 H new ATOM 0 HD3 ARG A 41 -8.962 13.223 7.289 1.00 1.52 H new ATOM 0 HE ARG A 41 -10.705 10.974 7.271 1.00 2.11 H new ATOM 0 HH11 ARG A 41 -10.310 14.082 8.899 1.00 2.37 H new ATOM 0 HH12 ARG A 41 -12.042 14.284 9.185 1.00 2.37 H new ATOM 0 HH21 ARG A 41 -12.928 11.239 7.644 1.00 3.51 H new ATOM 0 HH22 ARG A 41 -13.517 12.681 8.477 1.00 3.51 H new ATOM 620 N THR A 42 -7.361 8.341 6.908 1.00 0.80 N ATOM 621 CA THR A 42 -7.602 7.133 7.687 1.00 0.97 C ATOM 622 C THR A 42 -7.234 7.359 9.154 1.00 1.03 C ATOM 623 O THR A 42 -6.207 7.966 9.455 1.00 1.12 O ATOM 624 CB THR A 42 -6.793 5.966 7.117 1.00 1.17 C ATOM 625 OG1 THR A 42 -7.172 5.700 5.780 1.00 1.44 O ATOM 626 CG2 THR A 42 -6.953 4.684 7.904 1.00 1.32 C ATOM 0 H THR A 42 -6.670 8.970 7.316 1.00 0.80 H new ATOM 0 HA THR A 42 -8.663 6.890 7.628 1.00 0.97 H new ATOM 0 HB THR A 42 -5.751 6.281 7.177 1.00 1.17 H new ATOM 0 HG1 THR A 42 -6.722 6.332 5.181 1.00 1.44 H new ATOM 0 HG21 THR A 42 -6.353 3.898 7.445 1.00 1.32 H new ATOM 0 HG22 THR A 42 -6.620 4.843 8.930 1.00 1.32 H new ATOM 0 HG23 THR A 42 -8.001 4.386 7.905 1.00 1.32 H new ATOM 634 N PRO A 43 -8.069 6.878 10.095 1.00 1.12 N ATOM 635 CA PRO A 43 -7.815 7.039 11.528 1.00 1.31 C ATOM 636 C PRO A 43 -6.781 6.041 12.050 1.00 1.50 C ATOM 637 O PRO A 43 -7.057 4.846 12.146 1.00 1.71 O ATOM 638 CB PRO A 43 -9.183 6.771 12.151 1.00 1.48 C ATOM 639 CG PRO A 43 -9.845 5.820 11.214 1.00 1.38 C ATOM 640 CD PRO A 43 -9.328 6.147 9.837 1.00 1.15 C ATOM 0 HA PRO A 43 -7.404 8.020 11.768 1.00 1.31 H new ATOM 0 HB2 PRO A 43 -9.087 6.342 13.148 1.00 1.48 H new ATOM 0 HB3 PRO A 43 -9.759 7.691 12.254 1.00 1.48 H new ATOM 0 HG2 PRO A 43 -9.614 4.789 11.480 1.00 1.38 H new ATOM 0 HG3 PRO A 43 -10.929 5.925 11.256 1.00 1.38 H new ATOM 0 HD2 PRO A 43 -9.153 5.245 9.251 1.00 1.15 H new ATOM 0 HD3 PRO A 43 -10.037 6.758 9.278 1.00 1.15 H new ATOM 648 N PRO A 44 -5.567 6.517 12.391 1.00 1.55 N ATOM 649 CA PRO A 44 -4.492 5.662 12.899 1.00 1.80 C ATOM 650 C PRO A 44 -4.694 5.293 14.365 1.00 2.15 C ATOM 651 O PRO A 44 -4.386 6.078 15.261 1.00 2.77 O ATOM 652 CB PRO A 44 -3.226 6.525 12.734 1.00 1.80 C ATOM 653 CG PRO A 44 -3.666 7.772 12.031 1.00 1.81 C ATOM 654 CD PRO A 44 -5.133 7.913 12.310 1.00 1.54 C ATOM 0 HA PRO A 44 -4.445 4.713 12.365 1.00 1.80 H new ATOM 0 HB2 PRO A 44 -2.784 6.758 13.703 1.00 1.80 H new ATOM 0 HB3 PRO A 44 -2.467 5.998 12.156 1.00 1.80 H new ATOM 0 HG2 PRO A 44 -3.115 8.639 12.395 1.00 1.81 H new ATOM 0 HG3 PRO A 44 -3.478 7.702 10.960 1.00 1.81 H new ATOM 0 HD2 PRO A 44 -5.321 8.453 13.238 1.00 1.54 H new ATOM 0 HD3 PRO A 44 -5.648 8.454 11.517 1.00 1.54 H new ATOM 662 N LEU A 45 -5.213 4.093 14.600 1.00 2.16 N ATOM 663 CA LEU A 45 -5.460 3.619 15.957 1.00 2.52 C ATOM 664 C LEU A 45 -4.373 2.642 16.399 1.00 2.69 C ATOM 665 O LEU A 45 -4.664 1.515 16.800 1.00 3.09 O ATOM 666 CB LEU A 45 -6.832 2.946 16.045 1.00 2.75 C ATOM 667 CG LEU A 45 -8.022 3.844 15.690 1.00 3.05 C ATOM 668 CD1 LEU A 45 -9.322 3.058 15.765 1.00 3.66 C ATOM 669 CD2 LEU A 45 -8.075 5.050 16.616 1.00 3.32 C ATOM 0 H LEU A 45 -5.471 3.431 13.868 1.00 2.16 H new ATOM 0 HA LEU A 45 -5.443 4.481 16.624 1.00 2.52 H new ATOM 0 HB2 LEU A 45 -6.838 2.082 15.381 1.00 2.75 H new ATOM 0 HB3 LEU A 45 -6.970 2.570 17.059 1.00 2.75 H new ATOM 0 HG LEU A 45 -7.892 4.200 14.668 1.00 3.05 H new ATOM 0 HD11 LEU A 45 -10.157 3.711 15.510 1.00 3.66 H new ATOM 0 HD12 LEU A 45 -9.285 2.225 15.063 1.00 3.66 H new ATOM 0 HD13 LEU A 45 -9.457 2.674 16.776 1.00 3.66 H new ATOM 0 HD21 LEU A 45 -8.926 5.676 16.349 1.00 3.32 H new ATOM 0 HD22 LEU A 45 -8.182 4.713 17.647 1.00 3.32 H new ATOM 0 HD23 LEU A 45 -7.155 5.626 16.516 1.00 3.32 H new ATOM 681 N GLY A 46 -3.119 3.081 16.324 1.00 2.52 N ATOM 682 CA GLY A 46 -2.013 2.231 16.722 1.00 2.73 C ATOM 683 C GLY A 46 -0.673 2.942 16.647 1.00 2.68 C ATOM 684 O GLY A 46 -0.179 3.440 17.660 1.00 2.81 O ATOM 0 H GLY A 46 -2.851 4.009 15.995 1.00 2.52 H new ATOM 0 HA2 GLY A 46 -2.177 1.880 17.741 1.00 2.73 H new ATOM 0 HA3 GLY A 46 -1.989 1.349 16.082 1.00 2.73 H new ATOM 688 N PRO A 47 -0.053 3.001 15.455 1.00 2.59 N ATOM 689 CA PRO A 47 1.247 3.659 15.269 1.00 2.65 C ATOM 690 C PRO A 47 1.240 5.114 15.729 1.00 2.60 C ATOM 691 O PRO A 47 1.939 5.479 16.675 1.00 2.86 O ATOM 692 CB PRO A 47 1.477 3.582 13.757 1.00 2.59 C ATOM 693 CG PRO A 47 0.638 2.440 13.297 1.00 2.63 C ATOM 694 CD PRO A 47 -0.565 2.429 14.196 1.00 2.54 C ATOM 0 HA PRO A 47 2.027 3.179 15.859 1.00 2.65 H new ATOM 0 HB2 PRO A 47 1.184 4.510 13.266 1.00 2.59 H new ATOM 0 HB3 PRO A 47 2.529 3.417 13.526 1.00 2.59 H new ATOM 0 HG2 PRO A 47 0.346 2.564 12.254 1.00 2.63 H new ATOM 0 HG3 PRO A 47 1.186 1.500 13.365 1.00 2.63 H new ATOM 0 HD2 PRO A 47 -1.380 3.025 13.785 1.00 2.54 H new ATOM 0 HD3 PRO A 47 -0.950 1.420 14.340 1.00 2.54 H new ATOM 702 N GLN A 48 0.450 5.942 15.053 1.00 2.39 N ATOM 703 CA GLN A 48 0.354 7.351 15.380 1.00 2.50 C ATOM 704 C GLN A 48 -0.782 7.584 16.382 1.00 2.40 C ATOM 705 O GLN A 48 -0.782 7.005 17.468 1.00 2.57 O ATOM 706 CB GLN A 48 0.134 8.150 14.090 1.00 2.56 C ATOM 707 CG GLN A 48 0.323 9.650 14.241 1.00 2.73 C ATOM 708 CD GLN A 48 0.083 10.408 12.944 1.00 2.73 C ATOM 709 OE1 GLN A 48 0.268 11.622 12.881 1.00 3.26 O ATOM 710 NE2 GLN A 48 -0.339 9.699 11.901 1.00 2.45 N ATOM 0 H GLN A 48 -0.136 5.653 14.269 1.00 2.39 H new ATOM 0 HA GLN A 48 1.279 7.689 15.847 1.00 2.50 H new ATOM 0 HB2 GLN A 48 0.823 7.784 13.328 1.00 2.56 H new ATOM 0 HB3 GLN A 48 -0.875 7.958 13.726 1.00 2.56 H new ATOM 0 HG2 GLN A 48 -0.359 10.022 15.006 1.00 2.73 H new ATOM 0 HG3 GLN A 48 1.335 9.851 14.592 1.00 2.73 H new ATOM 0 HE21 GLN A 48 -0.481 8.693 11.992 1.00 2.45 H new ATOM 0 HE22 GLN A 48 -0.521 10.161 11.010 1.00 2.45 H new ATOM 719 N ASP A 49 -1.745 8.427 16.004 1.00 2.45 N ATOM 720 CA ASP A 49 -2.897 8.751 16.844 1.00 2.47 C ATOM 721 C ASP A 49 -3.617 9.964 16.271 1.00 2.38 C ATOM 722 O ASP A 49 -4.722 10.309 16.687 1.00 2.57 O ATOM 723 CB ASP A 49 -2.467 9.049 18.285 1.00 2.79 C ATOM 724 CG ASP A 49 -1.526 10.234 18.375 1.00 2.83 C ATOM 725 OD1 ASP A 49 -0.439 10.179 17.762 1.00 3.28 O ATOM 726 OD2 ASP A 49 -1.876 11.219 19.060 1.00 3.02 O ATOM 0 H ASP A 49 -1.747 8.905 15.103 1.00 2.45 H new ATOM 0 HA ASP A 49 -3.564 7.889 16.856 1.00 2.47 H new ATOM 0 HB2 ASP A 49 -3.351 9.244 18.892 1.00 2.79 H new ATOM 0 HB3 ASP A 49 -1.980 8.169 18.705 1.00 2.79 H new ATOM 731 N GLN A 50 -2.958 10.605 15.314 1.00 2.26 N ATOM 732 CA GLN A 50 -3.485 11.791 14.659 1.00 2.39 C ATOM 733 C GLN A 50 -4.201 11.412 13.363 1.00 2.01 C ATOM 734 O GLN A 50 -3.579 10.892 12.438 1.00 2.19 O ATOM 735 CB GLN A 50 -2.329 12.742 14.372 1.00 3.08 C ATOM 736 CG GLN A 50 -1.427 12.938 15.577 1.00 3.45 C ATOM 737 CD GLN A 50 -0.010 13.307 15.199 1.00 3.73 C ATOM 738 OE1 GLN A 50 0.257 14.421 14.748 1.00 4.34 O ATOM 739 NE2 GLN A 50 0.906 12.355 15.355 1.00 3.74 N ATOM 0 H GLN A 50 -2.042 10.315 14.971 1.00 2.26 H new ATOM 0 HA GLN A 50 -4.210 12.280 15.310 1.00 2.39 H new ATOM 0 HB2 GLN A 50 -1.741 12.354 13.541 1.00 3.08 H new ATOM 0 HB3 GLN A 50 -2.726 13.707 14.058 1.00 3.08 H new ATOM 0 HG2 GLN A 50 -1.843 13.720 16.212 1.00 3.45 H new ATOM 0 HG3 GLN A 50 -1.413 12.021 16.167 1.00 3.45 H new ATOM 0 HE21 GLN A 50 0.638 11.446 15.733 1.00 3.74 H new ATOM 0 HE22 GLN A 50 1.876 12.534 15.097 1.00 3.74 H new ATOM 748 N PRO A 51 -5.523 11.654 13.284 1.00 1.98 N ATOM 749 CA PRO A 51 -6.319 11.321 12.094 1.00 2.00 C ATOM 750 C PRO A 51 -5.864 12.072 10.847 1.00 1.82 C ATOM 751 O PRO A 51 -6.467 13.072 10.455 1.00 2.47 O ATOM 752 CB PRO A 51 -7.745 11.738 12.479 1.00 2.71 C ATOM 753 CG PRO A 51 -7.576 12.704 13.602 1.00 2.89 C ATOM 754 CD PRO A 51 -6.350 12.258 14.344 1.00 2.51 C ATOM 0 HA PRO A 51 -6.224 10.266 11.836 1.00 2.00 H new ATOM 0 HB2 PRO A 51 -8.262 12.198 11.637 1.00 2.71 H new ATOM 0 HB3 PRO A 51 -8.339 10.877 12.785 1.00 2.71 H new ATOM 0 HG2 PRO A 51 -7.459 13.721 13.228 1.00 2.89 H new ATOM 0 HG3 PRO A 51 -8.450 12.703 14.254 1.00 2.89 H new ATOM 0 HD2 PRO A 51 -5.842 13.094 14.825 1.00 2.51 H new ATOM 0 HD3 PRO A 51 -6.591 11.539 15.127 1.00 2.51 H new ATOM 762 N ASP A 52 -4.799 11.574 10.223 1.00 1.32 N ATOM 763 CA ASP A 52 -4.255 12.181 9.011 1.00 1.52 C ATOM 764 C ASP A 52 -3.522 11.136 8.176 1.00 1.28 C ATOM 765 O ASP A 52 -2.671 11.470 7.351 1.00 2.07 O ATOM 766 CB ASP A 52 -3.299 13.325 9.365 1.00 2.12 C ATOM 767 CG ASP A 52 -3.989 14.458 10.101 1.00 2.77 C ATOM 768 OD1 ASP A 52 -4.926 15.053 9.531 1.00 3.33 O ATOM 769 OD2 ASP A 52 -3.592 14.748 11.250 1.00 3.26 O ATOM 0 H ASP A 52 -4.293 10.747 10.539 1.00 1.32 H new ATOM 0 HA ASP A 52 -5.085 12.582 8.429 1.00 1.52 H new ATOM 0 HB2 ASP A 52 -2.488 12.938 9.981 1.00 2.12 H new ATOM 0 HB3 ASP A 52 -2.848 13.712 8.451 1.00 2.12 H new ATOM 774 N TYR A 53 -3.853 9.868 8.404 1.00 0.84 N ATOM 775 CA TYR A 53 -3.224 8.769 7.682 1.00 1.19 C ATOM 776 C TYR A 53 -3.649 8.770 6.216 1.00 0.96 C ATOM 777 O TYR A 53 -4.781 8.414 5.886 1.00 1.43 O ATOM 778 CB TYR A 53 -3.588 7.433 8.339 1.00 2.08 C ATOM 779 CG TYR A 53 -2.805 6.246 7.819 1.00 3.12 C ATOM 780 CD1 TYR A 53 -1.432 6.325 7.631 1.00 3.74 C ATOM 781 CD2 TYR A 53 -3.441 5.051 7.508 1.00 3.88 C ATOM 782 CE1 TYR A 53 -0.713 5.249 7.149 1.00 4.86 C ATOM 783 CE2 TYR A 53 -2.729 3.968 7.025 1.00 5.03 C ATOM 784 CZ TYR A 53 -1.366 4.057 6.881 1.00 5.45 C ATOM 785 OH TYR A 53 -0.653 2.998 6.366 1.00 6.66 O ATOM 0 H TYR A 53 -4.555 9.577 9.085 1.00 0.84 H new ATOM 0 HA TYR A 53 -2.143 8.903 7.724 1.00 1.19 H new ATOM 0 HB2 TYR A 53 -3.428 7.515 9.414 1.00 2.08 H new ATOM 0 HB3 TYR A 53 -4.651 7.246 8.188 1.00 2.08 H new ATOM 0 HD1 TYR A 53 -0.917 7.245 7.866 1.00 3.74 H new ATOM 0 HD2 TYR A 53 -4.509 4.966 7.646 1.00 3.88 H new ATOM 0 HE1 TYR A 53 0.350 5.336 6.982 1.00 4.86 H new ATOM 0 HE2 TYR A 53 -3.243 3.055 6.762 1.00 5.03 H new ATOM 0 HH TYR A 53 -1.252 2.234 6.234 1.00 6.66 H new ATOM 795 N LEU A 54 -2.728 9.171 5.343 1.00 0.84 N ATOM 796 CA LEU A 54 -2.993 9.220 3.908 1.00 0.76 C ATOM 797 C LEU A 54 -2.514 7.933 3.250 1.00 0.76 C ATOM 798 O LEU A 54 -1.427 7.445 3.550 1.00 0.98 O ATOM 799 CB LEU A 54 -2.293 10.443 3.290 1.00 0.97 C ATOM 800 CG LEU A 54 -2.513 10.679 1.785 1.00 1.15 C ATOM 801 CD1 LEU A 54 -1.762 9.656 0.946 1.00 1.60 C ATOM 802 CD2 LEU A 54 -3.995 10.656 1.444 1.00 1.60 C ATOM 0 H LEU A 54 -1.788 9.468 5.606 1.00 0.84 H new ATOM 0 HA LEU A 54 -4.066 9.315 3.740 1.00 0.76 H new ATOM 0 HB2 LEU A 54 -2.626 11.332 3.826 1.00 0.97 H new ATOM 0 HB3 LEU A 54 -1.222 10.347 3.466 1.00 0.97 H new ATOM 0 HG LEU A 54 -2.116 11.666 1.548 1.00 1.15 H new ATOM 0 HD11 LEU A 54 -1.939 9.852 -0.111 1.00 1.60 H new ATOM 0 HD12 LEU A 54 -0.694 9.728 1.154 1.00 1.60 H new ATOM 0 HD13 LEU A 54 -2.113 8.654 1.193 1.00 1.60 H new ATOM 0 HD21 LEU A 54 -4.125 10.825 0.375 1.00 1.60 H new ATOM 0 HD22 LEU A 54 -4.415 9.686 1.712 1.00 1.60 H new ATOM 0 HD23 LEU A 54 -4.509 11.440 2.000 1.00 1.60 H new ATOM 814 N ASN A 55 -3.328 7.382 2.357 1.00 0.60 N ATOM 815 CA ASN A 55 -2.962 6.148 1.676 1.00 0.66 C ATOM 816 C ASN A 55 -3.799 5.919 0.422 1.00 0.50 C ATOM 817 O ASN A 55 -4.999 6.189 0.395 1.00 0.56 O ATOM 818 CB ASN A 55 -3.114 4.960 2.626 1.00 0.87 C ATOM 819 CG ASN A 55 -4.485 4.904 3.265 1.00 1.51 C ATOM 820 OD1 ASN A 55 -5.500 4.828 2.577 1.00 2.21 O ATOM 821 ND2 ASN A 55 -4.520 4.946 4.591 1.00 2.21 N ATOM 0 H ASN A 55 -4.235 7.765 2.091 1.00 0.60 H new ATOM 0 HA ASN A 55 -1.921 6.240 1.367 1.00 0.66 H new ATOM 0 HB2 ASN A 55 -2.933 4.035 2.078 1.00 0.87 H new ATOM 0 HB3 ASN A 55 -2.355 5.022 3.406 1.00 0.87 H new ATOM 0 HD21 ASN A 55 -5.415 4.915 5.079 1.00 2.21 H new ATOM 0 HD22 ASN A 55 -3.652 5.009 5.122 1.00 2.21 H new ATOM 828 N ALA A 56 -3.142 5.406 -0.611 1.00 0.50 N ATOM 829 CA ALA A 56 -3.787 5.111 -1.879 1.00 0.45 C ATOM 830 C ALA A 56 -3.522 3.669 -2.289 1.00 0.45 C ATOM 831 O ALA A 56 -2.911 2.901 -1.541 1.00 0.61 O ATOM 832 CB ALA A 56 -3.298 6.066 -2.957 1.00 0.58 C ATOM 0 H ALA A 56 -2.147 5.184 -0.591 1.00 0.50 H new ATOM 0 HA ALA A 56 -4.862 5.244 -1.758 1.00 0.45 H new ATOM 0 HB1 ALA A 56 -3.790 5.832 -3.901 1.00 0.58 H new ATOM 0 HB2 ALA A 56 -3.533 7.091 -2.669 1.00 0.58 H new ATOM 0 HB3 ALA A 56 -2.219 5.961 -3.075 1.00 0.58 H new ATOM 838 N ALA A 57 -3.982 3.302 -3.478 1.00 0.43 N ATOM 839 CA ALA A 57 -3.794 1.949 -3.980 1.00 0.47 C ATOM 840 C ALA A 57 -3.190 1.955 -5.375 1.00 0.40 C ATOM 841 O ALA A 57 -3.587 2.747 -6.232 1.00 0.44 O ATOM 842 CB ALA A 57 -5.116 1.208 -3.982 1.00 0.59 C ATOM 0 H ALA A 57 -4.487 3.922 -4.111 1.00 0.43 H new ATOM 0 HA ALA A 57 -3.097 1.436 -3.318 1.00 0.47 H new ATOM 0 HB1 ALA A 57 -4.966 0.196 -4.359 1.00 0.59 H new ATOM 0 HB2 ALA A 57 -5.509 1.162 -2.966 1.00 0.59 H new ATOM 0 HB3 ALA A 57 -5.826 1.732 -4.622 1.00 0.59 H new ATOM 848 N VAL A 58 -2.223 1.073 -5.595 1.00 0.39 N ATOM 849 CA VAL A 58 -1.560 0.983 -6.884 1.00 0.39 C ATOM 850 C VAL A 58 -1.352 -0.467 -7.321 1.00 0.40 C ATOM 851 O VAL A 58 -0.803 -1.282 -6.584 1.00 0.60 O ATOM 852 CB VAL A 58 -0.199 1.703 -6.856 1.00 0.49 C ATOM 853 CG1 VAL A 58 0.682 1.139 -5.751 1.00 1.11 C ATOM 854 CG2 VAL A 58 0.494 1.602 -8.207 1.00 1.22 C ATOM 0 H VAL A 58 -1.883 0.412 -4.897 1.00 0.39 H new ATOM 0 HA VAL A 58 -2.216 1.471 -7.605 1.00 0.39 H new ATOM 0 HB VAL A 58 -0.375 2.758 -6.646 1.00 0.49 H new ATOM 0 HG11 VAL A 58 1.639 1.660 -5.747 1.00 1.11 H new ATOM 0 HG12 VAL A 58 0.190 1.276 -4.788 1.00 1.11 H new ATOM 0 HG13 VAL A 58 0.849 0.076 -5.925 1.00 1.11 H new ATOM 0 HG21 VAL A 58 1.453 2.118 -8.163 1.00 1.22 H new ATOM 0 HG22 VAL A 58 0.657 0.553 -8.455 1.00 1.22 H new ATOM 0 HG23 VAL A 58 -0.131 2.063 -8.972 1.00 1.22 H new ATOM 864 N ALA A 59 -1.775 -0.763 -8.541 1.00 0.34 N ATOM 865 CA ALA A 59 -1.620 -2.094 -9.112 1.00 0.36 C ATOM 866 C ALA A 59 -0.614 -2.029 -10.251 1.00 0.37 C ATOM 867 O ALA A 59 -0.957 -1.675 -11.381 1.00 0.43 O ATOM 868 CB ALA A 59 -2.957 -2.630 -9.601 1.00 0.44 C ATOM 0 H ALA A 59 -2.232 -0.093 -9.160 1.00 0.34 H new ATOM 0 HA ALA A 59 -1.254 -2.777 -8.345 1.00 0.36 H new ATOM 0 HB1 ALA A 59 -2.818 -3.625 -10.024 1.00 0.44 H new ATOM 0 HB2 ALA A 59 -3.655 -2.685 -8.765 1.00 0.44 H new ATOM 0 HB3 ALA A 59 -3.358 -1.964 -10.365 1.00 0.44 H new ATOM 874 N LEU A 60 0.637 -2.333 -9.937 1.00 0.37 N ATOM 875 CA LEU A 60 1.709 -2.272 -10.921 1.00 0.45 C ATOM 876 C LEU A 60 2.264 -3.660 -11.235 1.00 0.39 C ATOM 877 O LEU A 60 2.319 -4.529 -10.366 1.00 0.38 O ATOM 878 CB LEU A 60 2.799 -1.314 -10.404 1.00 0.56 C ATOM 879 CG LEU A 60 4.242 -1.813 -10.477 1.00 0.48 C ATOM 880 CD1 LEU A 60 5.205 -0.643 -10.363 1.00 0.44 C ATOM 881 CD2 LEU A 60 4.507 -2.811 -9.364 1.00 0.98 C ATOM 0 H LEU A 60 0.936 -2.625 -9.006 1.00 0.37 H new ATOM 0 HA LEU A 60 1.318 -1.888 -11.863 1.00 0.45 H new ATOM 0 HB2 LEU A 60 2.731 -0.385 -10.969 1.00 0.56 H new ATOM 0 HB3 LEU A 60 2.575 -1.072 -9.365 1.00 0.56 H new ATOM 0 HG LEU A 60 4.394 -2.306 -11.437 1.00 0.48 H new ATOM 0 HD11 LEU A 60 6.230 -1.009 -10.416 1.00 0.44 H new ATOM 0 HD12 LEU A 60 5.027 0.056 -11.180 1.00 0.44 H new ATOM 0 HD13 LEU A 60 5.050 -0.135 -9.411 1.00 0.44 H new ATOM 0 HD21 LEU A 60 5.538 -3.160 -9.426 1.00 0.98 H new ATOM 0 HD22 LEU A 60 4.343 -2.332 -8.399 1.00 0.98 H new ATOM 0 HD23 LEU A 60 3.830 -3.659 -9.467 1.00 0.98 H new ATOM 893 N GLU A 61 2.667 -3.861 -12.487 1.00 0.39 N ATOM 894 CA GLU A 61 3.210 -5.146 -12.919 1.00 0.38 C ATOM 895 C GLU A 61 4.708 -5.233 -12.645 1.00 0.36 C ATOM 896 O GLU A 61 5.496 -4.458 -13.189 1.00 0.38 O ATOM 897 CB GLU A 61 2.931 -5.367 -14.409 1.00 0.44 C ATOM 898 CG GLU A 61 3.475 -4.268 -15.306 1.00 1.08 C ATOM 899 CD GLU A 61 3.198 -4.519 -16.777 1.00 1.06 C ATOM 900 OE1 GLU A 61 2.575 -5.553 -17.098 1.00 1.39 O ATOM 901 OE2 GLU A 61 3.607 -3.681 -17.609 1.00 1.24 O ATOM 0 H GLU A 61 2.628 -3.152 -13.219 1.00 0.39 H new ATOM 0 HA GLU A 61 2.716 -5.930 -12.345 1.00 0.38 H new ATOM 0 HB2 GLU A 61 3.366 -6.319 -14.713 1.00 0.44 H new ATOM 0 HB3 GLU A 61 1.854 -5.446 -14.559 1.00 0.44 H new ATOM 0 HG2 GLU A 61 3.032 -3.315 -15.015 1.00 1.08 H new ATOM 0 HG3 GLU A 61 4.551 -4.180 -15.153 1.00 1.08 H new ATOM 908 N THR A 62 5.095 -6.179 -11.794 1.00 0.39 N ATOM 909 CA THR A 62 6.493 -6.364 -11.442 1.00 0.43 C ATOM 910 C THR A 62 7.106 -7.558 -12.154 1.00 0.39 C ATOM 911 O THR A 62 6.435 -8.313 -12.858 1.00 0.43 O ATOM 912 CB THR A 62 6.652 -6.576 -9.935 1.00 0.54 C ATOM 913 OG1 THR A 62 5.809 -7.620 -9.485 1.00 1.47 O ATOM 914 CG2 THR A 62 6.349 -5.352 -9.108 1.00 1.02 C ATOM 0 H THR A 62 4.456 -6.829 -11.336 1.00 0.39 H new ATOM 0 HA THR A 62 7.010 -5.457 -11.754 1.00 0.43 H new ATOM 0 HB THR A 62 7.704 -6.824 -9.797 1.00 0.54 H new ATOM 0 HG1 THR A 62 5.926 -7.742 -8.520 1.00 1.47 H new ATOM 0 HG21 THR A 62 6.485 -5.584 -8.052 1.00 1.02 H new ATOM 0 HG22 THR A 62 7.024 -4.545 -9.392 1.00 1.02 H new ATOM 0 HG23 THR A 62 5.319 -5.041 -9.282 1.00 1.02 H new ATOM 922 N SER A 63 8.392 -7.722 -11.909 1.00 0.40 N ATOM 923 CA SER A 63 9.180 -8.817 -12.441 1.00 0.44 C ATOM 924 C SER A 63 10.236 -9.150 -11.402 1.00 0.44 C ATOM 925 O SER A 63 11.151 -9.941 -11.629 1.00 0.64 O ATOM 926 CB SER A 63 9.830 -8.431 -13.771 1.00 0.56 C ATOM 927 OG SER A 63 8.850 -8.098 -14.740 1.00 1.23 O ATOM 0 H SER A 63 8.929 -7.084 -11.322 1.00 0.40 H new ATOM 0 HA SER A 63 8.547 -9.682 -12.640 1.00 0.44 H new ATOM 0 HB2 SER A 63 10.499 -7.584 -13.620 1.00 0.56 H new ATOM 0 HB3 SER A 63 10.440 -9.258 -14.135 1.00 0.56 H new ATOM 0 HG SER A 63 8.843 -7.128 -14.878 1.00 1.23 H new ATOM 933 N LEU A 64 10.071 -8.502 -10.252 1.00 0.39 N ATOM 934 CA LEU A 64 10.951 -8.644 -9.115 1.00 0.38 C ATOM 935 C LEU A 64 10.120 -8.719 -7.840 1.00 0.35 C ATOM 936 O LEU A 64 9.649 -7.700 -7.337 1.00 0.39 O ATOM 937 CB LEU A 64 11.915 -7.456 -9.085 1.00 0.42 C ATOM 938 CG LEU A 64 11.259 -6.090 -9.305 1.00 0.50 C ATOM 939 CD1 LEU A 64 11.211 -5.303 -8.010 1.00 0.78 C ATOM 940 CD2 LEU A 64 12.005 -5.311 -10.373 1.00 0.84 C ATOM 0 H LEU A 64 9.302 -7.851 -10.090 1.00 0.39 H new ATOM 0 HA LEU A 64 11.534 -9.562 -9.192 1.00 0.38 H new ATOM 0 HB2 LEU A 64 12.427 -7.446 -8.123 1.00 0.42 H new ATOM 0 HB3 LEU A 64 12.677 -7.605 -9.850 1.00 0.42 H new ATOM 0 HG LEU A 64 10.236 -6.252 -9.644 1.00 0.50 H new ATOM 0 HD11 LEU A 64 10.741 -4.336 -8.189 1.00 0.78 H new ATOM 0 HD12 LEU A 64 10.633 -5.856 -7.270 1.00 0.78 H new ATOM 0 HD13 LEU A 64 12.225 -5.151 -7.639 1.00 0.78 H new ATOM 0 HD21 LEU A 64 11.527 -4.342 -10.518 1.00 0.84 H new ATOM 0 HD22 LEU A 64 13.038 -5.162 -10.060 1.00 0.84 H new ATOM 0 HD23 LEU A 64 11.987 -5.868 -11.310 1.00 0.84 H new ATOM 952 N ALA A 65 9.924 -9.946 -7.350 1.00 0.38 N ATOM 953 CA ALA A 65 9.128 -10.201 -6.148 1.00 0.42 C ATOM 954 C ALA A 65 9.112 -9.003 -5.204 1.00 0.39 C ATOM 955 O ALA A 65 10.167 -8.489 -4.840 1.00 0.38 O ATOM 956 CB ALA A 65 9.654 -11.433 -5.426 1.00 0.52 C ATOM 0 H ALA A 65 10.312 -10.788 -7.775 1.00 0.38 H new ATOM 0 HA ALA A 65 8.100 -10.376 -6.466 1.00 0.42 H new ATOM 0 HB1 ALA A 65 9.056 -11.615 -4.533 1.00 0.52 H new ATOM 0 HB2 ALA A 65 9.591 -12.297 -6.087 1.00 0.52 H new ATOM 0 HB3 ALA A 65 10.693 -11.271 -5.140 1.00 0.52 H new ATOM 962 N PRO A 66 7.906 -8.537 -4.805 1.00 0.44 N ATOM 963 CA PRO A 66 7.737 -7.398 -3.910 1.00 0.47 C ATOM 964 C PRO A 66 8.843 -7.265 -2.888 1.00 0.45 C ATOM 965 O PRO A 66 9.247 -6.161 -2.552 1.00 0.49 O ATOM 966 CB PRO A 66 6.437 -7.714 -3.193 1.00 0.55 C ATOM 967 CG PRO A 66 5.667 -8.601 -4.109 1.00 0.57 C ATOM 968 CD PRO A 66 6.599 -9.072 -5.205 1.00 0.50 C ATOM 0 HA PRO A 66 7.746 -6.461 -4.466 1.00 0.47 H new ATOM 0 HB2 PRO A 66 6.627 -8.208 -2.240 1.00 0.55 H new ATOM 0 HB3 PRO A 66 5.881 -6.803 -2.974 1.00 0.55 H new ATOM 0 HG2 PRO A 66 5.262 -9.453 -3.562 1.00 0.57 H new ATOM 0 HG3 PRO A 66 4.820 -8.064 -4.535 1.00 0.57 H new ATOM 0 HD2 PRO A 66 6.616 -10.160 -5.276 1.00 0.50 H new ATOM 0 HD3 PRO A 66 6.293 -8.694 -6.180 1.00 0.50 H new ATOM 976 N GLU A 67 9.337 -8.393 -2.398 1.00 0.45 N ATOM 977 CA GLU A 67 10.405 -8.370 -1.416 1.00 0.49 C ATOM 978 C GLU A 67 11.437 -7.350 -1.856 1.00 0.44 C ATOM 979 O GLU A 67 11.750 -6.398 -1.140 1.00 0.47 O ATOM 980 CB GLU A 67 11.033 -9.758 -1.287 1.00 0.52 C ATOM 981 CG GLU A 67 10.050 -10.827 -0.835 1.00 0.71 C ATOM 982 CD GLU A 67 10.685 -12.200 -0.726 1.00 0.77 C ATOM 983 OE1 GLU A 67 11.897 -12.319 -1.006 1.00 1.20 O ATOM 984 OE2 GLU A 67 9.971 -13.157 -0.360 1.00 1.06 O ATOM 0 H GLU A 67 9.018 -9.325 -2.662 1.00 0.45 H new ATOM 0 HA GLU A 67 10.011 -8.092 -0.438 1.00 0.49 H new ATOM 0 HB2 GLU A 67 11.456 -10.048 -2.249 1.00 0.52 H new ATOM 0 HB3 GLU A 67 11.858 -9.710 -0.577 1.00 0.52 H new ATOM 0 HG2 GLU A 67 9.634 -10.546 0.133 1.00 0.71 H new ATOM 0 HG3 GLU A 67 9.219 -10.871 -1.539 1.00 0.71 H new ATOM 991 N GLU A 68 11.912 -7.544 -3.072 1.00 0.40 N ATOM 992 CA GLU A 68 12.873 -6.654 -3.686 1.00 0.39 C ATOM 993 C GLU A 68 12.205 -5.353 -4.145 1.00 0.35 C ATOM 994 O GLU A 68 12.817 -4.287 -4.103 1.00 0.40 O ATOM 995 CB GLU A 68 13.519 -7.370 -4.876 1.00 0.41 C ATOM 996 CG GLU A 68 13.801 -6.462 -6.052 1.00 0.97 C ATOM 997 CD GLU A 68 14.540 -7.165 -7.176 1.00 1.52 C ATOM 998 OE1 GLU A 68 14.818 -8.374 -7.037 1.00 2.06 O ATOM 999 OE2 GLU A 68 14.841 -6.506 -8.193 1.00 1.90 O ATOM 0 H GLU A 68 11.639 -8.329 -3.663 1.00 0.40 H new ATOM 0 HA GLU A 68 13.636 -6.391 -2.953 1.00 0.39 H new ATOM 0 HB2 GLU A 68 14.453 -7.828 -4.550 1.00 0.41 H new ATOM 0 HB3 GLU A 68 12.864 -8.178 -5.201 1.00 0.41 H new ATOM 0 HG2 GLU A 68 12.860 -6.067 -6.434 1.00 0.97 H new ATOM 0 HG3 GLU A 68 14.390 -5.610 -5.714 1.00 0.97 H new ATOM 1006 N LEU A 69 10.956 -5.451 -4.603 1.00 0.32 N ATOM 1007 CA LEU A 69 10.227 -4.281 -5.094 1.00 0.33 C ATOM 1008 C LEU A 69 10.037 -3.222 -4.009 1.00 0.34 C ATOM 1009 O LEU A 69 10.485 -2.086 -4.170 1.00 0.44 O ATOM 1010 CB LEU A 69 8.876 -4.710 -5.685 1.00 0.38 C ATOM 1011 CG LEU A 69 7.663 -3.871 -5.262 1.00 0.44 C ATOM 1012 CD1 LEU A 69 7.661 -2.532 -5.981 1.00 0.66 C ATOM 1013 CD2 LEU A 69 6.364 -4.625 -5.521 1.00 0.67 C ATOM 0 H LEU A 69 10.430 -6.324 -4.644 1.00 0.32 H new ATOM 0 HA LEU A 69 10.828 -3.823 -5.879 1.00 0.33 H new ATOM 0 HB2 LEU A 69 8.952 -4.682 -6.772 1.00 0.38 H new ATOM 0 HB3 LEU A 69 8.692 -5.747 -5.405 1.00 0.38 H new ATOM 0 HG LEU A 69 7.737 -3.684 -4.191 1.00 0.44 H new ATOM 0 HD11 LEU A 69 6.793 -1.952 -5.667 1.00 0.66 H new ATOM 0 HD12 LEU A 69 8.571 -1.985 -5.734 1.00 0.66 H new ATOM 0 HD13 LEU A 69 7.617 -2.697 -7.058 1.00 0.66 H new ATOM 0 HD21 LEU A 69 5.519 -4.010 -5.213 1.00 0.67 H new ATOM 0 HD22 LEU A 69 6.280 -4.851 -6.584 1.00 0.67 H new ATOM 0 HD23 LEU A 69 6.363 -5.554 -4.951 1.00 0.67 H new ATOM 1025 N LEU A 70 9.384 -3.581 -2.907 1.00 0.39 N ATOM 1026 CA LEU A 70 9.176 -2.627 -1.837 1.00 0.47 C ATOM 1027 C LEU A 70 10.500 -2.307 -1.169 1.00 0.44 C ATOM 1028 O LEU A 70 10.640 -1.272 -0.526 1.00 0.47 O ATOM 1029 CB LEU A 70 8.122 -3.112 -0.839 1.00 0.62 C ATOM 1030 CG LEU A 70 8.280 -4.542 -0.335 1.00 0.99 C ATOM 1031 CD1 LEU A 70 9.162 -4.587 0.896 1.00 1.48 C ATOM 1032 CD2 LEU A 70 6.917 -5.139 -0.046 1.00 1.65 C ATOM 0 H LEU A 70 8.998 -4.510 -2.738 1.00 0.39 H new ATOM 0 HA LEU A 70 8.781 -1.705 -2.264 1.00 0.47 H new ATOM 0 HB2 LEU A 70 8.131 -2.443 0.021 1.00 0.62 H new ATOM 0 HB3 LEU A 70 7.141 -3.019 -1.305 1.00 0.62 H new ATOM 0 HG LEU A 70 8.765 -5.135 -1.110 1.00 0.99 H new ATOM 0 HD11 LEU A 70 9.259 -5.618 1.236 1.00 1.48 H new ATOM 0 HD12 LEU A 70 10.148 -4.191 0.652 1.00 1.48 H new ATOM 0 HD13 LEU A 70 8.714 -3.985 1.687 1.00 1.48 H new ATOM 0 HD21 LEU A 70 7.036 -6.161 0.314 1.00 1.65 H new ATOM 0 HD22 LEU A 70 6.413 -4.543 0.715 1.00 1.65 H new ATOM 0 HD23 LEU A 70 6.321 -5.143 -0.958 1.00 1.65 H new ATOM 1044 N ASN A 71 11.496 -3.171 -1.371 1.00 0.46 N ATOM 1045 CA ASN A 71 12.820 -2.907 -0.826 1.00 0.50 C ATOM 1046 C ASN A 71 13.304 -1.562 -1.364 1.00 0.41 C ATOM 1047 O ASN A 71 13.907 -0.771 -0.643 1.00 0.44 O ATOM 1048 CB ASN A 71 13.812 -4.010 -1.214 1.00 0.59 C ATOM 1049 CG ASN A 71 14.173 -4.914 -0.050 1.00 0.79 C ATOM 1050 OD1 ASN A 71 14.562 -4.440 1.019 1.00 1.59 O ATOM 1051 ND2 ASN A 71 14.066 -6.220 -0.256 1.00 0.72 N ATOM 0 H ASN A 71 11.411 -4.041 -1.897 1.00 0.46 H new ATOM 0 HA ASN A 71 12.760 -2.885 0.262 1.00 0.50 H new ATOM 0 HB2 ASN A 71 13.384 -4.612 -2.016 1.00 0.59 H new ATOM 0 HB3 ASN A 71 14.720 -3.553 -1.608 1.00 0.59 H new ATOM 0 HD21 ASN A 71 14.310 -6.875 0.487 1.00 0.72 H new ATOM 0 HD22 ASN A 71 13.739 -6.569 -1.157 1.00 0.72 H new ATOM 1058 N HIS A 72 13.007 -1.313 -2.645 1.00 0.37 N ATOM 1059 CA HIS A 72 13.380 -0.066 -3.308 1.00 0.35 C ATOM 1060 C HIS A 72 12.438 1.061 -2.919 1.00 0.32 C ATOM 1061 O HIS A 72 12.870 2.187 -2.676 1.00 0.35 O ATOM 1062 CB HIS A 72 13.353 -0.244 -4.823 1.00 0.39 C ATOM 1063 CG HIS A 72 14.446 -1.124 -5.335 1.00 0.57 C ATOM 1064 ND1 HIS A 72 15.761 -0.720 -5.429 1.00 1.07 N ATOM 1065 CD2 HIS A 72 14.416 -2.405 -5.760 1.00 0.61 C ATOM 1066 CE1 HIS A 72 16.493 -1.717 -5.894 1.00 1.40 C ATOM 1067 NE2 HIS A 72 15.701 -2.752 -6.102 1.00 1.11 N ATOM 0 H HIS A 72 12.505 -1.968 -3.244 1.00 0.37 H new ATOM 0 HA HIS A 72 14.389 0.192 -2.988 1.00 0.35 H new ATOM 0 HB2 HIS A 72 12.391 -0.664 -5.115 1.00 0.39 H new ATOM 0 HB3 HIS A 72 13.431 0.734 -5.298 1.00 0.39 H new ATOM 0 HD2 HIS A 72 13.544 -3.039 -5.820 1.00 0.61 H new ATOM 0 HE1 HIS A 72 17.558 -1.690 -6.073 1.00 1.40 H new ATOM 0 HE2 HIS A 72 15.995 -3.661 -6.459 1.00 1.11 H new ATOM 1076 N THR A 73 11.144 0.763 -2.864 1.00 0.34 N ATOM 1077 CA THR A 73 10.165 1.775 -2.500 1.00 0.38 C ATOM 1078 C THR A 73 10.463 2.296 -1.099 1.00 0.36 C ATOM 1079 O THR A 73 10.663 3.495 -0.893 1.00 0.36 O ATOM 1080 CB THR A 73 8.761 1.194 -2.564 1.00 0.47 C ATOM 1081 OG1 THR A 73 8.584 0.212 -1.561 1.00 0.77 O ATOM 1082 CG2 THR A 73 8.436 0.555 -3.897 1.00 0.61 C ATOM 0 H THR A 73 10.755 -0.158 -3.064 1.00 0.34 H new ATOM 0 HA THR A 73 10.226 2.604 -3.206 1.00 0.38 H new ATOM 0 HB THR A 73 8.089 2.039 -2.415 1.00 0.47 H new ATOM 0 HG1 THR A 73 8.356 0.648 -0.713 1.00 0.77 H new ATOM 0 HG21 THR A 73 7.420 0.161 -3.874 1.00 0.61 H new ATOM 0 HG22 THR A 73 8.518 1.301 -4.688 1.00 0.61 H new ATOM 0 HG23 THR A 73 9.136 -0.258 -4.091 1.00 0.61 H new ATOM 1090 N GLN A 74 10.518 1.376 -0.144 1.00 0.39 N ATOM 1091 CA GLN A 74 10.824 1.718 1.233 1.00 0.42 C ATOM 1092 C GLN A 74 12.241 2.262 1.319 1.00 0.41 C ATOM 1093 O GLN A 74 12.599 2.950 2.272 1.00 0.50 O ATOM 1094 CB GLN A 74 10.668 0.496 2.142 1.00 0.49 C ATOM 1095 CG GLN A 74 9.264 -0.087 2.139 1.00 1.45 C ATOM 1096 CD GLN A 74 9.101 -1.254 3.101 1.00 1.87 C ATOM 1097 OE1 GLN A 74 8.025 -1.847 3.190 1.00 2.25 O ATOM 1098 NE2 GLN A 74 10.163 -1.590 3.828 1.00 2.54 N ATOM 0 H GLN A 74 10.353 0.382 -0.303 1.00 0.39 H new ATOM 0 HA GLN A 74 10.124 2.482 1.570 1.00 0.42 H new ATOM 0 HB2 GLN A 74 11.373 -0.273 1.827 1.00 0.49 H new ATOM 0 HB3 GLN A 74 10.935 0.775 3.161 1.00 0.49 H new ATOM 0 HG2 GLN A 74 8.552 0.695 2.402 1.00 1.45 H new ATOM 0 HG3 GLN A 74 9.016 -0.418 1.130 1.00 1.45 H new ATOM 0 HE21 GLN A 74 11.036 -1.073 3.724 1.00 2.54 H new ATOM 0 HE22 GLN A 74 10.104 -2.364 4.489 1.00 2.54 H new ATOM 1107 N ARG A 75 13.038 1.974 0.296 1.00 0.37 N ATOM 1108 CA ARG A 75 14.403 2.469 0.247 1.00 0.41 C ATOM 1109 C ARG A 75 14.348 3.985 0.158 1.00 0.39 C ATOM 1110 O ARG A 75 15.176 4.700 0.731 1.00 0.43 O ATOM 1111 CB ARG A 75 15.142 1.890 -0.964 1.00 0.48 C ATOM 1112 CG ARG A 75 16.631 2.188 -0.985 1.00 0.89 C ATOM 1113 CD ARG A 75 17.275 1.679 -2.266 1.00 0.88 C ATOM 1114 NE ARG A 75 18.731 1.801 -2.226 1.00 1.59 N ATOM 1115 CZ ARG A 75 19.532 1.450 -3.228 1.00 2.26 C ATOM 1116 NH1 ARG A 75 19.023 0.960 -4.351 1.00 2.72 N ATOM 1117 NH2 ARG A 75 20.846 1.588 -3.107 1.00 3.06 N ATOM 0 H ARG A 75 12.762 1.404 -0.504 1.00 0.37 H new ATOM 0 HA ARG A 75 14.945 2.163 1.142 1.00 0.41 H new ATOM 0 HB2 ARG A 75 14.999 0.810 -0.981 1.00 0.48 H new ATOM 0 HB3 ARG A 75 14.691 2.285 -1.874 1.00 0.48 H new ATOM 0 HG2 ARG A 75 16.791 3.263 -0.896 1.00 0.89 H new ATOM 0 HG3 ARG A 75 17.110 1.722 -0.124 1.00 0.89 H new ATOM 0 HD2 ARG A 75 17.002 0.635 -2.421 1.00 0.88 H new ATOM 0 HD3 ARG A 75 16.886 2.240 -3.116 1.00 0.88 H new ATOM 0 HE ARG A 75 19.158 2.178 -1.380 1.00 1.59 H new ATOM 0 HH11 ARG A 75 18.014 0.851 -4.449 1.00 2.72 H new ATOM 0 HH12 ARG A 75 19.641 0.692 -5.117 1.00 2.72 H new ATOM 0 HH21 ARG A 75 21.242 1.963 -2.245 1.00 3.06 H new ATOM 0 HH22 ARG A 75 21.460 1.319 -3.876 1.00 3.06 H new ATOM 1131 N ILE A 76 13.326 4.461 -0.549 1.00 0.38 N ATOM 1132 CA ILE A 76 13.105 5.883 -0.711 1.00 0.41 C ATOM 1133 C ILE A 76 12.766 6.508 0.624 1.00 0.42 C ATOM 1134 O ILE A 76 13.411 7.448 1.055 1.00 0.44 O ATOM 1135 CB ILE A 76 11.963 6.183 -1.697 1.00 0.45 C ATOM 1136 CG1 ILE A 76 12.104 5.332 -2.958 1.00 0.55 C ATOM 1137 CG2 ILE A 76 11.946 7.659 -2.053 1.00 0.50 C ATOM 1138 CD1 ILE A 76 13.404 5.556 -3.705 1.00 0.83 C ATOM 0 H ILE A 76 12.638 3.873 -1.019 1.00 0.38 H new ATOM 0 HA ILE A 76 14.026 6.306 -1.111 1.00 0.41 H new ATOM 0 HB ILE A 76 11.018 5.930 -1.216 1.00 0.45 H new ATOM 0 HG12 ILE A 76 12.029 4.279 -2.685 1.00 0.55 H new ATOM 0 HG13 ILE A 76 11.270 5.548 -3.626 1.00 0.55 H new ATOM 0 HG21 ILE A 76 11.133 7.855 -2.751 1.00 0.50 H new ATOM 0 HG22 ILE A 76 11.799 8.250 -1.149 1.00 0.50 H new ATOM 0 HG23 ILE A 76 12.895 7.933 -2.515 1.00 0.50 H new ATOM 0 HD11 ILE A 76 13.431 4.917 -4.588 1.00 0.83 H new ATOM 0 HD12 ILE A 76 13.473 6.600 -4.010 1.00 0.83 H new ATOM 0 HD13 ILE A 76 14.244 5.312 -3.055 1.00 0.83 H new ATOM 1150 N GLU A 77 11.747 5.976 1.278 1.00 0.44 N ATOM 1151 CA GLU A 77 11.337 6.501 2.568 1.00 0.47 C ATOM 1152 C GLU A 77 12.486 6.453 3.570 1.00 0.48 C ATOM 1153 O GLU A 77 12.542 7.265 4.491 1.00 0.54 O ATOM 1154 CB GLU A 77 10.113 5.748 3.087 1.00 0.50 C ATOM 1155 CG GLU A 77 10.321 4.261 3.329 1.00 0.66 C ATOM 1156 CD GLU A 77 11.099 3.951 4.597 1.00 0.97 C ATOM 1157 OE1 GLU A 77 11.355 4.892 5.377 1.00 1.43 O ATOM 1158 OE2 GLU A 77 11.470 2.777 4.801 1.00 1.32 O ATOM 0 H GLU A 77 11.194 5.188 0.941 1.00 0.44 H new ATOM 0 HA GLU A 77 11.060 7.547 2.440 1.00 0.47 H new ATOM 0 HB2 GLU A 77 9.791 6.210 4.020 1.00 0.50 H new ATOM 0 HB3 GLU A 77 9.300 5.873 2.372 1.00 0.50 H new ATOM 0 HG2 GLU A 77 9.349 3.771 3.381 1.00 0.66 H new ATOM 0 HG3 GLU A 77 10.848 3.833 2.476 1.00 0.66 H new ATOM 1165 N LEU A 78 13.409 5.513 3.380 1.00 0.45 N ATOM 1166 CA LEU A 78 14.559 5.395 4.273 1.00 0.49 C ATOM 1167 C LEU A 78 15.342 6.702 4.301 1.00 0.49 C ATOM 1168 O LEU A 78 15.655 7.227 5.369 1.00 0.59 O ATOM 1169 CB LEU A 78 15.475 4.248 3.840 1.00 0.53 C ATOM 1170 CG LEU A 78 14.944 2.842 4.125 1.00 0.88 C ATOM 1171 CD1 LEU A 78 15.899 1.792 3.581 1.00 1.66 C ATOM 1172 CD2 LEU A 78 14.730 2.644 5.620 1.00 1.52 C ATOM 0 H LEU A 78 13.384 4.829 2.624 1.00 0.45 H new ATOM 0 HA LEU A 78 14.187 5.179 5.275 1.00 0.49 H new ATOM 0 HB2 LEU A 78 15.661 4.338 2.770 1.00 0.53 H new ATOM 0 HB3 LEU A 78 16.436 4.364 4.341 1.00 0.53 H new ATOM 0 HG LEU A 78 13.984 2.729 3.622 1.00 0.88 H new ATOM 0 HD11 LEU A 78 15.506 0.798 3.793 1.00 1.66 H new ATOM 0 HD12 LEU A 78 16.004 1.919 2.504 1.00 1.66 H new ATOM 0 HD13 LEU A 78 16.873 1.905 4.056 1.00 1.66 H new ATOM 0 HD21 LEU A 78 14.352 1.638 5.803 1.00 1.52 H new ATOM 0 HD22 LEU A 78 15.677 2.777 6.144 1.00 1.52 H new ATOM 0 HD23 LEU A 78 14.008 3.375 5.984 1.00 1.52 H new ATOM 1184 N GLN A 79 15.646 7.227 3.118 1.00 0.47 N ATOM 1185 CA GLN A 79 16.386 8.481 3.010 1.00 0.52 C ATOM 1186 C GLN A 79 15.443 9.651 2.717 1.00 0.53 C ATOM 1187 O GLN A 79 15.476 10.673 3.402 1.00 0.72 O ATOM 1188 CB GLN A 79 17.461 8.376 1.925 1.00 0.63 C ATOM 1189 CG GLN A 79 16.918 7.997 0.556 1.00 1.12 C ATOM 1190 CD GLN A 79 18.013 7.840 -0.482 1.00 1.67 C ATOM 1191 OE1 GLN A 79 18.896 6.991 -0.345 1.00 2.24 O ATOM 1192 NE2 GLN A 79 17.965 8.662 -1.523 1.00 2.32 N ATOM 0 H GLN A 79 15.393 6.806 2.224 1.00 0.47 H new ATOM 0 HA GLN A 79 16.873 8.670 3.967 1.00 0.52 H new ATOM 0 HB2 GLN A 79 17.980 9.331 1.848 1.00 0.63 H new ATOM 0 HB3 GLN A 79 18.200 7.635 2.230 1.00 0.63 H new ATOM 0 HG2 GLN A 79 16.361 7.063 0.636 1.00 1.12 H new ATOM 0 HG3 GLN A 79 16.214 8.760 0.224 1.00 1.12 H new ATOM 0 HE21 GLN A 79 17.215 9.350 -1.596 1.00 2.32 H new ATOM 0 HE22 GLN A 79 18.678 8.606 -2.250 1.00 2.32 H new ATOM 1201 N GLN A 80 14.610 9.489 1.696 1.00 0.61 N ATOM 1202 CA GLN A 80 13.658 10.520 1.298 1.00 0.72 C ATOM 1203 C GLN A 80 12.614 10.792 2.379 1.00 0.88 C ATOM 1204 O GLN A 80 12.164 11.927 2.537 1.00 1.15 O ATOM 1205 CB GLN A 80 12.976 10.141 -0.017 1.00 0.74 C ATOM 1206 CG GLN A 80 13.917 10.161 -1.213 1.00 1.27 C ATOM 1207 CD GLN A 80 14.493 11.539 -1.487 1.00 1.51 C ATOM 1208 OE1 GLN A 80 15.209 12.102 -0.659 1.00 2.00 O ATOM 1209 NE2 GLN A 80 14.179 12.089 -2.653 1.00 2.07 N ATOM 0 H GLN A 80 14.575 8.645 1.124 1.00 0.61 H new ATOM 0 HA GLN A 80 14.224 11.441 1.155 1.00 0.72 H new ATOM 0 HB2 GLN A 80 12.545 9.145 0.080 1.00 0.74 H new ATOM 0 HB3 GLN A 80 12.151 10.829 -0.201 1.00 0.74 H new ATOM 0 HG2 GLN A 80 14.733 9.459 -1.039 1.00 1.27 H new ATOM 0 HG3 GLN A 80 13.381 9.814 -2.097 1.00 1.27 H new ATOM 0 HE21 GLN A 80 13.582 11.586 -3.310 1.00 2.07 H new ATOM 0 HE22 GLN A 80 14.535 13.015 -2.893 1.00 2.07 H new ATOM 1218 N GLY A 81 12.221 9.757 3.122 1.00 0.99 N ATOM 1219 CA GLY A 81 11.231 9.937 4.164 1.00 1.25 C ATOM 1220 C GLY A 81 11.783 10.624 5.401 1.00 1.79 C ATOM 1221 O GLY A 81 11.162 10.584 6.463 1.00 2.18 O ATOM 0 H GLY A 81 12.570 8.804 3.019 1.00 0.99 H new ATOM 0 HA2 GLY A 81 10.401 10.524 3.770 1.00 1.25 H new ATOM 0 HA3 GLY A 81 10.828 8.964 4.446 1.00 1.25 H new ATOM 1225 N ARG A 82 12.948 11.253 5.267 1.00 2.09 N ATOM 1226 CA ARG A 82 13.574 11.948 6.389 1.00 2.89 C ATOM 1227 C ARG A 82 13.798 10.996 7.561 1.00 2.71 C ATOM 1228 O ARG A 82 13.619 11.369 8.718 1.00 3.22 O ATOM 1229 CB ARG A 82 12.701 13.126 6.834 1.00 3.76 C ATOM 1230 CG ARG A 82 12.566 14.226 5.792 1.00 4.75 C ATOM 1231 CD ARG A 82 13.805 15.111 5.740 1.00 5.59 C ATOM 1232 NE ARG A 82 15.002 14.382 5.329 1.00 6.37 N ATOM 1233 CZ ARG A 82 15.162 13.836 4.126 1.00 7.14 C ATOM 1234 NH1 ARG A 82 14.197 13.920 3.217 1.00 7.29 N ATOM 1235 NH2 ARG A 82 16.290 13.204 3.830 1.00 8.02 N ATOM 0 H ARG A 82 13.476 11.296 4.396 1.00 2.09 H new ATOM 0 HA ARG A 82 14.542 12.324 6.059 1.00 2.89 H new ATOM 0 HB2 ARG A 82 11.708 12.754 7.085 1.00 3.76 H new ATOM 0 HB3 ARG A 82 13.121 13.552 7.745 1.00 3.76 H new ATOM 0 HG2 ARG A 82 12.397 13.780 4.812 1.00 4.75 H new ATOM 0 HG3 ARG A 82 11.692 14.837 6.019 1.00 4.75 H new ATOM 0 HD2 ARG A 82 13.630 15.934 5.047 1.00 5.59 H new ATOM 0 HD3 ARG A 82 13.973 15.552 6.723 1.00 5.59 H new ATOM 0 HE ARG A 82 15.760 14.286 6.004 1.00 6.37 H new ATOM 0 HH11 ARG A 82 13.328 14.405 3.439 1.00 7.29 H new ATOM 0 HH12 ARG A 82 14.325 13.500 2.297 1.00 7.29 H new ATOM 0 HH21 ARG A 82 17.034 13.137 4.524 1.00 8.02 H new ATOM 0 HH22 ARG A 82 16.413 12.785 2.908 1.00 8.02 H new ATOM 1249 N VAL A 83 14.188 9.764 7.253 1.00 2.65 N ATOM 1250 CA VAL A 83 14.433 8.759 8.285 1.00 2.95 C ATOM 1251 C VAL A 83 15.897 8.339 8.276 1.00 2.78 C ATOM 1252 O VAL A 83 16.725 8.986 7.635 1.00 3.48 O ATOM 1253 CB VAL A 83 13.559 7.510 8.065 1.00 3.70 C ATOM 1254 CG1 VAL A 83 13.292 6.792 9.380 1.00 4.50 C ATOM 1255 CG2 VAL A 83 12.256 7.877 7.375 1.00 4.33 C ATOM 0 H VAL A 83 14.341 9.436 6.299 1.00 2.65 H new ATOM 0 HA VAL A 83 14.179 9.207 9.246 1.00 2.95 H new ATOM 0 HB VAL A 83 14.106 6.827 7.415 1.00 3.70 H new ATOM 0 HG11 VAL A 83 12.673 5.914 9.196 1.00 4.50 H new ATOM 0 HG12 VAL A 83 14.238 6.482 9.824 1.00 4.50 H new ATOM 0 HG13 VAL A 83 12.774 7.465 10.063 1.00 4.50 H new ATOM 0 HG21 VAL A 83 11.655 6.979 7.230 1.00 4.33 H new ATOM 0 HG22 VAL A 83 11.705 8.587 7.992 1.00 4.33 H new ATOM 0 HG23 VAL A 83 12.472 8.329 6.407 1.00 4.33 H new ATOM 1265 N ARG A 84 16.203 7.247 8.979 1.00 2.54 N ATOM 1266 CA ARG A 84 17.563 6.721 9.045 1.00 3.37 C ATOM 1267 C ARG A 84 18.478 7.646 9.844 1.00 3.75 C ATOM 1268 O ARG A 84 18.894 7.313 10.954 1.00 4.35 O ATOM 1269 CB ARG A 84 18.115 6.514 7.633 1.00 3.92 C ATOM 1270 CG ARG A 84 19.522 5.947 7.596 1.00 4.19 C ATOM 1271 CD ARG A 84 19.571 4.497 8.062 1.00 5.23 C ATOM 1272 NE ARG A 84 19.290 4.360 9.488 1.00 5.75 N ATOM 1273 CZ ARG A 84 19.263 3.193 10.126 1.00 6.40 C ATOM 1274 NH1 ARG A 84 19.494 2.066 9.463 1.00 6.67 N ATOM 1275 NH2 ARG A 84 19.006 3.151 11.426 1.00 7.08 N ATOM 0 H ARG A 84 15.521 6.709 9.513 1.00 2.54 H new ATOM 0 HA ARG A 84 17.530 5.760 9.559 1.00 3.37 H new ATOM 0 HB2 ARG A 84 17.450 5.843 7.089 1.00 3.92 H new ATOM 0 HB3 ARG A 84 18.105 7.469 7.107 1.00 3.92 H new ATOM 0 HG2 ARG A 84 19.912 6.014 6.580 1.00 4.19 H new ATOM 0 HG3 ARG A 84 20.172 6.552 8.228 1.00 4.19 H new ATOM 0 HD2 ARG A 84 18.848 3.911 7.494 1.00 5.23 H new ATOM 0 HD3 ARG A 84 20.556 4.082 7.847 1.00 5.23 H new ATOM 0 HE ARG A 84 19.104 5.207 10.025 1.00 5.75 H new ATOM 0 HH11 ARG A 84 19.693 2.094 8.463 1.00 6.67 H new ATOM 0 HH12 ARG A 84 19.473 1.172 9.954 1.00 6.67 H new ATOM 0 HH21 ARG A 84 18.828 4.015 11.939 1.00 7.08 H new ATOM 0 HH22 ARG A 84 18.986 2.255 11.913 1.00 7.08 H new ATOM 1289 N LYS A 85 18.788 8.804 9.274 1.00 4.00 N ATOM 1290 CA LYS A 85 19.652 9.774 9.935 1.00 4.93 C ATOM 1291 C LYS A 85 18.849 10.961 10.454 1.00 5.06 C ATOM 1292 O LYS A 85 19.409 12.000 10.806 1.00 5.81 O ATOM 1293 CB LYS A 85 20.754 10.242 8.977 1.00 5.72 C ATOM 1294 CG LYS A 85 20.275 10.513 7.556 1.00 6.56 C ATOM 1295 CD LYS A 85 19.313 11.690 7.487 1.00 7.22 C ATOM 1296 CE LYS A 85 18.811 11.915 6.069 1.00 8.23 C ATOM 1297 NZ LYS A 85 19.928 12.178 5.120 1.00 8.70 N ATOM 0 H LYS A 85 18.454 9.094 8.355 1.00 4.00 H new ATOM 0 HA LYS A 85 20.118 9.288 10.792 1.00 4.93 H new ATOM 0 HB2 LYS A 85 21.204 11.151 9.376 1.00 5.72 H new ATOM 0 HB3 LYS A 85 21.538 9.485 8.946 1.00 5.72 H new ATOM 0 HG2 LYS A 85 21.135 10.711 6.916 1.00 6.56 H new ATOM 0 HG3 LYS A 85 19.785 9.622 7.164 1.00 6.56 H new ATOM 0 HD2 LYS A 85 18.467 11.509 8.150 1.00 7.22 H new ATOM 0 HD3 LYS A 85 19.812 12.591 7.845 1.00 7.22 H new ATOM 0 HE2 LYS A 85 18.252 11.039 5.738 1.00 8.23 H new ATOM 0 HE3 LYS A 85 18.119 12.757 6.058 1.00 8.23 H new ATOM 0 HZ1 LYS A 85 19.543 12.524 4.218 1.00 8.70 H new ATOM 0 HZ2 LYS A 85 20.564 12.895 5.523 1.00 8.70 H new ATOM 0 HZ3 LYS A 85 20.458 11.298 4.955 1.00 8.70 H new ATOM 1311 N ALA A 86 17.529 10.797 10.505 1.00 4.58 N ATOM 1312 CA ALA A 86 16.644 11.849 10.986 1.00 4.96 C ATOM 1313 C ALA A 86 15.516 11.270 11.833 1.00 4.23 C ATOM 1314 O ALA A 86 15.410 11.563 13.024 1.00 4.67 O ATOM 1315 CB ALA A 86 16.082 12.645 9.817 1.00 5.68 C ATOM 0 H ALA A 86 17.050 9.943 10.218 1.00 4.58 H new ATOM 0 HA ALA A 86 17.226 12.521 11.616 1.00 4.96 H new ATOM 0 HB1 ALA A 86 15.423 13.427 10.193 1.00 5.68 H new ATOM 0 HB2 ALA A 86 16.901 13.098 9.258 1.00 5.68 H new ATOM 0 HB3 ALA A 86 15.519 11.980 9.161 1.00 5.68 H new ATOM 1321 N GLU A 87 14.676 10.440 11.218 1.00 3.27 N ATOM 1322 CA GLU A 87 13.562 9.818 11.930 1.00 2.78 C ATOM 1323 C GLU A 87 13.930 8.422 12.419 1.00 2.78 C ATOM 1324 O GLU A 87 14.862 7.801 11.911 1.00 3.47 O ATOM 1325 CB GLU A 87 12.326 9.750 11.032 1.00 2.42 C ATOM 1326 CG GLU A 87 11.397 10.950 11.168 1.00 3.19 C ATOM 1327 CD GLU A 87 12.070 12.273 10.848 1.00 3.92 C ATOM 1328 OE1 GLU A 87 12.992 12.663 11.596 1.00 4.37 O ATOM 1329 OE2 GLU A 87 11.678 12.918 9.854 1.00 4.46 O ATOM 0 H GLU A 87 14.745 10.184 10.233 1.00 3.27 H new ATOM 0 HA GLU A 87 13.336 10.435 12.800 1.00 2.78 H new ATOM 0 HB2 GLU A 87 12.647 9.668 9.994 1.00 2.42 H new ATOM 0 HB3 GLU A 87 11.769 8.843 11.266 1.00 2.42 H new ATOM 0 HG2 GLU A 87 10.543 10.816 10.505 1.00 3.19 H new ATOM 0 HG3 GLU A 87 11.008 10.985 12.186 1.00 3.19 H new ATOM 1336 N ARG A 88 13.190 7.935 13.414 1.00 2.49 N ATOM 1337 CA ARG A 88 13.441 6.612 13.976 1.00 2.70 C ATOM 1338 C ARG A 88 12.196 6.057 14.664 1.00 2.60 C ATOM 1339 O ARG A 88 12.023 4.843 14.766 1.00 3.18 O ATOM 1340 CB ARG A 88 14.599 6.671 14.974 1.00 3.45 C ATOM 1341 CG ARG A 88 14.301 7.511 16.205 1.00 4.14 C ATOM 1342 CD ARG A 88 15.509 7.597 17.126 1.00 4.97 C ATOM 1343 NE ARG A 88 15.210 8.324 18.359 1.00 5.51 N ATOM 1344 CZ ARG A 88 14.346 7.897 19.279 1.00 6.30 C ATOM 1345 NH1 ARG A 88 13.705 6.748 19.111 1.00 6.63 N ATOM 1346 NH2 ARG A 88 14.127 8.620 20.369 1.00 7.05 N ATOM 0 H ARG A 88 12.414 8.437 13.846 1.00 2.49 H new ATOM 0 HA ARG A 88 13.705 5.946 13.154 1.00 2.70 H new ATOM 0 HB2 ARG A 88 14.849 5.658 15.288 1.00 3.45 H new ATOM 0 HB3 ARG A 88 15.479 7.075 14.473 1.00 3.45 H new ATOM 0 HG2 ARG A 88 14.003 8.514 15.899 1.00 4.14 H new ATOM 0 HG3 ARG A 88 13.459 7.079 16.746 1.00 4.14 H new ATOM 0 HD2 ARG A 88 15.849 6.591 17.372 1.00 4.97 H new ATOM 0 HD3 ARG A 88 16.328 8.091 16.604 1.00 4.97 H new ATOM 0 HE ARG A 88 15.690 9.209 18.524 1.00 5.51 H new ATOM 0 HH11 ARG A 88 13.873 6.188 18.275 1.00 6.63 H new ATOM 0 HH12 ARG A 88 13.044 6.425 19.818 1.00 6.63 H new ATOM 0 HH21 ARG A 88 14.620 9.503 20.503 1.00 7.05 H new ATOM 0 HH22 ARG A 88 13.466 8.293 21.073 1.00 7.05 H new ATOM 1360 N TRP A 89 11.335 6.952 15.145 1.00 2.49 N ATOM 1361 CA TRP A 89 10.114 6.541 15.830 1.00 2.93 C ATOM 1362 C TRP A 89 8.992 7.555 15.608 1.00 2.93 C ATOM 1363 O TRP A 89 9.245 8.714 15.279 1.00 3.71 O ATOM 1364 CB TRP A 89 10.384 6.379 17.329 1.00 3.69 C ATOM 1365 CG TRP A 89 9.221 5.822 18.094 1.00 4.09 C ATOM 1366 CD1 TRP A 89 8.654 6.347 19.219 1.00 4.50 C ATOM 1367 CD2 TRP A 89 8.490 4.625 17.797 1.00 4.70 C ATOM 1368 NE1 TRP A 89 7.612 5.556 19.636 1.00 5.25 N ATOM 1369 CE2 TRP A 89 7.491 4.493 18.780 1.00 5.32 C ATOM 1370 CE3 TRP A 89 8.579 3.657 16.793 1.00 5.16 C ATOM 1371 CZ2 TRP A 89 6.591 3.430 18.788 1.00 6.18 C ATOM 1372 CZ3 TRP A 89 7.686 2.602 16.803 1.00 6.02 C ATOM 1373 CH2 TRP A 89 6.703 2.496 17.794 1.00 6.44 C ATOM 0 H TRP A 89 11.461 7.962 15.073 1.00 2.49 H new ATOM 0 HA TRP A 89 9.796 5.584 15.415 1.00 2.93 H new ATOM 0 HB2 TRP A 89 11.245 5.724 17.465 1.00 3.69 H new ATOM 0 HB3 TRP A 89 10.652 7.349 17.748 1.00 3.69 H new ATOM 0 HD1 TRP A 89 8.978 7.253 19.710 1.00 4.50 H new ATOM 0 HE1 TRP A 89 7.024 5.731 20.451 1.00 5.25 H new ATOM 0 HE3 TRP A 89 9.332 3.732 16.023 1.00 5.16 H new ATOM 0 HZ2 TRP A 89 5.832 3.346 19.551 1.00 6.18 H new ATOM 0 HZ3 TRP A 89 7.748 1.847 16.033 1.00 6.02 H new ATOM 0 HH2 TRP A 89 6.019 1.660 17.774 1.00 6.44 H new ATOM 1384 N GLY A 90 7.751 7.106 15.788 1.00 2.39 N ATOM 1385 CA GLY A 90 6.608 7.981 15.604 1.00 2.51 C ATOM 1386 C GLY A 90 6.121 7.997 14.167 1.00 2.11 C ATOM 1387 O GLY A 90 6.277 7.008 13.451 1.00 2.15 O ATOM 0 H GLY A 90 7.518 6.150 16.058 1.00 2.39 H new ATOM 0 HA2 GLY A 90 5.797 7.658 16.257 1.00 2.51 H new ATOM 0 HA3 GLY A 90 6.876 8.994 15.906 1.00 2.51 H new ATOM 1391 N PRO A 91 5.525 9.115 13.707 1.00 1.87 N ATOM 1392 CA PRO A 91 5.025 9.234 12.333 1.00 1.71 C ATOM 1393 C PRO A 91 6.154 9.165 11.309 1.00 1.71 C ATOM 1394 O PRO A 91 7.177 8.522 11.546 1.00 2.14 O ATOM 1395 CB PRO A 91 4.357 10.613 12.306 1.00 1.86 C ATOM 1396 CG PRO A 91 4.992 11.366 13.423 1.00 2.00 C ATOM 1397 CD PRO A 91 5.296 10.347 14.484 1.00 1.98 C ATOM 0 HA PRO A 91 4.347 8.421 12.072 1.00 1.71 H new ATOM 0 HB2 PRO A 91 4.519 11.112 11.351 1.00 1.86 H new ATOM 0 HB3 PRO A 91 3.279 10.533 12.446 1.00 1.86 H new ATOM 0 HG2 PRO A 91 5.901 11.867 13.090 1.00 2.00 H new ATOM 0 HG3 PRO A 91 4.324 12.139 13.803 1.00 2.00 H new ATOM 0 HD2 PRO A 91 6.173 10.624 15.069 1.00 1.98 H new ATOM 0 HD3 PRO A 91 4.468 10.234 15.184 1.00 1.98 H new ATOM 1405 N ARG A 92 5.966 9.829 10.169 1.00 2.00 N ATOM 1406 CA ARG A 92 6.976 9.838 9.114 1.00 2.09 C ATOM 1407 C ARG A 92 7.241 8.423 8.610 1.00 1.39 C ATOM 1408 O ARG A 92 6.627 7.463 9.074 1.00 1.88 O ATOM 1409 CB ARG A 92 8.286 10.437 9.636 1.00 3.24 C ATOM 1410 CG ARG A 92 8.162 11.859 10.160 1.00 4.14 C ATOM 1411 CD ARG A 92 8.062 12.869 9.028 1.00 4.91 C ATOM 1412 NE ARG A 92 8.029 14.242 9.525 1.00 5.90 N ATOM 1413 CZ ARG A 92 7.984 15.311 8.736 1.00 6.64 C ATOM 1414 NH1 ARG A 92 7.970 15.168 7.419 1.00 6.67 N ATOM 1415 NH2 ARG A 92 7.958 16.526 9.267 1.00 7.60 N ATOM 0 H ARG A 92 5.126 10.366 9.954 1.00 2.00 H new ATOM 0 HA ARG A 92 6.598 10.447 8.293 1.00 2.09 H new ATOM 0 HB2 ARG A 92 8.670 9.801 10.434 1.00 3.24 H new ATOM 0 HB3 ARG A 92 9.024 10.422 8.834 1.00 3.24 H new ATOM 0 HG2 ARG A 92 7.280 11.937 10.796 1.00 4.14 H new ATOM 0 HG3 ARG A 92 9.026 12.094 10.782 1.00 4.14 H new ATOM 0 HD2 ARG A 92 8.911 12.746 8.356 1.00 4.91 H new ATOM 0 HD3 ARG A 92 7.163 12.672 8.444 1.00 4.91 H new ATOM 0 HE ARG A 92 8.041 14.389 10.534 1.00 5.90 H new ATOM 0 HH11 ARG A 92 7.994 14.235 7.007 1.00 6.67 H new ATOM 0 HH12 ARG A 92 7.935 15.991 6.817 1.00 6.67 H new ATOM 0 HH21 ARG A 92 7.973 16.640 10.280 1.00 7.60 H new ATOM 0 HH22 ARG A 92 7.923 17.346 8.662 1.00 7.60 H new ATOM 1429 N THR A 93 8.176 8.310 7.671 1.00 1.14 N ATOM 1430 CA THR A 93 8.561 7.019 7.106 1.00 1.33 C ATOM 1431 C THR A 93 7.433 6.388 6.302 1.00 1.11 C ATOM 1432 O THR A 93 6.387 6.029 6.842 1.00 1.61 O ATOM 1433 CB THR A 93 9.005 6.062 8.217 1.00 1.94 C ATOM 1434 OG1 THR A 93 10.093 6.603 8.942 1.00 2.57 O ATOM 1435 CG2 THR A 93 9.426 4.700 7.707 1.00 2.58 C ATOM 0 H THR A 93 8.685 9.104 7.282 1.00 1.14 H new ATOM 0 HA THR A 93 9.394 7.200 6.426 1.00 1.33 H new ATOM 0 HB THR A 93 8.129 5.938 8.853 1.00 1.94 H new ATOM 0 HG1 THR A 93 10.360 5.977 9.647 1.00 2.57 H new ATOM 0 HG21 THR A 93 9.728 4.074 8.547 1.00 2.58 H new ATOM 0 HG22 THR A 93 8.590 4.232 7.188 1.00 2.58 H new ATOM 0 HG23 THR A 93 10.264 4.812 7.019 1.00 2.58 H new ATOM 1443 N LEU A 94 7.673 6.235 5.004 1.00 0.80 N ATOM 1444 CA LEU A 94 6.706 5.622 4.107 1.00 0.54 C ATOM 1445 C LEU A 94 6.746 4.107 4.253 1.00 0.52 C ATOM 1446 O LEU A 94 7.770 3.527 4.613 1.00 0.65 O ATOM 1447 CB LEU A 94 6.970 6.046 2.659 1.00 0.48 C ATOM 1448 CG LEU A 94 6.205 5.280 1.572 1.00 0.52 C ATOM 1449 CD1 LEU A 94 6.912 3.972 1.241 1.00 1.39 C ATOM 1450 CD2 LEU A 94 4.748 5.053 1.951 1.00 1.37 C ATOM 0 H LEU A 94 8.537 6.530 4.549 1.00 0.80 H new ATOM 0 HA LEU A 94 5.707 5.965 4.376 1.00 0.54 H new ATOM 0 HB2 LEU A 94 6.729 7.105 2.564 1.00 0.48 H new ATOM 0 HB3 LEU A 94 8.037 5.943 2.462 1.00 0.48 H new ATOM 0 HG LEU A 94 6.198 5.897 0.674 1.00 0.52 H new ATOM 0 HD11 LEU A 94 6.355 3.443 0.468 1.00 1.39 H new ATOM 0 HD12 LEU A 94 7.919 4.184 0.882 1.00 1.39 H new ATOM 0 HD13 LEU A 94 6.969 3.352 2.136 1.00 1.39 H new ATOM 0 HD21 LEU A 94 4.245 4.507 1.153 1.00 1.37 H new ATOM 0 HD22 LEU A 94 4.698 4.474 2.873 1.00 1.37 H new ATOM 0 HD23 LEU A 94 4.256 6.015 2.099 1.00 1.37 H new ATOM 1462 N ASP A 95 5.606 3.485 4.019 1.00 0.49 N ATOM 1463 CA ASP A 95 5.458 2.054 4.163 1.00 0.56 C ATOM 1464 C ASP A 95 4.529 1.469 3.098 1.00 0.48 C ATOM 1465 O ASP A 95 3.346 1.807 3.055 1.00 0.65 O ATOM 1466 CB ASP A 95 4.850 1.849 5.525 1.00 0.87 C ATOM 1467 CG ASP A 95 4.339 0.439 5.775 1.00 1.51 C ATOM 1468 OD1 ASP A 95 4.588 -0.439 4.921 1.00 1.92 O ATOM 1469 OD2 ASP A 95 3.677 0.213 6.810 1.00 2.19 O ATOM 0 H ASP A 95 4.755 3.962 3.723 1.00 0.49 H new ATOM 0 HA ASP A 95 6.420 1.555 4.048 1.00 0.56 H new ATOM 0 HB2 ASP A 95 5.594 2.093 6.283 1.00 0.87 H new ATOM 0 HB3 ASP A 95 4.025 2.550 5.651 1.00 0.87 H new ATOM 1474 N LEU A 96 5.050 0.576 2.261 1.00 0.48 N ATOM 1475 CA LEU A 96 4.220 -0.050 1.236 1.00 0.63 C ATOM 1476 C LEU A 96 4.570 -1.520 1.036 1.00 0.60 C ATOM 1477 O LEU A 96 5.742 -1.899 1.005 1.00 0.76 O ATOM 1478 CB LEU A 96 4.316 0.707 -0.086 1.00 0.97 C ATOM 1479 CG LEU A 96 5.663 0.658 -0.799 1.00 0.98 C ATOM 1480 CD1 LEU A 96 5.741 -0.552 -1.718 1.00 1.91 C ATOM 1481 CD2 LEU A 96 5.871 1.942 -1.575 1.00 2.04 C ATOM 0 H LEU A 96 6.024 0.274 2.270 1.00 0.48 H new ATOM 0 HA LEU A 96 3.190 -0.003 1.589 1.00 0.63 H new ATOM 0 HB2 LEU A 96 3.557 0.312 -0.762 1.00 0.97 H new ATOM 0 HB3 LEU A 96 4.065 1.751 0.099 1.00 0.97 H new ATOM 0 HG LEU A 96 6.457 0.561 -0.058 1.00 0.98 H new ATOM 0 HD11 LEU A 96 6.710 -0.568 -2.217 1.00 1.91 H new ATOM 0 HD12 LEU A 96 5.620 -1.463 -1.132 1.00 1.91 H new ATOM 0 HD13 LEU A 96 4.949 -0.493 -2.465 1.00 1.91 H new ATOM 0 HD21 LEU A 96 6.834 1.907 -2.085 1.00 2.04 H new ATOM 0 HD22 LEU A 96 5.075 2.056 -2.311 1.00 2.04 H new ATOM 0 HD23 LEU A 96 5.854 2.789 -0.889 1.00 2.04 H new ATOM 1493 N ASP A 97 3.534 -2.334 0.889 1.00 0.55 N ATOM 1494 CA ASP A 97 3.690 -3.769 0.675 1.00 0.62 C ATOM 1495 C ASP A 97 2.560 -4.289 -0.193 1.00 0.56 C ATOM 1496 O ASP A 97 1.486 -3.692 -0.260 1.00 0.70 O ATOM 1497 CB ASP A 97 3.722 -4.516 2.010 1.00 0.79 C ATOM 1498 CG ASP A 97 2.473 -4.287 2.842 1.00 1.45 C ATOM 1499 OD1 ASP A 97 1.596 -3.519 2.392 1.00 1.98 O ATOM 1500 OD2 ASP A 97 2.369 -4.875 3.939 1.00 2.17 O ATOM 0 H ASP A 97 2.564 -2.021 0.914 1.00 0.55 H new ATOM 0 HA ASP A 97 4.638 -3.943 0.165 1.00 0.62 H new ATOM 0 HB2 ASP A 97 3.837 -5.583 1.821 1.00 0.79 H new ATOM 0 HB3 ASP A 97 4.595 -4.197 2.579 1.00 0.79 H new ATOM 1505 N ILE A 98 2.815 -5.395 -0.865 1.00 0.69 N ATOM 1506 CA ILE A 98 1.831 -5.993 -1.747 1.00 0.63 C ATOM 1507 C ILE A 98 0.665 -6.615 -0.994 1.00 0.67 C ATOM 1508 O ILE A 98 0.791 -7.003 0.165 1.00 0.93 O ATOM 1509 CB ILE A 98 2.477 -7.079 -2.625 1.00 0.74 C ATOM 1510 CG1 ILE A 98 3.459 -7.924 -1.801 1.00 1.91 C ATOM 1511 CG2 ILE A 98 3.178 -6.447 -3.815 1.00 1.40 C ATOM 1512 CD1 ILE A 98 2.815 -8.753 -0.710 1.00 2.73 C ATOM 0 H ILE A 98 3.700 -5.900 -0.816 1.00 0.69 H new ATOM 0 HA ILE A 98 1.447 -5.180 -2.363 1.00 0.63 H new ATOM 0 HB ILE A 98 1.692 -7.737 -2.998 1.00 0.74 H new ATOM 0 HG12 ILE A 98 3.999 -8.590 -2.474 1.00 1.91 H new ATOM 0 HG13 ILE A 98 4.197 -7.262 -1.348 1.00 1.91 H new ATOM 0 HG21 ILE A 98 3.630 -7.227 -4.427 1.00 1.40 H new ATOM 0 HG22 ILE A 98 2.454 -5.892 -4.411 1.00 1.40 H new ATOM 0 HG23 ILE A 98 3.954 -5.768 -3.462 1.00 1.40 H new ATOM 0 HD11 ILE A 98 3.583 -9.317 -0.180 1.00 2.73 H new ATOM 0 HD12 ILE A 98 2.299 -8.096 -0.010 1.00 2.73 H new ATOM 0 HD13 ILE A 98 2.098 -9.444 -1.153 1.00 2.73 H new ATOM 1524 N MET A 99 -0.454 -6.740 -1.691 1.00 0.53 N ATOM 1525 CA MET A 99 -1.646 -7.366 -1.151 1.00 0.63 C ATOM 1526 C MET A 99 -1.909 -8.652 -1.921 1.00 0.63 C ATOM 1527 O MET A 99 -2.502 -9.590 -1.403 1.00 0.87 O ATOM 1528 CB MET A 99 -2.848 -6.424 -1.225 1.00 0.70 C ATOM 1529 CG MET A 99 -3.040 -5.597 0.034 1.00 0.93 C ATOM 1530 SD MET A 99 -1.534 -4.750 0.547 1.00 1.77 S ATOM 1531 CE MET A 99 -2.059 -4.048 2.108 1.00 2.48 C ATOM 0 H MET A 99 -0.559 -6.408 -2.650 1.00 0.53 H new ATOM 0 HA MET A 99 -1.490 -7.596 -0.097 1.00 0.63 H new ATOM 0 HB2 MET A 99 -2.724 -5.754 -2.076 1.00 0.70 H new ATOM 0 HB3 MET A 99 -3.749 -7.009 -1.408 1.00 0.70 H new ATOM 0 HG2 MET A 99 -3.826 -4.861 -0.136 1.00 0.93 H new ATOM 0 HG3 MET A 99 -3.380 -6.246 0.841 1.00 0.93 H new ATOM 0 HE1 MET A 99 -1.265 -3.418 2.509 1.00 2.48 H new ATOM 0 HE2 MET A 99 -2.956 -3.448 1.954 1.00 2.48 H new ATOM 0 HE3 MET A 99 -2.277 -4.850 2.813 1.00 2.48 H new ATOM 1541 N LEU A 100 -1.432 -8.673 -3.169 1.00 0.51 N ATOM 1542 CA LEU A 100 -1.571 -9.835 -4.056 1.00 0.55 C ATOM 1543 C LEU A 100 -0.417 -9.852 -5.061 1.00 0.54 C ATOM 1544 O LEU A 100 0.240 -8.830 -5.259 1.00 0.76 O ATOM 1545 CB LEU A 100 -2.902 -9.803 -4.822 1.00 0.75 C ATOM 1546 CG LEU A 100 -4.177 -9.776 -3.976 1.00 1.12 C ATOM 1547 CD1 LEU A 100 -4.490 -8.362 -3.512 1.00 1.87 C ATOM 1548 CD2 LEU A 100 -5.343 -10.344 -4.766 1.00 1.69 C ATOM 0 H LEU A 100 -0.939 -7.887 -3.594 1.00 0.51 H new ATOM 0 HA LEU A 100 -1.551 -10.733 -3.438 1.00 0.55 H new ATOM 0 HB2 LEU A 100 -2.903 -8.925 -5.468 1.00 0.75 H new ATOM 0 HB3 LEU A 100 -2.942 -10.677 -5.472 1.00 0.75 H new ATOM 0 HG LEU A 100 -4.015 -10.395 -3.093 1.00 1.12 H new ATOM 0 HD11 LEU A 100 -5.400 -8.369 -2.913 1.00 1.87 H new ATOM 0 HD12 LEU A 100 -3.663 -7.985 -2.911 1.00 1.87 H new ATOM 0 HD13 LEU A 100 -4.632 -7.717 -4.379 1.00 1.87 H new ATOM 0 HD21 LEU A 100 -6.244 -10.319 -4.153 1.00 1.69 H new ATOM 0 HD22 LEU A 100 -5.499 -9.747 -5.665 1.00 1.69 H new ATOM 0 HD23 LEU A 100 -5.124 -11.374 -5.048 1.00 1.69 H new ATOM 1560 N PHE A 101 -0.165 -10.998 -5.702 1.00 0.46 N ATOM 1561 CA PHE A 101 0.921 -11.074 -6.682 1.00 0.46 C ATOM 1562 C PHE A 101 0.454 -11.687 -8.004 1.00 0.51 C ATOM 1563 O PHE A 101 0.594 -12.890 -8.230 1.00 0.58 O ATOM 1564 CB PHE A 101 2.103 -11.873 -6.124 1.00 0.45 C ATOM 1565 CG PHE A 101 3.305 -11.894 -7.029 1.00 0.51 C ATOM 1566 CD1 PHE A 101 3.821 -10.715 -7.543 1.00 0.56 C ATOM 1567 CD2 PHE A 101 3.919 -13.091 -7.366 1.00 0.58 C ATOM 1568 CE1 PHE A 101 4.924 -10.728 -8.375 1.00 0.65 C ATOM 1569 CE2 PHE A 101 5.023 -13.111 -8.197 1.00 0.68 C ATOM 1570 CZ PHE A 101 5.526 -11.936 -8.702 1.00 0.71 C ATOM 0 H PHE A 101 -0.684 -11.865 -5.565 1.00 0.46 H new ATOM 0 HA PHE A 101 1.244 -10.052 -6.881 1.00 0.46 H new ATOM 0 HB2 PHE A 101 2.392 -11.451 -5.161 1.00 0.45 H new ATOM 0 HB3 PHE A 101 1.781 -12.898 -5.939 1.00 0.45 H new ATOM 0 HD1 PHE A 101 3.355 -9.774 -7.290 1.00 0.56 H new ATOM 0 HD2 PHE A 101 3.530 -14.019 -6.974 1.00 0.58 H new ATOM 0 HE1 PHE A 101 5.316 -9.802 -8.769 1.00 0.65 H new ATOM 0 HE2 PHE A 101 5.491 -14.051 -8.450 1.00 0.68 H new ATOM 0 HZ PHE A 101 6.388 -11.952 -9.352 1.00 0.71 H new ATOM 1580 N GLY A 102 -0.087 -10.841 -8.878 1.00 0.54 N ATOM 1581 CA GLY A 102 -0.557 -11.291 -10.180 1.00 0.65 C ATOM 1582 C GLY A 102 -1.784 -12.180 -10.108 1.00 0.67 C ATOM 1583 O GLY A 102 -2.328 -12.564 -11.143 1.00 0.99 O ATOM 0 H GLY A 102 -0.209 -9.843 -8.706 1.00 0.54 H new ATOM 0 HA2 GLY A 102 -0.785 -10.421 -10.796 1.00 0.65 H new ATOM 0 HA3 GLY A 102 0.246 -11.833 -10.679 1.00 0.65 H new ATOM 1587 N ASN A 103 -2.185 -12.529 -8.883 1.00 0.58 N ATOM 1588 CA ASN A 103 -3.328 -13.406 -8.633 1.00 0.64 C ATOM 1589 C ASN A 103 -2.821 -14.830 -8.663 1.00 0.71 C ATOM 1590 O ASN A 103 -3.375 -15.711 -9.319 1.00 1.08 O ATOM 1591 CB ASN A 103 -4.455 -13.194 -9.649 1.00 0.78 C ATOM 1592 CG ASN A 103 -5.731 -13.910 -9.254 1.00 1.18 C ATOM 1593 OD1 ASN A 103 -5.803 -15.139 -9.269 1.00 2.12 O ATOM 1594 ND2 ASN A 103 -6.743 -13.141 -8.882 1.00 1.38 N ATOM 0 H ASN A 103 -1.722 -12.208 -8.033 1.00 0.58 H new ATOM 0 HA ASN A 103 -3.762 -13.174 -7.661 1.00 0.64 H new ATOM 0 HB2 ASN A 103 -4.656 -12.127 -9.748 1.00 0.78 H new ATOM 0 HB3 ASN A 103 -4.130 -13.549 -10.627 1.00 0.78 H new ATOM 0 HD21 ASN A 103 -7.625 -13.564 -8.593 1.00 1.38 H new ATOM 0 HD22 ASN A 103 -6.640 -12.126 -8.884 1.00 1.38 H new ATOM 1601 N GLU A 104 -1.719 -15.012 -7.958 1.00 0.53 N ATOM 1602 CA GLU A 104 -1.040 -16.280 -7.877 1.00 0.61 C ATOM 1603 C GLU A 104 -1.047 -16.761 -6.434 1.00 0.64 C ATOM 1604 O GLU A 104 -1.236 -15.968 -5.524 1.00 0.84 O ATOM 1605 CB GLU A 104 0.386 -16.057 -8.368 1.00 0.70 C ATOM 1606 CG GLU A 104 1.029 -17.262 -9.008 1.00 1.16 C ATOM 1607 CD GLU A 104 1.336 -18.371 -8.022 1.00 1.28 C ATOM 1608 OE1 GLU A 104 2.113 -18.126 -7.076 1.00 1.87 O ATOM 1609 OE2 GLU A 104 0.800 -19.486 -8.197 1.00 1.79 O ATOM 0 H GLU A 104 -1.270 -14.270 -7.421 1.00 0.53 H new ATOM 0 HA GLU A 104 -1.531 -17.039 -8.486 1.00 0.61 H new ATOM 0 HB2 GLU A 104 0.384 -15.238 -9.088 1.00 0.70 H new ATOM 0 HB3 GLU A 104 1.000 -15.739 -7.525 1.00 0.70 H new ATOM 0 HG2 GLU A 104 0.369 -17.648 -9.785 1.00 1.16 H new ATOM 0 HG3 GLU A 104 1.953 -16.955 -9.498 1.00 1.16 H new ATOM 1616 N VAL A 105 -0.836 -18.046 -6.214 1.00 0.62 N ATOM 1617 CA VAL A 105 -0.816 -18.557 -4.854 1.00 0.66 C ATOM 1618 C VAL A 105 0.620 -18.738 -4.395 1.00 0.70 C ATOM 1619 O VAL A 105 1.206 -19.811 -4.528 1.00 0.83 O ATOM 1620 CB VAL A 105 -1.582 -19.888 -4.718 1.00 0.75 C ATOM 1621 CG1 VAL A 105 -1.566 -20.373 -3.278 1.00 1.18 C ATOM 1622 CG2 VAL A 105 -3.011 -19.733 -5.219 1.00 0.95 C ATOM 0 H VAL A 105 -0.679 -18.743 -6.942 1.00 0.62 H new ATOM 0 HA VAL A 105 -1.320 -17.826 -4.222 1.00 0.66 H new ATOM 0 HB VAL A 105 -1.082 -20.637 -5.333 1.00 0.75 H new ATOM 0 HG11 VAL A 105 -2.112 -21.313 -3.205 1.00 1.18 H new ATOM 0 HG12 VAL A 105 -0.536 -20.526 -2.957 1.00 1.18 H new ATOM 0 HG13 VAL A 105 -2.039 -19.628 -2.638 1.00 1.18 H new ATOM 0 HG21 VAL A 105 -3.538 -20.682 -5.116 1.00 0.95 H new ATOM 0 HG22 VAL A 105 -3.521 -18.969 -4.632 1.00 0.95 H new ATOM 0 HG23 VAL A 105 -2.999 -19.437 -6.268 1.00 0.95 H new ATOM 1632 N ILE A 106 1.187 -17.655 -3.886 1.00 0.65 N ATOM 1633 CA ILE A 106 2.565 -17.643 -3.433 1.00 0.72 C ATOM 1634 C ILE A 106 2.696 -16.927 -2.090 1.00 0.77 C ATOM 1635 O ILE A 106 2.683 -15.697 -2.023 1.00 0.84 O ATOM 1636 CB ILE A 106 3.445 -16.955 -4.497 1.00 0.81 C ATOM 1637 CG1 ILE A 106 4.805 -16.538 -3.935 1.00 0.76 C ATOM 1638 CG2 ILE A 106 2.716 -15.754 -5.082 1.00 1.33 C ATOM 1639 CD1 ILE A 106 5.613 -15.715 -4.913 1.00 0.76 C ATOM 0 H ILE A 106 0.704 -16.763 -3.776 1.00 0.65 H new ATOM 0 HA ILE A 106 2.898 -18.671 -3.294 1.00 0.72 H new ATOM 0 HB ILE A 106 3.634 -17.680 -5.289 1.00 0.81 H new ATOM 0 HG12 ILE A 106 4.655 -15.964 -3.020 1.00 0.76 H new ATOM 0 HG13 ILE A 106 5.370 -17.430 -3.663 1.00 0.76 H new ATOM 0 HG21 ILE A 106 3.346 -15.276 -5.832 1.00 1.33 H new ATOM 0 HG22 ILE A 106 1.786 -16.083 -5.546 1.00 1.33 H new ATOM 0 HG23 ILE A 106 2.493 -15.042 -4.288 1.00 1.33 H new ATOM 0 HD11 ILE A 106 6.568 -15.447 -4.461 1.00 0.76 H new ATOM 0 HD12 ILE A 106 5.790 -16.296 -5.818 1.00 0.76 H new ATOM 0 HD13 ILE A 106 5.064 -14.808 -5.166 1.00 0.76 H new ATOM 1651 N ASN A 107 2.812 -17.712 -1.022 1.00 0.80 N ATOM 1652 CA ASN A 107 2.937 -17.165 0.326 1.00 0.91 C ATOM 1653 C ASN A 107 4.251 -17.573 0.981 1.00 0.92 C ATOM 1654 O ASN A 107 4.662 -18.732 0.912 1.00 1.03 O ATOM 1655 CB ASN A 107 1.761 -17.620 1.193 1.00 1.00 C ATOM 1656 CG ASN A 107 0.458 -16.944 0.814 1.00 1.11 C ATOM 1657 OD1 ASN A 107 -0.600 -17.264 1.356 1.00 1.79 O ATOM 1658 ND2 ASN A 107 0.528 -15.996 -0.114 1.00 1.12 N ATOM 0 H ASN A 107 2.822 -18.731 -1.064 1.00 0.80 H new ATOM 0 HA ASN A 107 2.928 -16.078 0.241 1.00 0.91 H new ATOM 0 HB2 ASN A 107 1.645 -18.700 1.103 1.00 1.00 H new ATOM 0 HB3 ASN A 107 1.984 -17.410 2.239 1.00 1.00 H new ATOM 0 HD21 ASN A 107 -0.316 -15.502 -0.403 1.00 1.12 H new ATOM 0 HD22 ASN A 107 1.426 -15.762 -0.538 1.00 1.12 H new ATOM 1665 N THR A 108 4.898 -16.609 1.627 1.00 0.92 N ATOM 1666 CA THR A 108 6.162 -16.850 2.310 1.00 1.01 C ATOM 1667 C THR A 108 6.213 -16.084 3.629 1.00 1.15 C ATOM 1668 O THR A 108 6.135 -16.677 4.706 1.00 1.79 O ATOM 1669 CB THR A 108 7.342 -16.445 1.421 1.00 1.00 C ATOM 1670 OG1 THR A 108 7.223 -15.096 1.011 1.00 1.66 O ATOM 1671 CG2 THR A 108 7.473 -17.293 0.174 1.00 1.26 C ATOM 0 H THR A 108 4.564 -15.647 1.691 1.00 0.92 H new ATOM 0 HA THR A 108 6.235 -17.917 2.522 1.00 1.01 H new ATOM 0 HB THR A 108 8.229 -16.594 2.037 1.00 1.00 H new ATOM 0 HG1 THR A 108 7.987 -14.857 0.446 1.00 1.66 H new ATOM 0 HG21 THR A 108 8.328 -16.952 -0.410 1.00 1.26 H new ATOM 0 HG22 THR A 108 7.619 -18.336 0.457 1.00 1.26 H new ATOM 0 HG23 THR A 108 6.566 -17.203 -0.424 1.00 1.26 H new ATOM 1679 N GLU A 109 6.338 -14.761 3.536 1.00 0.95 N ATOM 1680 CA GLU A 109 6.393 -13.905 4.718 1.00 1.05 C ATOM 1681 C GLU A 109 6.456 -12.434 4.320 1.00 1.06 C ATOM 1682 O GLU A 109 5.911 -11.571 5.009 1.00 1.32 O ATOM 1683 CB GLU A 109 7.604 -14.265 5.584 1.00 1.20 C ATOM 1684 CG GLU A 109 8.934 -14.121 4.859 1.00 1.46 C ATOM 1685 CD GLU A 109 10.119 -14.484 5.733 1.00 2.13 C ATOM 1686 OE1 GLU A 109 9.900 -14.848 6.908 1.00 2.74 O ATOM 1687 OE2 GLU A 109 11.266 -14.405 5.245 1.00 2.57 O ATOM 0 H GLU A 109 6.403 -14.258 2.651 1.00 0.95 H new ATOM 0 HA GLU A 109 5.484 -14.069 5.296 1.00 1.05 H new ATOM 0 HB2 GLU A 109 7.611 -13.628 6.468 1.00 1.20 H new ATOM 0 HB3 GLU A 109 7.499 -15.292 5.932 1.00 1.20 H new ATOM 0 HG2 GLU A 109 8.932 -14.758 3.974 1.00 1.46 H new ATOM 0 HG3 GLU A 109 9.045 -13.094 4.512 1.00 1.46 H new ATOM 1694 N ARG A 110 7.119 -12.155 3.204 1.00 0.93 N ATOM 1695 CA ARG A 110 7.247 -10.790 2.709 1.00 0.97 C ATOM 1696 C ARG A 110 6.439 -10.622 1.429 1.00 0.79 C ATOM 1697 O ARG A 110 6.563 -9.619 0.728 1.00 0.87 O ATOM 1698 CB ARG A 110 8.726 -10.455 2.464 1.00 1.17 C ATOM 1699 CG ARG A 110 9.004 -8.972 2.237 1.00 1.05 C ATOM 1700 CD ARG A 110 10.487 -8.666 2.364 1.00 1.57 C ATOM 1701 NE ARG A 110 10.768 -7.241 2.229 1.00 2.14 N ATOM 1702 CZ ARG A 110 11.983 -6.715 2.357 1.00 2.68 C ATOM 1703 NH1 ARG A 110 13.021 -7.495 2.625 1.00 2.96 N ATOM 1704 NH2 ARG A 110 12.160 -5.407 2.222 1.00 3.52 N ATOM 0 H ARG A 110 7.577 -12.858 2.624 1.00 0.93 H new ATOM 0 HA ARG A 110 6.857 -10.101 3.458 1.00 0.97 H new ATOM 0 HB2 ARG A 110 9.310 -10.796 3.319 1.00 1.17 H new ATOM 0 HB3 ARG A 110 9.075 -11.015 1.596 1.00 1.17 H new ATOM 0 HG2 ARG A 110 8.653 -8.681 1.247 1.00 1.05 H new ATOM 0 HG3 ARG A 110 8.444 -8.379 2.961 1.00 1.05 H new ATOM 0 HD2 ARG A 110 10.847 -9.016 3.332 1.00 1.57 H new ATOM 0 HD3 ARG A 110 11.037 -9.217 1.601 1.00 1.57 H new ATOM 0 HE ARG A 110 9.990 -6.613 2.025 1.00 2.14 H new ATOM 0 HH11 ARG A 110 12.889 -8.501 2.733 1.00 2.96 H new ATOM 0 HH12 ARG A 110 13.952 -7.090 2.723 1.00 2.96 H new ATOM 0 HH21 ARG A 110 11.364 -4.803 2.020 1.00 3.52 H new ATOM 0 HH22 ARG A 110 13.093 -5.006 2.321 1.00 3.52 H new ATOM 1718 N LEU A 111 5.605 -11.620 1.134 1.00 0.72 N ATOM 1719 CA LEU A 111 4.774 -11.586 -0.061 1.00 0.75 C ATOM 1720 C LEU A 111 3.689 -12.664 -0.050 1.00 0.66 C ATOM 1721 O LEU A 111 3.896 -13.775 -0.538 1.00 0.70 O ATOM 1722 CB LEU A 111 5.644 -11.738 -1.312 1.00 0.95 C ATOM 1723 CG LEU A 111 4.885 -12.058 -2.609 1.00 0.69 C ATOM 1724 CD1 LEU A 111 3.787 -11.043 -2.858 1.00 0.95 C ATOM 1725 CD2 LEU A 111 5.844 -12.093 -3.785 1.00 1.36 C ATOM 0 H LEU A 111 5.490 -12.457 1.706 1.00 0.72 H new ATOM 0 HA LEU A 111 4.272 -10.619 -0.074 1.00 0.75 H new ATOM 0 HB2 LEU A 111 6.205 -10.815 -1.458 1.00 0.95 H new ATOM 0 HB3 LEU A 111 6.373 -12.529 -1.133 1.00 0.95 H new ATOM 0 HG LEU A 111 4.424 -13.040 -2.500 1.00 0.69 H new ATOM 0 HD11 LEU A 111 3.265 -11.291 -3.782 1.00 0.95 H new ATOM 0 HD12 LEU A 111 3.082 -11.058 -2.027 1.00 0.95 H new ATOM 0 HD13 LEU A 111 4.224 -10.048 -2.945 1.00 0.95 H new ATOM 0 HD21 LEU A 111 5.293 -12.321 -4.697 1.00 1.36 H new ATOM 0 HD22 LEU A 111 6.330 -11.123 -3.887 1.00 1.36 H new ATOM 0 HD23 LEU A 111 6.599 -12.861 -3.616 1.00 1.36 H new ATOM 1737 N THR A 112 2.519 -12.314 0.474 1.00 0.71 N ATOM 1738 CA THR A 112 1.391 -13.229 0.498 1.00 0.67 C ATOM 1739 C THR A 112 0.287 -12.677 -0.400 1.00 0.66 C ATOM 1740 O THR A 112 -0.227 -11.585 -0.161 1.00 0.82 O ATOM 1741 CB THR A 112 0.892 -13.429 1.931 1.00 0.74 C ATOM 1742 OG1 THR A 112 -0.335 -14.135 1.943 1.00 0.75 O ATOM 1743 CG2 THR A 112 0.693 -12.134 2.689 1.00 0.83 C ATOM 0 H THR A 112 2.330 -11.401 0.888 1.00 0.71 H new ATOM 0 HA THR A 112 1.700 -14.204 0.122 1.00 0.67 H new ATOM 0 HB THR A 112 1.677 -13.998 2.430 1.00 0.74 H new ATOM 0 HG1 THR A 112 -0.635 -14.253 2.868 1.00 0.75 H new ATOM 0 HG21 THR A 112 0.339 -12.353 3.696 1.00 0.83 H new ATOM 0 HG22 THR A 112 1.640 -11.597 2.746 1.00 0.83 H new ATOM 0 HG23 THR A 112 -0.043 -11.519 2.171 1.00 0.83 H new ATOM 1751 N VAL A 113 -0.060 -13.421 -1.450 1.00 0.60 N ATOM 1752 CA VAL A 113 -1.082 -12.976 -2.388 1.00 0.61 C ATOM 1753 C VAL A 113 -2.452 -12.961 -1.729 1.00 0.64 C ATOM 1754 O VAL A 113 -3.060 -11.901 -1.604 1.00 0.80 O ATOM 1755 CB VAL A 113 -1.105 -13.836 -3.658 1.00 0.64 C ATOM 1756 CG1 VAL A 113 -2.228 -13.398 -4.583 1.00 1.27 C ATOM 1757 CG2 VAL A 113 0.235 -13.759 -4.359 1.00 1.38 C ATOM 0 H VAL A 113 0.351 -14.329 -1.669 1.00 0.60 H new ATOM 0 HA VAL A 113 -0.827 -11.959 -2.684 1.00 0.61 H new ATOM 0 HB VAL A 113 -1.290 -14.873 -3.377 1.00 0.64 H new ATOM 0 HG11 VAL A 113 -2.226 -14.021 -5.478 1.00 1.27 H new ATOM 0 HG12 VAL A 113 -3.184 -13.503 -4.070 1.00 1.27 H new ATOM 0 HG13 VAL A 113 -2.080 -12.356 -4.866 1.00 1.27 H new ATOM 0 HG21 VAL A 113 0.210 -14.372 -5.260 1.00 1.38 H new ATOM 0 HG22 VAL A 113 0.445 -12.724 -4.630 1.00 1.38 H new ATOM 0 HG23 VAL A 113 1.016 -14.125 -3.692 1.00 1.38 H new ATOM 1767 N PRO A 114 -2.958 -14.114 -1.252 1.00 0.61 N ATOM 1768 CA PRO A 114 -4.241 -14.141 -0.562 1.00 0.70 C ATOM 1769 C PRO A 114 -4.213 -13.097 0.537 1.00 0.76 C ATOM 1770 O PRO A 114 -5.227 -12.489 0.880 1.00 0.88 O ATOM 1771 CB PRO A 114 -4.304 -15.552 0.021 1.00 0.68 C ATOM 1772 CG PRO A 114 -3.432 -16.363 -0.873 1.00 0.83 C ATOM 1773 CD PRO A 114 -2.324 -15.445 -1.292 1.00 0.63 C ATOM 0 HA PRO A 114 -5.101 -13.924 -1.196 1.00 0.70 H new ATOM 0 HB2 PRO A 114 -3.946 -15.573 1.050 1.00 0.68 H new ATOM 0 HB3 PRO A 114 -5.325 -15.932 0.031 1.00 0.68 H new ATOM 0 HG2 PRO A 114 -3.041 -17.237 -0.352 1.00 0.83 H new ATOM 0 HG3 PRO A 114 -3.987 -16.728 -1.737 1.00 0.83 H new ATOM 0 HD2 PRO A 114 -1.472 -15.506 -0.615 1.00 0.63 H new ATOM 0 HD3 PRO A 114 -1.956 -15.686 -2.289 1.00 0.63 H new ATOM 1781 N HIS A 115 -2.993 -12.884 1.035 1.00 0.82 N ATOM 1782 CA HIS A 115 -2.686 -11.900 2.066 1.00 0.95 C ATOM 1783 C HIS A 115 -3.707 -11.887 3.192 1.00 0.86 C ATOM 1784 O HIS A 115 -4.859 -11.496 3.007 1.00 0.88 O ATOM 1785 CB HIS A 115 -2.575 -10.514 1.446 1.00 1.14 C ATOM 1786 CG HIS A 115 -1.557 -9.653 2.126 1.00 2.17 C ATOM 1787 ND1 HIS A 115 -1.581 -9.380 3.477 1.00 3.14 N ATOM 1788 CD2 HIS A 115 -0.469 -9.019 1.637 1.00 2.95 C ATOM 1789 CE1 HIS A 115 -0.549 -8.614 3.788 1.00 4.09 C ATOM 1790 NE2 HIS A 115 0.140 -8.382 2.688 1.00 3.97 N ATOM 0 H HIS A 115 -2.174 -13.405 0.723 1.00 0.82 H new ATOM 0 HA HIS A 115 -1.731 -12.188 2.507 1.00 0.95 H new ATOM 0 HB2 HIS A 115 -2.315 -10.612 0.392 1.00 1.14 H new ATOM 0 HB3 HIS A 115 -3.547 -10.023 1.490 1.00 1.14 H new ATOM 0 HD1 HIS A 115 -2.285 -9.716 4.134 1.00 3.14 H new ATOM 0 HD2 HIS A 115 -0.140 -9.015 0.608 1.00 2.95 H new ATOM 0 HE1 HIS A 115 -0.311 -8.242 4.774 1.00 4.09 H new ATOM 1799 N TYR A 116 -3.265 -12.297 4.373 1.00 1.04 N ATOM 1800 CA TYR A 116 -4.147 -12.312 5.532 1.00 1.14 C ATOM 1801 C TYR A 116 -4.108 -10.967 6.249 1.00 1.04 C ATOM 1802 O TYR A 116 -3.187 -10.703 7.022 1.00 1.47 O ATOM 1803 CB TYR A 116 -3.747 -13.430 6.498 1.00 1.62 C ATOM 1804 CG TYR A 116 -4.658 -13.551 7.703 1.00 2.18 C ATOM 1805 CD1 TYR A 116 -6.039 -13.563 7.554 1.00 3.06 C ATOM 1806 CD2 TYR A 116 -4.138 -13.647 8.989 1.00 2.56 C ATOM 1807 CE1 TYR A 116 -6.875 -13.670 8.650 1.00 4.05 C ATOM 1808 CE2 TYR A 116 -4.966 -13.755 10.089 1.00 3.50 C ATOM 1809 CZ TYR A 116 -6.326 -13.774 9.918 1.00 4.18 C ATOM 1810 OH TYR A 116 -7.163 -13.872 11.008 1.00 5.29 O ATOM 0 H TYR A 116 -2.314 -12.620 4.553 1.00 1.04 H new ATOM 0 HA TYR A 116 -5.163 -12.497 5.184 1.00 1.14 H new ATOM 0 HB2 TYR A 116 -3.743 -14.378 5.960 1.00 1.62 H new ATOM 0 HB3 TYR A 116 -2.727 -13.254 6.841 1.00 1.62 H new ATOM 0 HD1 TYR A 116 -6.467 -13.487 6.565 1.00 3.06 H new ATOM 0 HD2 TYR A 116 -3.067 -13.637 9.130 1.00 2.56 H new ATOM 0 HE1 TYR A 116 -7.947 -13.673 8.519 1.00 4.05 H new ATOM 0 HE2 TYR A 116 -4.544 -13.824 11.081 1.00 3.50 H new ATOM 0 HH TYR A 116 -6.628 -13.939 11.826 1.00 5.29 H new ATOM 1820 N ASP A 117 -5.136 -10.147 5.986 1.00 0.77 N ATOM 1821 CA ASP A 117 -5.304 -8.814 6.578 1.00 0.80 C ATOM 1822 C ASP A 117 -5.886 -7.843 5.553 1.00 0.72 C ATOM 1823 O ASP A 117 -6.422 -6.804 5.922 1.00 0.82 O ATOM 1824 CB ASP A 117 -3.993 -8.235 7.135 1.00 1.03 C ATOM 1825 CG ASP A 117 -2.966 -7.936 6.059 1.00 1.77 C ATOM 1826 OD1 ASP A 117 -3.277 -8.124 4.867 1.00 2.46 O ATOM 1827 OD2 ASP A 117 -1.849 -7.503 6.412 1.00 2.22 O ATOM 0 H ASP A 117 -5.888 -10.398 5.344 1.00 0.77 H new ATOM 0 HA ASP A 117 -5.992 -8.937 7.414 1.00 0.80 H new ATOM 0 HB2 ASP A 117 -4.212 -7.319 7.683 1.00 1.03 H new ATOM 0 HB3 ASP A 117 -3.567 -8.940 7.849 1.00 1.03 H new ATOM 1832 N MET A 118 -5.775 -8.179 4.262 1.00 0.69 N ATOM 1833 CA MET A 118 -6.295 -7.311 3.203 1.00 0.72 C ATOM 1834 C MET A 118 -7.728 -6.884 3.511 1.00 0.71 C ATOM 1835 O MET A 118 -8.047 -5.699 3.521 1.00 0.73 O ATOM 1836 CB MET A 118 -6.210 -8.001 1.830 1.00 0.83 C ATOM 1837 CG MET A 118 -6.813 -9.398 1.786 1.00 1.15 C ATOM 1838 SD MET A 118 -8.580 -9.387 1.421 1.00 2.40 S ATOM 1839 CE MET A 118 -8.942 -11.140 1.429 1.00 3.10 C ATOM 0 H MET A 118 -5.334 -9.037 3.930 1.00 0.69 H new ATOM 0 HA MET A 118 -5.674 -6.416 3.165 1.00 0.72 H new ATOM 0 HB2 MET A 118 -6.716 -7.378 1.093 1.00 0.83 H new ATOM 0 HB3 MET A 118 -5.163 -8.062 1.532 1.00 0.83 H new ATOM 0 HG2 MET A 118 -6.295 -9.989 1.031 1.00 1.15 H new ATOM 0 HG3 MET A 118 -6.648 -9.890 2.744 1.00 1.15 H new ATOM 0 HE1 MET A 118 -9.728 -11.352 0.705 1.00 3.10 H new ATOM 0 HE2 MET A 118 -8.044 -11.698 1.164 1.00 3.10 H new ATOM 0 HE3 MET A 118 -9.274 -11.438 2.423 1.00 3.10 H new ATOM 1849 N LYS A 119 -8.578 -7.861 3.783 1.00 0.80 N ATOM 1850 CA LYS A 119 -9.981 -7.615 4.108 1.00 0.95 C ATOM 1851 C LYS A 119 -10.141 -6.823 5.410 1.00 0.99 C ATOM 1852 O LYS A 119 -11.241 -6.731 5.955 1.00 1.24 O ATOM 1853 CB LYS A 119 -10.719 -8.946 4.206 1.00 1.15 C ATOM 1854 CG LYS A 119 -9.970 -9.981 5.024 1.00 1.30 C ATOM 1855 CD LYS A 119 -10.688 -11.318 5.036 1.00 1.70 C ATOM 1856 CE LYS A 119 -9.886 -12.354 5.794 1.00 2.06 C ATOM 1857 NZ LYS A 119 -8.621 -12.701 5.088 1.00 2.67 N ATOM 0 H LYS A 119 -8.319 -8.848 3.786 1.00 0.80 H new ATOM 0 HA LYS A 119 -10.410 -7.010 3.310 1.00 0.95 H new ATOM 0 HB2 LYS A 119 -11.700 -8.779 4.652 1.00 1.15 H new ATOM 0 HB3 LYS A 119 -10.887 -9.337 3.202 1.00 1.15 H new ATOM 0 HG2 LYS A 119 -8.968 -10.111 4.616 1.00 1.30 H new ATOM 0 HG3 LYS A 119 -9.854 -9.622 6.046 1.00 1.30 H new ATOM 0 HD2 LYS A 119 -11.670 -11.204 5.496 1.00 1.70 H new ATOM 0 HD3 LYS A 119 -10.852 -11.656 4.013 1.00 1.70 H new ATOM 0 HE2 LYS A 119 -9.654 -11.977 6.790 1.00 2.06 H new ATOM 0 HE3 LYS A 119 -10.487 -13.254 5.926 1.00 2.06 H new ATOM 0 HZ1 LYS A 119 -8.229 -13.577 5.489 1.00 2.67 H new ATOM 0 HZ2 LYS A 119 -8.815 -12.840 4.076 1.00 2.67 H new ATOM 0 HZ3 LYS A 119 -7.935 -11.928 5.206 1.00 2.67 H new ATOM 1871 N ASN A 120 -9.043 -6.264 5.910 1.00 0.90 N ATOM 1872 CA ASN A 120 -9.063 -5.495 7.148 1.00 1.04 C ATOM 1873 C ASN A 120 -8.599 -4.049 6.928 1.00 1.08 C ATOM 1874 O ASN A 120 -8.723 -3.208 7.820 1.00 1.35 O ATOM 1875 CB ASN A 120 -8.192 -6.201 8.195 1.00 1.08 C ATOM 1876 CG ASN A 120 -7.872 -5.336 9.394 1.00 1.41 C ATOM 1877 OD1 ASN A 120 -8.763 -4.791 10.043 1.00 1.77 O ATOM 1878 ND2 ASN A 120 -6.585 -5.221 9.697 1.00 1.84 N ATOM 0 H ASN A 120 -8.124 -6.330 5.473 1.00 0.90 H new ATOM 0 HA ASN A 120 -10.090 -5.442 7.509 1.00 1.04 H new ATOM 0 HB2 ASN A 120 -8.703 -7.103 8.533 1.00 1.08 H new ATOM 0 HB3 ASN A 120 -7.260 -6.519 7.727 1.00 1.08 H new ATOM 0 HD21 ASN A 120 -6.298 -4.661 10.500 1.00 1.84 H new ATOM 0 HD22 ASN A 120 -5.883 -5.693 9.127 1.00 1.84 H new ATOM 1885 N ARG A 121 -8.076 -3.758 5.734 1.00 0.93 N ATOM 1886 CA ARG A 121 -7.611 -2.407 5.413 1.00 1.06 C ATOM 1887 C ARG A 121 -8.476 -1.763 4.333 1.00 0.84 C ATOM 1888 O ARG A 121 -8.130 -1.792 3.154 1.00 0.87 O ATOM 1889 CB ARG A 121 -6.155 -2.417 4.932 1.00 1.31 C ATOM 1890 CG ARG A 121 -5.141 -2.814 5.990 1.00 1.14 C ATOM 1891 CD ARG A 121 -5.277 -4.271 6.373 1.00 1.39 C ATOM 1892 NE ARG A 121 -4.177 -4.728 7.218 1.00 1.56 N ATOM 1893 CZ ARG A 121 -3.909 -4.232 8.424 1.00 1.73 C ATOM 1894 NH1 ARG A 121 -4.671 -3.273 8.940 1.00 2.29 N ATOM 1895 NH2 ARG A 121 -2.882 -4.700 9.118 1.00 2.04 N ATOM 0 H ARG A 121 -7.965 -4.435 4.979 1.00 0.93 H new ATOM 0 HA ARG A 121 -7.686 -1.826 6.332 1.00 1.06 H new ATOM 0 HB2 ARG A 121 -6.069 -3.104 4.090 1.00 1.31 H new ATOM 0 HB3 ARG A 121 -5.902 -1.424 4.560 1.00 1.31 H new ATOM 0 HG2 ARG A 121 -4.134 -2.628 5.617 1.00 1.14 H new ATOM 0 HG3 ARG A 121 -5.274 -2.191 6.874 1.00 1.14 H new ATOM 0 HD2 ARG A 121 -6.221 -4.420 6.898 1.00 1.39 H new ATOM 0 HD3 ARG A 121 -5.315 -4.880 5.470 1.00 1.39 H new ATOM 0 HE ARG A 121 -3.577 -5.473 6.862 1.00 1.56 H new ATOM 0 HH11 ARG A 121 -5.466 -2.913 8.412 1.00 2.29 H new ATOM 0 HH12 ARG A 121 -4.461 -2.897 9.864 1.00 2.29 H new ATOM 0 HH21 ARG A 121 -2.298 -5.440 8.728 1.00 2.04 H new ATOM 0 HH22 ARG A 121 -2.676 -4.321 10.042 1.00 2.04 H new ATOM 1909 N GLY A 122 -9.592 -1.168 4.733 1.00 0.73 N ATOM 1910 CA GLY A 122 -10.463 -0.515 3.771 1.00 0.60 C ATOM 1911 C GLY A 122 -9.798 0.681 3.151 1.00 0.57 C ATOM 1912 O GLY A 122 -10.319 1.262 2.203 1.00 0.59 O ATOM 0 H GLY A 122 -9.910 -1.125 5.701 1.00 0.73 H new ATOM 0 HA2 GLY A 122 -10.741 -1.223 2.991 1.00 0.60 H new ATOM 0 HA3 GLY A 122 -11.385 -0.206 4.264 1.00 0.60 H new ATOM 1916 N PHE A 123 -8.638 1.044 3.691 1.00 0.65 N ATOM 1917 CA PHE A 123 -7.884 2.185 3.194 1.00 0.72 C ATOM 1918 C PHE A 123 -6.910 1.779 2.096 1.00 0.80 C ATOM 1919 O PHE A 123 -6.222 2.622 1.522 1.00 1.14 O ATOM 1920 CB PHE A 123 -7.163 2.901 4.341 1.00 0.84 C ATOM 1921 CG PHE A 123 -6.381 1.997 5.252 1.00 0.95 C ATOM 1922 CD1 PHE A 123 -5.134 1.525 4.884 1.00 1.47 C ATOM 1923 CD2 PHE A 123 -6.897 1.628 6.484 1.00 1.10 C ATOM 1924 CE1 PHE A 123 -4.412 0.703 5.729 1.00 2.04 C ATOM 1925 CE2 PHE A 123 -6.182 0.804 7.332 1.00 1.49 C ATOM 1926 CZ PHE A 123 -4.937 0.342 6.955 1.00 1.98 C ATOM 0 H PHE A 123 -8.201 0.561 4.476 1.00 0.65 H new ATOM 0 HA PHE A 123 -8.593 2.884 2.752 1.00 0.72 H new ATOM 0 HB2 PHE A 123 -6.486 3.643 3.919 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -7.900 3.442 4.934 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -4.720 1.802 3.926 1.00 1.47 H new ATOM 0 HD2 PHE A 123 -7.869 1.989 6.785 1.00 1.10 H new ATOM 0 HE1 PHE A 123 -3.438 0.343 5.431 1.00 2.04 H new ATOM 0 HE2 PHE A 123 -6.597 0.522 8.288 1.00 1.49 H new ATOM 0 HZ PHE A 123 -4.375 -0.300 7.617 1.00 1.98 H new ATOM 1936 N MET A 124 -6.871 0.488 1.790 1.00 0.62 N ATOM 1937 CA MET A 124 -5.999 -0.015 0.737 1.00 0.68 C ATOM 1938 C MET A 124 -6.780 -0.898 -0.227 1.00 0.64 C ATOM 1939 O MET A 124 -6.438 -1.004 -1.403 1.00 0.68 O ATOM 1940 CB MET A 124 -4.824 -0.793 1.337 1.00 0.80 C ATOM 1941 CG MET A 124 -3.865 0.079 2.132 1.00 1.00 C ATOM 1942 SD MET A 124 -2.534 -0.864 2.899 1.00 1.91 S ATOM 1943 CE MET A 124 -1.607 0.443 3.699 1.00 2.23 C ATOM 0 H MET A 124 -7.431 -0.227 2.254 1.00 0.62 H new ATOM 0 HA MET A 124 -5.604 0.837 0.184 1.00 0.68 H new ATOM 0 HB2 MET A 124 -5.212 -1.579 1.986 1.00 0.80 H new ATOM 0 HB3 MET A 124 -4.275 -1.285 0.534 1.00 0.80 H new ATOM 0 HG2 MET A 124 -3.436 0.834 1.473 1.00 1.00 H new ATOM 0 HG3 MET A 124 -4.420 0.610 2.905 1.00 1.00 H new ATOM 0 HE1 MET A 124 -1.242 0.092 4.664 1.00 2.23 H new ATOM 0 HE2 MET A 124 -0.761 0.726 3.072 1.00 2.23 H new ATOM 0 HE3 MET A 124 -2.253 1.308 3.849 1.00 2.23 H new ATOM 1953 N LEU A 125 -7.831 -1.534 0.282 1.00 0.61 N ATOM 1954 CA LEU A 125 -8.666 -2.416 -0.514 1.00 0.62 C ATOM 1955 C LEU A 125 -9.725 -1.630 -1.271 1.00 0.56 C ATOM 1956 O LEU A 125 -9.997 -1.930 -2.424 1.00 0.63 O ATOM 1957 CB LEU A 125 -9.306 -3.471 0.390 1.00 0.67 C ATOM 1958 CG LEU A 125 -8.354 -4.507 1.012 1.00 0.77 C ATOM 1959 CD1 LEU A 125 -8.068 -5.630 0.033 1.00 1.24 C ATOM 1960 CD2 LEU A 125 -7.043 -3.880 1.467 1.00 1.16 C ATOM 0 H LEU A 125 -8.124 -1.450 1.255 1.00 0.61 H new ATOM 0 HA LEU A 125 -8.043 -2.918 -1.254 1.00 0.62 H new ATOM 0 HB2 LEU A 125 -9.827 -2.958 1.198 1.00 0.67 H new ATOM 0 HB3 LEU A 125 -10.061 -4.004 -0.188 1.00 0.67 H new ATOM 0 HG LEU A 125 -8.858 -4.911 1.890 1.00 0.77 H new ATOM 0 HD11 LEU A 125 -7.393 -6.351 0.494 1.00 1.24 H new ATOM 0 HD12 LEU A 125 -9.001 -6.126 -0.234 1.00 1.24 H new ATOM 0 HD13 LEU A 125 -7.604 -5.221 -0.865 1.00 1.24 H new ATOM 0 HD21 LEU A 125 -6.403 -4.649 1.899 1.00 1.16 H new ATOM 0 HD22 LEU A 125 -6.540 -3.428 0.612 1.00 1.16 H new ATOM 0 HD23 LEU A 125 -7.246 -3.114 2.215 1.00 1.16 H new ATOM 1972 N TRP A 126 -10.308 -0.608 -0.639 1.00 0.48 N ATOM 1973 CA TRP A 126 -11.308 0.210 -1.318 1.00 0.48 C ATOM 1974 C TRP A 126 -10.640 0.974 -2.464 1.00 0.47 C ATOM 1975 O TRP A 126 -11.056 0.852 -3.615 1.00 0.48 O ATOM 1976 CB TRP A 126 -12.009 1.171 -0.348 1.00 0.52 C ATOM 1977 CG TRP A 126 -12.753 2.282 -1.024 1.00 0.80 C ATOM 1978 CD1 TRP A 126 -12.741 3.586 -0.654 1.00 1.33 C ATOM 1979 CD2 TRP A 126 -13.610 2.201 -2.175 1.00 1.45 C ATOM 1980 NE1 TRP A 126 -13.530 4.332 -1.494 1.00 1.82 N ATOM 1981 CE2 TRP A 126 -14.074 3.506 -2.437 1.00 1.88 C ATOM 1982 CE3 TRP A 126 -14.029 1.162 -3.010 1.00 2.11 C ATOM 1983 CZ2 TRP A 126 -14.932 3.795 -3.495 1.00 2.60 C ATOM 1984 CZ3 TRP A 126 -14.881 1.451 -4.060 1.00 2.88 C ATOM 1985 CH2 TRP A 126 -15.324 2.757 -4.295 1.00 3.03 C ATOM 0 H TRP A 126 -10.108 -0.333 0.323 1.00 0.48 H new ATOM 0 HA TRP A 126 -12.079 -0.445 -1.722 1.00 0.48 H new ATOM 0 HB2 TRP A 126 -12.705 0.604 0.270 1.00 0.52 H new ATOM 0 HB3 TRP A 126 -11.265 1.601 0.323 1.00 0.52 H new ATOM 0 HD1 TRP A 126 -12.188 3.983 0.185 1.00 1.33 H new ATOM 0 HE1 TRP A 126 -13.685 5.338 -1.425 1.00 1.82 H new ATOM 0 HE3 TRP A 126 -13.693 0.150 -2.838 1.00 2.11 H new ATOM 0 HZ2 TRP A 126 -15.276 4.803 -3.677 1.00 2.60 H new ATOM 0 HZ3 TRP A 126 -15.210 0.654 -4.710 1.00 2.88 H new ATOM 0 HH2 TRP A 126 -15.989 2.949 -5.124 1.00 3.03 H new ATOM 1996 N PRO A 127 -9.577 1.760 -2.181 1.00 0.50 N ATOM 1997 CA PRO A 127 -8.863 2.497 -3.222 1.00 0.54 C ATOM 1998 C PRO A 127 -8.404 1.544 -4.324 1.00 0.53 C ATOM 1999 O PRO A 127 -8.402 1.892 -5.506 1.00 0.56 O ATOM 2000 CB PRO A 127 -7.664 3.124 -2.488 1.00 0.61 C ATOM 2001 CG PRO A 127 -7.592 2.434 -1.169 1.00 0.61 C ATOM 2002 CD PRO A 127 -8.986 1.984 -0.854 1.00 0.55 C ATOM 0 HA PRO A 127 -9.481 3.250 -3.711 1.00 0.54 H new ATOM 0 HB2 PRO A 127 -6.743 2.985 -3.053 1.00 0.61 H new ATOM 0 HB3 PRO A 127 -7.801 4.198 -2.361 1.00 0.61 H new ATOM 0 HG2 PRO A 127 -6.909 1.585 -1.211 1.00 0.61 H new ATOM 0 HG3 PRO A 127 -7.217 3.107 -0.398 1.00 0.61 H new ATOM 0 HD2 PRO A 127 -8.989 1.074 -0.254 1.00 0.55 H new ATOM 0 HD3 PRO A 127 -9.535 2.739 -0.291 1.00 0.55 H new ATOM 2010 N LEU A 128 -8.055 0.321 -3.920 1.00 0.53 N ATOM 2011 CA LEU A 128 -7.634 -0.714 -4.858 1.00 0.56 C ATOM 2012 C LEU A 128 -8.865 -1.380 -5.459 1.00 0.54 C ATOM 2013 O LEU A 128 -8.804 -1.985 -6.528 1.00 0.61 O ATOM 2014 CB LEU A 128 -6.745 -1.750 -4.151 1.00 0.63 C ATOM 2015 CG LEU A 128 -6.298 -2.951 -4.993 1.00 0.79 C ATOM 2016 CD1 LEU A 128 -5.622 -2.503 -6.277 1.00 1.42 C ATOM 2017 CD2 LEU A 128 -5.352 -3.830 -4.190 1.00 1.55 C ATOM 0 H LEU A 128 -8.057 0.025 -2.944 1.00 0.53 H new ATOM 0 HA LEU A 128 -7.049 -0.260 -5.658 1.00 0.56 H new ATOM 0 HB2 LEU A 128 -5.855 -1.241 -3.782 1.00 0.63 H new ATOM 0 HB3 LEU A 128 -7.283 -2.124 -3.280 1.00 0.63 H new ATOM 0 HG LEU A 128 -7.186 -3.524 -5.258 1.00 0.79 H new ATOM 0 HD11 LEU A 128 -5.317 -3.377 -6.852 1.00 1.42 H new ATOM 0 HD12 LEU A 128 -6.319 -1.907 -6.866 1.00 1.42 H new ATOM 0 HD13 LEU A 128 -4.745 -1.903 -6.036 1.00 1.42 H new ATOM 0 HD21 LEU A 128 -5.041 -4.680 -4.798 1.00 1.55 H new ATOM 0 HD22 LEU A 128 -4.475 -3.251 -3.900 1.00 1.55 H new ATOM 0 HD23 LEU A 128 -5.861 -4.190 -3.296 1.00 1.55 H new ATOM 2029 N PHE A 129 -9.991 -1.239 -4.760 1.00 0.50 N ATOM 2030 CA PHE A 129 -11.254 -1.799 -5.217 1.00 0.51 C ATOM 2031 C PHE A 129 -11.717 -1.044 -6.457 1.00 0.53 C ATOM 2032 O PHE A 129 -12.245 -1.627 -7.397 1.00 0.70 O ATOM 2033 CB PHE A 129 -12.326 -1.706 -4.127 1.00 0.49 C ATOM 2034 CG PHE A 129 -13.598 -2.429 -4.474 1.00 0.54 C ATOM 2035 CD1 PHE A 129 -13.750 -3.772 -4.168 1.00 0.60 C ATOM 2036 CD2 PHE A 129 -14.649 -1.765 -5.092 1.00 0.62 C ATOM 2037 CE1 PHE A 129 -14.919 -4.441 -4.476 1.00 0.71 C ATOM 2038 CE2 PHE A 129 -15.819 -2.429 -5.401 1.00 0.73 C ATOM 2039 CZ PHE A 129 -15.946 -3.760 -5.140 1.00 0.75 C ATOM 0 H PHE A 129 -10.050 -0.739 -3.873 1.00 0.50 H new ATOM 0 HA PHE A 129 -11.102 -2.852 -5.454 1.00 0.51 H new ATOM 0 HB2 PHE A 129 -11.926 -2.115 -3.199 1.00 0.49 H new ATOM 0 HB3 PHE A 129 -12.553 -0.656 -3.940 1.00 0.49 H new ATOM 0 HD1 PHE A 129 -12.944 -4.303 -3.682 1.00 0.60 H new ATOM 0 HD2 PHE A 129 -14.550 -0.717 -5.334 1.00 0.62 H new ATOM 0 HE1 PHE A 129 -15.039 -5.480 -4.207 1.00 0.71 H new ATOM 0 HE2 PHE A 129 -16.639 -1.890 -5.852 1.00 0.73 H new ATOM 0 HZ PHE A 129 -16.837 -4.289 -5.445 1.00 0.75 H new ATOM 2049 N GLU A 130 -11.499 0.270 -6.452 1.00 0.43 N ATOM 2050 CA GLU A 130 -11.880 1.109 -7.581 1.00 0.49 C ATOM 2051 C GLU A 130 -10.986 0.813 -8.777 1.00 0.53 C ATOM 2052 O GLU A 130 -11.465 0.640 -9.898 1.00 0.68 O ATOM 2053 CB GLU A 130 -11.786 2.590 -7.206 1.00 0.54 C ATOM 2054 CG GLU A 130 -12.227 3.532 -8.317 1.00 0.99 C ATOM 2055 CD GLU A 130 -13.695 3.377 -8.676 1.00 1.63 C ATOM 2056 OE1 GLU A 130 -14.082 2.281 -9.130 1.00 2.04 O ATOM 2057 OE2 GLU A 130 -14.457 4.353 -8.503 1.00 2.40 O ATOM 0 H GLU A 130 -11.062 0.773 -5.680 1.00 0.43 H new ATOM 0 HA GLU A 130 -12.913 0.885 -7.847 1.00 0.49 H new ATOM 0 HB2 GLU A 130 -12.399 2.772 -6.323 1.00 0.54 H new ATOM 0 HB3 GLU A 130 -10.757 2.822 -6.933 1.00 0.54 H new ATOM 0 HG2 GLU A 130 -12.040 4.561 -8.010 1.00 0.99 H new ATOM 0 HG3 GLU A 130 -11.620 3.349 -9.204 1.00 0.99 H new ATOM 2064 N ILE A 131 -9.681 0.745 -8.524 1.00 0.48 N ATOM 2065 CA ILE A 131 -8.716 0.455 -9.576 1.00 0.56 C ATOM 2066 C ILE A 131 -8.720 -1.038 -9.905 1.00 0.52 C ATOM 2067 O ILE A 131 -8.022 -1.490 -10.813 1.00 0.64 O ATOM 2068 CB ILE A 131 -7.294 0.896 -9.175 1.00 0.77 C ATOM 2069 CG1 ILE A 131 -6.792 0.101 -7.964 1.00 0.77 C ATOM 2070 CG2 ILE A 131 -7.274 2.390 -8.885 1.00 1.55 C ATOM 2071 CD1 ILE A 131 -5.415 0.524 -7.496 1.00 1.41 C ATOM 0 H ILE A 131 -9.270 0.887 -7.601 1.00 0.48 H new ATOM 0 HA ILE A 131 -9.012 1.021 -10.459 1.00 0.56 H new ATOM 0 HB ILE A 131 -6.621 0.691 -10.008 1.00 0.77 H new ATOM 0 HG12 ILE A 131 -7.499 0.219 -7.143 1.00 0.77 H new ATOM 0 HG13 ILE A 131 -6.772 -0.959 -8.217 1.00 0.77 H new ATOM 0 HG21 ILE A 131 -6.266 2.692 -8.603 1.00 1.55 H new ATOM 0 HG22 ILE A 131 -7.581 2.938 -9.776 1.00 1.55 H new ATOM 0 HG23 ILE A 131 -7.961 2.611 -8.068 1.00 1.55 H new ATOM 0 HD11 ILE A 131 -5.122 -0.079 -6.637 1.00 1.41 H new ATOM 0 HD12 ILE A 131 -4.696 0.380 -8.303 1.00 1.41 H new ATOM 0 HD13 ILE A 131 -5.435 1.576 -7.211 1.00 1.41 H new ATOM 2083 N ALA A 132 -9.528 -1.789 -9.151 1.00 0.53 N ATOM 2084 CA ALA A 132 -9.658 -3.235 -9.334 1.00 0.58 C ATOM 2085 C ALA A 132 -10.696 -3.803 -8.363 1.00 0.56 C ATOM 2086 O ALA A 132 -10.362 -4.190 -7.246 1.00 0.63 O ATOM 2087 CB ALA A 132 -8.315 -3.922 -9.133 1.00 0.73 C ATOM 0 H ALA A 132 -10.107 -1.413 -8.400 1.00 0.53 H new ATOM 0 HA ALA A 132 -9.993 -3.424 -10.354 1.00 0.58 H new ATOM 0 HB1 ALA A 132 -8.431 -4.997 -9.273 1.00 0.73 H new ATOM 0 HB2 ALA A 132 -7.597 -3.537 -9.858 1.00 0.73 H new ATOM 0 HB3 ALA A 132 -7.953 -3.725 -8.124 1.00 0.73 H new ATOM 2093 N PRO A 133 -11.981 -3.836 -8.770 1.00 0.63 N ATOM 2094 CA PRO A 133 -13.073 -4.328 -7.936 1.00 0.66 C ATOM 2095 C PRO A 133 -13.388 -5.797 -8.169 1.00 0.88 C ATOM 2096 O PRO A 133 -14.505 -6.240 -7.919 1.00 1.24 O ATOM 2097 CB PRO A 133 -14.241 -3.460 -8.397 1.00 0.79 C ATOM 2098 CG PRO A 133 -13.965 -3.167 -9.841 1.00 0.82 C ATOM 2099 CD PRO A 133 -12.482 -3.371 -10.072 1.00 0.81 C ATOM 0 HA PRO A 133 -12.841 -4.265 -6.873 1.00 0.66 H new ATOM 0 HB2 PRO A 133 -15.191 -3.981 -8.275 1.00 0.79 H new ATOM 0 HB3 PRO A 133 -14.304 -2.541 -7.814 1.00 0.79 H new ATOM 0 HG2 PRO A 133 -14.547 -3.827 -10.484 1.00 0.82 H new ATOM 0 HG3 PRO A 133 -14.254 -2.145 -10.087 1.00 0.82 H new ATOM 0 HD2 PRO A 133 -12.297 -4.105 -10.856 1.00 0.81 H new ATOM 0 HD3 PRO A 133 -11.995 -2.446 -10.380 1.00 0.81 H new ATOM 2107 N GLU A 134 -12.405 -6.545 -8.650 1.00 0.90 N ATOM 2108 CA GLU A 134 -12.587 -7.968 -8.915 1.00 1.12 C ATOM 2109 C GLU A 134 -11.252 -8.697 -8.851 1.00 1.08 C ATOM 2110 O GLU A 134 -11.007 -9.623 -9.626 1.00 1.25 O ATOM 2111 CB GLU A 134 -13.219 -8.185 -10.296 1.00 1.34 C ATOM 2112 CG GLU A 134 -14.634 -7.645 -10.427 1.00 1.87 C ATOM 2113 CD GLU A 134 -15.206 -7.843 -11.817 1.00 2.20 C ATOM 2114 OE1 GLU A 134 -15.306 -9.007 -12.258 1.00 2.50 O ATOM 2115 OE2 GLU A 134 -15.553 -6.833 -12.466 1.00 2.61 O ATOM 0 H GLU A 134 -11.473 -6.192 -8.865 1.00 0.90 H new ATOM 0 HA GLU A 134 -13.253 -8.369 -8.151 1.00 1.12 H new ATOM 0 HB2 GLU A 134 -12.590 -7.710 -11.049 1.00 1.34 H new ATOM 0 HB3 GLU A 134 -13.228 -9.253 -10.515 1.00 1.34 H new ATOM 0 HG2 GLU A 134 -15.277 -8.140 -9.699 1.00 1.87 H new ATOM 0 HG3 GLU A 134 -14.638 -6.582 -10.184 1.00 1.87 H new ATOM 2122 N LEU A 135 -10.378 -8.269 -7.944 1.00 0.99 N ATOM 2123 CA LEU A 135 -9.063 -8.890 -7.833 1.00 1.03 C ATOM 2124 C LEU A 135 -8.636 -9.170 -6.397 1.00 1.50 C ATOM 2125 O LEU A 135 -7.954 -8.369 -5.758 1.00 2.32 O ATOM 2126 CB LEU A 135 -8.034 -8.035 -8.553 1.00 1.00 C ATOM 2127 CG LEU A 135 -8.126 -8.123 -10.074 1.00 1.43 C ATOM 2128 CD1 LEU A 135 -7.142 -7.167 -10.730 1.00 2.07 C ATOM 2129 CD2 LEU A 135 -7.886 -9.557 -10.529 1.00 2.26 C ATOM 0 H LEU A 135 -10.552 -7.509 -7.287 1.00 0.99 H new ATOM 0 HA LEU A 135 -9.131 -9.868 -8.310 1.00 1.03 H new ATOM 0 HB2 LEU A 135 -8.160 -6.996 -8.249 1.00 1.00 H new ATOM 0 HB3 LEU A 135 -7.036 -8.340 -8.239 1.00 1.00 H new ATOM 0 HG LEU A 135 -9.129 -7.827 -10.383 1.00 1.43 H new ATOM 0 HD11 LEU A 135 -7.225 -7.247 -11.814 1.00 2.07 H new ATOM 0 HD12 LEU A 135 -7.367 -6.146 -10.423 1.00 2.07 H new ATOM 0 HD13 LEU A 135 -6.128 -7.423 -10.424 1.00 2.07 H new ATOM 0 HD21 LEU A 135 -7.954 -9.610 -11.616 1.00 2.26 H new ATOM 0 HD22 LEU A 135 -6.894 -9.878 -10.211 1.00 2.26 H new ATOM 0 HD23 LEU A 135 -8.638 -10.210 -10.086 1.00 2.26 H new ATOM 2141 N VAL A 136 -9.026 -10.350 -5.933 1.00 1.65 N ATOM 2142 CA VAL A 136 -8.702 -10.850 -4.599 1.00 2.11 C ATOM 2143 C VAL A 136 -8.905 -12.360 -4.565 1.00 1.98 C ATOM 2144 O VAL A 136 -8.504 -13.029 -3.617 1.00 2.82 O ATOM 2145 CB VAL A 136 -9.543 -10.161 -3.494 1.00 2.85 C ATOM 2146 CG1 VAL A 136 -9.713 -11.046 -2.264 1.00 3.55 C ATOM 2147 CG2 VAL A 136 -8.888 -8.858 -3.091 1.00 3.66 C ATOM 0 H VAL A 136 -9.587 -11.001 -6.482 1.00 1.65 H new ATOM 0 HA VAL A 136 -7.658 -10.613 -4.392 1.00 2.11 H new ATOM 0 HB VAL A 136 -10.534 -9.973 -3.907 1.00 2.85 H new ATOM 0 HG11 VAL A 136 -10.309 -10.521 -1.517 1.00 3.55 H new ATOM 0 HG12 VAL A 136 -10.218 -11.970 -2.547 1.00 3.55 H new ATOM 0 HG13 VAL A 136 -8.734 -11.281 -1.847 1.00 3.55 H new ATOM 0 HG21 VAL A 136 -9.482 -8.377 -2.314 1.00 3.66 H new ATOM 0 HG22 VAL A 136 -7.886 -9.057 -2.710 1.00 3.66 H new ATOM 0 HG23 VAL A 136 -8.823 -8.200 -3.958 1.00 3.66 H new ATOM 2157 N PHE A 137 -9.520 -12.880 -5.633 1.00 1.34 N ATOM 2158 CA PHE A 137 -9.793 -14.309 -5.788 1.00 1.66 C ATOM 2159 C PHE A 137 -8.844 -15.192 -4.964 1.00 1.18 C ATOM 2160 O PHE A 137 -9.310 -16.033 -4.195 1.00 1.57 O ATOM 2161 CB PHE A 137 -9.720 -14.693 -7.267 1.00 2.23 C ATOM 2162 CG PHE A 137 -9.928 -16.159 -7.530 1.00 3.15 C ATOM 2163 CD1 PHE A 137 -10.997 -16.838 -6.964 1.00 3.49 C ATOM 2164 CD2 PHE A 137 -9.054 -16.857 -8.348 1.00 3.88 C ATOM 2165 CE1 PHE A 137 -11.188 -18.185 -7.208 1.00 4.44 C ATOM 2166 CE2 PHE A 137 -9.240 -18.205 -8.596 1.00 4.85 C ATOM 2167 CZ PHE A 137 -10.309 -18.869 -8.024 1.00 5.09 C ATOM 0 H PHE A 137 -9.844 -12.315 -6.418 1.00 1.34 H new ATOM 0 HA PHE A 137 -10.798 -14.487 -5.405 1.00 1.66 H new ATOM 0 HB2 PHE A 137 -10.471 -14.126 -7.816 1.00 2.23 H new ATOM 0 HB3 PHE A 137 -8.747 -14.398 -7.661 1.00 2.23 H new ATOM 0 HD1 PHE A 137 -11.688 -16.308 -6.325 1.00 3.49 H new ATOM 0 HD2 PHE A 137 -8.218 -16.342 -8.797 1.00 3.88 H new ATOM 0 HE1 PHE A 137 -12.024 -18.702 -6.761 1.00 4.44 H new ATOM 0 HE2 PHE A 137 -8.551 -18.738 -9.235 1.00 4.85 H new ATOM 0 HZ PHE A 137 -10.456 -19.922 -8.215 1.00 5.09 H new ATOM 2177 N PRO A 138 -7.500 -15.021 -5.105 1.00 0.88 N ATOM 2178 CA PRO A 138 -6.506 -15.800 -4.367 1.00 0.92 C ATOM 2179 C PRO A 138 -6.984 -16.173 -2.967 1.00 1.20 C ATOM 2180 O PRO A 138 -6.733 -17.276 -2.483 1.00 1.94 O ATOM 2181 CB PRO A 138 -5.301 -14.845 -4.279 1.00 1.24 C ATOM 2182 CG PRO A 138 -5.611 -13.688 -5.186 1.00 1.68 C ATOM 2183 CD PRO A 138 -6.826 -14.067 -5.986 1.00 1.44 C ATOM 0 HA PRO A 138 -6.286 -16.748 -4.858 1.00 0.92 H new ATOM 0 HB2 PRO A 138 -5.148 -14.506 -3.255 1.00 1.24 H new ATOM 0 HB3 PRO A 138 -4.384 -15.347 -4.589 1.00 1.24 H new ATOM 0 HG2 PRO A 138 -5.798 -12.784 -4.607 1.00 1.68 H new ATOM 0 HG3 PRO A 138 -4.767 -13.477 -5.843 1.00 1.68 H new ATOM 0 HD2 PRO A 138 -7.454 -13.203 -6.205 1.00 1.44 H new ATOM 0 HD3 PRO A 138 -6.558 -14.517 -6.942 1.00 1.44 H new ATOM 2191 N ASP A 139 -7.674 -15.235 -2.329 1.00 1.07 N ATOM 2192 CA ASP A 139 -8.197 -15.437 -0.988 1.00 1.62 C ATOM 2193 C ASP A 139 -9.723 -15.495 -0.991 1.00 1.65 C ATOM 2194 O ASP A 139 -10.321 -16.243 -0.218 1.00 2.28 O ATOM 2195 CB ASP A 139 -7.734 -14.306 -0.068 1.00 2.26 C ATOM 2196 CG ASP A 139 -8.003 -14.596 1.398 1.00 2.93 C ATOM 2197 OD1 ASP A 139 -8.559 -15.674 1.697 1.00 3.67 O ATOM 2198 OD2 ASP A 139 -7.662 -13.747 2.247 1.00 3.20 O ATOM 0 H ASP A 139 -7.884 -14.319 -2.726 1.00 1.07 H new ATOM 0 HA ASP A 139 -7.815 -16.390 -0.622 1.00 1.62 H new ATOM 0 HB2 ASP A 139 -6.666 -14.141 -0.211 1.00 2.26 H new ATOM 0 HB3 ASP A 139 -8.240 -13.383 -0.350 1.00 2.26 H new ATOM 2203 N GLY A 140 -10.357 -14.691 -1.850 1.00 1.25 N ATOM 2204 CA GLY A 140 -11.809 -14.681 -1.890 1.00 1.72 C ATOM 2205 C GLY A 140 -12.408 -14.178 -3.193 1.00 1.31 C ATOM 2206 O GLY A 140 -13.013 -14.949 -3.937 1.00 1.85 O ATOM 0 H GLY A 140 -9.898 -14.059 -2.506 1.00 1.25 H new ATOM 0 HA2 GLY A 140 -12.170 -15.693 -1.707 1.00 1.72 H new ATOM 0 HA3 GLY A 140 -12.177 -14.059 -1.074 1.00 1.72 H new ATOM 2210 N GLU A 141 -12.271 -12.879 -3.457 1.00 0.75 N ATOM 2211 CA GLU A 141 -12.841 -12.282 -4.668 1.00 0.94 C ATOM 2212 C GLU A 141 -12.370 -10.851 -4.892 1.00 0.82 C ATOM 2213 O GLU A 141 -11.504 -10.602 -5.726 1.00 1.19 O ATOM 2214 CB GLU A 141 -14.367 -12.287 -4.599 1.00 1.56 C ATOM 2215 CG GLU A 141 -14.923 -12.092 -3.198 1.00 1.38 C ATOM 2216 CD GLU A 141 -16.436 -12.182 -3.156 1.00 2.16 C ATOM 2217 OE1 GLU A 141 -17.098 -11.382 -3.848 1.00 2.97 O ATOM 2218 OE2 GLU A 141 -16.958 -13.053 -2.428 1.00 2.47 O ATOM 0 H GLU A 141 -11.774 -12.223 -2.855 1.00 0.75 H new ATOM 0 HA GLU A 141 -12.494 -12.891 -5.503 1.00 0.94 H new ATOM 0 HB2 GLU A 141 -14.752 -11.498 -5.245 1.00 1.56 H new ATOM 0 HB3 GLU A 141 -14.735 -13.233 -4.997 1.00 1.56 H new ATOM 0 HG2 GLU A 141 -14.499 -12.845 -2.534 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -14.609 -11.120 -2.818 1.00 1.38 H new ATOM 2225 N MET A 142 -12.963 -9.907 -4.160 1.00 0.57 N ATOM 2226 CA MET A 142 -12.602 -8.509 -4.305 1.00 0.54 C ATOM 2227 C MET A 142 -11.882 -8.013 -3.075 1.00 0.58 C ATOM 2228 O MET A 142 -11.855 -8.667 -2.033 1.00 0.92 O ATOM 2229 CB MET A 142 -13.829 -7.641 -4.566 1.00 0.57 C ATOM 2230 CG MET A 142 -14.669 -8.155 -5.706 1.00 0.67 C ATOM 2231 SD MET A 142 -16.212 -7.248 -5.930 1.00 1.32 S ATOM 2232 CE MET A 142 -16.919 -8.120 -7.327 1.00 1.58 C ATOM 0 H MET A 142 -13.689 -10.090 -3.467 1.00 0.57 H new ATOM 0 HA MET A 142 -11.936 -8.433 -5.165 1.00 0.54 H new ATOM 0 HB2 MET A 142 -14.437 -7.597 -3.662 1.00 0.57 H new ATOM 0 HB3 MET A 142 -13.509 -6.622 -4.785 1.00 0.57 H new ATOM 0 HG2 MET A 142 -14.089 -8.102 -6.627 1.00 0.67 H new ATOM 0 HG3 MET A 142 -14.897 -9.207 -5.533 1.00 0.67 H new ATOM 0 HE1 MET A 142 -17.127 -7.413 -8.130 1.00 1.58 H new ATOM 0 HE2 MET A 142 -16.215 -8.873 -7.680 1.00 1.58 H new ATOM 0 HE3 MET A 142 -17.846 -8.605 -7.022 1.00 1.58 H new ATOM 2242 N LEU A 143 -11.294 -6.854 -3.225 1.00 0.55 N ATOM 2243 CA LEU A 143 -10.545 -6.220 -2.157 1.00 0.62 C ATOM 2244 C LEU A 143 -11.467 -5.807 -1.028 1.00 0.56 C ATOM 2245 O LEU A 143 -11.452 -6.367 0.070 1.00 0.60 O ATOM 2246 CB LEU A 143 -9.838 -4.966 -2.685 1.00 0.76 C ATOM 2247 CG LEU A 143 -8.778 -5.168 -3.773 1.00 0.81 C ATOM 2248 CD1 LEU A 143 -7.597 -5.955 -3.236 1.00 1.54 C ATOM 2249 CD2 LEU A 143 -9.362 -5.850 -5.001 1.00 1.70 C ATOM 0 H LEU A 143 -11.318 -6.317 -4.092 1.00 0.55 H new ATOM 0 HA LEU A 143 -9.814 -6.939 -1.788 1.00 0.62 H new ATOM 0 HB2 LEU A 143 -10.598 -4.288 -3.075 1.00 0.76 H new ATOM 0 HB3 LEU A 143 -9.365 -4.464 -1.841 1.00 0.76 H new ATOM 0 HG LEU A 143 -8.427 -4.182 -4.076 1.00 0.81 H new ATOM 0 HD11 LEU A 143 -6.858 -6.086 -4.026 1.00 1.54 H new ATOM 0 HD12 LEU A 143 -7.147 -5.413 -2.404 1.00 1.54 H new ATOM 0 HD13 LEU A 143 -7.937 -6.932 -2.892 1.00 1.54 H new ATOM 0 HD21 LEU A 143 -8.582 -5.977 -5.752 1.00 1.70 H new ATOM 0 HD22 LEU A 143 -9.759 -6.826 -4.721 1.00 1.70 H new ATOM 0 HD23 LEU A 143 -10.164 -5.236 -5.411 1.00 1.70 H new ATOM 2261 N ARG A 144 -12.253 -4.805 -1.340 1.00 0.53 N ATOM 2262 CA ARG A 144 -13.205 -4.220 -0.430 1.00 0.52 C ATOM 2263 C ARG A 144 -14.344 -5.172 -0.130 1.00 0.61 C ATOM 2264 O ARG A 144 -15.070 -4.987 0.829 1.00 0.69 O ATOM 2265 CB ARG A 144 -13.741 -2.929 -1.035 1.00 0.53 C ATOM 2266 CG ARG A 144 -14.856 -2.286 -0.233 1.00 0.58 C ATOM 2267 CD ARG A 144 -15.534 -1.172 -1.014 1.00 0.85 C ATOM 2268 NE ARG A 144 -16.648 -0.580 -0.274 1.00 1.18 N ATOM 2269 CZ ARG A 144 -17.435 0.375 -0.762 1.00 1.39 C ATOM 2270 NH1 ARG A 144 -17.236 0.841 -1.987 1.00 1.59 N ATOM 2271 NH2 ARG A 144 -18.427 0.860 -0.027 1.00 2.16 N ATOM 0 H ARG A 144 -12.247 -4.363 -2.259 1.00 0.53 H new ATOM 0 HA ARG A 144 -12.702 -4.008 0.513 1.00 0.52 H new ATOM 0 HB2 ARG A 144 -12.921 -2.218 -1.132 1.00 0.53 H new ATOM 0 HB3 ARG A 144 -14.104 -3.135 -2.042 1.00 0.53 H new ATOM 0 HG2 ARG A 144 -15.593 -3.042 0.038 1.00 0.58 H new ATOM 0 HG3 ARG A 144 -14.452 -1.886 0.697 1.00 0.58 H new ATOM 0 HD2 ARG A 144 -14.803 -0.398 -1.249 1.00 0.85 H new ATOM 0 HD3 ARG A 144 -15.898 -1.565 -1.963 1.00 0.85 H new ATOM 0 HE ARG A 144 -16.832 -0.919 0.670 1.00 1.18 H new ATOM 0 HH11 ARG A 144 -16.478 0.467 -2.558 1.00 1.59 H new ATOM 0 HH12 ARG A 144 -17.841 1.573 -2.359 1.00 1.59 H new ATOM 0 HH21 ARG A 144 -18.587 0.501 0.914 1.00 2.16 H new ATOM 0 HH22 ARG A 144 -19.029 1.592 -0.403 1.00 2.16 H new ATOM 2285 N GLN A 145 -14.529 -6.159 -0.980 1.00 0.76 N ATOM 2286 CA GLN A 145 -15.622 -7.101 -0.808 1.00 0.92 C ATOM 2287 C GLN A 145 -15.745 -7.593 0.617 1.00 0.89 C ATOM 2288 O GLN A 145 -16.743 -7.340 1.297 1.00 0.97 O ATOM 2289 CB GLN A 145 -15.414 -8.294 -1.722 1.00 1.21 C ATOM 2290 CG GLN A 145 -16.708 -8.774 -2.315 1.00 0.96 C ATOM 2291 CD GLN A 145 -17.454 -7.649 -3.005 1.00 1.54 C ATOM 2292 OE1 GLN A 145 -18.621 -7.791 -3.368 1.00 2.27 O ATOM 2293 NE2 GLN A 145 -16.763 -6.527 -3.214 1.00 1.87 N ATOM 0 H GLN A 145 -13.941 -6.333 -1.795 1.00 0.76 H new ATOM 0 HA GLN A 145 -16.542 -6.573 -1.060 1.00 0.92 H new ATOM 0 HB2 GLN A 145 -14.726 -8.023 -2.522 1.00 1.21 H new ATOM 0 HB3 GLN A 145 -14.948 -9.105 -1.162 1.00 1.21 H new ATOM 0 HG2 GLN A 145 -16.508 -9.572 -3.030 1.00 0.96 H new ATOM 0 HG3 GLN A 145 -17.334 -9.199 -1.530 1.00 0.96 H new ATOM 0 HE21 GLN A 145 -15.797 -6.456 -2.894 1.00 1.87 H new ATOM 0 HE22 GLN A 145 -17.201 -5.740 -3.693 1.00 1.87 H new ATOM 2302 N ILE A 146 -14.715 -8.273 1.067 1.00 0.85 N ATOM 2303 CA ILE A 146 -14.685 -8.797 2.410 1.00 0.90 C ATOM 2304 C ILE A 146 -14.317 -7.684 3.352 1.00 0.85 C ATOM 2305 O ILE A 146 -14.797 -7.592 4.477 1.00 1.01 O ATOM 2306 CB ILE A 146 -13.627 -9.901 2.541 1.00 0.95 C ATOM 2307 CG1 ILE A 146 -13.724 -10.904 1.390 1.00 1.06 C ATOM 2308 CG2 ILE A 146 -13.760 -10.606 3.877 1.00 1.24 C ATOM 2309 CD1 ILE A 146 -13.039 -10.437 0.123 1.00 1.06 C ATOM 0 H ILE A 146 -13.881 -8.476 0.516 1.00 0.85 H new ATOM 0 HA ILE A 146 -15.666 -9.210 2.646 1.00 0.90 H new ATOM 0 HB ILE A 146 -12.644 -9.432 2.490 1.00 0.95 H new ATOM 0 HG12 ILE A 146 -13.283 -11.850 1.705 1.00 1.06 H new ATOM 0 HG13 ILE A 146 -14.775 -11.098 1.175 1.00 1.06 H new ATOM 0 HG21 ILE A 146 -13.002 -11.386 3.954 1.00 1.24 H new ATOM 0 HG22 ILE A 146 -13.623 -9.886 4.684 1.00 1.24 H new ATOM 0 HG23 ILE A 146 -14.751 -11.054 3.955 1.00 1.24 H new ATOM 0 HD11 ILE A 146 -13.147 -11.197 -0.651 1.00 1.06 H new ATOM 0 HD12 ILE A 146 -13.495 -9.507 -0.216 1.00 1.06 H new ATOM 0 HD13 ILE A 146 -11.980 -10.270 0.322 1.00 1.06 H new ATOM 2321 N LEU A 147 -13.437 -6.852 2.846 1.00 0.72 N ATOM 2322 CA LEU A 147 -12.903 -5.717 3.554 1.00 0.75 C ATOM 2323 C LEU A 147 -13.982 -4.690 3.944 1.00 0.71 C ATOM 2324 O LEU A 147 -13.818 -3.936 4.902 1.00 0.81 O ATOM 2325 CB LEU A 147 -11.833 -5.146 2.628 1.00 0.92 C ATOM 2326 CG LEU A 147 -11.314 -3.756 2.904 1.00 0.82 C ATOM 2327 CD1 LEU A 147 -12.206 -2.717 2.235 1.00 1.36 C ATOM 2328 CD2 LEU A 147 -11.183 -3.510 4.394 1.00 1.66 C ATOM 0 H LEU A 147 -13.063 -6.951 1.902 1.00 0.72 H new ATOM 0 HA LEU A 147 -12.481 -6.005 4.517 1.00 0.75 H new ATOM 0 HB2 LEU A 147 -10.982 -5.827 2.643 1.00 0.92 H new ATOM 0 HB3 LEU A 147 -12.232 -5.156 1.614 1.00 0.92 H new ATOM 0 HG LEU A 147 -10.316 -3.665 2.476 1.00 0.82 H new ATOM 0 HD11 LEU A 147 -11.820 -1.719 2.442 1.00 1.36 H new ATOM 0 HD12 LEU A 147 -12.217 -2.886 1.158 1.00 1.36 H new ATOM 0 HD13 LEU A 147 -13.220 -2.802 2.626 1.00 1.36 H new ATOM 0 HD21 LEU A 147 -10.807 -2.501 4.565 1.00 1.66 H new ATOM 0 HD22 LEU A 147 -12.159 -3.619 4.868 1.00 1.66 H new ATOM 0 HD23 LEU A 147 -10.489 -4.233 4.823 1.00 1.66 H new ATOM 2340 N HIS A 148 -15.083 -4.678 3.219 1.00 0.71 N ATOM 2341 CA HIS A 148 -16.180 -3.756 3.501 1.00 0.76 C ATOM 2342 C HIS A 148 -17.117 -4.351 4.533 1.00 0.83 C ATOM 2343 O HIS A 148 -17.548 -3.678 5.471 1.00 0.92 O ATOM 2344 CB HIS A 148 -16.951 -3.446 2.211 1.00 0.79 C ATOM 2345 CG HIS A 148 -18.128 -2.527 2.378 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -18.988 -2.221 1.342 1.00 1.04 N ATOM 2347 CD2 HIS A 148 -18.589 -1.845 3.454 1.00 1.02 C ATOM 2348 CE1 HIS A 148 -19.921 -1.393 1.773 1.00 1.20 C ATOM 2349 NE2 HIS A 148 -19.702 -1.149 3.052 1.00 1.19 N ATOM 0 H HIS A 148 -15.248 -5.297 2.425 1.00 0.71 H new ATOM 0 HA HIS A 148 -15.764 -2.830 3.898 1.00 0.76 H new ATOM 0 HB2 HIS A 148 -16.262 -3.002 1.492 1.00 0.79 H new ATOM 0 HB3 HIS A 148 -17.300 -4.384 1.780 1.00 0.79 H new ATOM 0 HD2 HIS A 148 -18.160 -1.848 4.445 1.00 1.02 H new ATOM 0 HE1 HIS A 148 -20.726 -0.985 1.181 1.00 1.20 H new ATOM 0 HE2 HIS A 148 -20.268 -0.542 3.645 1.00 1.19 H new ATOM 2358 N THR A 149 -17.444 -5.615 4.335 1.00 0.86 N ATOM 2359 CA THR A 149 -18.354 -6.312 5.223 1.00 0.97 C ATOM 2360 C THR A 149 -17.738 -6.625 6.583 1.00 1.00 C ATOM 2361 O THR A 149 -18.463 -6.787 7.565 1.00 1.13 O ATOM 2362 CB THR A 149 -18.833 -7.596 4.551 1.00 1.02 C ATOM 2363 OG1 THR A 149 -19.378 -8.496 5.500 1.00 1.35 O ATOM 2364 CG2 THR A 149 -17.752 -8.318 3.776 1.00 1.48 C ATOM 0 H THR A 149 -17.091 -6.181 3.564 1.00 0.86 H new ATOM 0 HA THR A 149 -19.197 -5.647 5.412 1.00 0.97 H new ATOM 0 HB THR A 149 -19.596 -7.275 3.842 1.00 1.02 H new ATOM 0 HG1 THR A 149 -19.679 -9.310 5.044 1.00 1.35 H new ATOM 0 HG21 THR A 149 -18.167 -9.220 3.327 1.00 1.48 H new ATOM 0 HG22 THR A 149 -17.369 -7.665 2.991 1.00 1.48 H new ATOM 0 HG23 THR A 149 -16.940 -8.589 4.451 1.00 1.48 H new ATOM 2372 N ARG A 150 -16.417 -6.750 6.647 1.00 0.91 N ATOM 2373 CA ARG A 150 -15.776 -7.089 7.912 1.00 0.97 C ATOM 2374 C ARG A 150 -14.848 -6.001 8.464 1.00 0.97 C ATOM 2375 O ARG A 150 -14.412 -6.109 9.611 1.00 1.16 O ATOM 2376 CB ARG A 150 -15.002 -8.394 7.767 1.00 1.01 C ATOM 2377 CG ARG A 150 -13.691 -8.240 7.028 1.00 1.12 C ATOM 2378 CD ARG A 150 -12.976 -9.572 6.892 1.00 1.43 C ATOM 2379 NE ARG A 150 -12.767 -10.222 8.184 1.00 1.84 N ATOM 2380 CZ ARG A 150 -12.015 -9.718 9.159 1.00 2.15 C ATOM 2381 NH1 ARG A 150 -11.382 -8.564 8.987 1.00 2.45 N ATOM 2382 NH2 ARG A 150 -11.890 -10.371 10.305 1.00 2.86 N ATOM 0 H ARG A 150 -15.782 -6.625 5.859 1.00 0.91 H new ATOM 0 HA ARG A 150 -16.585 -7.192 8.635 1.00 0.97 H new ATOM 0 HB2 ARG A 150 -14.805 -8.802 8.758 1.00 1.01 H new ATOM 0 HB3 ARG A 150 -15.623 -9.119 7.241 1.00 1.01 H new ATOM 0 HG2 ARG A 150 -13.876 -7.821 6.039 1.00 1.12 H new ATOM 0 HG3 ARG A 150 -13.052 -7.534 7.559 1.00 1.12 H new ATOM 0 HD2 ARG A 150 -13.557 -10.230 6.246 1.00 1.43 H new ATOM 0 HD3 ARG A 150 -12.013 -9.417 6.405 1.00 1.43 H new ATOM 0 HE ARG A 150 -13.226 -11.118 8.349 1.00 1.84 H new ATOM 0 HH11 ARG A 150 -11.471 -8.060 8.105 1.00 2.45 H new ATOM 0 HH12 ARG A 150 -10.807 -8.181 9.737 1.00 2.45 H new ATOM 0 HH21 ARG A 150 -12.370 -11.261 10.440 1.00 2.86 H new ATOM 0 HH22 ARG A 150 -11.313 -9.984 11.052 1.00 2.86 H new ATOM 2396 N ALA A 151 -14.513 -4.964 7.687 1.00 0.88 N ATOM 2397 CA ALA A 151 -13.617 -3.947 8.204 1.00 0.91 C ATOM 2398 C ALA A 151 -14.201 -2.556 8.045 1.00 0.92 C ATOM 2399 O ALA A 151 -15.093 -2.159 8.796 1.00 1.18 O ATOM 2400 CB ALA A 151 -12.258 -4.048 7.526 1.00 0.89 C ATOM 0 H ALA A 151 -14.840 -4.817 6.732 1.00 0.88 H new ATOM 0 HA ALA A 151 -13.488 -4.123 9.272 1.00 0.91 H new ATOM 0 HB1 ALA A 151 -11.595 -3.279 7.923 1.00 0.89 H new ATOM 0 HB2 ALA A 151 -11.828 -5.031 7.717 1.00 0.89 H new ATOM 0 HB3 ALA A 151 -12.376 -3.906 6.452 1.00 0.89 H new ATOM 2406 N PHE A 152 -13.694 -1.816 7.072 1.00 0.79 N ATOM 2407 CA PHE A 152 -14.155 -0.478 6.826 1.00 0.99 C ATOM 2408 C PHE A 152 -15.389 -0.484 5.941 1.00 0.88 C ATOM 2409 O PHE A 152 -15.870 -1.542 5.537 1.00 1.32 O ATOM 2410 CB PHE A 152 -13.040 0.313 6.165 1.00 1.26 C ATOM 2411 CG PHE A 152 -11.869 0.596 7.072 1.00 2.02 C ATOM 2412 CD1 PHE A 152 -11.256 -0.431 7.769 1.00 2.81 C ATOM 2413 CD2 PHE A 152 -11.382 1.886 7.227 1.00 2.37 C ATOM 2414 CE1 PHE A 152 -10.182 -0.180 8.601 1.00 3.76 C ATOM 2415 CE2 PHE A 152 -10.308 2.142 8.057 1.00 3.27 C ATOM 2416 CZ PHE A 152 -9.711 1.121 8.746 1.00 3.92 C ATOM 0 H PHE A 152 -12.958 -2.131 6.441 1.00 0.79 H new ATOM 0 HA PHE A 152 -14.427 -0.014 7.774 1.00 0.99 H new ATOM 0 HB2 PHE A 152 -12.686 -0.236 5.293 1.00 1.26 H new ATOM 0 HB3 PHE A 152 -13.444 1.259 5.804 1.00 1.26 H new ATOM 0 HD1 PHE A 152 -11.622 -1.441 7.661 1.00 2.81 H new ATOM 0 HD2 PHE A 152 -11.848 2.700 6.692 1.00 2.37 H new ATOM 0 HE1 PHE A 152 -9.710 -0.990 9.137 1.00 3.76 H new ATOM 0 HE2 PHE A 152 -9.938 3.151 8.163 1.00 3.27 H new ATOM 0 HZ PHE A 152 -8.876 1.325 9.401 1.00 3.92 H new ATOM 2426 N ASP A 153 -15.893 0.702 5.637 1.00 0.92 N ATOM 2427 CA ASP A 153 -17.066 0.832 4.792 1.00 1.10 C ATOM 2428 C ASP A 153 -16.679 1.412 3.441 1.00 1.14 C ATOM 2429 O ASP A 153 -17.296 1.101 2.421 1.00 1.88 O ATOM 2430 CB ASP A 153 -18.116 1.717 5.465 1.00 1.43 C ATOM 2431 CG ASP A 153 -18.571 1.161 6.800 1.00 2.10 C ATOM 2432 OD1 ASP A 153 -19.103 0.032 6.821 1.00 2.58 O ATOM 2433 OD2 ASP A 153 -18.399 1.857 7.821 1.00 2.80 O ATOM 0 H ASP A 153 -15.507 1.588 5.964 1.00 0.92 H new ATOM 0 HA ASP A 153 -17.494 -0.159 4.640 1.00 1.10 H new ATOM 0 HB2 ASP A 153 -17.705 2.716 5.612 1.00 1.43 H new ATOM 0 HB3 ASP A 153 -18.977 1.820 4.805 1.00 1.43 H new ATOM 2438 N LYS A 154 -15.648 2.255 3.446 1.00 0.75 N ATOM 2439 CA LYS A 154 -15.162 2.890 2.225 1.00 0.78 C ATOM 2440 C LYS A 154 -14.019 3.859 2.515 1.00 0.91 C ATOM 2441 O LYS A 154 -12.885 3.625 2.106 1.00 1.80 O ATOM 2442 CB LYS A 154 -16.301 3.646 1.529 1.00 0.89 C ATOM 2443 CG LYS A 154 -15.818 4.683 0.522 1.00 0.86 C ATOM 2444 CD LYS A 154 -16.947 5.572 0.029 1.00 1.03 C ATOM 2445 CE LYS A 154 -17.723 6.197 1.181 1.00 1.54 C ATOM 2446 NZ LYS A 154 -16.852 7.030 2.055 1.00 2.17 N ATOM 0 H LYS A 154 -15.132 2.514 4.287 1.00 0.75 H new ATOM 0 HA LYS A 154 -14.790 2.101 1.572 1.00 0.78 H new ATOM 0 HB2 LYS A 154 -16.944 2.929 1.019 1.00 0.89 H new ATOM 0 HB3 LYS A 154 -16.912 4.141 2.284 1.00 0.89 H new ATOM 0 HG2 LYS A 154 -15.045 5.300 0.981 1.00 0.86 H new ATOM 0 HG3 LYS A 154 -15.359 4.177 -0.327 1.00 0.86 H new ATOM 0 HD2 LYS A 154 -16.539 6.360 -0.603 1.00 1.03 H new ATOM 0 HD3 LYS A 154 -17.626 4.986 -0.590 1.00 1.03 H new ATOM 0 HE2 LYS A 154 -18.530 6.812 0.783 1.00 1.54 H new ATOM 0 HE3 LYS A 154 -18.186 5.409 1.776 1.00 1.54 H new ATOM 0 HZ1 LYS A 154 -16.773 6.585 2.992 1.00 2.17 H new ATOM 0 HZ2 LYS A 154 -15.907 7.110 1.628 1.00 2.17 H new ATOM 0 HZ3 LYS A 154 -17.267 7.978 2.156 1.00 2.17 H new ATOM 2460 N LEU A 155 -14.363 4.959 3.190 1.00 0.61 N ATOM 2461 CA LEU A 155 -13.428 6.043 3.532 1.00 0.61 C ATOM 2462 C LEU A 155 -13.554 7.143 2.472 1.00 0.68 C ATOM 2463 O LEU A 155 -14.085 6.892 1.392 1.00 0.89 O ATOM 2464 CB LEU A 155 -11.977 5.545 3.653 1.00 0.60 C ATOM 2465 CG LEU A 155 -11.738 4.449 4.708 1.00 0.60 C ATOM 2466 CD1 LEU A 155 -10.247 4.207 4.885 1.00 1.18 C ATOM 2467 CD2 LEU A 155 -12.377 4.841 6.034 1.00 1.23 C ATOM 0 H LEU A 155 -15.313 5.128 3.521 1.00 0.61 H new ATOM 0 HA LEU A 155 -13.690 6.440 4.513 1.00 0.61 H new ATOM 0 HB2 LEU A 155 -11.659 5.165 2.682 1.00 0.60 H new ATOM 0 HB3 LEU A 155 -11.338 6.396 3.887 1.00 0.60 H new ATOM 0 HG LEU A 155 -12.201 3.524 4.363 1.00 0.60 H new ATOM 0 HD11 LEU A 155 -10.091 3.430 5.633 1.00 1.18 H new ATOM 0 HD12 LEU A 155 -9.815 3.889 3.936 1.00 1.18 H new ATOM 0 HD13 LEU A 155 -9.765 5.128 5.212 1.00 1.18 H new ATOM 0 HD21 LEU A 155 -12.199 4.056 6.769 1.00 1.23 H new ATOM 0 HD22 LEU A 155 -11.939 5.775 6.387 1.00 1.23 H new ATOM 0 HD23 LEU A 155 -13.450 4.973 5.896 1.00 1.23 H new ATOM 2479 N ASN A 156 -13.109 8.367 2.766 1.00 0.66 N ATOM 2480 CA ASN A 156 -13.253 9.450 1.798 1.00 0.77 C ATOM 2481 C ASN A 156 -11.915 10.042 1.386 1.00 0.65 C ATOM 2482 O ASN A 156 -11.034 10.271 2.219 1.00 0.69 O ATOM 2483 CB ASN A 156 -14.151 10.552 2.356 1.00 1.04 C ATOM 2484 CG ASN A 156 -13.461 11.377 3.419 1.00 1.66 C ATOM 2485 OD1 ASN A 156 -12.547 12.151 3.129 1.00 2.44 O ATOM 2486 ND2 ASN A 156 -13.884 11.209 4.659 1.00 2.12 N ATOM 0 H ASN A 156 -12.658 8.627 3.643 1.00 0.66 H new ATOM 0 HA ASN A 156 -13.712 9.017 0.909 1.00 0.77 H new ATOM 0 HB2 ASN A 156 -14.468 11.205 1.543 1.00 1.04 H new ATOM 0 HB3 ASN A 156 -15.052 10.105 2.776 1.00 1.04 H new ATOM 0 HD21 ASN A 156 -13.451 11.731 5.421 1.00 2.12 H new ATOM 0 HD22 ASN A 156 -14.644 10.558 4.855 1.00 2.12 H new ATOM 2493 N LYS A 157 -11.808 10.308 0.083 1.00 0.64 N ATOM 2494 CA LYS A 157 -10.611 10.895 -0.496 1.00 0.64 C ATOM 2495 C LYS A 157 -10.165 12.084 0.328 1.00 0.68 C ATOM 2496 O LYS A 157 -10.982 12.898 0.763 1.00 0.95 O ATOM 2497 CB LYS A 157 -10.846 11.287 -1.950 1.00 0.79 C ATOM 2498 CG LYS A 157 -11.151 10.092 -2.842 1.00 0.96 C ATOM 2499 CD LYS A 157 -11.951 10.484 -4.070 1.00 1.67 C ATOM 2500 CE LYS A 157 -12.413 9.256 -4.839 1.00 1.70 C ATOM 2501 NZ LYS A 157 -13.219 9.620 -6.038 1.00 2.51 N ATOM 0 H LYS A 157 -12.548 10.121 -0.593 1.00 0.64 H new ATOM 0 HA LYS A 157 -9.815 10.151 -0.483 1.00 0.64 H new ATOM 0 HB2 LYS A 157 -11.674 11.994 -2.002 1.00 0.79 H new ATOM 0 HB3 LYS A 157 -9.964 11.802 -2.330 1.00 0.79 H new ATOM 0 HG2 LYS A 157 -10.217 9.625 -3.153 1.00 0.96 H new ATOM 0 HG3 LYS A 157 -11.706 9.347 -2.272 1.00 0.96 H new ATOM 0 HD2 LYS A 157 -12.816 11.076 -3.770 1.00 1.67 H new ATOM 0 HD3 LYS A 157 -11.342 11.115 -4.718 1.00 1.67 H new ATOM 0 HE2 LYS A 157 -11.545 8.674 -5.149 1.00 1.70 H new ATOM 0 HE3 LYS A 157 -13.006 8.619 -4.183 1.00 1.70 H new ATOM 0 HZ1 LYS A 157 -13.514 8.755 -6.534 1.00 2.51 H new ATOM 0 HZ2 LYS A 157 -14.061 10.153 -5.741 1.00 2.51 H new ATOM 0 HZ3 LYS A 157 -12.645 10.206 -6.677 1.00 2.51 H new ATOM 2515 N TRP A 158 -8.870 12.147 0.569 1.00 0.73 N ATOM 2516 CA TRP A 158 -8.293 13.202 1.379 1.00 0.83 C ATOM 2517 C TRP A 158 -8.803 14.576 0.950 1.00 1.08 C ATOM 2518 O TRP A 158 -8.784 14.860 -0.265 1.00 1.47 O ATOM 2519 CB TRP A 158 -6.774 13.147 1.268 1.00 0.85 C ATOM 2520 CG TRP A 158 -6.063 13.864 2.376 1.00 1.04 C ATOM 2521 CD1 TRP A 158 -6.321 13.767 3.714 1.00 1.51 C ATOM 2522 CD2 TRP A 158 -4.977 14.790 2.244 1.00 1.55 C ATOM 2523 NE1 TRP A 158 -5.462 14.572 4.420 1.00 1.52 N ATOM 2524 CE2 TRP A 158 -4.628 15.211 3.540 1.00 1.52 C ATOM 2525 CE3 TRP A 158 -4.266 15.304 1.155 1.00 2.50 C ATOM 2526 CZ2 TRP A 158 -3.599 16.120 3.777 1.00 2.07 C ATOM 2527 CZ3 TRP A 158 -3.246 16.205 1.392 1.00 3.24 C ATOM 2528 CH2 TRP A 158 -2.920 16.605 2.694 1.00 2.95 C ATOM 2529 OXT TRP A 158 -9.216 15.355 1.835 1.00 1.75 O ATOM 0 H TRP A 158 -8.192 11.474 0.212 1.00 0.73 H new ATOM 0 HA TRP A 158 -8.594 13.048 2.415 1.00 0.83 H new ATOM 0 HB2 TRP A 158 -6.457 12.104 1.259 1.00 0.85 H new ATOM 0 HB3 TRP A 158 -6.472 13.580 0.314 1.00 0.85 H new ATOM 0 HD1 TRP A 158 -7.089 13.147 4.153 1.00 1.51 H new ATOM 0 HE1 TRP A 158 -5.447 14.677 5.434 1.00 1.52 H new ATOM 0 HE3 TRP A 158 -4.510 15.002 0.147 1.00 2.50 H new ATOM 0 HZ2 TRP A 158 -3.347 16.430 4.780 1.00 2.07 H new ATOM 0 HZ3 TRP A 158 -2.690 16.608 0.558 1.00 3.24 H new ATOM 0 HH2 TRP A 158 -2.116 17.310 2.845 1.00 2.95 H new TER 2540 TRP A 158