USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=28 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 99 MET CE :methyl 171:sc= -4.08! (180deg=-3.11) USER MOD Set 1.2: A 124 MET CE :methyl -155:sc= -0.444 (180deg=-0.595) USER MOD Set 2.1: A 31 SER OG : rot 70:sc= 1.01 USER MOD Set 2.2: A 62 THR OG1 : rot 101:sc= 1.32 USER MOD Set 3.1: A 53 TYR OH : rot -32:sc= 0.617 USER MOD Set 3.2: A 55 ASN : amide:sc= -7.12! C(o=-6.5!,f=-4.9!) USER MOD Set 4.1: A 48 GLN : amide:sc= -15.7! C(o=-28!,f=-29!) USER MOD Set 4.2: A 50 GLN : amide:sc= -12! C(o=-28!,f=-24!) USER MOD Single : A 1 THR N :NH3+ 170:sc= 0.761 (180deg=0.69) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.00385 USER MOD Single : A 4 TYR OH : rot -163:sc= -2.21! USER MOD Single : A 9 SER OG : rot -41:sc= -2.17! USER MOD Single : A 10 ASN : amide:sc= -9.33! C(o=-9.3!,f=-15!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -7.26! C(o=-7.3!,f=-10!) USER MOD Single : A 19 ASN : amide:sc= -4.2! K(o=-4.2!,f=-0.78) USER MOD Single : A 23 LYS NZ :NH3+ 164:sc= -0.0577 (180deg=-0.327) USER MOD Single : A 32 HIS : no HD1:sc= -1.93 K(o=-1.9,f=-4.1!) USER MOD Single : A 35 THR OG1 : rot 161:sc=-9.46e-05 USER MOD Single : A 37 SER OG : rot -68:sc= 1.08 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot -120:sc= -4.05! USER MOD Single : A 63 SER OG : rot -32:sc= 0.62 USER MOD Single : A 71 ASN : amide:sc= -6.92! C(o=-6.9!,f=-3.3!) USER MOD Single : A 72 HIS : no HD1:sc= -4.67! C(o=-4.7!,f=-6.8!) USER MOD Single : A 73 THR OG1 : rot -19:sc= -3.9! USER MOD Single : A 74 GLN : amide:sc= -2.77! K(o=-2.8!,f=0.31) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.00018) USER MOD Single : A 80 GLN : amide:sc= -5.55! C(o=-5.5!,f=-4.1!) USER MOD Single : A 85 LYS NZ :NH3+ 151:sc= -0.137 (180deg=-1.49) USER MOD Single : A 93 THR OG1 : rot -130:sc= -5.38! USER MOD Single : A 103 ASN : amide:sc=-0.00329 X(o=-0.0033,f=-0.35) USER MOD Single : A 107 ASN : amide:sc= -2.16! K(o=-2.2!,f=-0.53) USER MOD Single : A 108 THR OG1 : rot 121:sc= -1.05! USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.0239 USER MOD Single : A 115 HIS : no HD1:sc= -1.65 K(o=-1.7,f=-6.4!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl -120:sc= -3.5! (180deg=-4.5!) USER MOD Single : A 119 LYS NZ :NH3+ 165:sc= -0.0135 (180deg=-0.28) USER MOD Single : A 120 ASN : amide:sc= -0.432 X(o=-0.43,f=-0.77) USER MOD Single : A 142 MET CE :methyl -161:sc= -0.149 (180deg=-0.637) USER MOD Single : A 145 GLN : amide:sc= -9.61! C(o=-9.6!,f=-4.6!) USER MOD Single : A 148 HIS : no HD1:sc= -0.0982 K(o=-0.098,f=-1.8!) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -150:sc= -1.3 (180deg=-2.15!) USER MOD Single : A 156 ASN : amide:sc= -1.77 K(o=-1.8,f=-4.5!) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 1.999 -13.296 -9.249 1.00 0.73 N ATOM 2 CA THR A 1 1.026 -12.823 -8.228 1.00 0.53 C ATOM 3 C THR A 1 0.970 -11.296 -8.189 1.00 0.47 C ATOM 4 O THR A 1 1.917 -10.621 -8.594 1.00 0.70 O ATOM 5 CB THR A 1 1.445 -13.381 -6.866 1.00 0.54 C ATOM 6 OG1 THR A 1 1.526 -14.797 -6.911 1.00 0.58 O ATOM 7 CG2 THR A 1 0.492 -13.018 -5.749 1.00 0.81 C ATOM 0 H1 THR A 1 2.145 -14.320 -9.142 1.00 0.73 H new ATOM 0 H2 THR A 1 1.629 -13.097 -10.200 1.00 0.73 H new ATOM 0 H3 THR A 1 2.905 -12.802 -9.120 1.00 0.73 H new ATOM 0 HA THR A 1 0.028 -13.177 -8.485 1.00 0.53 H new ATOM 0 HB THR A 1 2.415 -12.930 -6.656 1.00 0.54 H new ATOM 0 HG1 THR A 1 1.797 -15.137 -6.033 1.00 0.58 H new ATOM 0 HG21 THR A 1 0.850 -13.446 -4.812 1.00 0.81 H new ATOM 0 HG22 THR A 1 0.438 -11.933 -5.655 1.00 0.81 H new ATOM 0 HG23 THR A 1 -0.499 -13.413 -5.973 1.00 0.81 H new ATOM 17 N VAL A 2 -0.146 -10.755 -7.709 1.00 0.44 N ATOM 18 CA VAL A 2 -0.322 -9.308 -7.627 1.00 0.42 C ATOM 19 C VAL A 2 0.031 -8.777 -6.243 1.00 0.38 C ATOM 20 O VAL A 2 -0.278 -9.402 -5.228 1.00 0.43 O ATOM 21 CB VAL A 2 -1.770 -8.893 -7.954 1.00 0.51 C ATOM 22 CG1 VAL A 2 -1.958 -7.400 -7.739 1.00 1.29 C ATOM 23 CG2 VAL A 2 -2.130 -9.267 -9.379 1.00 0.85 C ATOM 0 H VAL A 2 -0.942 -11.296 -7.371 1.00 0.44 H new ATOM 0 HA VAL A 2 0.355 -8.877 -8.365 1.00 0.42 H new ATOM 0 HB VAL A 2 -2.436 -9.430 -7.279 1.00 0.51 H new ATOM 0 HG11 VAL A 2 -2.986 -7.125 -7.975 1.00 1.29 H new ATOM 0 HG12 VAL A 2 -1.746 -7.153 -6.699 1.00 1.29 H new ATOM 0 HG13 VAL A 2 -1.277 -6.850 -8.389 1.00 1.29 H new ATOM 0 HG21 VAL A 2 -3.156 -8.964 -9.586 1.00 0.85 H new ATOM 0 HG22 VAL A 2 -1.456 -8.761 -10.070 1.00 0.85 H new ATOM 0 HG23 VAL A 2 -2.037 -10.346 -9.507 1.00 0.85 H new ATOM 33 N ALA A 3 0.659 -7.606 -6.212 1.00 0.38 N ATOM 34 CA ALA A 3 1.033 -6.970 -4.956 1.00 0.40 C ATOM 35 C ALA A 3 0.186 -5.725 -4.722 1.00 0.40 C ATOM 36 O ALA A 3 0.460 -4.662 -5.275 1.00 0.65 O ATOM 37 CB ALA A 3 2.514 -6.620 -4.952 1.00 0.43 C ATOM 0 H ALA A 3 0.920 -7.078 -7.045 1.00 0.38 H new ATOM 0 HA ALA A 3 0.848 -7.673 -4.143 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.773 -6.146 -4.005 1.00 0.43 H new ATOM 0 HB2 ALA A 3 3.103 -7.529 -5.076 1.00 0.43 H new ATOM 0 HB3 ALA A 3 2.728 -5.934 -5.772 1.00 0.43 H new ATOM 43 N TYR A 4 -0.842 -5.874 -3.896 1.00 0.25 N ATOM 44 CA TYR A 4 -1.746 -4.779 -3.570 1.00 0.24 C ATOM 45 C TYR A 4 -1.129 -3.919 -2.469 1.00 0.27 C ATOM 46 O TYR A 4 -1.466 -4.058 -1.294 1.00 0.35 O ATOM 47 CB TYR A 4 -3.086 -5.345 -3.116 1.00 0.25 C ATOM 48 CG TYR A 4 -3.690 -6.338 -4.091 1.00 0.27 C ATOM 49 CD1 TYR A 4 -3.173 -7.624 -4.224 1.00 0.55 C ATOM 50 CD2 TYR A 4 -4.772 -5.987 -4.883 1.00 0.62 C ATOM 51 CE1 TYR A 4 -3.717 -8.524 -5.117 1.00 0.61 C ATOM 52 CE2 TYR A 4 -5.320 -6.884 -5.778 1.00 0.66 C ATOM 53 CZ TYR A 4 -4.791 -8.151 -5.892 1.00 0.45 C ATOM 54 OH TYR A 4 -5.338 -9.044 -6.784 1.00 0.55 O ATOM 0 H TYR A 4 -1.072 -6.754 -3.435 1.00 0.25 H new ATOM 0 HA TYR A 4 -1.907 -4.158 -4.451 1.00 0.24 H new ATOM 0 HB2 TYR A 4 -2.956 -5.831 -2.149 1.00 0.25 H new ATOM 0 HB3 TYR A 4 -3.786 -4.523 -2.968 1.00 0.25 H new ATOM 0 HD1 TYR A 4 -2.331 -7.922 -3.617 1.00 0.55 H new ATOM 0 HD2 TYR A 4 -5.193 -4.996 -4.799 1.00 0.62 H new ATOM 0 HE1 TYR A 4 -3.302 -9.517 -5.207 1.00 0.61 H new ATOM 0 HE2 TYR A 4 -6.162 -6.593 -6.388 1.00 0.66 H new ATOM 0 HH TYR A 4 -5.893 -8.561 -7.432 1.00 0.55 H new ATOM 64 N ILE A 5 -0.191 -3.057 -2.858 1.00 0.28 N ATOM 65 CA ILE A 5 0.515 -2.206 -1.904 1.00 0.34 C ATOM 66 C ILE A 5 -0.236 -0.912 -1.606 1.00 0.34 C ATOM 67 O ILE A 5 -0.984 -0.403 -2.441 1.00 0.39 O ATOM 68 CB ILE A 5 1.918 -1.849 -2.431 1.00 0.41 C ATOM 69 CG1 ILE A 5 2.617 -3.103 -2.964 1.00 0.44 C ATOM 70 CG2 ILE A 5 2.749 -1.198 -1.333 1.00 0.53 C ATOM 71 CD1 ILE A 5 3.988 -2.837 -3.549 1.00 0.95 C ATOM 0 H ILE A 5 0.097 -2.930 -3.828 1.00 0.28 H new ATOM 0 HA ILE A 5 0.590 -2.780 -0.980 1.00 0.34 H new ATOM 0 HB ILE A 5 1.813 -1.136 -3.249 1.00 0.41 H new ATOM 0 HG12 ILE A 5 2.712 -3.826 -2.154 1.00 0.44 H new ATOM 0 HG13 ILE A 5 1.989 -3.561 -3.728 1.00 0.44 H new ATOM 0 HG21 ILE A 5 3.737 -0.952 -1.722 1.00 0.53 H new ATOM 0 HG22 ILE A 5 2.255 -0.287 -0.995 1.00 0.53 H new ATOM 0 HG23 ILE A 5 2.850 -1.888 -0.496 1.00 0.53 H new ATOM 0 HD11 ILE A 5 4.419 -3.773 -3.905 1.00 0.95 H new ATOM 0 HD12 ILE A 5 3.899 -2.138 -4.381 1.00 0.95 H new ATOM 0 HD13 ILE A 5 4.634 -2.408 -2.783 1.00 0.95 H new ATOM 83 N ALA A 6 -0.009 -0.377 -0.406 1.00 0.40 N ATOM 84 CA ALA A 6 -0.630 0.870 0.022 1.00 0.44 C ATOM 85 C ALA A 6 0.441 1.919 0.303 1.00 0.42 C ATOM 86 O ALA A 6 1.138 1.852 1.317 1.00 0.58 O ATOM 87 CB ALA A 6 -1.490 0.637 1.256 1.00 0.53 C ATOM 0 H ALA A 6 0.607 -0.795 0.291 1.00 0.40 H new ATOM 0 HA ALA A 6 -1.273 1.236 -0.778 1.00 0.44 H new ATOM 0 HB1 ALA A 6 -1.947 1.577 1.564 1.00 0.53 H new ATOM 0 HB2 ALA A 6 -2.271 -0.087 1.024 1.00 0.53 H new ATOM 0 HB3 ALA A 6 -0.869 0.254 2.065 1.00 0.53 H new ATOM 93 N ILE A 7 0.582 2.873 -0.610 1.00 0.41 N ATOM 94 CA ILE A 7 1.585 3.925 -0.476 1.00 0.40 C ATOM 95 C ILE A 7 1.054 5.127 0.299 1.00 0.44 C ATOM 96 O ILE A 7 -0.082 5.554 0.099 1.00 0.52 O ATOM 97 CB ILE A 7 2.066 4.400 -1.864 1.00 0.50 C ATOM 98 CG1 ILE A 7 2.656 3.223 -2.646 1.00 0.65 C ATOM 99 CG2 ILE A 7 3.088 5.521 -1.721 1.00 0.53 C ATOM 100 CD1 ILE A 7 3.027 3.562 -4.073 1.00 0.99 C ATOM 0 H ILE A 7 0.013 2.940 -1.454 1.00 0.41 H new ATOM 0 HA ILE A 7 2.418 3.494 0.080 1.00 0.40 H new ATOM 0 HB ILE A 7 1.212 4.791 -2.417 1.00 0.50 H new ATOM 0 HG12 ILE A 7 3.543 2.862 -2.126 1.00 0.65 H new ATOM 0 HG13 ILE A 7 1.935 2.405 -2.652 1.00 0.65 H new ATOM 0 HG21 ILE A 7 3.416 5.843 -2.709 1.00 0.53 H new ATOM 0 HG22 ILE A 7 2.634 6.362 -1.197 1.00 0.53 H new ATOM 0 HG23 ILE A 7 3.946 5.161 -1.154 1.00 0.53 H new ATOM 0 HD11 ILE A 7 3.438 2.679 -4.562 1.00 0.99 H new ATOM 0 HD12 ILE A 7 2.139 3.894 -4.611 1.00 0.99 H new ATOM 0 HD13 ILE A 7 3.772 4.358 -4.076 1.00 0.99 H new ATOM 112 N GLY A 8 1.897 5.683 1.168 1.00 0.50 N ATOM 113 CA GLY A 8 1.507 6.845 1.939 1.00 0.61 C ATOM 114 C GLY A 8 2.518 7.955 1.787 1.00 0.62 C ATOM 115 O GLY A 8 3.711 7.685 1.655 1.00 0.90 O ATOM 0 H GLY A 8 2.843 5.347 1.349 1.00 0.50 H new ATOM 0 HA2 GLY A 8 0.527 7.192 1.611 1.00 0.61 H new ATOM 0 HA3 GLY A 8 1.413 6.574 2.991 1.00 0.61 H new ATOM 119 N SER A 9 2.055 9.199 1.789 1.00 0.56 N ATOM 120 CA SER A 9 2.956 10.331 1.626 1.00 0.63 C ATOM 121 C SER A 9 2.295 11.623 2.073 1.00 0.66 C ATOM 122 O SER A 9 1.175 11.930 1.675 1.00 0.77 O ATOM 123 CB SER A 9 3.388 10.447 0.167 1.00 0.77 C ATOM 124 OG SER A 9 3.926 9.230 -0.313 1.00 1.58 O ATOM 0 H SER A 9 1.072 9.447 1.900 1.00 0.56 H new ATOM 0 HA SER A 9 3.833 10.161 2.251 1.00 0.63 H new ATOM 0 HB2 SER A 9 2.533 10.734 -0.445 1.00 0.77 H new ATOM 0 HB3 SER A 9 4.131 11.238 0.068 1.00 0.77 H new ATOM 0 HG SER A 9 4.493 8.828 0.378 1.00 1.58 H new ATOM 130 N ASN A 10 2.993 12.366 2.920 1.00 0.69 N ATOM 131 CA ASN A 10 2.475 13.616 3.448 1.00 0.79 C ATOM 132 C ASN A 10 3.498 14.271 4.358 1.00 0.83 C ATOM 133 O ASN A 10 3.574 15.495 4.462 1.00 0.98 O ATOM 134 CB ASN A 10 1.176 13.348 4.212 1.00 0.99 C ATOM 135 CG ASN A 10 1.251 12.089 5.064 1.00 1.05 C ATOM 136 OD1 ASN A 10 1.557 11.003 4.573 1.00 2.01 O ATOM 137 ND2 ASN A 10 0.947 12.218 6.344 1.00 1.01 N ATOM 0 H ASN A 10 3.924 12.121 3.257 1.00 0.69 H new ATOM 0 HA ASN A 10 2.270 14.296 2.621 1.00 0.79 H new ATOM 0 HB2 ASN A 10 0.951 14.202 4.851 1.00 0.99 H new ATOM 0 HB3 ASN A 10 0.354 13.255 3.503 1.00 0.99 H new ATOM 0 HD21 ASN A 10 0.962 11.402 6.956 1.00 1.01 H new ATOM 0 HD22 ASN A 10 0.698 13.133 6.719 1.00 1.01 H new ATOM 144 N LEU A 11 4.285 13.434 5.014 1.00 0.83 N ATOM 145 CA LEU A 11 5.319 13.888 5.928 1.00 0.95 C ATOM 146 C LEU A 11 6.351 14.758 5.202 1.00 0.93 C ATOM 147 O LEU A 11 7.161 15.436 5.833 1.00 1.38 O ATOM 148 CB LEU A 11 5.968 12.652 6.576 1.00 1.12 C ATOM 149 CG LEU A 11 6.787 12.878 7.852 1.00 0.90 C ATOM 150 CD1 LEU A 11 8.152 13.472 7.537 1.00 1.77 C ATOM 151 CD2 LEU A 11 6.031 13.768 8.828 1.00 1.54 C ATOM 0 H LEU A 11 4.224 12.419 4.927 1.00 0.83 H new ATOM 0 HA LEU A 11 4.882 14.513 6.706 1.00 0.95 H new ATOM 0 HB2 LEU A 11 5.178 11.936 6.804 1.00 1.12 H new ATOM 0 HB3 LEU A 11 6.618 12.185 5.836 1.00 1.12 H new ATOM 0 HG LEU A 11 6.944 11.906 8.319 1.00 0.90 H new ATOM 0 HD11 LEU A 11 8.707 13.620 8.463 1.00 1.77 H new ATOM 0 HD12 LEU A 11 8.704 12.792 6.888 1.00 1.77 H new ATOM 0 HD13 LEU A 11 8.024 14.430 7.034 1.00 1.77 H new ATOM 0 HD21 LEU A 11 6.631 13.915 9.726 1.00 1.54 H new ATOM 0 HD22 LEU A 11 5.833 14.733 8.362 1.00 1.54 H new ATOM 0 HD23 LEU A 11 5.087 13.294 9.096 1.00 1.54 H new ATOM 163 N ALA A 12 6.301 14.755 3.870 1.00 0.84 N ATOM 164 CA ALA A 12 7.221 15.556 3.062 1.00 0.91 C ATOM 165 C ALA A 12 6.896 15.465 1.571 1.00 0.95 C ATOM 166 O ALA A 12 7.483 14.661 0.846 1.00 1.72 O ATOM 167 CB ALA A 12 8.660 15.127 3.309 1.00 0.97 C ATOM 0 H ALA A 12 5.633 14.207 3.328 1.00 0.84 H new ATOM 0 HA ALA A 12 7.099 16.595 3.367 1.00 0.91 H new ATOM 0 HB1 ALA A 12 9.330 15.733 2.700 1.00 0.97 H new ATOM 0 HB2 ALA A 12 8.904 15.263 4.362 1.00 0.97 H new ATOM 0 HB3 ALA A 12 8.778 14.077 3.042 1.00 0.97 H new ATOM 173 N SER A 13 5.964 16.300 1.121 1.00 0.81 N ATOM 174 CA SER A 13 5.556 16.331 -0.288 1.00 0.79 C ATOM 175 C SER A 13 4.981 14.987 -0.724 1.00 0.71 C ATOM 176 O SER A 13 5.706 14.131 -1.224 1.00 0.71 O ATOM 177 CB SER A 13 6.745 16.695 -1.183 1.00 0.89 C ATOM 178 OG SER A 13 6.345 16.813 -2.536 1.00 1.47 O ATOM 0 H SER A 13 5.472 16.970 1.712 1.00 0.81 H new ATOM 0 HA SER A 13 4.782 17.091 -0.391 1.00 0.79 H new ATOM 0 HB2 SER A 13 7.184 17.634 -0.847 1.00 0.89 H new ATOM 0 HB3 SER A 13 7.519 15.932 -1.094 1.00 0.89 H new ATOM 0 HG SER A 13 7.121 17.047 -3.087 1.00 1.47 H new ATOM 184 N PRO A 14 3.664 14.784 -0.542 1.00 0.69 N ATOM 185 CA PRO A 14 2.989 13.531 -0.912 1.00 0.66 C ATOM 186 C PRO A 14 3.148 13.159 -2.385 1.00 0.67 C ATOM 187 O PRO A 14 2.723 12.081 -2.806 1.00 0.66 O ATOM 188 CB PRO A 14 1.518 13.813 -0.607 1.00 0.68 C ATOM 189 CG PRO A 14 1.527 14.923 0.382 1.00 0.80 C ATOM 190 CD PRO A 14 2.729 15.759 0.050 1.00 0.78 C ATOM 0 HA PRO A 14 3.413 12.688 -0.367 1.00 0.66 H new ATOM 0 HB2 PRO A 14 0.976 14.095 -1.510 1.00 0.68 H new ATOM 0 HB3 PRO A 14 1.024 12.930 -0.202 1.00 0.68 H new ATOM 0 HG2 PRO A 14 0.612 15.511 0.317 1.00 0.80 H new ATOM 0 HG3 PRO A 14 1.587 14.539 1.400 1.00 0.80 H new ATOM 0 HD2 PRO A 14 2.483 16.558 -0.650 1.00 0.78 H new ATOM 0 HD3 PRO A 14 3.149 16.232 0.938 1.00 0.78 H new ATOM 198 N LEU A 15 3.733 14.054 -3.168 1.00 0.73 N ATOM 199 CA LEU A 15 3.912 13.820 -4.597 1.00 0.78 C ATOM 200 C LEU A 15 5.189 13.034 -4.908 1.00 0.73 C ATOM 201 O LEU A 15 5.137 11.953 -5.491 1.00 0.79 O ATOM 202 CB LEU A 15 3.939 15.158 -5.339 1.00 0.92 C ATOM 203 CG LEU A 15 4.072 15.059 -6.859 1.00 0.98 C ATOM 204 CD1 LEU A 15 2.890 14.310 -7.455 1.00 1.00 C ATOM 205 CD2 LEU A 15 4.191 16.444 -7.475 1.00 1.15 C ATOM 0 H LEU A 15 4.093 14.950 -2.839 1.00 0.73 H new ATOM 0 HA LEU A 15 3.069 13.217 -4.934 1.00 0.78 H new ATOM 0 HB2 LEU A 15 3.024 15.703 -5.105 1.00 0.92 H new ATOM 0 HB3 LEU A 15 4.770 15.751 -4.956 1.00 0.92 H new ATOM 0 HG LEU A 15 4.980 14.501 -7.087 1.00 0.98 H new ATOM 0 HD11 LEU A 15 3.005 14.251 -8.537 1.00 1.00 H new ATOM 0 HD12 LEU A 15 2.850 13.303 -7.039 1.00 1.00 H new ATOM 0 HD13 LEU A 15 1.967 14.838 -7.216 1.00 1.00 H new ATOM 0 HD21 LEU A 15 4.285 16.354 -8.557 1.00 1.15 H new ATOM 0 HD22 LEU A 15 3.302 17.027 -7.235 1.00 1.15 H new ATOM 0 HD23 LEU A 15 5.072 16.946 -7.075 1.00 1.15 H new ATOM 217 N GLU A 16 6.331 13.607 -4.545 1.00 0.71 N ATOM 218 CA GLU A 16 7.629 12.998 -4.812 1.00 0.71 C ATOM 219 C GLU A 16 7.817 11.652 -4.117 1.00 0.63 C ATOM 220 O GLU A 16 8.602 10.821 -4.574 1.00 0.65 O ATOM 221 CB GLU A 16 8.720 13.960 -4.370 1.00 0.81 C ATOM 222 CG GLU A 16 8.829 15.198 -5.246 1.00 0.95 C ATOM 223 CD GLU A 16 9.344 14.887 -6.638 1.00 1.57 C ATOM 224 OE1 GLU A 16 8.677 14.117 -7.360 1.00 2.35 O ATOM 225 OE2 GLU A 16 10.416 15.414 -7.008 1.00 2.01 O ATOM 0 H GLU A 16 6.384 14.503 -4.060 1.00 0.71 H new ATOM 0 HA GLU A 16 7.686 12.804 -5.883 1.00 0.71 H new ATOM 0 HB2 GLU A 16 8.527 14.268 -3.342 1.00 0.81 H new ATOM 0 HB3 GLU A 16 9.677 13.438 -4.372 1.00 0.81 H new ATOM 0 HG2 GLU A 16 7.850 15.671 -5.323 1.00 0.95 H new ATOM 0 HG3 GLU A 16 9.494 15.918 -4.769 1.00 0.95 H new ATOM 232 N GLN A 17 7.124 11.442 -3.006 1.00 0.59 N ATOM 233 CA GLN A 17 7.259 10.195 -2.259 1.00 0.56 C ATOM 234 C GLN A 17 6.645 9.025 -3.020 1.00 0.55 C ATOM 235 O GLN A 17 7.075 7.881 -2.869 1.00 0.61 O ATOM 236 CB GLN A 17 6.583 10.312 -0.895 1.00 0.62 C ATOM 237 CG GLN A 17 6.776 11.659 -0.223 1.00 0.71 C ATOM 238 CD GLN A 17 8.228 12.004 0.026 1.00 1.20 C ATOM 239 OE1 GLN A 17 9.027 12.109 -0.902 1.00 1.99 O ATOM 240 NE2 GLN A 17 8.568 12.200 1.292 1.00 1.63 N ATOM 0 H GLN A 17 6.468 12.111 -2.603 1.00 0.59 H new ATOM 0 HA GLN A 17 8.325 10.009 -2.126 1.00 0.56 H new ATOM 0 HB2 GLN A 17 5.515 10.126 -1.013 1.00 0.62 H new ATOM 0 HB3 GLN A 17 6.972 9.532 -0.240 1.00 0.62 H new ATOM 0 HG2 GLN A 17 6.328 12.434 -0.844 1.00 0.71 H new ATOM 0 HG3 GLN A 17 6.241 11.663 0.727 1.00 0.71 H new ATOM 0 HE21 GLN A 17 7.870 12.101 2.029 1.00 1.63 H new ATOM 0 HE22 GLN A 17 9.528 12.449 1.529 1.00 1.63 H new ATOM 249 N VAL A 18 5.623 9.314 -3.819 1.00 0.56 N ATOM 250 CA VAL A 18 4.930 8.282 -4.583 1.00 0.62 C ATOM 251 C VAL A 18 5.535 8.080 -5.971 1.00 0.60 C ATOM 252 O VAL A 18 5.651 6.947 -6.440 1.00 0.64 O ATOM 253 CB VAL A 18 3.434 8.616 -4.734 1.00 0.76 C ATOM 254 CG1 VAL A 18 2.714 7.533 -5.522 1.00 0.82 C ATOM 255 CG2 VAL A 18 2.791 8.806 -3.368 1.00 0.83 C ATOM 0 H VAL A 18 5.256 10.256 -3.955 1.00 0.56 H new ATOM 0 HA VAL A 18 5.047 7.357 -4.019 1.00 0.62 H new ATOM 0 HB VAL A 18 3.347 9.550 -5.289 1.00 0.76 H new ATOM 0 HG11 VAL A 18 1.659 7.791 -5.615 1.00 0.82 H new ATOM 0 HG12 VAL A 18 3.157 7.450 -6.515 1.00 0.82 H new ATOM 0 HG13 VAL A 18 2.809 6.580 -5.002 1.00 0.82 H new ATOM 0 HG21 VAL A 18 1.734 9.041 -3.493 1.00 0.83 H new ATOM 0 HG22 VAL A 18 2.892 7.889 -2.787 1.00 0.83 H new ATOM 0 HG23 VAL A 18 3.285 9.624 -2.844 1.00 0.83 H new ATOM 265 N ASN A 19 5.899 9.174 -6.636 1.00 0.60 N ATOM 266 CA ASN A 19 6.467 9.098 -7.981 1.00 0.64 C ATOM 267 C ASN A 19 7.614 8.093 -8.066 1.00 0.56 C ATOM 268 O ASN A 19 7.570 7.164 -8.870 1.00 0.63 O ATOM 269 CB ASN A 19 6.946 10.473 -8.443 1.00 0.72 C ATOM 270 CG ASN A 19 5.800 11.428 -8.701 1.00 0.82 C ATOM 271 OD1 ASN A 19 4.914 11.151 -9.511 1.00 0.92 O ATOM 272 ND2 ASN A 19 5.811 12.568 -8.020 1.00 0.84 N ATOM 0 H ASN A 19 5.811 10.121 -6.267 1.00 0.60 H new ATOM 0 HA ASN A 19 5.672 8.752 -8.642 1.00 0.64 H new ATOM 0 HB2 ASN A 19 7.606 10.898 -7.686 1.00 0.72 H new ATOM 0 HB3 ASN A 19 7.535 10.362 -9.354 1.00 0.72 H new ATOM 0 HD21 ASN A 19 5.067 13.252 -8.159 1.00 0.84 H new ATOM 0 HD22 ASN A 19 6.563 12.759 -7.358 1.00 0.84 H new ATOM 279 N ALA A 20 8.643 8.288 -7.249 1.00 0.47 N ATOM 280 CA ALA A 20 9.798 7.398 -7.256 1.00 0.42 C ATOM 281 C ALA A 20 9.490 6.062 -6.584 1.00 0.35 C ATOM 282 O ALA A 20 10.192 5.076 -6.800 1.00 0.36 O ATOM 283 CB ALA A 20 10.981 8.069 -6.575 1.00 0.43 C ATOM 0 H ALA A 20 8.701 9.052 -6.576 1.00 0.47 H new ATOM 0 HA ALA A 20 10.050 7.192 -8.296 1.00 0.42 H new ATOM 0 HB1 ALA A 20 11.838 7.395 -6.586 1.00 0.43 H new ATOM 0 HB2 ALA A 20 11.234 8.986 -7.106 1.00 0.43 H new ATOM 0 HB3 ALA A 20 10.720 8.307 -5.544 1.00 0.43 H new ATOM 289 N ALA A 21 8.445 6.039 -5.765 1.00 0.36 N ATOM 290 CA ALA A 21 8.058 4.823 -5.058 1.00 0.39 C ATOM 291 C ALA A 21 7.508 3.759 -6.005 1.00 0.41 C ATOM 292 O ALA A 21 7.934 2.606 -5.965 1.00 0.44 O ATOM 293 CB ALA A 21 7.032 5.146 -3.981 1.00 0.46 C ATOM 0 H ALA A 21 7.851 6.846 -5.574 1.00 0.36 H new ATOM 0 HA ALA A 21 8.956 4.415 -4.594 1.00 0.39 H new ATOM 0 HB1 ALA A 21 6.751 4.231 -3.460 1.00 0.46 H new ATOM 0 HB2 ALA A 21 7.461 5.851 -3.269 1.00 0.46 H new ATOM 0 HB3 ALA A 21 6.148 5.588 -4.441 1.00 0.46 H new ATOM 299 N LEU A 22 6.546 4.145 -6.842 1.00 0.47 N ATOM 300 CA LEU A 22 5.928 3.209 -7.779 1.00 0.53 C ATOM 301 C LEU A 22 6.740 3.065 -9.064 1.00 0.50 C ATOM 302 O LEU A 22 6.603 2.076 -9.783 1.00 0.64 O ATOM 303 CB LEU A 22 4.493 3.652 -8.098 1.00 0.70 C ATOM 304 CG LEU A 22 4.330 5.092 -8.604 1.00 0.81 C ATOM 305 CD1 LEU A 22 4.808 5.231 -10.042 1.00 1.28 C ATOM 306 CD2 LEU A 22 2.880 5.535 -8.480 1.00 1.35 C ATOM 0 H LEU A 22 6.179 5.095 -6.890 1.00 0.47 H new ATOM 0 HA LEU A 22 5.905 2.230 -7.300 1.00 0.53 H new ATOM 0 HB2 LEU A 22 4.084 2.976 -8.848 1.00 0.70 H new ATOM 0 HB3 LEU A 22 3.889 3.533 -7.199 1.00 0.70 H new ATOM 0 HG LEU A 22 4.950 5.738 -7.983 1.00 0.81 H new ATOM 0 HD11 LEU A 22 4.679 6.262 -10.370 1.00 1.28 H new ATOM 0 HD12 LEU A 22 5.862 4.960 -10.103 1.00 1.28 H new ATOM 0 HD13 LEU A 22 4.226 4.570 -10.684 1.00 1.28 H new ATOM 0 HD21 LEU A 22 2.780 6.558 -8.843 1.00 1.35 H new ATOM 0 HD22 LEU A 22 2.246 4.876 -9.073 1.00 1.35 H new ATOM 0 HD23 LEU A 22 2.574 5.489 -7.435 1.00 1.35 H new ATOM 318 N LYS A 23 7.578 4.053 -9.352 1.00 0.45 N ATOM 319 CA LYS A 23 8.398 4.025 -10.560 1.00 0.49 C ATOM 320 C LYS A 23 9.594 3.091 -10.373 1.00 0.43 C ATOM 321 O LYS A 23 9.942 2.327 -11.272 1.00 0.51 O ATOM 322 CB LYS A 23 8.869 5.444 -10.903 1.00 0.56 C ATOM 323 CG LYS A 23 9.327 5.626 -12.346 1.00 0.93 C ATOM 324 CD LYS A 23 10.649 4.928 -12.623 1.00 1.62 C ATOM 325 CE LYS A 23 11.112 5.166 -14.051 1.00 2.52 C ATOM 326 NZ LYS A 23 11.300 6.616 -14.338 1.00 3.23 N ATOM 0 H LYS A 23 7.709 4.880 -8.770 1.00 0.45 H new ATOM 0 HA LYS A 23 7.797 3.645 -11.386 1.00 0.49 H new ATOM 0 HB2 LYS A 23 8.056 6.142 -10.702 1.00 0.56 H new ATOM 0 HB3 LYS A 23 9.690 5.712 -10.238 1.00 0.56 H new ATOM 0 HG2 LYS A 23 8.564 5.235 -13.019 1.00 0.93 H new ATOM 0 HG3 LYS A 23 9.428 6.690 -12.562 1.00 0.93 H new ATOM 0 HD2 LYS A 23 11.406 5.290 -11.928 1.00 1.62 H new ATOM 0 HD3 LYS A 23 10.541 3.858 -12.447 1.00 1.62 H new ATOM 0 HE2 LYS A 23 12.050 4.637 -14.222 1.00 2.52 H new ATOM 0 HE3 LYS A 23 10.381 4.750 -14.744 1.00 2.52 H new ATOM 0 HZ1 LYS A 23 11.863 6.728 -15.205 1.00 3.23 H new ATOM 0 HZ2 LYS A 23 10.372 7.068 -14.467 1.00 3.23 H new ATOM 0 HZ3 LYS A 23 11.797 7.066 -13.543 1.00 3.23 H new ATOM 340 N ALA A 24 10.216 3.162 -9.200 1.00 0.37 N ATOM 341 CA ALA A 24 11.376 2.328 -8.896 1.00 0.41 C ATOM 342 C ALA A 24 11.005 0.849 -8.812 1.00 0.41 C ATOM 343 O ALA A 24 11.878 -0.019 -8.856 1.00 0.43 O ATOM 344 CB ALA A 24 12.028 2.784 -7.599 1.00 0.46 C ATOM 0 H ALA A 24 9.937 3.788 -8.444 1.00 0.37 H new ATOM 0 HA ALA A 24 12.088 2.442 -9.714 1.00 0.41 H new ATOM 0 HB1 ALA A 24 12.891 2.154 -7.384 1.00 0.46 H new ATOM 0 HB2 ALA A 24 12.351 3.820 -7.699 1.00 0.46 H new ATOM 0 HB3 ALA A 24 11.309 2.705 -6.783 1.00 0.46 H new ATOM 350 N LEU A 25 9.710 0.562 -8.692 1.00 0.43 N ATOM 351 CA LEU A 25 9.248 -0.820 -8.604 1.00 0.48 C ATOM 352 C LEU A 25 9.423 -1.530 -9.940 1.00 0.49 C ATOM 353 O LEU A 25 9.586 -2.749 -9.989 1.00 0.57 O ATOM 354 CB LEU A 25 7.783 -0.870 -8.164 1.00 0.53 C ATOM 355 CG LEU A 25 7.506 -0.311 -6.766 1.00 0.70 C ATOM 356 CD1 LEU A 25 6.017 -0.341 -6.461 1.00 0.95 C ATOM 357 CD2 LEU A 25 8.278 -1.095 -5.715 1.00 1.00 C ATOM 0 H LEU A 25 8.969 1.262 -8.654 1.00 0.43 H new ATOM 0 HA LEU A 25 9.852 -1.335 -7.857 1.00 0.48 H new ATOM 0 HB2 LEU A 25 7.184 -0.315 -8.886 1.00 0.53 H new ATOM 0 HB3 LEU A 25 7.445 -1.906 -8.198 1.00 0.53 H new ATOM 0 HG LEU A 25 7.841 0.726 -6.741 1.00 0.70 H new ATOM 0 HD11 LEU A 25 5.842 0.060 -5.463 1.00 0.95 H new ATOM 0 HD12 LEU A 25 5.483 0.264 -7.194 1.00 0.95 H new ATOM 0 HD13 LEU A 25 5.657 -1.369 -6.507 1.00 0.95 H new ATOM 0 HD21 LEU A 25 8.069 -0.683 -4.728 1.00 1.00 H new ATOM 0 HD22 LEU A 25 7.973 -2.141 -5.744 1.00 1.00 H new ATOM 0 HD23 LEU A 25 9.346 -1.023 -5.919 1.00 1.00 H new ATOM 369 N GLY A 26 9.407 -0.757 -11.021 1.00 0.47 N ATOM 370 CA GLY A 26 9.587 -1.330 -12.340 1.00 0.53 C ATOM 371 C GLY A 26 10.957 -1.961 -12.489 1.00 0.50 C ATOM 372 O GLY A 26 11.204 -2.728 -13.420 1.00 0.64 O ATOM 0 H GLY A 26 9.273 0.254 -11.006 1.00 0.47 H new ATOM 0 HA2 GLY A 26 8.818 -2.081 -12.520 1.00 0.53 H new ATOM 0 HA3 GLY A 26 9.458 -0.555 -13.095 1.00 0.53 H new ATOM 376 N ASP A 27 11.844 -1.635 -11.553 1.00 0.43 N ATOM 377 CA ASP A 27 13.201 -2.166 -11.551 1.00 0.46 C ATOM 378 C ASP A 27 13.327 -3.281 -10.515 1.00 0.41 C ATOM 379 O ASP A 27 14.214 -4.130 -10.607 1.00 0.56 O ATOM 380 CB ASP A 27 14.203 -1.045 -11.254 1.00 0.59 C ATOM 381 CG ASP A 27 15.645 -1.517 -11.281 1.00 1.05 C ATOM 382 OD1 ASP A 27 16.014 -2.345 -10.422 1.00 1.50 O ATOM 383 OD2 ASP A 27 16.406 -1.062 -12.161 1.00 1.48 O ATOM 0 H ASP A 27 11.643 -1.000 -10.780 1.00 0.43 H new ATOM 0 HA ASP A 27 13.421 -2.579 -12.535 1.00 0.46 H new ATOM 0 HB2 ASP A 27 14.074 -0.247 -11.985 1.00 0.59 H new ATOM 0 HB3 ASP A 27 13.984 -0.619 -10.275 1.00 0.59 H new ATOM 388 N ILE A 28 12.425 -3.272 -9.532 1.00 0.37 N ATOM 389 CA ILE A 28 12.425 -4.281 -8.476 1.00 0.36 C ATOM 390 C ILE A 28 12.551 -5.688 -9.061 1.00 0.42 C ATOM 391 O ILE A 28 11.954 -6.002 -10.090 1.00 0.47 O ATOM 392 CB ILE A 28 11.149 -4.187 -7.606 1.00 0.41 C ATOM 393 CG1 ILE A 28 11.152 -2.883 -6.806 1.00 0.45 C ATOM 394 CG2 ILE A 28 11.032 -5.384 -6.670 1.00 0.47 C ATOM 395 CD1 ILE A 28 12.323 -2.752 -5.852 1.00 1.27 C ATOM 0 H ILE A 28 11.685 -2.575 -9.447 1.00 0.37 H new ATOM 0 HA ILE A 28 13.290 -4.084 -7.843 1.00 0.36 H new ATOM 0 HB ILE A 28 10.284 -4.194 -8.269 1.00 0.41 H new ATOM 0 HG12 ILE A 28 11.165 -2.042 -7.500 1.00 0.45 H new ATOM 0 HG13 ILE A 28 10.224 -2.814 -6.239 1.00 0.45 H new ATOM 0 HG21 ILE A 28 10.126 -5.290 -6.071 1.00 0.47 H new ATOM 0 HG22 ILE A 28 10.986 -6.302 -7.257 1.00 0.47 H new ATOM 0 HG23 ILE A 28 11.900 -5.417 -6.012 1.00 0.47 H new ATOM 0 HD11 ILE A 28 12.256 -1.802 -5.321 1.00 1.27 H new ATOM 0 HD12 ILE A 28 12.300 -3.571 -5.134 1.00 1.27 H new ATOM 0 HD13 ILE A 28 13.256 -2.788 -6.414 1.00 1.27 H new ATOM 407 N PRO A 29 13.353 -6.549 -8.411 1.00 0.49 N ATOM 408 CA PRO A 29 13.584 -7.926 -8.868 1.00 0.65 C ATOM 409 C PRO A 29 12.313 -8.769 -8.866 1.00 0.73 C ATOM 410 O PRO A 29 11.617 -8.860 -7.855 1.00 0.77 O ATOM 411 CB PRO A 29 14.598 -8.478 -7.854 1.00 0.75 C ATOM 412 CG PRO A 29 15.205 -7.272 -7.219 1.00 0.74 C ATOM 413 CD PRO A 29 14.111 -6.247 -7.187 1.00 0.51 C ATOM 0 HA PRO A 29 13.935 -7.953 -9.900 1.00 0.65 H new ATOM 0 HB2 PRO A 29 14.110 -9.111 -7.113 1.00 0.75 H new ATOM 0 HB3 PRO A 29 15.355 -9.089 -8.346 1.00 0.75 H new ATOM 0 HG2 PRO A 29 15.564 -7.495 -6.214 1.00 0.74 H new ATOM 0 HG3 PRO A 29 16.061 -6.915 -7.791 1.00 0.74 H new ATOM 0 HD2 PRO A 29 13.493 -6.341 -6.294 1.00 0.51 H new ATOM 0 HD3 PRO A 29 14.507 -5.231 -7.195 1.00 0.51 H new ATOM 421 N GLU A 30 12.021 -9.386 -10.010 1.00 0.83 N ATOM 422 CA GLU A 30 10.840 -10.230 -10.155 1.00 0.95 C ATOM 423 C GLU A 30 9.571 -9.473 -9.787 1.00 0.84 C ATOM 424 O GLU A 30 8.652 -10.033 -9.194 1.00 1.18 O ATOM 425 CB GLU A 30 10.978 -11.481 -9.286 1.00 1.17 C ATOM 426 CG GLU A 30 12.191 -12.324 -9.632 1.00 1.47 C ATOM 427 CD GLU A 30 12.070 -13.001 -10.983 1.00 2.16 C ATOM 428 OE1 GLU A 30 11.967 -12.286 -12.003 1.00 2.84 O ATOM 429 OE2 GLU A 30 12.075 -14.249 -11.024 1.00 2.65 O ATOM 0 H GLU A 30 12.591 -9.315 -10.853 1.00 0.83 H new ATOM 0 HA GLU A 30 10.764 -10.527 -11.201 1.00 0.95 H new ATOM 0 HB2 GLU A 30 11.039 -11.182 -8.239 1.00 1.17 H new ATOM 0 HB3 GLU A 30 10.080 -12.089 -9.392 1.00 1.17 H new ATOM 0 HG2 GLU A 30 13.080 -11.693 -9.625 1.00 1.47 H new ATOM 0 HG3 GLU A 30 12.332 -13.082 -8.862 1.00 1.47 H new ATOM 436 N SER A 31 9.526 -8.199 -10.153 1.00 0.60 N ATOM 437 CA SER A 31 8.369 -7.359 -9.869 1.00 0.54 C ATOM 438 C SER A 31 8.151 -6.360 -10.994 1.00 0.47 C ATOM 439 O SER A 31 9.066 -5.633 -11.379 1.00 0.59 O ATOM 440 CB SER A 31 8.553 -6.618 -8.545 1.00 0.57 C ATOM 441 OG SER A 31 8.728 -7.524 -7.471 1.00 1.37 O ATOM 0 H SER A 31 10.280 -7.723 -10.649 1.00 0.60 H new ATOM 0 HA SER A 31 7.493 -8.002 -9.791 1.00 0.54 H new ATOM 0 HB2 SER A 31 9.418 -5.958 -8.612 1.00 0.57 H new ATOM 0 HB3 SER A 31 7.685 -5.987 -8.354 1.00 0.57 H new ATOM 0 HG SER A 31 9.603 -7.959 -7.549 1.00 1.37 H new ATOM 447 N HIS A 32 6.934 -6.333 -11.526 1.00 0.38 N ATOM 448 CA HIS A 32 6.602 -5.423 -12.618 1.00 0.42 C ATOM 449 C HIS A 32 5.182 -4.891 -12.472 1.00 0.39 C ATOM 450 O HIS A 32 4.215 -5.632 -12.629 1.00 0.39 O ATOM 451 CB HIS A 32 6.750 -6.131 -13.967 1.00 0.52 C ATOM 452 CG HIS A 32 8.119 -6.687 -14.215 1.00 1.10 C ATOM 453 ND1 HIS A 32 8.670 -7.699 -13.458 1.00 1.90 N ATOM 454 CD2 HIS A 32 9.053 -6.366 -15.144 1.00 1.90 C ATOM 455 CE1 HIS A 32 9.881 -7.978 -13.909 1.00 2.46 C ATOM 456 NE2 HIS A 32 10.136 -7.183 -14.932 1.00 2.42 N ATOM 0 H HIS A 32 6.163 -6.928 -11.221 1.00 0.38 H new ATOM 0 HA HIS A 32 7.295 -4.583 -12.575 1.00 0.42 H new ATOM 0 HB2 HIS A 32 6.024 -6.942 -14.022 1.00 0.52 H new ATOM 0 HB3 HIS A 32 6.504 -5.429 -14.764 1.00 0.52 H new ATOM 0 HD2 HIS A 32 8.962 -5.609 -15.909 1.00 1.90 H new ATOM 0 HE1 HIS A 32 10.548 -8.728 -13.509 1.00 2.46 H new ATOM 0 HE2 HIS A 32 10.998 -7.177 -15.477 1.00 2.42 H new ATOM 465 N ILE A 33 5.062 -3.603 -12.173 1.00 0.42 N ATOM 466 CA ILE A 33 3.754 -2.977 -12.005 1.00 0.42 C ATOM 467 C ILE A 33 2.925 -3.039 -13.285 1.00 0.41 C ATOM 468 O ILE A 33 3.412 -2.742 -14.374 1.00 0.48 O ATOM 469 CB ILE A 33 3.889 -1.515 -11.535 1.00 0.51 C ATOM 470 CG1 ILE A 33 4.228 -1.488 -10.044 1.00 0.61 C ATOM 471 CG2 ILE A 33 2.614 -0.731 -11.815 1.00 0.79 C ATOM 472 CD1 ILE A 33 4.397 -0.092 -9.482 1.00 0.70 C ATOM 0 H ILE A 33 5.852 -2.972 -12.042 1.00 0.42 H new ATOM 0 HA ILE A 33 3.232 -3.545 -11.235 1.00 0.42 H new ATOM 0 HB ILE A 33 4.695 -1.038 -12.092 1.00 0.51 H new ATOM 0 HG12 ILE A 33 3.439 -1.999 -9.492 1.00 0.61 H new ATOM 0 HG13 ILE A 33 5.147 -2.050 -9.880 1.00 0.61 H new ATOM 0 HG21 ILE A 33 2.737 0.297 -11.474 1.00 0.79 H new ATOM 0 HG22 ILE A 33 2.412 -0.736 -12.886 1.00 0.79 H new ATOM 0 HG23 ILE A 33 1.780 -1.192 -11.286 1.00 0.79 H new ATOM 0 HD11 ILE A 33 4.636 -0.154 -8.420 1.00 0.70 H new ATOM 0 HD12 ILE A 33 5.206 0.416 -10.007 1.00 0.70 H new ATOM 0 HD13 ILE A 33 3.471 0.468 -9.614 1.00 0.70 H new ATOM 484 N LEU A 34 1.664 -3.434 -13.128 1.00 0.39 N ATOM 485 CA LEU A 34 0.740 -3.547 -14.252 1.00 0.40 C ATOM 486 C LEU A 34 -0.269 -2.401 -14.259 1.00 0.37 C ATOM 487 O LEU A 34 -0.302 -1.599 -15.192 1.00 0.50 O ATOM 488 CB LEU A 34 0.002 -4.888 -14.186 1.00 0.43 C ATOM 489 CG LEU A 34 -1.026 -5.120 -15.296 1.00 0.66 C ATOM 490 CD1 LEU A 34 -0.348 -5.144 -16.657 1.00 1.42 C ATOM 491 CD2 LEU A 34 -1.786 -6.415 -15.053 1.00 1.39 C ATOM 0 H LEU A 34 1.257 -3.683 -12.226 1.00 0.39 H new ATOM 0 HA LEU A 34 1.320 -3.493 -15.173 1.00 0.40 H new ATOM 0 HB2 LEU A 34 0.738 -5.692 -14.220 1.00 0.43 H new ATOM 0 HB3 LEU A 34 -0.504 -4.959 -13.223 1.00 0.43 H new ATOM 0 HG LEU A 34 -1.738 -4.295 -15.284 1.00 0.66 H new ATOM 0 HD11 LEU A 34 -1.095 -5.310 -17.433 1.00 1.42 H new ATOM 0 HD12 LEU A 34 0.151 -4.191 -16.832 1.00 1.42 H new ATOM 0 HD13 LEU A 34 0.387 -5.948 -16.683 1.00 1.42 H new ATOM 0 HD21 LEU A 34 -2.513 -6.565 -15.851 1.00 1.39 H new ATOM 0 HD22 LEU A 34 -1.086 -7.250 -15.038 1.00 1.39 H new ATOM 0 HD23 LEU A 34 -2.304 -6.359 -14.096 1.00 1.39 H new ATOM 503 N THR A 35 -1.094 -2.331 -13.215 1.00 0.30 N ATOM 504 CA THR A 35 -2.109 -1.285 -13.107 1.00 0.33 C ATOM 505 C THR A 35 -1.860 -0.408 -11.884 1.00 0.34 C ATOM 506 O THR A 35 -1.428 -0.894 -10.840 1.00 0.44 O ATOM 507 CB THR A 35 -3.505 -1.904 -13.028 1.00 0.39 C ATOM 508 OG1 THR A 35 -3.616 -2.747 -11.898 1.00 0.97 O ATOM 509 CG2 THR A 35 -3.866 -2.723 -14.249 1.00 0.93 C ATOM 0 H THR A 35 -1.079 -2.986 -12.433 1.00 0.30 H new ATOM 0 HA THR A 35 -2.046 -0.661 -13.999 1.00 0.33 H new ATOM 0 HB THR A 35 -4.192 -1.060 -12.960 1.00 0.39 H new ATOM 0 HG1 THR A 35 -4.563 -2.889 -11.687 1.00 0.97 H new ATOM 0 HG21 THR A 35 -4.868 -3.134 -14.128 1.00 0.93 H new ATOM 0 HG22 THR A 35 -3.838 -2.088 -15.134 1.00 0.93 H new ATOM 0 HG23 THR A 35 -3.152 -3.538 -14.365 1.00 0.93 H new ATOM 517 N VAL A 36 -2.134 0.887 -12.022 1.00 0.33 N ATOM 518 CA VAL A 36 -1.934 1.832 -10.930 1.00 0.39 C ATOM 519 C VAL A 36 -3.187 2.671 -10.687 1.00 0.36 C ATOM 520 O VAL A 36 -3.928 2.983 -11.619 1.00 0.38 O ATOM 521 CB VAL A 36 -0.751 2.776 -11.222 1.00 0.51 C ATOM 522 CG1 VAL A 36 -0.484 3.694 -10.038 1.00 1.05 C ATOM 523 CG2 VAL A 36 0.495 1.981 -11.578 1.00 1.21 C ATOM 0 H VAL A 36 -2.495 1.304 -12.880 1.00 0.33 H new ATOM 0 HA VAL A 36 -1.717 1.244 -10.038 1.00 0.39 H new ATOM 0 HB VAL A 36 -1.017 3.397 -12.078 1.00 0.51 H new ATOM 0 HG11 VAL A 36 0.355 4.350 -10.268 1.00 1.05 H new ATOM 0 HG12 VAL A 36 -1.371 4.295 -9.837 1.00 1.05 H new ATOM 0 HG13 VAL A 36 -0.245 3.095 -9.159 1.00 1.05 H new ATOM 0 HG21 VAL A 36 1.318 2.666 -11.780 1.00 1.21 H new ATOM 0 HG22 VAL A 36 0.761 1.330 -10.745 1.00 1.21 H new ATOM 0 HG23 VAL A 36 0.300 1.376 -12.464 1.00 1.21 H new ATOM 533 N SER A 37 -3.410 3.039 -9.428 1.00 0.35 N ATOM 534 CA SER A 37 -4.566 3.851 -9.059 1.00 0.35 C ATOM 535 C SER A 37 -4.218 5.336 -9.157 1.00 0.40 C ATOM 536 O SER A 37 -3.175 5.700 -9.703 1.00 0.72 O ATOM 537 CB SER A 37 -5.018 3.512 -7.635 1.00 0.36 C ATOM 538 OG SER A 37 -4.018 3.844 -6.688 1.00 1.35 O ATOM 0 H SER A 37 -2.805 2.788 -8.646 1.00 0.35 H new ATOM 0 HA SER A 37 -5.381 3.632 -9.749 1.00 0.35 H new ATOM 0 HB2 SER A 37 -5.936 4.053 -7.403 1.00 0.36 H new ATOM 0 HB3 SER A 37 -5.248 2.449 -7.567 1.00 0.36 H new ATOM 0 HG SER A 37 -3.249 3.248 -6.802 1.00 1.35 H new ATOM 544 N SER A 38 -5.088 6.189 -8.623 1.00 0.43 N ATOM 545 CA SER A 38 -4.856 7.628 -8.651 1.00 0.45 C ATOM 546 C SER A 38 -4.267 8.095 -7.327 1.00 0.47 C ATOM 547 O SER A 38 -3.927 7.280 -6.469 1.00 0.70 O ATOM 548 CB SER A 38 -6.160 8.373 -8.935 1.00 0.50 C ATOM 549 OG SER A 38 -6.695 8.005 -10.195 1.00 1.19 O ATOM 0 H SER A 38 -5.957 5.909 -8.168 1.00 0.43 H new ATOM 0 HA SER A 38 -4.146 7.847 -9.449 1.00 0.45 H new ATOM 0 HB2 SER A 38 -6.885 8.155 -8.151 1.00 0.50 H new ATOM 0 HB3 SER A 38 -5.980 9.448 -8.913 1.00 0.50 H new ATOM 0 HG SER A 38 -7.530 8.494 -10.352 1.00 1.19 H new ATOM 555 N PHE A 39 -4.160 9.407 -7.155 1.00 0.38 N ATOM 556 CA PHE A 39 -3.626 9.968 -5.921 1.00 0.43 C ATOM 557 C PHE A 39 -4.749 10.626 -5.136 1.00 0.40 C ATOM 558 O PHE A 39 -5.264 11.673 -5.528 1.00 0.65 O ATOM 559 CB PHE A 39 -2.513 10.984 -6.202 1.00 0.59 C ATOM 560 CG PHE A 39 -1.454 10.496 -7.155 1.00 1.42 C ATOM 561 CD1 PHE A 39 -1.756 10.288 -8.492 1.00 1.93 C ATOM 562 CD2 PHE A 39 -0.161 10.247 -6.719 1.00 2.21 C ATOM 563 CE1 PHE A 39 -0.790 9.841 -9.374 1.00 2.75 C ATOM 564 CE2 PHE A 39 0.807 9.799 -7.597 1.00 3.01 C ATOM 565 CZ PHE A 39 0.510 9.600 -8.909 1.00 3.17 C ATOM 0 H PHE A 39 -4.435 10.100 -7.852 1.00 0.38 H new ATOM 0 HA PHE A 39 -3.193 9.157 -5.335 1.00 0.43 H new ATOM 0 HB2 PHE A 39 -2.960 11.892 -6.608 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -2.039 11.256 -5.259 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -2.758 10.477 -8.849 1.00 1.93 H new ATOM 0 HD2 PHE A 39 0.092 10.405 -5.681 1.00 2.21 H new ATOM 0 HE1 PHE A 39 -1.035 9.679 -10.413 1.00 2.75 H new ATOM 0 HE2 PHE A 39 1.807 9.605 -7.239 1.00 3.01 H new ATOM 0 HZ PHE A 39 1.274 9.257 -9.591 1.00 3.17 H new ATOM 575 N TYR A 40 -5.139 9.997 -4.037 1.00 0.38 N ATOM 576 CA TYR A 40 -6.219 10.512 -3.210 1.00 0.37 C ATOM 577 C TYR A 40 -5.684 11.146 -1.933 1.00 0.40 C ATOM 578 O TYR A 40 -4.956 10.511 -1.172 1.00 0.53 O ATOM 579 CB TYR A 40 -7.205 9.391 -2.860 1.00 0.44 C ATOM 580 CG TYR A 40 -7.795 8.689 -4.067 1.00 0.49 C ATOM 581 CD1 TYR A 40 -7.005 7.883 -4.878 1.00 0.49 C ATOM 582 CD2 TYR A 40 -9.136 8.840 -4.404 1.00 0.59 C ATOM 583 CE1 TYR A 40 -7.533 7.243 -5.982 1.00 0.57 C ATOM 584 CE2 TYR A 40 -9.672 8.203 -5.505 1.00 0.67 C ATOM 585 CZ TYR A 40 -8.888 7.395 -6.275 1.00 0.66 C ATOM 586 OH TYR A 40 -9.397 6.771 -7.391 1.00 0.76 O ATOM 0 H TYR A 40 -4.723 9.129 -3.698 1.00 0.38 H new ATOM 0 HA TYR A 40 -6.737 11.281 -3.783 1.00 0.37 H new ATOM 0 HB2 TYR A 40 -6.696 8.655 -2.237 1.00 0.44 H new ATOM 0 HB3 TYR A 40 -8.016 9.808 -2.263 1.00 0.44 H new ATOM 0 HD1 TYR A 40 -5.959 7.755 -4.641 1.00 0.49 H new ATOM 0 HD2 TYR A 40 -9.769 9.467 -3.793 1.00 0.59 H new ATOM 0 HE1 TYR A 40 -6.904 6.632 -6.612 1.00 0.57 H new ATOM 0 HE2 TYR A 40 -10.713 8.344 -5.757 1.00 0.67 H new ATOM 0 HH TYR A 40 -10.354 6.966 -7.467 1.00 0.76 H new ATOM 596 N ARG A 41 -6.067 12.395 -1.694 1.00 0.43 N ATOM 597 CA ARG A 41 -5.641 13.103 -0.497 1.00 0.50 C ATOM 598 C ARG A 41 -6.572 12.750 0.656 1.00 0.54 C ATOM 599 O ARG A 41 -7.777 12.588 0.466 1.00 0.67 O ATOM 600 CB ARG A 41 -5.618 14.616 -0.740 1.00 0.66 C ATOM 601 CG ARG A 41 -5.097 15.420 0.443 1.00 0.69 C ATOM 602 CD ARG A 41 -6.202 15.747 1.436 1.00 0.94 C ATOM 603 NE ARG A 41 -7.224 16.614 0.852 1.00 1.56 N ATOM 604 CZ ARG A 41 -8.283 17.062 1.522 1.00 2.07 C ATOM 605 NH1 ARG A 41 -8.464 16.717 2.789 1.00 2.32 N ATOM 606 NH2 ARG A 41 -9.158 17.856 0.922 1.00 2.95 N ATOM 0 H ARG A 41 -6.671 12.936 -2.313 1.00 0.43 H new ATOM 0 HA ARG A 41 -4.627 12.796 -0.241 1.00 0.50 H new ATOM 0 HB2 ARG A 41 -4.997 14.825 -1.611 1.00 0.66 H new ATOM 0 HB3 ARG A 41 -6.627 14.952 -0.979 1.00 0.66 H new ATOM 0 HG2 ARG A 41 -4.311 14.857 0.947 1.00 0.69 H new ATOM 0 HG3 ARG A 41 -4.646 16.345 0.083 1.00 0.69 H new ATOM 0 HD2 ARG A 41 -6.665 14.822 1.781 1.00 0.94 H new ATOM 0 HD3 ARG A 41 -5.771 16.233 2.311 1.00 0.94 H new ATOM 0 HE ARG A 41 -7.120 16.891 -0.124 1.00 1.56 H new ATOM 0 HH11 ARG A 41 -7.791 16.107 3.253 1.00 2.32 H new ATOM 0 HH12 ARG A 41 -9.276 17.062 3.300 1.00 2.32 H new ATOM 0 HH21 ARG A 41 -9.020 18.123 -0.053 1.00 2.95 H new ATOM 0 HH22 ARG A 41 -9.970 18.200 1.435 1.00 2.95 H new ATOM 620 N THR A 42 -6.003 12.602 1.844 1.00 0.61 N ATOM 621 CA THR A 42 -6.782 12.232 3.018 1.00 0.73 C ATOM 622 C THR A 42 -6.014 12.526 4.305 1.00 0.84 C ATOM 623 O THR A 42 -4.791 12.644 4.289 1.00 1.10 O ATOM 624 CB THR A 42 -7.139 10.745 2.932 1.00 0.81 C ATOM 625 OG1 THR A 42 -7.482 10.224 4.201 1.00 1.30 O ATOM 626 CG2 THR A 42 -6.025 9.888 2.370 1.00 1.28 C ATOM 0 H THR A 42 -5.007 12.732 2.021 1.00 0.61 H new ATOM 0 HA THR A 42 -7.695 12.827 3.040 1.00 0.73 H new ATOM 0 HB THR A 42 -7.989 10.703 2.251 1.00 0.81 H new ATOM 0 HG1 THR A 42 -6.868 9.496 4.433 1.00 1.30 H new ATOM 0 HG21 THR A 42 -6.347 8.847 2.338 1.00 1.28 H new ATOM 0 HG22 THR A 42 -5.781 10.223 1.362 1.00 1.28 H new ATOM 0 HG23 THR A 42 -5.143 9.975 3.005 1.00 1.28 H new ATOM 634 N PRO A 43 -6.725 12.651 5.444 1.00 0.74 N ATOM 635 CA PRO A 43 -6.092 12.927 6.734 1.00 0.86 C ATOM 636 C PRO A 43 -5.296 11.730 7.247 1.00 0.90 C ATOM 637 O PRO A 43 -5.831 10.631 7.377 1.00 0.94 O ATOM 638 CB PRO A 43 -7.274 13.218 7.660 1.00 0.98 C ATOM 639 CG PRO A 43 -8.421 12.493 7.048 1.00 0.87 C ATOM 640 CD PRO A 43 -8.192 12.527 5.563 1.00 0.71 C ATOM 0 HA PRO A 43 -5.376 13.746 6.671 1.00 0.86 H new ATOM 0 HB2 PRO A 43 -7.079 12.867 8.673 1.00 0.98 H new ATOM 0 HB3 PRO A 43 -7.471 14.288 7.726 1.00 0.98 H new ATOM 0 HG2 PRO A 43 -8.471 11.466 7.411 1.00 0.87 H new ATOM 0 HG3 PRO A 43 -9.366 12.970 7.307 1.00 0.87 H new ATOM 0 HD2 PRO A 43 -8.559 11.622 5.079 1.00 0.71 H new ATOM 0 HD3 PRO A 43 -8.705 13.368 5.097 1.00 0.71 H new ATOM 648 N PRO A 44 -3.998 11.925 7.552 1.00 0.98 N ATOM 649 CA PRO A 44 -3.136 10.853 8.053 1.00 1.12 C ATOM 650 C PRO A 44 -3.584 10.365 9.419 1.00 1.19 C ATOM 651 O PRO A 44 -4.464 10.959 10.044 1.00 2.06 O ATOM 652 CB PRO A 44 -1.746 11.500 8.128 1.00 1.28 C ATOM 653 CG PRO A 44 -1.849 12.733 7.302 1.00 1.18 C ATOM 654 CD PRO A 44 -3.268 13.192 7.438 1.00 1.03 C ATOM 0 HA PRO A 44 -3.159 9.972 7.411 1.00 1.12 H new ATOM 0 HB2 PRO A 44 -1.476 11.736 9.157 1.00 1.28 H new ATOM 0 HB3 PRO A 44 -0.978 10.830 7.742 1.00 1.28 H new ATOM 0 HG2 PRO A 44 -1.155 13.497 7.651 1.00 1.18 H new ATOM 0 HG3 PRO A 44 -1.601 12.529 6.260 1.00 1.18 H new ATOM 0 HD2 PRO A 44 -3.409 13.823 8.316 1.00 1.03 H new ATOM 0 HD3 PRO A 44 -3.592 13.772 6.574 1.00 1.03 H new ATOM 662 N LEU A 45 -2.988 9.275 9.873 1.00 0.99 N ATOM 663 CA LEU A 45 -3.333 8.699 11.162 1.00 1.03 C ATOM 664 C LEU A 45 -2.090 8.209 11.885 1.00 1.08 C ATOM 665 O LEU A 45 -1.631 7.090 11.666 1.00 1.32 O ATOM 666 CB LEU A 45 -4.317 7.547 10.973 1.00 1.15 C ATOM 667 CG LEU A 45 -5.679 7.944 10.399 1.00 1.53 C ATOM 668 CD1 LEU A 45 -6.529 6.710 10.138 1.00 1.83 C ATOM 669 CD2 LEU A 45 -6.401 8.898 11.341 1.00 2.21 C ATOM 0 H LEU A 45 -2.261 8.770 9.366 1.00 0.99 H new ATOM 0 HA LEU A 45 -3.801 9.473 11.770 1.00 1.03 H new ATOM 0 HB2 LEU A 45 -3.864 6.807 10.313 1.00 1.15 H new ATOM 0 HB3 LEU A 45 -4.474 7.062 11.936 1.00 1.15 H new ATOM 0 HG LEU A 45 -5.514 8.456 9.451 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -7.494 7.012 9.730 1.00 1.83 H new ATOM 0 HD12 LEU A 45 -6.020 6.062 9.424 1.00 1.83 H new ATOM 0 HD13 LEU A 45 -6.683 6.170 11.072 1.00 1.83 H new ATOM 0 HD21 LEU A 45 -7.367 9.168 10.915 1.00 2.21 H new ATOM 0 HD22 LEU A 45 -6.553 8.412 12.305 1.00 2.21 H new ATOM 0 HD23 LEU A 45 -5.801 9.797 11.478 1.00 2.21 H new ATOM 681 N GLY A 46 -1.549 9.061 12.743 1.00 1.09 N ATOM 682 CA GLY A 46 -0.358 8.707 13.483 1.00 1.18 C ATOM 683 C GLY A 46 0.321 9.918 14.085 1.00 1.11 C ATOM 684 O GLY A 46 -0.336 10.916 14.384 1.00 1.19 O ATOM 0 H GLY A 46 -1.915 9.993 12.939 1.00 1.09 H new ATOM 0 HA2 GLY A 46 -0.620 8.007 14.277 1.00 1.18 H new ATOM 0 HA3 GLY A 46 0.339 8.193 12.822 1.00 1.18 H new ATOM 688 N PRO A 47 1.633 9.841 14.342 1.00 1.12 N ATOM 689 CA PRO A 47 2.384 10.904 14.973 1.00 1.16 C ATOM 690 C PRO A 47 3.395 11.642 14.086 1.00 1.14 C ATOM 691 O PRO A 47 3.995 12.623 14.532 1.00 1.99 O ATOM 692 CB PRO A 47 3.147 10.098 16.003 1.00 1.36 C ATOM 693 CG PRO A 47 3.412 8.765 15.342 1.00 1.39 C ATOM 694 CD PRO A 47 2.494 8.678 14.140 1.00 1.26 C ATOM 0 HA PRO A 47 1.728 11.705 15.314 1.00 1.16 H new ATOM 0 HB2 PRO A 47 4.078 10.593 16.280 1.00 1.36 H new ATOM 0 HB3 PRO A 47 2.566 9.976 16.917 1.00 1.36 H new ATOM 0 HG2 PRO A 47 4.456 8.686 15.037 1.00 1.39 H new ATOM 0 HG3 PRO A 47 3.220 7.946 16.035 1.00 1.39 H new ATOM 0 HD2 PRO A 47 3.043 8.733 13.200 1.00 1.26 H new ATOM 0 HD3 PRO A 47 1.928 7.747 14.124 1.00 1.26 H new ATOM 702 N GLN A 48 3.633 11.166 12.868 1.00 0.95 N ATOM 703 CA GLN A 48 4.632 11.807 12.005 1.00 0.84 C ATOM 704 C GLN A 48 4.381 13.308 11.817 1.00 0.90 C ATOM 705 O GLN A 48 5.324 14.099 11.878 1.00 1.04 O ATOM 706 CB GLN A 48 4.788 11.082 10.654 1.00 0.83 C ATOM 707 CG GLN A 48 3.498 10.643 9.982 1.00 1.00 C ATOM 708 CD GLN A 48 2.584 11.787 9.614 1.00 1.29 C ATOM 709 OE1 GLN A 48 3.014 12.777 9.025 1.00 2.23 O ATOM 710 NE2 GLN A 48 1.306 11.641 9.934 1.00 1.15 N ATOM 0 H GLN A 48 3.163 10.358 12.459 1.00 0.95 H new ATOM 0 HA GLN A 48 5.582 11.715 12.531 1.00 0.84 H new ATOM 0 HB2 GLN A 48 5.325 11.740 9.971 1.00 0.83 H new ATOM 0 HB3 GLN A 48 5.413 10.202 10.806 1.00 0.83 H new ATOM 0 HG2 GLN A 48 3.742 10.080 9.081 1.00 1.00 H new ATOM 0 HG3 GLN A 48 2.965 9.964 10.648 1.00 1.00 H new ATOM 0 HE21 GLN A 48 0.995 10.802 10.423 1.00 1.15 H new ATOM 0 HE22 GLN A 48 0.633 12.368 9.691 1.00 1.15 H new ATOM 719 N ASP A 49 3.123 13.706 11.616 1.00 0.99 N ATOM 720 CA ASP A 49 2.779 15.124 11.448 1.00 1.16 C ATOM 721 C ASP A 49 1.308 15.281 11.095 1.00 1.20 C ATOM 722 O ASP A 49 0.651 16.235 11.515 1.00 1.33 O ATOM 723 CB ASP A 49 3.641 15.781 10.365 1.00 1.28 C ATOM 724 CG ASP A 49 3.454 17.286 10.318 1.00 1.51 C ATOM 725 OD1 ASP A 49 3.721 17.948 11.343 1.00 1.81 O ATOM 726 OD2 ASP A 49 3.043 17.801 9.258 1.00 1.70 O ATOM 0 H ASP A 49 2.327 13.071 11.565 1.00 0.99 H new ATOM 0 HA ASP A 49 2.975 15.623 12.397 1.00 1.16 H new ATOM 0 HB2 ASP A 49 4.691 15.553 10.550 1.00 1.28 H new ATOM 0 HB3 ASP A 49 3.389 15.355 9.394 1.00 1.28 H new ATOM 731 N GLN A 50 0.810 14.324 10.321 1.00 1.19 N ATOM 732 CA GLN A 50 -0.580 14.293 9.881 1.00 1.31 C ATOM 733 C GLN A 50 -0.888 15.326 8.785 1.00 1.33 C ATOM 734 O GLN A 50 -1.984 15.886 8.762 1.00 1.40 O ATOM 735 CB GLN A 50 -1.511 14.493 11.073 1.00 1.42 C ATOM 736 CG GLN A 50 -1.166 13.606 12.260 1.00 1.67 C ATOM 737 CD GLN A 50 -1.427 12.131 12.015 1.00 1.43 C ATOM 738 OE1 GLN A 50 -2.573 11.695 11.916 1.00 2.03 O ATOM 739 NE2 GLN A 50 -0.350 11.361 11.892 1.00 1.24 N ATOM 0 H GLN A 50 1.365 13.540 9.978 1.00 1.19 H new ATOM 0 HA GLN A 50 -0.750 13.311 9.440 1.00 1.31 H new ATOM 0 HB2 GLN A 50 -1.472 15.537 11.385 1.00 1.42 H new ATOM 0 HB3 GLN A 50 -2.536 14.291 10.763 1.00 1.42 H new ATOM 0 HG2 GLN A 50 -0.114 13.743 12.511 1.00 1.67 H new ATOM 0 HG3 GLN A 50 -1.745 13.930 13.125 1.00 1.67 H new ATOM 0 HE21 GLN A 50 0.581 11.768 11.982 1.00 1.24 H new ATOM 0 HE22 GLN A 50 -0.455 10.363 11.708 1.00 1.24 H new ATOM 748 N PRO A 51 0.055 15.592 7.847 1.00 1.35 N ATOM 749 CA PRO A 51 -0.169 16.551 6.750 1.00 1.46 C ATOM 750 C PRO A 51 -1.283 16.074 5.805 1.00 1.54 C ATOM 751 O PRO A 51 -2.301 15.563 6.260 1.00 2.26 O ATOM 752 CB PRO A 51 1.187 16.589 6.025 1.00 1.52 C ATOM 753 CG PRO A 51 2.161 16.022 6.999 1.00 1.53 C ATOM 754 CD PRO A 51 1.401 14.990 7.767 1.00 1.37 C ATOM 0 HA PRO A 51 -0.491 17.529 7.107 1.00 1.46 H new ATOM 0 HB2 PRO A 51 1.160 16.002 5.107 1.00 1.52 H new ATOM 0 HB3 PRO A 51 1.456 17.607 5.745 1.00 1.52 H new ATOM 0 HG2 PRO A 51 3.016 15.580 6.487 1.00 1.53 H new ATOM 0 HG3 PRO A 51 2.551 16.796 7.660 1.00 1.53 H new ATOM 0 HD2 PRO A 51 1.387 14.028 7.254 1.00 1.37 H new ATOM 0 HD3 PRO A 51 1.830 14.819 8.754 1.00 1.37 H new ATOM 762 N ASP A 52 -1.092 16.235 4.496 1.00 1.24 N ATOM 763 CA ASP A 52 -2.092 15.796 3.528 1.00 1.23 C ATOM 764 C ASP A 52 -1.724 14.420 2.977 1.00 0.91 C ATOM 765 O ASP A 52 -1.138 14.303 1.901 1.00 1.55 O ATOM 766 CB ASP A 52 -2.217 16.812 2.391 1.00 1.67 C ATOM 767 CG ASP A 52 -2.638 18.185 2.879 1.00 2.16 C ATOM 768 OD1 ASP A 52 -2.838 18.343 4.102 1.00 2.69 O ATOM 769 OD2 ASP A 52 -2.767 19.103 2.041 1.00 2.56 O ATOM 0 H ASP A 52 -0.262 16.662 4.086 1.00 1.24 H new ATOM 0 HA ASP A 52 -3.056 15.723 4.031 1.00 1.23 H new ATOM 0 HB2 ASP A 52 -1.261 16.892 1.873 1.00 1.67 H new ATOM 0 HB3 ASP A 52 -2.944 16.450 1.664 1.00 1.67 H new ATOM 774 N TYR A 53 -2.061 13.381 3.739 1.00 0.76 N ATOM 775 CA TYR A 53 -1.765 12.005 3.369 1.00 1.08 C ATOM 776 C TYR A 53 -2.348 11.630 2.007 1.00 0.87 C ATOM 777 O TYR A 53 -3.561 11.541 1.836 1.00 0.98 O ATOM 778 CB TYR A 53 -2.302 11.083 4.466 1.00 1.83 C ATOM 779 CG TYR A 53 -2.414 9.632 4.082 1.00 2.62 C ATOM 780 CD1 TYR A 53 -1.387 8.976 3.423 1.00 3.32 C ATOM 781 CD2 TYR A 53 -3.559 8.918 4.392 1.00 3.26 C ATOM 782 CE1 TYR A 53 -1.501 7.643 3.080 1.00 4.46 C ATOM 783 CE2 TYR A 53 -3.683 7.586 4.055 1.00 4.34 C ATOM 784 CZ TYR A 53 -2.650 6.951 3.399 1.00 4.90 C ATOM 785 OH TYR A 53 -2.768 5.624 3.062 1.00 6.13 O ATOM 0 H TYR A 53 -2.547 13.473 4.631 1.00 0.76 H new ATOM 0 HA TYR A 53 -0.685 11.892 3.277 1.00 1.08 H new ATOM 0 HB2 TYR A 53 -1.652 11.163 5.337 1.00 1.83 H new ATOM 0 HB3 TYR A 53 -3.286 11.440 4.769 1.00 1.83 H new ATOM 0 HD1 TYR A 53 -0.485 9.515 3.174 1.00 3.32 H new ATOM 0 HD2 TYR A 53 -4.369 9.413 4.907 1.00 3.26 H new ATOM 0 HE1 TYR A 53 -0.694 7.145 2.564 1.00 4.46 H new ATOM 0 HE2 TYR A 53 -4.584 7.044 4.303 1.00 4.34 H new ATOM 0 HH TYR A 53 -2.278 5.453 2.231 1.00 6.13 H new ATOM 795 N LEU A 54 -1.459 11.387 1.049 1.00 0.72 N ATOM 796 CA LEU A 54 -1.854 10.994 -0.298 1.00 0.59 C ATOM 797 C LEU A 54 -1.594 9.506 -0.496 1.00 0.61 C ATOM 798 O LEU A 54 -0.444 9.067 -0.491 1.00 0.88 O ATOM 799 CB LEU A 54 -1.067 11.795 -1.337 1.00 0.60 C ATOM 800 CG LEU A 54 -1.511 11.605 -2.786 1.00 0.54 C ATOM 801 CD1 LEU A 54 -2.722 12.472 -3.084 1.00 0.92 C ATOM 802 CD2 LEU A 54 -0.367 11.925 -3.733 1.00 1.10 C ATOM 0 H LEU A 54 -0.450 11.457 1.184 1.00 0.72 H new ATOM 0 HA LEU A 54 -2.917 11.198 -0.426 1.00 0.59 H new ATOM 0 HB2 LEU A 54 -1.142 12.853 -1.088 1.00 0.60 H new ATOM 0 HB3 LEU A 54 -0.014 11.523 -1.259 1.00 0.60 H new ATOM 0 HG LEU A 54 -1.794 10.563 -2.935 1.00 0.54 H new ATOM 0 HD11 LEU A 54 -3.028 12.327 -4.120 1.00 0.92 H new ATOM 0 HD12 LEU A 54 -3.541 12.193 -2.421 1.00 0.92 H new ATOM 0 HD13 LEU A 54 -2.467 13.520 -2.925 1.00 0.92 H new ATOM 0 HD21 LEU A 54 -0.697 11.785 -4.762 1.00 1.10 H new ATOM 0 HD22 LEU A 54 -0.054 12.959 -3.589 1.00 1.10 H new ATOM 0 HD23 LEU A 54 0.472 11.260 -3.528 1.00 1.10 H new ATOM 814 N ASN A 55 -2.657 8.732 -0.662 1.00 0.50 N ATOM 815 CA ASN A 55 -2.519 7.293 -0.849 1.00 0.58 C ATOM 816 C ASN A 55 -2.746 6.906 -2.305 1.00 0.57 C ATOM 817 O ASN A 55 -3.396 7.632 -3.058 1.00 0.70 O ATOM 818 CB ASN A 55 -3.506 6.537 0.036 1.00 0.82 C ATOM 819 CG ASN A 55 -3.296 5.038 -0.033 1.00 1.80 C ATOM 820 OD1 ASN A 55 -2.369 4.498 0.569 1.00 2.63 O ATOM 821 ND2 ASN A 55 -4.141 4.361 -0.799 1.00 2.49 N ATOM 0 H ASN A 55 -3.619 9.072 -0.671 1.00 0.50 H new ATOM 0 HA ASN A 55 -1.502 7.021 -0.566 1.00 0.58 H new ATOM 0 HB2 ASN A 55 -3.398 6.871 1.068 1.00 0.82 H new ATOM 0 HB3 ASN A 55 -4.524 6.775 -0.271 1.00 0.82 H new ATOM 0 HD21 ASN A 55 -4.036 3.352 -0.907 1.00 2.49 H new ATOM 0 HD22 ASN A 55 -4.896 4.849 -1.280 1.00 2.49 H new ATOM 828 N ALA A 56 -2.208 5.754 -2.693 1.00 0.51 N ATOM 829 CA ALA A 56 -2.353 5.266 -4.061 1.00 0.57 C ATOM 830 C ALA A 56 -1.925 3.807 -4.183 1.00 0.54 C ATOM 831 O ALA A 56 -0.731 3.507 -4.225 1.00 0.75 O ATOM 832 CB ALA A 56 -1.543 6.132 -5.014 1.00 0.61 C ATOM 0 H ALA A 56 -1.669 5.142 -2.081 1.00 0.51 H new ATOM 0 HA ALA A 56 -3.408 5.327 -4.328 1.00 0.57 H new ATOM 0 HB1 ALA A 56 -1.658 5.759 -6.032 1.00 0.61 H new ATOM 0 HB2 ALA A 56 -1.899 7.161 -4.962 1.00 0.61 H new ATOM 0 HB3 ALA A 56 -0.491 6.097 -4.732 1.00 0.61 H new ATOM 838 N ALA A 57 -2.900 2.902 -4.245 1.00 0.31 N ATOM 839 CA ALA A 57 -2.604 1.481 -4.371 1.00 0.29 C ATOM 840 C ALA A 57 -2.085 1.159 -5.769 1.00 0.29 C ATOM 841 O ALA A 57 -2.099 2.017 -6.652 1.00 0.39 O ATOM 842 CB ALA A 57 -3.844 0.663 -4.064 1.00 0.33 C ATOM 0 H ALA A 57 -3.894 3.128 -4.210 1.00 0.31 H new ATOM 0 HA ALA A 57 -1.825 1.224 -3.653 1.00 0.29 H new ATOM 0 HB1 ALA A 57 -3.613 -0.398 -4.161 1.00 0.33 H new ATOM 0 HB2 ALA A 57 -4.174 0.871 -3.046 1.00 0.33 H new ATOM 0 HB3 ALA A 57 -4.637 0.927 -4.764 1.00 0.33 H new ATOM 848 N VAL A 58 -1.624 -0.075 -5.971 1.00 0.26 N ATOM 849 CA VAL A 58 -1.104 -0.483 -7.273 1.00 0.27 C ATOM 850 C VAL A 58 -0.870 -1.988 -7.351 1.00 0.27 C ATOM 851 O VAL A 58 -0.131 -2.552 -6.544 1.00 0.28 O ATOM 852 CB VAL A 58 0.202 0.259 -7.603 1.00 0.31 C ATOM 853 CG1 VAL A 58 1.213 0.102 -6.478 1.00 1.20 C ATOM 854 CG2 VAL A 58 0.783 -0.228 -8.921 1.00 0.98 C ATOM 0 H VAL A 58 -1.600 -0.802 -5.256 1.00 0.26 H new ATOM 0 HA VAL A 58 -1.864 -0.219 -8.009 1.00 0.27 H new ATOM 0 HB VAL A 58 -0.029 1.319 -7.705 1.00 0.31 H new ATOM 0 HG11 VAL A 58 2.128 0.635 -6.734 1.00 1.20 H new ATOM 0 HG12 VAL A 58 0.799 0.513 -5.557 1.00 1.20 H new ATOM 0 HG13 VAL A 58 1.437 -0.955 -6.335 1.00 1.20 H new ATOM 0 HG21 VAL A 58 1.706 0.311 -9.133 1.00 0.98 H new ATOM 0 HG22 VAL A 58 0.994 -1.295 -8.854 1.00 0.98 H new ATOM 0 HG23 VAL A 58 0.066 -0.050 -9.723 1.00 0.98 H new ATOM 864 N ALA A 59 -1.508 -2.632 -8.326 1.00 0.28 N ATOM 865 CA ALA A 59 -1.372 -4.069 -8.506 1.00 0.29 C ATOM 866 C ALA A 59 -0.048 -4.419 -9.176 1.00 0.31 C ATOM 867 O ALA A 59 0.041 -4.515 -10.399 1.00 0.50 O ATOM 868 CB ALA A 59 -2.533 -4.600 -9.334 1.00 0.31 C ATOM 0 H ALA A 59 -2.123 -2.178 -9.001 1.00 0.28 H new ATOM 0 HA ALA A 59 -1.386 -4.538 -7.522 1.00 0.29 H new ATOM 0 HB1 ALA A 59 -2.424 -5.677 -9.465 1.00 0.31 H new ATOM 0 HB2 ALA A 59 -3.472 -4.390 -8.821 1.00 0.31 H new ATOM 0 HB3 ALA A 59 -2.536 -4.115 -10.310 1.00 0.31 H new ATOM 874 N LEU A 60 0.977 -4.610 -8.353 1.00 0.28 N ATOM 875 CA LEU A 60 2.309 -4.955 -8.836 1.00 0.28 C ATOM 876 C LEU A 60 2.355 -6.401 -9.308 1.00 0.30 C ATOM 877 O LEU A 60 2.195 -7.327 -8.513 1.00 0.33 O ATOM 878 CB LEU A 60 3.345 -4.739 -7.728 1.00 0.29 C ATOM 879 CG LEU A 60 4.743 -5.301 -8.012 1.00 0.29 C ATOM 880 CD1 LEU A 60 5.359 -4.628 -9.227 1.00 0.35 C ATOM 881 CD2 LEU A 60 5.641 -5.130 -6.796 1.00 0.31 C ATOM 0 H LEU A 60 0.909 -4.531 -7.338 1.00 0.28 H new ATOM 0 HA LEU A 60 2.544 -4.306 -9.680 1.00 0.28 H new ATOM 0 HB2 LEU A 60 3.434 -3.669 -7.541 1.00 0.29 H new ATOM 0 HB3 LEU A 60 2.970 -5.192 -6.811 1.00 0.29 H new ATOM 0 HG LEU A 60 4.646 -6.365 -8.226 1.00 0.29 H new ATOM 0 HD11 LEU A 60 6.350 -5.043 -9.409 1.00 0.35 H new ATOM 0 HD12 LEU A 60 4.727 -4.801 -10.098 1.00 0.35 H new ATOM 0 HD13 LEU A 60 5.442 -3.556 -9.046 1.00 0.35 H new ATOM 0 HD21 LEU A 60 6.630 -5.534 -7.014 1.00 0.31 H new ATOM 0 HD22 LEU A 60 5.727 -4.071 -6.553 1.00 0.31 H new ATOM 0 HD23 LEU A 60 5.210 -5.662 -5.948 1.00 0.31 H new ATOM 893 N GLU A 61 2.602 -6.597 -10.600 1.00 0.32 N ATOM 894 CA GLU A 61 2.691 -7.940 -11.145 1.00 0.36 C ATOM 895 C GLU A 61 4.060 -8.504 -10.810 1.00 0.34 C ATOM 896 O GLU A 61 5.023 -8.310 -11.552 1.00 0.36 O ATOM 897 CB GLU A 61 2.480 -7.912 -12.658 1.00 0.43 C ATOM 898 CG GLU A 61 2.292 -9.286 -13.278 1.00 0.52 C ATOM 899 CD GLU A 61 2.095 -9.227 -14.779 1.00 1.37 C ATOM 900 OE1 GLU A 61 1.118 -8.589 -15.226 1.00 1.88 O ATOM 901 OE2 GLU A 61 2.918 -9.818 -15.511 1.00 2.11 O ATOM 0 H GLU A 61 2.742 -5.849 -11.279 1.00 0.32 H new ATOM 0 HA GLU A 61 1.916 -8.571 -10.710 1.00 0.36 H new ATOM 0 HB2 GLU A 61 1.606 -7.300 -12.882 1.00 0.43 H new ATOM 0 HB3 GLU A 61 3.337 -7.427 -13.126 1.00 0.43 H new ATOM 0 HG2 GLU A 61 3.162 -9.904 -13.054 1.00 0.52 H new ATOM 0 HG3 GLU A 61 1.430 -9.772 -12.821 1.00 0.52 H new ATOM 908 N THR A 62 4.146 -9.170 -9.668 1.00 0.34 N ATOM 909 CA THR A 62 5.409 -9.720 -9.207 1.00 0.35 C ATOM 910 C THR A 62 5.297 -11.186 -8.822 1.00 0.39 C ATOM 911 O THR A 62 4.252 -11.653 -8.373 1.00 0.61 O ATOM 912 CB THR A 62 5.908 -8.915 -8.007 1.00 0.40 C ATOM 913 OG1 THR A 62 7.009 -9.552 -7.390 1.00 0.43 O ATOM 914 CG2 THR A 62 4.847 -8.703 -6.949 1.00 0.52 C ATOM 0 H THR A 62 3.357 -9.342 -9.045 1.00 0.34 H new ATOM 0 HA THR A 62 6.116 -9.652 -10.034 1.00 0.35 H new ATOM 0 HB THR A 62 6.196 -7.945 -8.413 1.00 0.40 H new ATOM 0 HG1 THR A 62 7.839 -9.110 -7.665 1.00 0.43 H new ATOM 0 HG21 THR A 62 5.265 -8.125 -6.125 1.00 0.52 H new ATOM 0 HG22 THR A 62 4.005 -8.162 -7.381 1.00 0.52 H new ATOM 0 HG23 THR A 62 4.505 -9.669 -6.578 1.00 0.52 H new ATOM 922 N SER A 63 6.407 -11.893 -8.974 1.00 0.37 N ATOM 923 CA SER A 63 6.482 -13.297 -8.619 1.00 0.48 C ATOM 924 C SER A 63 7.507 -13.463 -7.510 1.00 0.42 C ATOM 925 O SER A 63 7.810 -14.574 -7.077 1.00 0.45 O ATOM 926 CB SER A 63 6.874 -14.144 -9.831 1.00 0.69 C ATOM 927 OG SER A 63 6.916 -15.522 -9.502 1.00 1.22 O ATOM 0 H SER A 63 7.276 -11.509 -9.345 1.00 0.37 H new ATOM 0 HA SER A 63 5.504 -13.636 -8.277 1.00 0.48 H new ATOM 0 HB2 SER A 63 6.159 -13.982 -10.638 1.00 0.69 H new ATOM 0 HB3 SER A 63 7.849 -13.826 -10.200 1.00 0.69 H new ATOM 0 HG SER A 63 7.187 -15.627 -8.566 1.00 1.22 H new ATOM 933 N LEU A 64 8.038 -12.325 -7.062 1.00 0.37 N ATOM 934 CA LEU A 64 9.034 -12.306 -6.002 1.00 0.35 C ATOM 935 C LEU A 64 8.481 -12.982 -4.749 1.00 0.50 C ATOM 936 O LEU A 64 7.294 -12.862 -4.445 1.00 0.82 O ATOM 937 CB LEU A 64 9.444 -10.857 -5.709 1.00 0.49 C ATOM 938 CG LEU A 64 10.818 -10.663 -5.058 1.00 0.48 C ATOM 939 CD1 LEU A 64 10.832 -11.201 -3.637 1.00 0.90 C ATOM 940 CD2 LEU A 64 11.904 -11.329 -5.891 1.00 0.84 C ATOM 0 H LEU A 64 7.791 -11.403 -7.422 1.00 0.37 H new ATOM 0 HA LEU A 64 9.917 -12.860 -6.322 1.00 0.35 H new ATOM 0 HB2 LEU A 64 9.426 -10.300 -6.645 1.00 0.49 H new ATOM 0 HB3 LEU A 64 8.691 -10.412 -5.059 1.00 0.49 H new ATOM 0 HG LEU A 64 11.020 -9.593 -5.015 1.00 0.48 H new ATOM 0 HD11 LEU A 64 11.819 -11.050 -3.200 1.00 0.90 H new ATOM 0 HD12 LEU A 64 10.087 -10.674 -3.041 1.00 0.90 H new ATOM 0 HD13 LEU A 64 10.600 -12.266 -3.649 1.00 0.90 H new ATOM 0 HD21 LEU A 64 12.872 -11.180 -5.413 1.00 0.84 H new ATOM 0 HD22 LEU A 64 11.699 -12.397 -5.970 1.00 0.84 H new ATOM 0 HD23 LEU A 64 11.920 -10.888 -6.888 1.00 0.84 H new ATOM 952 N ALA A 65 9.346 -13.701 -4.039 1.00 0.58 N ATOM 953 CA ALA A 65 8.954 -14.416 -2.826 1.00 0.89 C ATOM 954 C ALA A 65 8.079 -13.555 -1.912 1.00 0.60 C ATOM 955 O ALA A 65 8.380 -12.393 -1.667 1.00 0.59 O ATOM 956 CB ALA A 65 10.189 -14.892 -2.079 1.00 1.41 C ATOM 0 H ALA A 65 10.331 -13.805 -4.285 1.00 0.58 H new ATOM 0 HA ALA A 65 8.360 -15.278 -3.128 1.00 0.89 H new ATOM 0 HB1 ALA A 65 9.886 -15.423 -1.177 1.00 1.41 H new ATOM 0 HB2 ALA A 65 10.765 -15.561 -2.718 1.00 1.41 H new ATOM 0 HB3 ALA A 65 10.802 -14.033 -1.806 1.00 1.41 H new ATOM 962 N PRO A 66 6.978 -14.130 -1.393 1.00 0.50 N ATOM 963 CA PRO A 66 6.045 -13.431 -0.496 1.00 0.40 C ATOM 964 C PRO A 66 6.676 -13.000 0.812 1.00 0.41 C ATOM 965 O PRO A 66 6.018 -12.374 1.644 1.00 0.62 O ATOM 966 CB PRO A 66 4.953 -14.453 -0.220 1.00 0.47 C ATOM 967 CG PRO A 66 5.562 -15.773 -0.544 1.00 0.75 C ATOM 968 CD PRO A 66 6.552 -15.515 -1.642 1.00 0.64 C ATOM 0 HA PRO A 66 5.690 -12.511 -0.960 1.00 0.40 H new ATOM 0 HB2 PRO A 66 4.630 -14.413 0.820 1.00 0.47 H new ATOM 0 HB3 PRO A 66 4.073 -14.264 -0.834 1.00 0.47 H new ATOM 0 HG2 PRO A 66 6.052 -16.201 0.330 1.00 0.75 H new ATOM 0 HG3 PRO A 66 4.802 -16.485 -0.864 1.00 0.75 H new ATOM 0 HD2 PRO A 66 7.392 -16.208 -1.598 1.00 0.64 H new ATOM 0 HD3 PRO A 66 6.099 -15.626 -2.627 1.00 0.64 H new ATOM 976 N GLU A 67 7.940 -13.336 0.996 1.00 0.40 N ATOM 977 CA GLU A 67 8.659 -12.963 2.207 1.00 0.44 C ATOM 978 C GLU A 67 9.641 -11.835 1.894 1.00 0.37 C ATOM 979 O GLU A 67 9.917 -10.976 2.731 1.00 0.40 O ATOM 980 CB GLU A 67 9.444 -14.148 2.736 1.00 0.57 C ATOM 981 CG GLU A 67 10.656 -14.422 1.880 1.00 0.65 C ATOM 982 CD GLU A 67 11.703 -15.267 2.580 1.00 0.80 C ATOM 983 OE1 GLU A 67 12.208 -14.832 3.635 1.00 1.28 O ATOM 984 OE2 GLU A 67 12.016 -16.364 2.072 1.00 1.19 O ATOM 0 H GLU A 67 8.493 -13.867 0.323 1.00 0.40 H new ATOM 0 HA GLU A 67 7.935 -12.638 2.954 1.00 0.44 H new ATOM 0 HB2 GLU A 67 9.756 -13.953 3.762 1.00 0.57 H new ATOM 0 HB3 GLU A 67 8.805 -15.030 2.760 1.00 0.57 H new ATOM 0 HG2 GLU A 67 10.341 -14.928 0.967 1.00 0.65 H new ATOM 0 HG3 GLU A 67 11.104 -13.474 1.581 1.00 0.65 H new ATOM 991 N GLU A 68 10.169 -11.864 0.675 1.00 0.34 N ATOM 992 CA GLU A 68 11.130 -10.855 0.226 1.00 0.31 C ATOM 993 C GLU A 68 10.499 -9.682 -0.548 1.00 0.29 C ATOM 994 O GLU A 68 11.052 -8.582 -0.555 1.00 0.30 O ATOM 995 CB GLU A 68 12.236 -11.494 -0.608 1.00 0.37 C ATOM 996 CG GLU A 68 13.365 -10.532 -0.942 1.00 0.34 C ATOM 997 CD GLU A 68 14.494 -11.199 -1.704 1.00 0.53 C ATOM 998 OE1 GLU A 68 14.240 -11.704 -2.819 1.00 1.21 O ATOM 999 OE2 GLU A 68 15.632 -11.214 -1.188 1.00 1.02 O ATOM 0 H GLU A 68 9.949 -12.575 -0.023 1.00 0.34 H new ATOM 0 HA GLU A 68 11.549 -10.429 1.138 1.00 0.31 H new ATOM 0 HB2 GLU A 68 12.643 -12.348 -0.067 1.00 0.37 H new ATOM 0 HB3 GLU A 68 11.808 -11.878 -1.534 1.00 0.37 H new ATOM 0 HG2 GLU A 68 12.970 -9.706 -1.534 1.00 0.34 H new ATOM 0 HG3 GLU A 68 13.757 -10.104 -0.020 1.00 0.34 H new ATOM 1006 N LEU A 69 9.385 -9.925 -1.250 1.00 0.32 N ATOM 1007 CA LEU A 69 8.750 -8.881 -2.073 1.00 0.36 C ATOM 1008 C LEU A 69 8.620 -7.564 -1.333 1.00 0.35 C ATOM 1009 O LEU A 69 9.274 -6.587 -1.695 1.00 0.41 O ATOM 1010 CB LEU A 69 7.372 -9.324 -2.554 1.00 0.42 C ATOM 1011 CG LEU A 69 6.535 -8.228 -3.221 1.00 0.54 C ATOM 1012 CD1 LEU A 69 7.216 -7.728 -4.486 1.00 1.08 C ATOM 1013 CD2 LEU A 69 5.137 -8.736 -3.529 1.00 1.51 C ATOM 0 H LEU A 69 8.906 -10.826 -1.267 1.00 0.32 H new ATOM 0 HA LEU A 69 9.405 -8.728 -2.931 1.00 0.36 H new ATOM 0 HB2 LEU A 69 7.497 -10.145 -3.260 1.00 0.42 H new ATOM 0 HB3 LEU A 69 6.816 -9.717 -1.703 1.00 0.42 H new ATOM 0 HG LEU A 69 6.450 -7.392 -2.527 1.00 0.54 H new ATOM 0 HD11 LEU A 69 6.606 -6.950 -4.945 1.00 1.08 H new ATOM 0 HD12 LEU A 69 8.195 -7.320 -4.235 1.00 1.08 H new ATOM 0 HD13 LEU A 69 7.336 -8.555 -5.186 1.00 1.08 H new ATOM 0 HD21 LEU A 69 4.558 -7.943 -4.002 1.00 1.51 H new ATOM 0 HD22 LEU A 69 5.201 -9.591 -4.203 1.00 1.51 H new ATOM 0 HD23 LEU A 69 4.648 -9.039 -2.603 1.00 1.51 H new ATOM 1025 N LEU A 70 7.796 -7.527 -0.291 1.00 0.33 N ATOM 1026 CA LEU A 70 7.654 -6.288 0.468 1.00 0.39 C ATOM 1027 C LEU A 70 9.021 -5.873 0.959 1.00 0.42 C ATOM 1028 O LEU A 70 9.417 -4.718 0.836 1.00 0.61 O ATOM 1029 CB LEU A 70 6.722 -6.452 1.654 1.00 0.44 C ATOM 1030 CG LEU A 70 6.411 -5.178 2.415 1.00 0.58 C ATOM 1031 CD1 LEU A 70 5.689 -4.210 1.506 1.00 1.16 C ATOM 1032 CD2 LEU A 70 5.596 -5.510 3.656 1.00 1.01 C ATOM 0 H LEU A 70 7.234 -8.311 0.040 1.00 0.33 H new ATOM 0 HA LEU A 70 7.222 -5.529 -0.185 1.00 0.39 H new ATOM 0 HB2 LEU A 70 5.785 -6.883 1.302 1.00 0.44 H new ATOM 0 HB3 LEU A 70 7.163 -7.170 2.345 1.00 0.44 H new ATOM 0 HG LEU A 70 7.334 -4.701 2.743 1.00 0.58 H new ATOM 0 HD11 LEU A 70 5.466 -3.294 2.054 1.00 1.16 H new ATOM 0 HD12 LEU A 70 6.321 -3.976 0.649 1.00 1.16 H new ATOM 0 HD13 LEU A 70 4.759 -4.661 1.159 1.00 1.16 H new ATOM 0 HD21 LEU A 70 5.374 -4.593 4.201 1.00 1.01 H new ATOM 0 HD22 LEU A 70 4.664 -5.992 3.361 1.00 1.01 H new ATOM 0 HD23 LEU A 70 6.166 -6.184 4.296 1.00 1.01 H new ATOM 1044 N ASN A 71 9.743 -6.846 1.501 1.00 0.31 N ATOM 1045 CA ASN A 71 11.094 -6.607 1.995 1.00 0.35 C ATOM 1046 C ASN A 71 11.870 -5.759 0.982 1.00 0.38 C ATOM 1047 O ASN A 71 12.688 -4.916 1.357 1.00 0.45 O ATOM 1048 CB ASN A 71 11.818 -7.937 2.241 1.00 0.36 C ATOM 1049 CG ASN A 71 13.189 -7.767 2.877 1.00 1.06 C ATOM 1050 OD1 ASN A 71 13.957 -8.724 2.974 1.00 1.87 O ATOM 1051 ND2 ASN A 71 13.497 -6.558 3.338 1.00 1.53 N ATOM 0 H ASN A 71 9.417 -7.806 1.610 1.00 0.31 H new ATOM 0 HA ASN A 71 11.035 -6.069 2.941 1.00 0.35 H new ATOM 0 HB2 ASN A 71 11.202 -8.564 2.885 1.00 0.36 H new ATOM 0 HB3 ASN A 71 11.928 -8.464 1.293 1.00 0.36 H new ATOM 0 HD21 ASN A 71 14.397 -6.399 3.791 1.00 1.53 H new ATOM 0 HD22 ASN A 71 12.833 -5.790 3.239 1.00 1.53 H new ATOM 1058 N HIS A 72 11.579 -5.966 -0.308 1.00 0.35 N ATOM 1059 CA HIS A 72 12.214 -5.200 -1.377 1.00 0.42 C ATOM 1060 C HIS A 72 11.593 -3.815 -1.469 1.00 0.41 C ATOM 1061 O HIS A 72 12.297 -2.807 -1.417 1.00 0.43 O ATOM 1062 CB HIS A 72 12.075 -5.909 -2.726 1.00 0.51 C ATOM 1063 CG HIS A 72 13.051 -7.023 -2.940 1.00 1.07 C ATOM 1064 ND1 HIS A 72 14.408 -6.883 -2.737 1.00 2.09 N ATOM 1065 CD2 HIS A 72 12.866 -8.288 -3.378 1.00 1.39 C ATOM 1066 CE1 HIS A 72 15.015 -8.017 -3.042 1.00 2.99 C ATOM 1067 NE2 HIS A 72 14.101 -8.885 -3.433 1.00 2.56 N ATOM 0 H HIS A 72 10.906 -6.660 -0.633 1.00 0.35 H new ATOM 0 HA HIS A 72 13.274 -5.113 -1.139 1.00 0.42 H new ATOM 0 HB2 HIS A 72 11.064 -6.306 -2.812 1.00 0.51 H new ATOM 0 HB3 HIS A 72 12.198 -5.176 -3.523 1.00 0.51 H new ATOM 0 HD2 HIS A 72 11.922 -8.744 -3.637 1.00 1.39 H new ATOM 0 HE1 HIS A 72 16.077 -8.202 -2.982 1.00 2.99 H new ATOM 0 HE2 HIS A 72 14.283 -9.844 -3.728 1.00 2.56 H new ATOM 1076 N THR A 73 10.264 -3.774 -1.599 1.00 0.45 N ATOM 1077 CA THR A 73 9.540 -2.505 -1.681 1.00 0.49 C ATOM 1078 C THR A 73 10.019 -1.555 -0.587 1.00 0.46 C ATOM 1079 O THR A 73 10.125 -0.348 -0.797 1.00 0.47 O ATOM 1080 CB THR A 73 8.039 -2.746 -1.549 1.00 0.58 C ATOM 1081 OG1 THR A 73 7.728 -3.273 -0.278 1.00 0.62 O ATOM 1082 CG2 THR A 73 7.491 -3.696 -2.591 1.00 0.66 C ATOM 0 H THR A 73 9.671 -4.602 -1.649 1.00 0.45 H new ATOM 0 HA THR A 73 9.738 -2.050 -2.652 1.00 0.49 H new ATOM 0 HB THR A 73 7.575 -1.770 -1.694 1.00 0.58 H new ATOM 0 HG1 THR A 73 8.536 -3.656 0.124 1.00 0.62 H new ATOM 0 HG21 THR A 73 6.419 -3.823 -2.440 1.00 0.66 H new ATOM 0 HG22 THR A 73 7.671 -3.288 -3.586 1.00 0.66 H new ATOM 0 HG23 THR A 73 7.987 -4.662 -2.499 1.00 0.66 H new ATOM 1090 N GLN A 74 10.333 -2.124 0.573 1.00 0.49 N ATOM 1091 CA GLN A 74 10.823 -1.350 1.707 1.00 0.49 C ATOM 1092 C GLN A 74 12.094 -0.598 1.334 1.00 0.43 C ATOM 1093 O GLN A 74 12.246 0.582 1.655 1.00 0.45 O ATOM 1094 CB GLN A 74 11.092 -2.275 2.895 1.00 0.60 C ATOM 1095 CG GLN A 74 9.839 -2.932 3.455 1.00 0.65 C ATOM 1096 CD GLN A 74 8.887 -1.948 4.119 1.00 0.87 C ATOM 1097 OE1 GLN A 74 7.795 -2.323 4.545 1.00 1.66 O ATOM 1098 NE2 GLN A 74 9.298 -0.687 4.225 1.00 1.05 N ATOM 0 H GLN A 74 10.256 -3.125 0.752 1.00 0.49 H new ATOM 0 HA GLN A 74 10.060 -0.623 1.986 1.00 0.49 H new ATOM 0 HB2 GLN A 74 11.792 -3.052 2.588 1.00 0.60 H new ATOM 0 HB3 GLN A 74 11.577 -1.704 3.687 1.00 0.60 H new ATOM 0 HG2 GLN A 74 9.315 -3.445 2.649 1.00 0.65 H new ATOM 0 HG3 GLN A 74 10.129 -3.692 4.181 1.00 0.65 H new ATOM 0 HE21 GLN A 74 10.211 -0.416 3.859 1.00 1.05 H new ATOM 0 HE22 GLN A 74 8.701 0.008 4.672 1.00 1.05 H new ATOM 1107 N ARG A 75 13.002 -1.288 0.649 1.00 0.44 N ATOM 1108 CA ARG A 75 14.259 -0.688 0.221 1.00 0.46 C ATOM 1109 C ARG A 75 14.020 0.607 -0.542 1.00 0.43 C ATOM 1110 O ARG A 75 14.725 1.585 -0.328 1.00 0.52 O ATOM 1111 CB ARG A 75 15.054 -1.664 -0.648 1.00 0.59 C ATOM 1112 CG ARG A 75 16.038 -2.519 0.134 1.00 1.17 C ATOM 1113 CD ARG A 75 17.211 -1.696 0.645 1.00 1.93 C ATOM 1114 NE ARG A 75 18.166 -2.509 1.397 1.00 2.51 N ATOM 1115 CZ ARG A 75 18.853 -3.522 0.872 1.00 2.97 C ATOM 1116 NH1 ARG A 75 18.708 -3.839 -0.409 1.00 3.08 N ATOM 1117 NH2 ARG A 75 19.691 -4.217 1.628 1.00 3.82 N ATOM 0 H ARG A 75 12.889 -2.265 0.379 1.00 0.44 H new ATOM 0 HA ARG A 75 14.836 -0.458 1.117 1.00 0.46 H new ATOM 0 HB2 ARG A 75 14.358 -2.317 -1.175 1.00 0.59 H new ATOM 0 HB3 ARG A 75 15.598 -1.101 -1.406 1.00 0.59 H new ATOM 0 HG2 ARG A 75 15.526 -2.986 0.975 1.00 1.17 H new ATOM 0 HG3 ARG A 75 16.407 -3.324 -0.502 1.00 1.17 H new ATOM 0 HD2 ARG A 75 17.719 -1.227 -0.198 1.00 1.93 H new ATOM 0 HD3 ARG A 75 16.840 -0.892 1.281 1.00 1.93 H new ATOM 0 HE ARG A 75 18.315 -2.287 2.381 1.00 2.51 H new ATOM 0 HH11 ARG A 75 18.068 -3.306 -0.997 1.00 3.08 H new ATOM 0 HH12 ARG A 75 19.237 -4.616 -0.805 1.00 3.08 H new ATOM 0 HH21 ARG A 75 19.810 -3.976 2.612 1.00 3.82 H new ATOM 0 HH22 ARG A 75 20.217 -4.993 1.226 1.00 3.82 H new ATOM 1131 N ILE A 76 13.026 0.607 -1.426 1.00 0.43 N ATOM 1132 CA ILE A 76 12.705 1.792 -2.218 1.00 0.48 C ATOM 1133 C ILE A 76 12.664 3.044 -1.346 1.00 0.49 C ATOM 1134 O ILE A 76 13.313 4.045 -1.651 1.00 0.60 O ATOM 1135 CB ILE A 76 11.357 1.636 -2.948 1.00 0.53 C ATOM 1136 CG1 ILE A 76 11.403 0.437 -3.900 1.00 0.62 C ATOM 1137 CG2 ILE A 76 11.011 2.912 -3.706 1.00 0.64 C ATOM 1138 CD1 ILE A 76 12.469 0.550 -4.970 1.00 1.42 C ATOM 0 H ILE A 76 12.429 -0.199 -1.612 1.00 0.43 H new ATOM 0 HA ILE A 76 13.496 1.899 -2.960 1.00 0.48 H new ATOM 0 HB ILE A 76 10.578 1.457 -2.207 1.00 0.53 H new ATOM 0 HG12 ILE A 76 11.577 -0.469 -3.320 1.00 0.62 H new ATOM 0 HG13 ILE A 76 10.430 0.327 -4.379 1.00 0.62 H new ATOM 0 HG21 ILE A 76 10.056 2.785 -4.216 1.00 0.64 H new ATOM 0 HG22 ILE A 76 10.940 3.744 -3.005 1.00 0.64 H new ATOM 0 HG23 ILE A 76 11.789 3.122 -4.440 1.00 0.64 H new ATOM 0 HD11 ILE A 76 12.441 -0.335 -5.606 1.00 1.42 H new ATOM 0 HD12 ILE A 76 12.284 1.438 -5.575 1.00 1.42 H new ATOM 0 HD13 ILE A 76 13.449 0.629 -4.500 1.00 1.42 H new ATOM 1150 N GLU A 77 11.910 2.976 -0.254 1.00 0.45 N ATOM 1151 CA GLU A 77 11.800 4.100 0.668 1.00 0.52 C ATOM 1152 C GLU A 77 13.168 4.436 1.252 1.00 0.52 C ATOM 1153 O GLU A 77 13.528 5.603 1.389 1.00 0.71 O ATOM 1154 CB GLU A 77 10.809 3.767 1.787 1.00 0.59 C ATOM 1155 CG GLU A 77 10.648 4.865 2.828 1.00 0.95 C ATOM 1156 CD GLU A 77 11.849 4.979 3.746 1.00 1.15 C ATOM 1157 OE1 GLU A 77 12.202 3.968 4.388 1.00 1.52 O ATOM 1158 OE2 GLU A 77 12.436 6.077 3.823 1.00 1.59 O ATOM 0 H GLU A 77 11.367 2.155 0.014 1.00 0.45 H new ATOM 0 HA GLU A 77 11.432 4.969 0.123 1.00 0.52 H new ATOM 0 HB2 GLU A 77 9.836 3.557 1.344 1.00 0.59 H new ATOM 0 HB3 GLU A 77 11.135 2.855 2.286 1.00 0.59 H new ATOM 0 HG2 GLU A 77 10.489 5.818 2.324 1.00 0.95 H new ATOM 0 HG3 GLU A 77 9.757 4.667 3.424 1.00 0.95 H new ATOM 1165 N LEU A 78 13.925 3.396 1.584 1.00 0.47 N ATOM 1166 CA LEU A 78 15.258 3.565 2.144 1.00 0.56 C ATOM 1167 C LEU A 78 16.155 4.290 1.151 1.00 0.57 C ATOM 1168 O LEU A 78 16.902 5.196 1.517 1.00 0.66 O ATOM 1169 CB LEU A 78 15.862 2.205 2.506 1.00 0.63 C ATOM 1170 CG LEU A 78 15.071 1.396 3.536 1.00 0.71 C ATOM 1171 CD1 LEU A 78 15.715 0.037 3.755 1.00 0.83 C ATOM 1172 CD2 LEU A 78 14.971 2.155 4.852 1.00 0.84 C ATOM 0 H LEU A 78 13.636 2.424 1.474 1.00 0.47 H new ATOM 0 HA LEU A 78 15.181 4.163 3.052 1.00 0.56 H new ATOM 0 HB2 LEU A 78 15.955 1.613 1.596 1.00 0.63 H new ATOM 0 HB3 LEU A 78 16.871 2.363 2.888 1.00 0.63 H new ATOM 0 HG LEU A 78 14.063 1.243 3.150 1.00 0.71 H new ATOM 0 HD11 LEU A 78 15.139 -0.524 4.491 1.00 0.83 H new ATOM 0 HD12 LEU A 78 15.735 -0.512 2.814 1.00 0.83 H new ATOM 0 HD13 LEU A 78 16.734 0.171 4.118 1.00 0.83 H new ATOM 0 HD21 LEU A 78 14.405 1.563 5.571 1.00 0.84 H new ATOM 0 HD22 LEU A 78 15.972 2.340 5.242 1.00 0.84 H new ATOM 0 HD23 LEU A 78 14.465 3.106 4.686 1.00 0.84 H new ATOM 1184 N GLN A 79 16.059 3.894 -0.114 1.00 0.56 N ATOM 1185 CA GLN A 79 16.840 4.514 -1.170 1.00 0.63 C ATOM 1186 C GLN A 79 16.313 5.918 -1.431 1.00 0.66 C ATOM 1187 O GLN A 79 16.935 6.718 -2.129 1.00 0.84 O ATOM 1188 CB GLN A 79 16.758 3.686 -2.447 1.00 0.67 C ATOM 1189 CG GLN A 79 16.939 2.201 -2.216 1.00 0.93 C ATOM 1190 CD GLN A 79 17.160 1.451 -3.507 1.00 1.22 C ATOM 1191 OE1 GLN A 79 18.170 1.642 -4.187 1.00 1.95 O ATOM 1192 NE2 GLN A 79 16.210 0.605 -3.862 1.00 1.30 N ATOM 0 H GLN A 79 15.445 3.144 -0.430 1.00 0.56 H new ATOM 0 HA GLN A 79 17.883 4.567 -0.856 1.00 0.63 H new ATOM 0 HB2 GLN A 79 15.791 3.857 -2.920 1.00 0.67 H new ATOM 0 HB3 GLN A 79 17.520 4.033 -3.145 1.00 0.67 H new ATOM 0 HG2 GLN A 79 17.788 2.038 -1.552 1.00 0.93 H new ATOM 0 HG3 GLN A 79 16.059 1.803 -1.711 1.00 0.93 H new ATOM 0 HE21 GLN A 79 15.391 0.479 -3.267 1.00 1.30 H new ATOM 0 HE22 GLN A 79 16.295 0.078 -4.731 1.00 1.30 H new ATOM 1201 N GLN A 80 15.146 6.192 -0.855 1.00 0.54 N ATOM 1202 CA GLN A 80 14.488 7.479 -0.998 1.00 0.59 C ATOM 1203 C GLN A 80 14.789 8.392 0.187 1.00 0.68 C ATOM 1204 O GLN A 80 14.513 9.592 0.135 1.00 0.78 O ATOM 1205 CB GLN A 80 12.976 7.263 -1.112 1.00 0.54 C ATOM 1206 CG GLN A 80 12.458 7.188 -2.539 1.00 0.99 C ATOM 1207 CD GLN A 80 12.497 8.527 -3.251 1.00 0.98 C ATOM 1208 OE1 GLN A 80 13.567 9.093 -3.477 1.00 1.68 O ATOM 1209 NE2 GLN A 80 11.322 9.047 -3.601 1.00 0.74 N ATOM 0 H GLN A 80 14.633 5.526 -0.277 1.00 0.54 H new ATOM 0 HA GLN A 80 14.867 7.961 -1.899 1.00 0.59 H new ATOM 0 HB2 GLN A 80 12.713 6.341 -0.594 1.00 0.54 H new ATOM 0 HB3 GLN A 80 12.465 8.076 -0.595 1.00 0.54 H new ATOM 0 HG2 GLN A 80 13.053 6.467 -3.099 1.00 0.99 H new ATOM 0 HG3 GLN A 80 11.433 6.817 -2.529 1.00 0.99 H new ATOM 0 HE21 GLN A 80 10.459 8.543 -3.394 1.00 0.74 H new ATOM 0 HE22 GLN A 80 11.285 9.949 -4.076 1.00 0.74 H new ATOM 1218 N GLY A 81 15.343 7.818 1.257 1.00 0.74 N ATOM 1219 CA GLY A 81 15.650 8.606 2.441 1.00 0.88 C ATOM 1220 C GLY A 81 14.452 9.423 2.882 1.00 0.89 C ATOM 1221 O GLY A 81 14.407 10.636 2.675 1.00 0.99 O ATOM 0 H GLY A 81 15.583 6.829 1.324 1.00 0.74 H new ATOM 0 HA2 GLY A 81 15.961 7.945 3.250 1.00 0.88 H new ATOM 0 HA3 GLY A 81 16.489 9.270 2.232 1.00 0.88 H new ATOM 1225 N ARG A 82 13.461 8.747 3.453 1.00 0.95 N ATOM 1226 CA ARG A 82 12.231 9.404 3.881 1.00 1.07 C ATOM 1227 C ARG A 82 12.073 9.398 5.376 1.00 1.09 C ATOM 1228 O ARG A 82 12.156 10.430 6.043 1.00 1.50 O ATOM 1229 CB ARG A 82 11.049 8.734 3.193 1.00 1.34 C ATOM 1230 CG ARG A 82 11.415 8.202 1.822 1.00 1.78 C ATOM 1231 CD ARG A 82 10.274 8.344 0.833 1.00 2.05 C ATOM 1232 NE ARG A 82 10.668 9.121 -0.342 1.00 2.68 N ATOM 1233 CZ ARG A 82 11.097 10.382 -0.290 1.00 3.14 C ATOM 1234 NH1 ARG A 82 11.153 11.024 0.869 1.00 3.20 N ATOM 1235 NH2 ARG A 82 11.460 11.005 -1.402 1.00 3.90 N ATOM 0 H ARG A 82 13.485 7.743 3.630 1.00 0.95 H new ATOM 0 HA ARG A 82 12.276 10.453 3.589 1.00 1.07 H new ATOM 0 HB2 ARG A 82 10.685 7.915 3.814 1.00 1.34 H new ATOM 0 HB3 ARG A 82 10.232 9.449 3.098 1.00 1.34 H new ATOM 0 HG2 ARG A 82 12.288 8.736 1.447 1.00 1.78 H new ATOM 0 HG3 ARG A 82 11.695 7.152 1.904 1.00 1.78 H new ATOM 0 HD2 ARG A 82 9.939 7.355 0.520 1.00 2.05 H new ATOM 0 HD3 ARG A 82 9.428 8.827 1.321 1.00 2.05 H new ATOM 0 HE ARG A 82 10.611 8.671 -1.256 1.00 2.68 H new ATOM 0 HH11 ARG A 82 10.867 10.553 1.727 1.00 3.20 H new ATOM 0 HH12 ARG A 82 11.482 11.989 0.902 1.00 3.20 H new ATOM 0 HH21 ARG A 82 11.411 10.520 -2.298 1.00 3.90 H new ATOM 0 HH22 ARG A 82 11.788 11.970 -1.362 1.00 3.90 H new ATOM 1249 N VAL A 83 11.844 8.231 5.877 1.00 1.01 N ATOM 1250 CA VAL A 83 11.663 8.023 7.304 1.00 1.24 C ATOM 1251 C VAL A 83 12.984 8.079 8.044 1.00 1.17 C ATOM 1252 O VAL A 83 13.817 7.180 7.941 1.00 1.65 O ATOM 1253 CB VAL A 83 10.963 6.692 7.612 1.00 1.94 C ATOM 1254 CG1 VAL A 83 11.612 5.548 6.848 1.00 2.77 C ATOM 1255 CG2 VAL A 83 10.973 6.415 9.108 1.00 2.45 C ATOM 0 H VAL A 83 11.774 7.380 5.319 1.00 1.01 H new ATOM 0 HA VAL A 83 11.024 8.835 7.650 1.00 1.24 H new ATOM 0 HB VAL A 83 9.926 6.770 7.285 1.00 1.94 H new ATOM 0 HG11 VAL A 83 11.098 4.616 7.083 1.00 2.77 H new ATOM 0 HG12 VAL A 83 11.543 5.740 5.777 1.00 2.77 H new ATOM 0 HG13 VAL A 83 12.660 5.467 7.135 1.00 2.77 H new ATOM 0 HG21 VAL A 83 10.472 5.467 9.306 1.00 2.45 H new ATOM 0 HG22 VAL A 83 12.003 6.362 9.461 1.00 2.45 H new ATOM 0 HG23 VAL A 83 10.451 7.217 9.630 1.00 2.45 H new ATOM 1265 N ARG A 84 13.160 9.150 8.797 1.00 1.26 N ATOM 1266 CA ARG A 84 14.365 9.356 9.571 1.00 1.64 C ATOM 1267 C ARG A 84 13.989 9.808 10.978 1.00 1.64 C ATOM 1268 O ARG A 84 14.771 10.456 11.675 1.00 2.28 O ATOM 1269 CB ARG A 84 15.250 10.395 8.879 1.00 2.64 C ATOM 1270 CG ARG A 84 15.491 10.096 7.402 1.00 3.46 C ATOM 1271 CD ARG A 84 16.275 8.809 7.210 1.00 4.08 C ATOM 1272 NE ARG A 84 17.601 8.877 7.820 1.00 4.79 N ATOM 1273 CZ ARG A 84 18.475 7.877 7.798 1.00 5.36 C ATOM 1274 NH1 ARG A 84 18.163 6.731 7.207 1.00 5.36 N ATOM 1275 NH2 ARG A 84 19.662 8.018 8.371 1.00 6.26 N ATOM 0 H ARG A 84 12.472 9.898 8.887 1.00 1.26 H new ATOM 0 HA ARG A 84 14.926 8.424 9.643 1.00 1.64 H new ATOM 0 HB2 ARG A 84 14.786 11.377 8.973 1.00 2.64 H new ATOM 0 HB3 ARG A 84 16.210 10.445 9.394 1.00 2.64 H new ATOM 0 HG2 ARG A 84 14.534 10.020 6.885 1.00 3.46 H new ATOM 0 HG3 ARG A 84 16.034 10.924 6.947 1.00 3.46 H new ATOM 0 HD2 ARG A 84 15.719 7.978 7.644 1.00 4.08 H new ATOM 0 HD3 ARG A 84 16.377 8.602 6.145 1.00 4.08 H new ATOM 0 HE ARG A 84 17.871 9.741 8.289 1.00 4.79 H new ATOM 0 HH11 ARG A 84 17.250 6.616 6.768 1.00 5.36 H new ATOM 0 HH12 ARG A 84 18.836 5.965 7.192 1.00 5.36 H new ATOM 0 HH21 ARG A 84 19.906 8.896 8.830 1.00 6.26 H new ATOM 0 HH22 ARG A 84 20.332 7.249 8.353 1.00 6.26 H new ATOM 1289 N LYS A 85 12.763 9.461 11.375 1.00 1.79 N ATOM 1290 CA LYS A 85 12.234 9.825 12.686 1.00 2.53 C ATOM 1291 C LYS A 85 11.602 8.607 13.369 1.00 2.61 C ATOM 1292 O LYS A 85 12.189 7.523 13.386 1.00 3.08 O ATOM 1293 CB LYS A 85 11.195 10.939 12.526 1.00 3.13 C ATOM 1294 CG LYS A 85 11.648 12.070 11.621 1.00 3.58 C ATOM 1295 CD LYS A 85 10.572 13.133 11.477 1.00 4.39 C ATOM 1296 CE LYS A 85 10.992 14.220 10.504 1.00 5.02 C ATOM 1297 NZ LYS A 85 11.276 13.673 9.148 1.00 5.50 N ATOM 0 H LYS A 85 12.115 8.923 10.799 1.00 1.79 H new ATOM 0 HA LYS A 85 13.052 10.181 13.312 1.00 2.53 H new ATOM 0 HB2 LYS A 85 10.276 10.511 12.126 1.00 3.13 H new ATOM 0 HB3 LYS A 85 10.956 11.345 13.509 1.00 3.13 H new ATOM 0 HG2 LYS A 85 12.554 12.521 12.026 1.00 3.58 H new ATOM 0 HG3 LYS A 85 11.901 11.672 10.638 1.00 3.58 H new ATOM 0 HD2 LYS A 85 9.647 12.672 11.132 1.00 4.39 H new ATOM 0 HD3 LYS A 85 10.363 13.576 12.451 1.00 4.39 H new ATOM 0 HE2 LYS A 85 10.204 14.970 10.435 1.00 5.02 H new ATOM 0 HE3 LYS A 85 11.880 14.725 10.885 1.00 5.02 H new ATOM 0 HZ1 LYS A 85 11.078 14.400 8.432 1.00 5.50 H new ATOM 0 HZ2 LYS A 85 12.276 13.393 9.089 1.00 5.50 H new ATOM 0 HZ3 LYS A 85 10.673 12.843 8.975 1.00 5.50 H new ATOM 1311 N ALA A 86 10.403 8.786 13.927 1.00 2.48 N ATOM 1312 CA ALA A 86 9.697 7.698 14.603 1.00 2.58 C ATOM 1313 C ALA A 86 8.250 7.603 14.124 1.00 2.00 C ATOM 1314 O ALA A 86 7.466 8.538 14.298 1.00 1.95 O ATOM 1315 CB ALA A 86 9.743 7.896 16.109 1.00 3.19 C ATOM 0 H ALA A 86 9.901 9.674 13.924 1.00 2.48 H new ATOM 0 HA ALA A 86 10.198 6.762 14.355 1.00 2.58 H new ATOM 0 HB1 ALA A 86 9.214 7.079 16.600 1.00 3.19 H new ATOM 0 HB2 ALA A 86 10.781 7.909 16.443 1.00 3.19 H new ATOM 0 HB3 ALA A 86 9.268 8.843 16.366 1.00 3.19 H new ATOM 1321 N GLU A 87 7.903 6.472 13.514 1.00 2.01 N ATOM 1322 CA GLU A 87 6.551 6.257 13.004 1.00 1.67 C ATOM 1323 C GLU A 87 5.913 5.011 13.621 1.00 1.90 C ATOM 1324 O GLU A 87 6.453 3.908 13.528 1.00 2.39 O ATOM 1325 CB GLU A 87 6.571 6.135 11.473 1.00 2.04 C ATOM 1326 CG GLU A 87 7.032 4.779 10.943 1.00 2.47 C ATOM 1327 CD GLU A 87 8.458 4.420 11.335 1.00 3.23 C ATOM 1328 OE1 GLU A 87 8.711 4.186 12.533 1.00 3.66 O ATOM 1329 OE2 GLU A 87 9.322 4.362 10.436 1.00 3.80 O ATOM 0 H GLU A 87 8.540 5.690 13.361 1.00 2.01 H new ATOM 0 HA GLU A 87 5.948 7.120 13.286 1.00 1.67 H new ATOM 0 HB2 GLU A 87 5.569 6.336 11.094 1.00 2.04 H new ATOM 0 HB3 GLU A 87 7.225 6.908 11.070 1.00 2.04 H new ATOM 0 HG2 GLU A 87 6.358 4.006 11.313 1.00 2.47 H new ATOM 0 HG3 GLU A 87 6.953 4.778 9.856 1.00 2.47 H new ATOM 1336 N ARG A 88 4.755 5.185 14.243 1.00 1.97 N ATOM 1337 CA ARG A 88 4.054 4.061 14.849 1.00 2.47 C ATOM 1338 C ARG A 88 2.867 3.660 13.980 1.00 2.28 C ATOM 1339 O ARG A 88 2.778 2.525 13.513 1.00 2.54 O ATOM 1340 CB ARG A 88 3.593 4.435 16.265 1.00 2.97 C ATOM 1341 CG ARG A 88 2.993 3.282 17.063 1.00 3.30 C ATOM 1342 CD ARG A 88 1.568 2.966 16.632 1.00 3.95 C ATOM 1343 NE ARG A 88 0.969 1.911 17.449 1.00 4.47 N ATOM 1344 CZ ARG A 88 0.748 2.021 18.757 1.00 5.01 C ATOM 1345 NH1 ARG A 88 1.065 3.139 19.399 1.00 5.17 N ATOM 1346 NH2 ARG A 88 0.206 1.013 19.425 1.00 5.74 N ATOM 0 H ARG A 88 4.284 6.085 14.341 1.00 1.97 H new ATOM 0 HA ARG A 88 4.730 3.209 14.921 1.00 2.47 H new ATOM 0 HB2 ARG A 88 4.444 4.837 16.816 1.00 2.97 H new ATOM 0 HB3 ARG A 88 2.854 5.233 16.193 1.00 2.97 H new ATOM 0 HG2 ARG A 88 3.614 2.395 16.939 1.00 3.30 H new ATOM 0 HG3 ARG A 88 3.003 3.532 18.124 1.00 3.30 H new ATOM 0 HD2 ARG A 88 0.960 3.868 16.702 1.00 3.95 H new ATOM 0 HD3 ARG A 88 1.565 2.660 15.586 1.00 3.95 H new ATOM 0 HE ARG A 88 0.705 1.040 16.989 1.00 4.47 H new ATOM 0 HH11 ARG A 88 1.480 3.919 18.890 1.00 5.17 H new ATOM 0 HH12 ARG A 88 0.893 3.218 20.401 1.00 5.17 H new ATOM 0 HH21 ARG A 88 -0.042 0.152 18.937 1.00 5.74 H new ATOM 0 HH22 ARG A 88 0.037 1.098 20.427 1.00 5.74 H new ATOM 1360 N TRP A 89 1.959 4.608 13.769 1.00 1.98 N ATOM 1361 CA TRP A 89 0.771 4.372 12.956 1.00 1.91 C ATOM 1362 C TRP A 89 0.680 5.375 11.799 1.00 1.60 C ATOM 1363 O TRP A 89 -0.080 5.179 10.851 1.00 1.71 O ATOM 1364 CB TRP A 89 -0.478 4.461 13.840 1.00 2.11 C ATOM 1365 CG TRP A 89 -1.756 4.112 13.140 1.00 2.00 C ATOM 1366 CD1 TRP A 89 -1.936 3.166 12.170 1.00 2.28 C ATOM 1367 CD2 TRP A 89 -3.044 4.695 13.374 1.00 2.29 C ATOM 1368 NE1 TRP A 89 -3.254 3.135 11.779 1.00 2.69 N ATOM 1369 CE2 TRP A 89 -3.953 4.062 12.506 1.00 2.74 C ATOM 1370 CE3 TRP A 89 -3.514 5.693 14.232 1.00 2.65 C ATOM 1371 CZ2 TRP A 89 -5.306 4.396 12.474 1.00 3.44 C ATOM 1372 CZ3 TRP A 89 -4.856 6.023 14.201 1.00 3.33 C ATOM 1373 CH2 TRP A 89 -5.739 5.376 13.326 1.00 3.70 C ATOM 0 H TRP A 89 2.024 5.551 14.152 1.00 1.98 H new ATOM 0 HA TRP A 89 0.839 3.374 12.522 1.00 1.91 H new ATOM 0 HB2 TRP A 89 -0.352 3.796 14.694 1.00 2.11 H new ATOM 0 HB3 TRP A 89 -0.558 5.474 14.234 1.00 2.11 H new ATOM 0 HD1 TRP A 89 -1.157 2.535 11.769 1.00 2.28 H new ATOM 0 HE1 TRP A 89 -3.647 2.522 11.065 1.00 2.69 H new ATOM 0 HE3 TRP A 89 -2.840 6.198 14.908 1.00 2.65 H new ATOM 0 HZ2 TRP A 89 -5.989 3.899 11.801 1.00 3.44 H new ATOM 0 HZ3 TRP A 89 -5.230 6.791 14.861 1.00 3.33 H new ATOM 0 HH2 TRP A 89 -6.782 5.656 13.324 1.00 3.70 H new ATOM 1384 N GLY A 90 1.447 6.459 11.900 1.00 1.35 N ATOM 1385 CA GLY A 90 1.429 7.500 10.883 1.00 1.15 C ATOM 1386 C GLY A 90 1.788 7.017 9.487 1.00 1.08 C ATOM 1387 O GLY A 90 2.651 6.151 9.330 1.00 1.29 O ATOM 0 H GLY A 90 2.086 6.636 12.675 1.00 1.35 H new ATOM 0 HA2 GLY A 90 0.436 7.948 10.856 1.00 1.15 H new ATOM 0 HA3 GLY A 90 2.125 8.287 11.173 1.00 1.15 H new ATOM 1391 N PRO A 91 1.151 7.585 8.440 1.00 0.96 N ATOM 1392 CA PRO A 91 1.435 7.222 7.049 1.00 1.07 C ATOM 1393 C PRO A 91 2.871 7.556 6.693 1.00 1.17 C ATOM 1394 O PRO A 91 3.492 6.887 5.868 1.00 1.60 O ATOM 1395 CB PRO A 91 0.469 8.081 6.224 1.00 1.09 C ATOM 1396 CG PRO A 91 -0.554 8.567 7.192 1.00 1.09 C ATOM 1397 CD PRO A 91 0.131 8.641 8.529 1.00 0.91 C ATOM 0 HA PRO A 91 1.307 6.155 6.866 1.00 1.07 H new ATOM 0 HB2 PRO A 91 0.990 8.914 5.751 1.00 1.09 H new ATOM 0 HB3 PRO A 91 0.009 7.498 5.426 1.00 1.09 H new ATOM 0 HG2 PRO A 91 -0.936 9.544 6.896 1.00 1.09 H new ATOM 0 HG3 PRO A 91 -1.407 7.889 7.229 1.00 1.09 H new ATOM 0 HD2 PRO A 91 0.578 9.620 8.699 1.00 0.91 H new ATOM 0 HD3 PRO A 91 -0.565 8.462 9.349 1.00 0.91 H new ATOM 1405 N ARG A 92 3.396 8.588 7.351 1.00 0.93 N ATOM 1406 CA ARG A 92 4.770 9.011 7.144 1.00 1.03 C ATOM 1407 C ARG A 92 4.988 9.489 5.704 1.00 1.13 C ATOM 1408 O ARG A 92 4.039 9.586 4.925 1.00 1.95 O ATOM 1409 CB ARG A 92 5.686 7.835 7.500 1.00 1.21 C ATOM 1410 CG ARG A 92 7.105 8.221 7.857 1.00 1.04 C ATOM 1411 CD ARG A 92 8.056 7.903 6.724 1.00 1.71 C ATOM 1412 NE ARG A 92 7.890 6.537 6.222 1.00 2.57 N ATOM 1413 CZ ARG A 92 7.992 5.442 6.975 1.00 3.53 C ATOM 1414 NH1 ARG A 92 8.236 5.536 8.273 1.00 3.96 N ATOM 1415 NH2 ARG A 92 7.842 4.243 6.426 1.00 4.39 N ATOM 0 H ARG A 92 2.884 9.146 8.034 1.00 0.93 H new ATOM 0 HA ARG A 92 5.004 9.860 7.786 1.00 1.03 H new ATOM 0 HB2 ARG A 92 5.249 7.294 8.340 1.00 1.21 H new ATOM 0 HB3 ARG A 92 5.713 7.146 6.656 1.00 1.21 H new ATOM 0 HG2 ARG A 92 7.149 9.286 8.085 1.00 1.04 H new ATOM 0 HG3 ARG A 92 7.415 7.689 8.756 1.00 1.04 H new ATOM 0 HD2 ARG A 92 7.895 8.609 5.909 1.00 1.71 H new ATOM 0 HD3 ARG A 92 9.082 8.039 7.065 1.00 1.71 H new ATOM 0 HE ARG A 92 7.683 6.416 5.231 1.00 2.57 H new ATOM 0 HH11 ARG A 92 8.348 6.453 8.706 1.00 3.96 H new ATOM 0 HH12 ARG A 92 8.312 4.692 8.840 1.00 3.96 H new ATOM 0 HH21 ARG A 92 7.649 4.160 5.428 1.00 4.39 H new ATOM 0 HH22 ARG A 92 7.920 3.405 7.002 1.00 4.39 H new ATOM 1429 N THR A 93 6.239 9.769 5.354 1.00 0.94 N ATOM 1430 CA THR A 93 6.586 10.217 4.012 1.00 0.91 C ATOM 1431 C THR A 93 6.281 9.110 3.037 1.00 0.83 C ATOM 1432 O THR A 93 5.584 9.309 2.048 1.00 1.08 O ATOM 1433 CB THR A 93 8.067 10.598 3.923 1.00 1.02 C ATOM 1434 OG1 THR A 93 8.860 9.685 4.648 1.00 1.52 O ATOM 1435 CG2 THR A 93 8.375 11.986 4.434 1.00 1.47 C ATOM 0 H THR A 93 7.035 9.692 5.988 1.00 0.94 H new ATOM 0 HA THR A 93 5.999 11.103 3.771 1.00 0.91 H new ATOM 0 HB THR A 93 8.301 10.572 2.859 1.00 1.02 H new ATOM 0 HG1 THR A 93 9.465 10.177 5.242 1.00 1.52 H new ATOM 0 HG21 THR A 93 9.443 12.181 4.337 1.00 1.47 H new ATOM 0 HG22 THR A 93 7.818 12.720 3.851 1.00 1.47 H new ATOM 0 HG23 THR A 93 8.086 12.060 5.482 1.00 1.47 H new ATOM 1443 N LEU A 94 6.797 7.929 3.338 1.00 0.68 N ATOM 1444 CA LEU A 94 6.547 6.780 2.499 1.00 0.64 C ATOM 1445 C LEU A 94 6.719 5.474 3.263 1.00 0.56 C ATOM 1446 O LEU A 94 7.789 5.183 3.796 1.00 0.71 O ATOM 1447 CB LEU A 94 7.453 6.800 1.268 1.00 0.72 C ATOM 1448 CG LEU A 94 7.398 5.546 0.389 1.00 1.00 C ATOM 1449 CD1 LEU A 94 5.995 5.330 -0.151 1.00 1.44 C ATOM 1450 CD2 LEU A 94 8.401 5.654 -0.748 1.00 1.87 C ATOM 0 H LEU A 94 7.386 7.747 4.151 1.00 0.68 H new ATOM 0 HA LEU A 94 5.509 6.838 2.172 1.00 0.64 H new ATOM 0 HB2 LEU A 94 7.188 7.663 0.657 1.00 0.72 H new ATOM 0 HB3 LEU A 94 8.482 6.947 1.598 1.00 0.72 H new ATOM 0 HG LEU A 94 7.661 4.683 1.001 1.00 1.00 H new ATOM 0 HD11 LEU A 94 5.978 4.435 -0.772 1.00 1.44 H new ATOM 0 HD12 LEU A 94 5.300 5.208 0.680 1.00 1.44 H new ATOM 0 HD13 LEU A 94 5.698 6.192 -0.749 1.00 1.44 H new ATOM 0 HD21 LEU A 94 8.351 4.756 -1.364 1.00 1.87 H new ATOM 0 HD22 LEU A 94 8.167 6.526 -1.358 1.00 1.87 H new ATOM 0 HD23 LEU A 94 9.406 5.757 -0.338 1.00 1.87 H new ATOM 1462 N ASP A 95 5.652 4.687 3.287 1.00 0.52 N ATOM 1463 CA ASP A 95 5.652 3.397 3.957 1.00 0.53 C ATOM 1464 C ASP A 95 4.853 2.400 3.131 1.00 0.46 C ATOM 1465 O ASP A 95 3.644 2.247 3.310 1.00 0.59 O ATOM 1466 CB ASP A 95 5.070 3.514 5.370 1.00 0.73 C ATOM 1467 CG ASP A 95 3.680 4.127 5.391 1.00 1.16 C ATOM 1468 OD1 ASP A 95 3.200 4.538 4.314 1.00 1.64 O ATOM 1469 OD2 ASP A 95 3.071 4.192 6.479 1.00 1.72 O ATOM 0 H ASP A 95 4.765 4.925 2.843 1.00 0.52 H new ATOM 0 HA ASP A 95 6.680 3.047 4.050 1.00 0.53 H new ATOM 0 HB2 ASP A 95 5.031 2.524 5.824 1.00 0.73 H new ATOM 0 HB3 ASP A 95 5.737 4.120 5.983 1.00 0.73 H new ATOM 1474 N LEU A 96 5.534 1.741 2.210 1.00 0.38 N ATOM 1475 CA LEU A 96 4.883 0.782 1.334 1.00 0.36 C ATOM 1476 C LEU A 96 4.942 -0.624 1.927 1.00 0.40 C ATOM 1477 O LEU A 96 5.968 -1.297 1.882 1.00 0.53 O ATOM 1478 CB LEU A 96 5.503 0.828 -0.076 1.00 0.43 C ATOM 1479 CG LEU A 96 6.920 0.265 -0.240 1.00 0.52 C ATOM 1480 CD1 LEU A 96 7.399 0.485 -1.667 1.00 0.97 C ATOM 1481 CD2 LEU A 96 7.890 0.904 0.745 1.00 0.89 C ATOM 0 H LEU A 96 6.535 1.852 2.049 1.00 0.38 H new ATOM 0 HA LEU A 96 3.832 1.055 1.244 1.00 0.36 H new ATOM 0 HB2 LEU A 96 4.844 0.284 -0.752 1.00 0.43 H new ATOM 0 HB3 LEU A 96 5.512 1.867 -0.407 1.00 0.43 H new ATOM 0 HG LEU A 96 6.888 -0.804 -0.028 1.00 0.52 H new ATOM 0 HD11 LEU A 96 8.406 0.083 -1.779 1.00 0.97 H new ATOM 0 HD12 LEU A 96 6.727 -0.023 -2.359 1.00 0.97 H new ATOM 0 HD13 LEU A 96 7.408 1.552 -1.887 1.00 0.97 H new ATOM 0 HD21 LEU A 96 8.885 0.482 0.602 1.00 0.89 H new ATOM 0 HD22 LEU A 96 7.924 1.980 0.576 1.00 0.89 H new ATOM 0 HD23 LEU A 96 7.556 0.707 1.764 1.00 0.89 H new ATOM 1493 N ASP A 97 3.812 -1.051 2.491 1.00 0.38 N ATOM 1494 CA ASP A 97 3.701 -2.369 3.101 1.00 0.44 C ATOM 1495 C ASP A 97 2.653 -3.204 2.372 1.00 0.39 C ATOM 1496 O ASP A 97 1.613 -2.691 1.956 1.00 0.40 O ATOM 1497 CB ASP A 97 3.343 -2.255 4.584 1.00 0.55 C ATOM 1498 CG ASP A 97 4.364 -1.454 5.371 1.00 1.14 C ATOM 1499 OD1 ASP A 97 5.355 -0.997 4.762 1.00 1.45 O ATOM 1500 OD2 ASP A 97 4.175 -1.282 6.593 1.00 1.93 O ATOM 0 H ASP A 97 2.957 -0.496 2.536 1.00 0.38 H new ATOM 0 HA ASP A 97 4.669 -2.864 3.018 1.00 0.44 H new ATOM 0 HB2 ASP A 97 2.364 -1.786 4.683 1.00 0.55 H new ATOM 0 HB3 ASP A 97 3.262 -3.254 5.012 1.00 0.55 H new ATOM 1505 N ILE A 98 2.940 -4.489 2.209 1.00 0.39 N ATOM 1506 CA ILE A 98 2.040 -5.397 1.524 1.00 0.36 C ATOM 1507 C ILE A 98 0.749 -5.589 2.308 1.00 0.35 C ATOM 1508 O ILE A 98 0.760 -6.016 3.463 1.00 0.53 O ATOM 1509 CB ILE A 98 2.722 -6.759 1.245 1.00 0.36 C ATOM 1510 CG1 ILE A 98 3.592 -6.660 -0.012 1.00 0.48 C ATOM 1511 CG2 ILE A 98 1.694 -7.875 1.101 1.00 0.44 C ATOM 1512 CD1 ILE A 98 2.831 -6.241 -1.253 1.00 1.20 C ATOM 0 H ILE A 98 3.798 -4.925 2.547 1.00 0.39 H new ATOM 0 HA ILE A 98 1.787 -4.946 0.565 1.00 0.36 H new ATOM 0 HB ILE A 98 3.356 -7.005 2.097 1.00 0.36 H new ATOM 0 HG12 ILE A 98 4.395 -5.945 0.169 1.00 0.48 H new ATOM 0 HG13 ILE A 98 4.061 -7.627 -0.194 1.00 0.48 H new ATOM 0 HG21 ILE A 98 2.205 -8.818 0.906 1.00 0.44 H new ATOM 0 HG22 ILE A 98 1.117 -7.959 2.022 1.00 0.44 H new ATOM 0 HG23 ILE A 98 1.024 -7.647 0.272 1.00 0.44 H new ATOM 0 HD11 ILE A 98 3.515 -6.194 -2.100 1.00 1.20 H new ATOM 0 HD12 ILE A 98 2.046 -6.968 -1.461 1.00 1.20 H new ATOM 0 HD13 ILE A 98 2.384 -5.260 -1.092 1.00 1.20 H new ATOM 1524 N MET A 99 -0.359 -5.252 1.662 1.00 0.32 N ATOM 1525 CA MET A 99 -1.678 -5.363 2.276 1.00 0.36 C ATOM 1526 C MET A 99 -2.469 -6.499 1.644 1.00 0.33 C ATOM 1527 O MET A 99 -3.470 -6.955 2.192 1.00 0.37 O ATOM 1528 CB MET A 99 -2.445 -4.049 2.121 1.00 0.43 C ATOM 1529 CG MET A 99 -1.641 -2.828 2.537 1.00 0.68 C ATOM 1530 SD MET A 99 -1.030 -2.942 4.228 1.00 1.56 S ATOM 1531 CE MET A 99 -0.053 -1.444 4.332 1.00 2.37 C ATOM 0 H MET A 99 -0.371 -4.897 0.706 1.00 0.32 H new ATOM 0 HA MET A 99 -1.545 -5.577 3.337 1.00 0.36 H new ATOM 0 HB2 MET A 99 -2.751 -3.936 1.081 1.00 0.43 H new ATOM 0 HB3 MET A 99 -3.356 -4.096 2.718 1.00 0.43 H new ATOM 0 HG2 MET A 99 -0.798 -2.705 1.858 1.00 0.68 H new ATOM 0 HG3 MET A 99 -2.262 -1.938 2.439 1.00 0.68 H new ATOM 0 HE1 MET A 99 0.262 -1.286 5.364 1.00 2.37 H new ATOM 0 HE2 MET A 99 0.826 -1.538 3.695 1.00 2.37 H new ATOM 0 HE3 MET A 99 -0.652 -0.595 4.001 1.00 2.37 H new ATOM 1541 N LEU A 100 -2.012 -6.942 0.481 1.00 0.30 N ATOM 1542 CA LEU A 100 -2.663 -8.019 -0.242 1.00 0.30 C ATOM 1543 C LEU A 100 -1.698 -8.609 -1.260 1.00 0.31 C ATOM 1544 O LEU A 100 -1.145 -7.892 -2.087 1.00 0.58 O ATOM 1545 CB LEU A 100 -3.940 -7.496 -0.916 1.00 0.30 C ATOM 1546 CG LEU A 100 -5.236 -7.803 -0.161 1.00 0.37 C ATOM 1547 CD1 LEU A 100 -6.422 -7.138 -0.840 1.00 0.40 C ATOM 1548 CD2 LEU A 100 -5.450 -9.305 -0.060 1.00 0.43 C ATOM 0 H LEU A 100 -1.185 -6.566 0.017 1.00 0.30 H new ATOM 0 HA LEU A 100 -2.949 -8.810 0.452 1.00 0.30 H new ATOM 0 HB2 LEU A 100 -3.854 -6.416 -1.037 1.00 0.30 H new ATOM 0 HB3 LEU A 100 -4.008 -7.925 -1.916 1.00 0.30 H new ATOM 0 HG LEU A 100 -5.150 -7.399 0.848 1.00 0.37 H new ATOM 0 HD11 LEU A 100 -7.333 -7.368 -0.288 1.00 0.40 H new ATOM 0 HD12 LEU A 100 -6.272 -6.059 -0.859 1.00 0.40 H new ATOM 0 HD13 LEU A 100 -6.512 -7.510 -1.861 1.00 0.40 H new ATOM 0 HD21 LEU A 100 -6.376 -9.505 0.480 1.00 0.43 H new ATOM 0 HD22 LEU A 100 -5.514 -9.732 -1.061 1.00 0.43 H new ATOM 0 HD23 LEU A 100 -4.614 -9.757 0.474 1.00 0.43 H new ATOM 1560 N PHE A 101 -1.472 -9.916 -1.175 1.00 0.36 N ATOM 1561 CA PHE A 101 -0.546 -10.580 -2.083 1.00 0.36 C ATOM 1562 C PHE A 101 -1.070 -11.948 -2.499 1.00 0.38 C ATOM 1563 O PHE A 101 -0.745 -12.965 -1.887 1.00 0.88 O ATOM 1564 CB PHE A 101 0.832 -10.712 -1.424 1.00 0.46 C ATOM 1565 CG PHE A 101 1.915 -11.165 -2.368 1.00 0.70 C ATOM 1566 CD1 PHE A 101 1.973 -10.676 -3.663 1.00 1.13 C ATOM 1567 CD2 PHE A 101 2.874 -12.079 -1.958 1.00 1.10 C ATOM 1568 CE1 PHE A 101 2.969 -11.090 -4.527 1.00 1.59 C ATOM 1569 CE2 PHE A 101 3.870 -12.496 -2.819 1.00 1.59 C ATOM 1570 CZ PHE A 101 3.913 -12.004 -4.111 1.00 1.75 C ATOM 0 H PHE A 101 -1.914 -10.532 -0.492 1.00 0.36 H new ATOM 0 HA PHE A 101 -0.453 -9.971 -2.982 1.00 0.36 H new ATOM 0 HB2 PHE A 101 1.114 -9.750 -0.997 1.00 0.46 H new ATOM 0 HB3 PHE A 101 0.763 -11.420 -0.598 1.00 0.46 H new ATOM 0 HD1 PHE A 101 1.233 -9.965 -4.000 1.00 1.13 H new ATOM 0 HD2 PHE A 101 2.842 -12.470 -0.952 1.00 1.10 H new ATOM 0 HE1 PHE A 101 3.008 -10.696 -5.532 1.00 1.59 H new ATOM 0 HE2 PHE A 101 4.613 -13.204 -2.484 1.00 1.59 H new ATOM 0 HZ PHE A 101 4.684 -12.335 -4.791 1.00 1.75 H new ATOM 1580 N GLY A 102 -1.884 -11.961 -3.550 1.00 0.58 N ATOM 1581 CA GLY A 102 -2.445 -13.203 -4.045 1.00 0.60 C ATOM 1582 C GLY A 102 -3.322 -13.898 -3.024 1.00 0.73 C ATOM 1583 O GLY A 102 -4.177 -13.272 -2.398 1.00 1.49 O ATOM 0 H GLY A 102 -2.165 -11.129 -4.069 1.00 0.58 H new ATOM 0 HA2 GLY A 102 -3.030 -13.000 -4.942 1.00 0.60 H new ATOM 0 HA3 GLY A 102 -1.635 -13.872 -4.337 1.00 0.60 H new ATOM 1587 N ASN A 103 -3.109 -15.198 -2.862 1.00 0.56 N ATOM 1588 CA ASN A 103 -3.882 -15.995 -1.920 1.00 0.58 C ATOM 1589 C ASN A 103 -2.984 -16.599 -0.848 1.00 0.52 C ATOM 1590 O ASN A 103 -3.459 -17.306 0.040 1.00 0.67 O ATOM 1591 CB ASN A 103 -4.601 -17.124 -2.653 1.00 0.76 C ATOM 1592 CG ASN A 103 -3.624 -18.040 -3.361 1.00 0.85 C ATOM 1593 OD1 ASN A 103 -3.119 -17.717 -4.436 1.00 1.55 O ATOM 1594 ND2 ASN A 103 -3.320 -19.172 -2.741 1.00 0.90 N ATOM 0 H ASN A 103 -2.402 -15.725 -3.375 1.00 0.56 H new ATOM 0 HA ASN A 103 -4.609 -15.336 -1.446 1.00 0.58 H new ATOM 0 HB2 ASN A 103 -5.192 -17.701 -1.942 1.00 0.76 H new ATOM 0 HB3 ASN A 103 -5.297 -16.703 -3.379 1.00 0.76 H new ATOM 0 HD21 ASN A 103 -2.644 -19.814 -3.154 1.00 0.90 H new ATOM 0 HD22 ASN A 103 -3.762 -19.401 -1.851 1.00 0.90 H new ATOM 1601 N GLU A 104 -1.686 -16.335 -0.939 1.00 0.43 N ATOM 1602 CA GLU A 104 -0.746 -16.882 0.027 1.00 0.42 C ATOM 1603 C GLU A 104 -0.873 -16.208 1.380 1.00 0.42 C ATOM 1604 O GLU A 104 -1.545 -15.187 1.524 1.00 0.58 O ATOM 1605 CB GLU A 104 0.694 -16.775 -0.460 1.00 0.51 C ATOM 1606 CG GLU A 104 1.079 -15.397 -0.976 1.00 0.56 C ATOM 1607 CD GLU A 104 0.982 -15.286 -2.487 1.00 1.57 C ATOM 1608 OE1 GLU A 104 -0.124 -15.496 -3.025 1.00 2.29 O ATOM 1609 OE2 GLU A 104 2.010 -14.990 -3.131 1.00 2.14 O ATOM 0 H GLU A 104 -1.266 -15.753 -1.663 1.00 0.43 H new ATOM 0 HA GLU A 104 -1.001 -17.936 0.136 1.00 0.42 H new ATOM 0 HB2 GLU A 104 1.363 -17.044 0.358 1.00 0.51 H new ATOM 0 HB3 GLU A 104 0.852 -17.505 -1.254 1.00 0.51 H new ATOM 0 HG2 GLU A 104 0.431 -14.649 -0.519 1.00 0.56 H new ATOM 0 HG3 GLU A 104 2.098 -15.169 -0.664 1.00 0.56 H new ATOM 1616 N VAL A 105 -0.222 -16.808 2.361 1.00 0.50 N ATOM 1617 CA VAL A 105 -0.236 -16.314 3.726 1.00 0.56 C ATOM 1618 C VAL A 105 1.081 -16.646 4.417 1.00 0.61 C ATOM 1619 O VAL A 105 1.224 -17.704 5.032 1.00 0.72 O ATOM 1620 CB VAL A 105 -1.398 -16.946 4.510 1.00 0.66 C ATOM 1621 CG1 VAL A 105 -1.312 -16.601 5.992 1.00 0.80 C ATOM 1622 CG2 VAL A 105 -2.740 -16.510 3.939 1.00 0.67 C ATOM 0 H VAL A 105 0.333 -17.654 2.233 1.00 0.50 H new ATOM 0 HA VAL A 105 -0.368 -15.232 3.700 1.00 0.56 H new ATOM 0 HB VAL A 105 -1.317 -18.028 4.408 1.00 0.66 H new ATOM 0 HG11 VAL A 105 -2.146 -17.061 6.522 1.00 0.80 H new ATOM 0 HG12 VAL A 105 -0.373 -16.976 6.399 1.00 0.80 H new ATOM 0 HG13 VAL A 105 -1.355 -15.519 6.117 1.00 0.80 H new ATOM 0 HG21 VAL A 105 -3.546 -16.971 4.511 1.00 0.67 H new ATOM 0 HG22 VAL A 105 -2.826 -15.425 4.000 1.00 0.67 H new ATOM 0 HG23 VAL A 105 -2.811 -16.822 2.897 1.00 0.67 H new ATOM 1632 N ILE A 106 2.054 -15.748 4.296 1.00 0.58 N ATOM 1633 CA ILE A 106 3.361 -15.969 4.898 1.00 0.64 C ATOM 1634 C ILE A 106 3.897 -14.708 5.561 1.00 0.61 C ATOM 1635 O ILE A 106 3.953 -13.643 4.948 1.00 0.57 O ATOM 1636 CB ILE A 106 4.385 -16.451 3.850 1.00 0.74 C ATOM 1637 CG1 ILE A 106 3.876 -17.710 3.145 1.00 0.76 C ATOM 1638 CG2 ILE A 106 5.733 -16.716 4.509 1.00 1.31 C ATOM 1639 CD1 ILE A 106 4.763 -18.169 2.007 1.00 1.45 C ATOM 0 H ILE A 106 1.962 -14.867 3.790 1.00 0.58 H new ATOM 0 HA ILE A 106 3.225 -16.740 5.657 1.00 0.64 H new ATOM 0 HB ILE A 106 4.513 -15.667 3.104 1.00 0.74 H new ATOM 0 HG12 ILE A 106 3.790 -18.515 3.875 1.00 0.76 H new ATOM 0 HG13 ILE A 106 2.874 -17.521 2.760 1.00 0.76 H new ATOM 0 HG21 ILE A 106 6.445 -17.055 3.757 1.00 1.31 H new ATOM 0 HG22 ILE A 106 6.100 -15.798 4.968 1.00 1.31 H new ATOM 0 HG23 ILE A 106 5.619 -17.484 5.274 1.00 1.31 H new ATOM 0 HD11 ILE A 106 4.340 -19.066 1.555 1.00 1.45 H new ATOM 0 HD12 ILE A 106 4.829 -17.381 1.257 1.00 1.45 H new ATOM 0 HD13 ILE A 106 5.759 -18.391 2.389 1.00 1.45 H new ATOM 1651 N ASN A 107 4.310 -14.849 6.815 1.00 0.84 N ATOM 1652 CA ASN A 107 4.866 -13.739 7.567 1.00 0.90 C ATOM 1653 C ASN A 107 6.288 -14.080 7.988 1.00 0.91 C ATOM 1654 O ASN A 107 6.500 -14.934 8.848 1.00 1.02 O ATOM 1655 CB ASN A 107 4.000 -13.443 8.790 1.00 1.09 C ATOM 1656 CG ASN A 107 2.520 -13.464 8.457 1.00 1.00 C ATOM 1657 OD1 ASN A 107 1.929 -14.528 8.271 1.00 1.28 O ATOM 1658 ND2 ASN A 107 1.921 -12.287 8.343 1.00 1.21 N ATOM 0 H ASN A 107 4.268 -15.728 7.332 1.00 0.84 H new ATOM 0 HA ASN A 107 4.883 -12.848 6.940 1.00 0.90 H new ATOM 0 HB2 ASN A 107 4.207 -14.178 9.567 1.00 1.09 H new ATOM 0 HB3 ASN A 107 4.267 -12.467 9.195 1.00 1.09 H new ATOM 0 HD21 ASN A 107 0.933 -12.240 8.093 1.00 1.21 H new ATOM 0 HD22 ASN A 107 2.448 -11.429 8.506 1.00 1.21 H new ATOM 1665 N THR A 108 7.260 -13.439 7.351 1.00 0.86 N ATOM 1666 CA THR A 108 8.664 -13.718 7.641 1.00 0.89 C ATOM 1667 C THR A 108 9.342 -12.628 8.462 1.00 0.91 C ATOM 1668 O THR A 108 9.338 -12.683 9.692 1.00 1.16 O ATOM 1669 CB THR A 108 9.430 -13.936 6.343 1.00 0.90 C ATOM 1670 OG1 THR A 108 9.071 -12.959 5.384 1.00 1.07 O ATOM 1671 CG2 THR A 108 9.196 -15.304 5.739 1.00 0.92 C ATOM 0 H THR A 108 7.106 -12.728 6.636 1.00 0.86 H new ATOM 0 HA THR A 108 8.680 -14.623 8.248 1.00 0.89 H new ATOM 0 HB THR A 108 10.485 -13.855 6.603 1.00 0.90 H new ATOM 0 HG1 THR A 108 9.868 -12.455 5.116 1.00 1.07 H new ATOM 0 HG21 THR A 108 9.769 -15.397 4.817 1.00 0.92 H new ATOM 0 HG22 THR A 108 9.515 -16.072 6.444 1.00 0.92 H new ATOM 0 HG23 THR A 108 8.135 -15.429 5.521 1.00 0.92 H new ATOM 1679 N GLU A 109 9.948 -11.651 7.786 1.00 0.83 N ATOM 1680 CA GLU A 109 10.648 -10.583 8.493 1.00 0.86 C ATOM 1681 C GLU A 109 9.765 -9.358 8.621 1.00 0.73 C ATOM 1682 O GLU A 109 9.249 -9.053 9.696 1.00 0.87 O ATOM 1683 CB GLU A 109 11.946 -10.213 7.766 1.00 0.95 C ATOM 1684 CG GLU A 109 12.862 -11.401 7.503 1.00 1.22 C ATOM 1685 CD GLU A 109 12.436 -12.218 6.298 1.00 1.93 C ATOM 1686 OE1 GLU A 109 11.492 -11.798 5.595 1.00 2.60 O ATOM 1687 OE2 GLU A 109 13.057 -13.273 6.049 1.00 2.37 O ATOM 0 H GLU A 109 9.968 -11.578 6.769 1.00 0.83 H new ATOM 0 HA GLU A 109 10.894 -10.946 9.491 1.00 0.86 H new ATOM 0 HB2 GLU A 109 11.697 -9.740 6.816 1.00 0.95 H new ATOM 0 HB3 GLU A 109 12.486 -9.474 8.358 1.00 0.95 H new ATOM 0 HG2 GLU A 109 13.880 -11.042 7.351 1.00 1.22 H new ATOM 0 HG3 GLU A 109 12.878 -12.043 8.384 1.00 1.22 H new ATOM 1694 N ARG A 110 9.580 -8.682 7.506 1.00 0.63 N ATOM 1695 CA ARG A 110 8.741 -7.503 7.458 1.00 0.64 C ATOM 1696 C ARG A 110 7.600 -7.760 6.500 1.00 0.66 C ATOM 1697 O ARG A 110 6.597 -7.046 6.491 1.00 0.77 O ATOM 1698 CB ARG A 110 9.539 -6.279 7.008 1.00 0.63 C ATOM 1699 CG ARG A 110 10.204 -6.431 5.649 1.00 0.86 C ATOM 1700 CD ARG A 110 11.629 -6.954 5.776 1.00 1.64 C ATOM 1701 NE ARG A 110 12.487 -6.039 6.523 1.00 2.22 N ATOM 1702 CZ ARG A 110 12.794 -4.810 6.115 1.00 2.77 C ATOM 1703 NH1 ARG A 110 12.328 -4.352 4.961 1.00 3.01 N ATOM 1704 NH2 ARG A 110 13.574 -4.038 6.860 1.00 3.68 N ATOM 0 H ARG A 110 10.004 -8.932 6.613 1.00 0.63 H new ATOM 0 HA ARG A 110 8.354 -7.298 8.456 1.00 0.64 H new ATOM 0 HB2 ARG A 110 8.873 -5.416 6.979 1.00 0.63 H new ATOM 0 HB3 ARG A 110 10.306 -6.066 7.753 1.00 0.63 H new ATOM 0 HG2 ARG A 110 9.619 -7.113 5.032 1.00 0.86 H new ATOM 0 HG3 ARG A 110 10.214 -5.468 5.139 1.00 0.86 H new ATOM 0 HD2 ARG A 110 11.615 -7.924 6.273 1.00 1.64 H new ATOM 0 HD3 ARG A 110 12.047 -7.111 4.782 1.00 1.64 H new ATOM 0 HE ARG A 110 12.874 -6.361 7.410 1.00 2.22 H new ATOM 0 HH11 ARG A 110 11.731 -4.942 4.382 1.00 3.01 H new ATOM 0 HH12 ARG A 110 12.566 -3.409 4.653 1.00 3.01 H new ATOM 0 HH21 ARG A 110 13.939 -4.386 7.746 1.00 3.68 H new ATOM 0 HH22 ARG A 110 13.809 -3.096 6.546 1.00 3.68 H new ATOM 1718 N LEU A 111 7.771 -8.793 5.685 1.00 0.62 N ATOM 1719 CA LEU A 111 6.758 -9.150 4.710 1.00 0.63 C ATOM 1720 C LEU A 111 5.552 -9.801 5.357 1.00 0.56 C ATOM 1721 O LEU A 111 5.538 -11.000 5.637 1.00 0.66 O ATOM 1722 CB LEU A 111 7.310 -10.040 3.591 1.00 0.73 C ATOM 1723 CG LEU A 111 7.027 -9.444 2.221 1.00 0.94 C ATOM 1724 CD1 LEU A 111 7.589 -10.226 1.066 1.00 1.15 C ATOM 1725 CD2 LEU A 111 5.528 -9.243 2.032 1.00 1.64 C ATOM 0 H LEU A 111 8.596 -9.392 5.682 1.00 0.62 H new ATOM 0 HA LEU A 111 6.436 -8.212 4.257 1.00 0.63 H new ATOM 0 HB2 LEU A 111 8.385 -10.166 3.720 1.00 0.73 H new ATOM 0 HB3 LEU A 111 6.863 -11.032 3.658 1.00 0.73 H new ATOM 0 HG LEU A 111 7.547 -8.486 2.210 1.00 0.94 H new ATOM 0 HD11 LEU A 111 7.337 -9.725 0.131 1.00 1.15 H new ATOM 0 HD12 LEU A 111 8.673 -10.290 1.163 1.00 1.15 H new ATOM 0 HD13 LEU A 111 7.165 -11.230 1.066 1.00 1.15 H new ATOM 0 HD21 LEU A 111 5.340 -8.816 1.047 1.00 1.64 H new ATOM 0 HD22 LEU A 111 5.019 -10.203 2.114 1.00 1.64 H new ATOM 0 HD23 LEU A 111 5.152 -8.566 2.799 1.00 1.64 H new ATOM 1737 N THR A 112 4.530 -8.987 5.558 1.00 0.46 N ATOM 1738 CA THR A 112 3.280 -9.445 6.137 1.00 0.42 C ATOM 1739 C THR A 112 2.236 -9.611 5.049 1.00 0.39 C ATOM 1740 O THR A 112 2.166 -8.809 4.117 1.00 0.43 O ATOM 1741 CB THR A 112 2.761 -8.460 7.192 1.00 0.45 C ATOM 1742 OG1 THR A 112 3.286 -7.163 6.972 1.00 0.65 O ATOM 1743 CG2 THR A 112 3.083 -8.863 8.615 1.00 0.68 C ATOM 0 H THR A 112 4.543 -7.994 5.325 1.00 0.46 H new ATOM 0 HA THR A 112 3.467 -10.404 6.621 1.00 0.42 H new ATOM 0 HB THR A 112 1.677 -8.469 7.078 1.00 0.45 H new ATOM 0 HG1 THR A 112 2.941 -6.550 7.655 1.00 0.65 H new ATOM 0 HG21 THR A 112 2.684 -8.118 9.303 1.00 0.68 H new ATOM 0 HG22 THR A 112 2.633 -9.833 8.829 1.00 0.68 H new ATOM 0 HG23 THR A 112 4.164 -8.929 8.739 1.00 0.68 H new ATOM 1751 N VAL A 113 1.414 -10.634 5.182 1.00 0.36 N ATOM 1752 CA VAL A 113 0.361 -10.877 4.219 1.00 0.38 C ATOM 1753 C VAL A 113 -0.836 -10.015 4.638 1.00 0.32 C ATOM 1754 O VAL A 113 -0.771 -9.414 5.711 1.00 0.30 O ATOM 1755 CB VAL A 113 0.013 -12.389 4.171 1.00 0.45 C ATOM 1756 CG1 VAL A 113 -1.323 -12.691 4.833 1.00 1.52 C ATOM 1757 CG2 VAL A 113 0.049 -12.907 2.739 1.00 1.18 C ATOM 0 H VAL A 113 1.456 -11.308 5.946 1.00 0.36 H new ATOM 0 HA VAL A 113 0.669 -10.606 3.209 1.00 0.38 H new ATOM 0 HB VAL A 113 0.776 -12.916 4.744 1.00 0.45 H new ATOM 0 HG11 VAL A 113 -1.524 -13.761 4.775 1.00 1.52 H new ATOM 0 HG12 VAL A 113 -1.289 -12.384 5.878 1.00 1.52 H new ATOM 0 HG13 VAL A 113 -2.115 -12.145 4.320 1.00 1.52 H new ATOM 0 HG21 VAL A 113 -0.198 -13.969 2.730 1.00 1.18 H new ATOM 0 HG22 VAL A 113 -0.676 -12.360 2.136 1.00 1.18 H new ATOM 0 HG23 VAL A 113 1.047 -12.763 2.325 1.00 1.18 H new ATOM 1767 N PRO A 114 -1.929 -9.908 3.839 1.00 0.35 N ATOM 1768 CA PRO A 114 -3.088 -9.096 4.182 1.00 0.36 C ATOM 1769 C PRO A 114 -3.164 -8.773 5.670 1.00 0.33 C ATOM 1770 O PRO A 114 -3.575 -9.603 6.481 1.00 0.35 O ATOM 1771 CB PRO A 114 -4.223 -10.002 3.724 1.00 0.43 C ATOM 1772 CG PRO A 114 -3.668 -10.733 2.528 1.00 0.46 C ATOM 1773 CD PRO A 114 -2.160 -10.552 2.544 1.00 0.42 C ATOM 0 HA PRO A 114 -3.089 -8.109 3.720 1.00 0.36 H new ATOM 0 HB2 PRO A 114 -4.518 -10.696 4.511 1.00 0.43 H new ATOM 0 HB3 PRO A 114 -5.109 -9.425 3.460 1.00 0.43 H new ATOM 0 HG2 PRO A 114 -3.928 -11.791 2.570 1.00 0.46 H new ATOM 0 HG3 PRO A 114 -4.092 -10.337 1.605 1.00 0.46 H new ATOM 0 HD2 PRO A 114 -1.637 -11.505 2.466 1.00 0.42 H new ATOM 0 HD3 PRO A 114 -1.817 -9.932 1.716 1.00 0.42 H new ATOM 1781 N HIS A 115 -2.736 -7.557 6.017 1.00 0.33 N ATOM 1782 CA HIS A 115 -2.717 -7.110 7.396 1.00 0.33 C ATOM 1783 C HIS A 115 -4.112 -6.727 7.847 1.00 0.34 C ATOM 1784 O HIS A 115 -4.906 -6.205 7.067 1.00 0.46 O ATOM 1785 CB HIS A 115 -1.774 -5.911 7.532 1.00 0.39 C ATOM 1786 CG HIS A 115 -1.442 -5.548 8.947 1.00 0.44 C ATOM 1787 ND1 HIS A 115 -2.396 -5.276 9.904 1.00 0.97 N ATOM 1788 CD2 HIS A 115 -0.243 -5.406 9.563 1.00 0.76 C ATOM 1789 CE1 HIS A 115 -1.801 -4.981 11.046 1.00 0.87 C ATOM 1790 NE2 HIS A 115 -0.494 -5.054 10.866 1.00 0.67 N ATOM 0 H HIS A 115 -2.397 -6.865 5.349 1.00 0.33 H new ATOM 0 HA HIS A 115 -2.361 -7.924 8.028 1.00 0.33 H new ATOM 0 HB2 HIS A 115 -0.849 -6.128 6.998 1.00 0.39 H new ATOM 0 HB3 HIS A 115 -2.229 -5.048 7.045 1.00 0.39 H new ATOM 0 HD2 HIS A 115 0.729 -5.544 9.113 1.00 0.76 H new ATOM 0 HE1 HIS A 115 -2.298 -4.724 11.970 1.00 0.87 H new ATOM 0 HE2 HIS A 115 0.213 -4.878 11.579 1.00 0.67 H new ATOM 1799 N TYR A 116 -4.394 -6.967 9.114 1.00 0.34 N ATOM 1800 CA TYR A 116 -5.688 -6.618 9.667 1.00 0.42 C ATOM 1801 C TYR A 116 -5.675 -5.134 9.943 1.00 0.43 C ATOM 1802 O TYR A 116 -5.249 -4.689 11.008 1.00 0.49 O ATOM 1803 CB TYR A 116 -5.960 -7.418 10.943 1.00 0.52 C ATOM 1804 CG TYR A 116 -6.045 -8.914 10.713 1.00 0.70 C ATOM 1805 CD1 TYR A 116 -5.229 -9.534 9.780 1.00 1.13 C ATOM 1806 CD2 TYR A 116 -6.937 -9.704 11.433 1.00 0.89 C ATOM 1807 CE1 TYR A 116 -5.297 -10.898 9.565 1.00 1.64 C ATOM 1808 CE2 TYR A 116 -7.011 -11.067 11.224 1.00 1.31 C ATOM 1809 CZ TYR A 116 -6.211 -11.660 10.296 1.00 1.68 C ATOM 1810 OH TYR A 116 -6.258 -13.019 10.081 1.00 2.22 O ATOM 0 H TYR A 116 -3.749 -7.399 9.775 1.00 0.34 H new ATOM 0 HA TYR A 116 -6.487 -6.860 8.966 1.00 0.42 H new ATOM 0 HB2 TYR A 116 -5.170 -7.214 11.666 1.00 0.52 H new ATOM 0 HB3 TYR A 116 -6.894 -7.073 11.386 1.00 0.52 H new ATOM 0 HD1 TYR A 116 -4.528 -8.941 9.211 1.00 1.13 H new ATOM 0 HD2 TYR A 116 -7.582 -9.243 12.167 1.00 0.89 H new ATOM 0 HE1 TYR A 116 -4.650 -11.369 8.840 1.00 1.64 H new ATOM 0 HE2 TYR A 116 -7.705 -11.663 11.798 1.00 1.31 H new ATOM 0 HH TYR A 116 -6.940 -13.418 10.660 1.00 2.22 H new ATOM 1820 N ASP A 117 -6.083 -4.365 8.943 1.00 0.42 N ATOM 1821 CA ASP A 117 -6.043 -2.923 9.053 1.00 0.50 C ATOM 1822 C ASP A 117 -6.718 -2.255 7.857 1.00 0.52 C ATOM 1823 O ASP A 117 -7.523 -1.338 8.012 1.00 0.73 O ATOM 1824 CB ASP A 117 -4.574 -2.510 9.093 1.00 0.52 C ATOM 1825 CG ASP A 117 -4.376 -1.051 9.454 1.00 0.67 C ATOM 1826 OD1 ASP A 117 -5.388 -0.350 9.673 1.00 1.07 O ATOM 1827 OD2 ASP A 117 -3.211 -0.607 9.516 1.00 0.87 O ATOM 0 H ASP A 117 -6.442 -4.717 8.055 1.00 0.42 H new ATOM 0 HA ASP A 117 -6.575 -2.611 9.952 1.00 0.50 H new ATOM 0 HB2 ASP A 117 -4.048 -3.132 9.817 1.00 0.52 H new ATOM 0 HB3 ASP A 117 -4.122 -2.702 8.120 1.00 0.52 H new ATOM 1832 N MET A 118 -6.351 -2.715 6.668 1.00 0.38 N ATOM 1833 CA MET A 118 -6.876 -2.167 5.419 1.00 0.39 C ATOM 1834 C MET A 118 -8.392 -2.258 5.340 1.00 0.38 C ATOM 1835 O MET A 118 -9.059 -1.346 4.855 1.00 0.45 O ATOM 1836 CB MET A 118 -6.269 -2.917 4.234 1.00 0.44 C ATOM 1837 CG MET A 118 -6.580 -4.406 4.222 1.00 0.48 C ATOM 1838 SD MET A 118 -5.901 -5.248 2.781 1.00 1.29 S ATOM 1839 CE MET A 118 -6.749 -4.394 1.454 1.00 2.05 C ATOM 0 H MET A 118 -5.684 -3.476 6.540 1.00 0.38 H new ATOM 0 HA MET A 118 -6.602 -1.112 5.388 1.00 0.39 H new ATOM 0 HB2 MET A 118 -6.635 -2.472 3.309 1.00 0.44 H new ATOM 0 HB3 MET A 118 -5.187 -2.782 4.247 1.00 0.44 H new ATOM 0 HG2 MET A 118 -6.180 -4.864 5.127 1.00 0.48 H new ATOM 0 HG3 MET A 118 -7.661 -4.547 4.244 1.00 0.48 H new ATOM 0 HE1 MET A 118 -7.336 -5.109 0.878 1.00 2.05 H new ATOM 0 HE2 MET A 118 -7.410 -3.636 1.873 1.00 2.05 H new ATOM 0 HE3 MET A 118 -6.017 -3.917 0.802 1.00 2.05 H new ATOM 1849 N LYS A 119 -8.918 -3.376 5.800 1.00 0.40 N ATOM 1850 CA LYS A 119 -10.350 -3.629 5.769 1.00 0.47 C ATOM 1851 C LYS A 119 -11.082 -2.853 6.855 1.00 0.50 C ATOM 1852 O LYS A 119 -12.307 -2.899 6.946 1.00 0.80 O ATOM 1853 CB LYS A 119 -10.590 -5.127 5.908 1.00 0.57 C ATOM 1854 CG LYS A 119 -9.769 -5.757 7.017 1.00 0.69 C ATOM 1855 CD LYS A 119 -9.948 -7.268 7.066 1.00 0.80 C ATOM 1856 CE LYS A 119 -9.441 -7.935 5.794 1.00 1.02 C ATOM 1857 NZ LYS A 119 -7.999 -7.650 5.553 1.00 1.93 N ATOM 0 H LYS A 119 -8.369 -4.134 6.205 1.00 0.40 H new ATOM 0 HA LYS A 119 -10.750 -3.283 4.816 1.00 0.47 H new ATOM 0 HB2 LYS A 119 -11.648 -5.304 6.101 1.00 0.57 H new ATOM 0 HB3 LYS A 119 -10.352 -5.617 4.964 1.00 0.57 H new ATOM 0 HG2 LYS A 119 -8.715 -5.521 6.868 1.00 0.69 H new ATOM 0 HG3 LYS A 119 -10.060 -5.325 7.975 1.00 0.69 H new ATOM 0 HD2 LYS A 119 -9.413 -7.670 7.926 1.00 0.80 H new ATOM 0 HD3 LYS A 119 -11.002 -7.506 7.206 1.00 0.80 H new ATOM 0 HE2 LYS A 119 -9.591 -9.012 5.865 1.00 1.02 H new ATOM 0 HE3 LYS A 119 -10.027 -7.587 4.943 1.00 1.02 H new ATOM 0 HZ1 LYS A 119 -7.629 -8.310 4.839 1.00 1.93 H new ATOM 0 HZ2 LYS A 119 -7.890 -6.674 5.211 1.00 1.93 H new ATOM 0 HZ3 LYS A 119 -7.469 -7.767 6.440 1.00 1.93 H new ATOM 1871 N ASN A 120 -10.323 -2.127 7.662 1.00 0.49 N ATOM 1872 CA ASN A 120 -10.893 -1.320 8.731 1.00 0.52 C ATOM 1873 C ASN A 120 -10.645 0.154 8.438 1.00 0.56 C ATOM 1874 O ASN A 120 -10.561 0.976 9.350 1.00 0.74 O ATOM 1875 CB ASN A 120 -10.266 -1.697 10.074 1.00 0.53 C ATOM 1876 CG ASN A 120 -10.315 -3.185 10.339 1.00 1.17 C ATOM 1877 OD1 ASN A 120 -11.381 -3.800 10.323 1.00 2.11 O ATOM 1878 ND2 ASN A 120 -9.152 -3.769 10.594 1.00 1.30 N ATOM 0 H ASN A 120 -9.306 -2.080 7.596 1.00 0.49 H new ATOM 0 HA ASN A 120 -11.966 -1.506 8.785 1.00 0.52 H new ATOM 0 HB2 ASN A 120 -9.229 -1.362 10.094 1.00 0.53 H new ATOM 0 HB3 ASN A 120 -10.786 -1.171 10.875 1.00 0.53 H new ATOM 0 HD21 ASN A 120 -9.116 -4.770 10.788 1.00 1.30 H new ATOM 0 HD22 ASN A 120 -8.294 -3.217 10.596 1.00 1.30 H new ATOM 1885 N ARG A 121 -10.516 0.467 7.149 1.00 0.49 N ATOM 1886 CA ARG A 121 -10.256 1.830 6.704 1.00 0.58 C ATOM 1887 C ARG A 121 -10.788 2.032 5.287 1.00 0.63 C ATOM 1888 O ARG A 121 -11.695 1.323 4.850 1.00 1.07 O ATOM 1889 CB ARG A 121 -8.747 2.116 6.733 1.00 0.64 C ATOM 1890 CG ARG A 121 -8.097 1.929 8.097 1.00 0.91 C ATOM 1891 CD ARG A 121 -8.173 3.185 8.963 1.00 1.24 C ATOM 1892 NE ARG A 121 -9.544 3.614 9.240 1.00 1.84 N ATOM 1893 CZ ARG A 121 -10.251 4.413 8.444 1.00 2.55 C ATOM 1894 NH1 ARG A 121 -9.710 4.902 7.336 1.00 2.86 N ATOM 1895 NH2 ARG A 121 -11.499 4.732 8.763 1.00 3.50 N ATOM 0 H ARG A 121 -10.588 -0.213 6.392 1.00 0.49 H new ATOM 0 HA ARG A 121 -10.765 2.519 7.378 1.00 0.58 H new ATOM 0 HB2 ARG A 121 -8.252 1.462 6.015 1.00 0.64 H new ATOM 0 HB3 ARG A 121 -8.577 3.140 6.401 1.00 0.64 H new ATOM 0 HG2 ARG A 121 -8.584 1.104 8.617 1.00 0.91 H new ATOM 0 HG3 ARG A 121 -7.052 1.648 7.962 1.00 0.91 H new ATOM 0 HD2 ARG A 121 -7.660 2.999 9.907 1.00 1.24 H new ATOM 0 HD3 ARG A 121 -7.640 3.995 8.465 1.00 1.24 H new ATOM 0 HE ARG A 121 -9.986 3.280 10.097 1.00 1.84 H new ATOM 0 HH11 ARG A 121 -8.748 4.666 7.091 1.00 2.86 H new ATOM 0 HH12 ARG A 121 -10.256 5.514 6.729 1.00 2.86 H new ATOM 0 HH21 ARG A 121 -11.917 4.365 9.618 1.00 3.50 H new ATOM 0 HH22 ARG A 121 -12.041 5.344 8.153 1.00 3.50 H new ATOM 1909 N GLY A 122 -10.217 2.999 4.574 1.00 0.62 N ATOM 1910 CA GLY A 122 -10.648 3.273 3.214 1.00 0.61 C ATOM 1911 C GLY A 122 -9.505 3.639 2.294 1.00 0.56 C ATOM 1912 O GLY A 122 -9.691 3.727 1.083 1.00 0.70 O ATOM 0 H GLY A 122 -9.464 3.597 4.913 1.00 0.62 H new ATOM 0 HA2 GLY A 122 -11.160 2.396 2.817 1.00 0.61 H new ATOM 0 HA3 GLY A 122 -11.373 4.087 3.226 1.00 0.61 H new ATOM 1916 N PHE A 123 -8.320 3.856 2.847 1.00 0.52 N ATOM 1917 CA PHE A 123 -7.176 4.222 2.028 1.00 0.58 C ATOM 1918 C PHE A 123 -6.530 2.987 1.413 1.00 0.42 C ATOM 1919 O PHE A 123 -5.915 3.061 0.356 1.00 0.43 O ATOM 1920 CB PHE A 123 -6.166 5.056 2.833 1.00 0.84 C ATOM 1921 CG PHE A 123 -5.932 4.577 4.238 1.00 1.19 C ATOM 1922 CD1 PHE A 123 -5.539 3.274 4.492 1.00 1.62 C ATOM 1923 CD2 PHE A 123 -6.102 5.439 5.310 1.00 2.11 C ATOM 1924 CE1 PHE A 123 -5.317 2.839 5.783 1.00 2.59 C ATOM 1925 CE2 PHE A 123 -5.885 5.009 6.606 1.00 3.16 C ATOM 1926 CZ PHE A 123 -5.491 3.708 6.843 1.00 3.31 C ATOM 0 H PHE A 123 -8.128 3.786 3.846 1.00 0.52 H new ATOM 0 HA PHE A 123 -7.529 4.846 1.207 1.00 0.58 H new ATOM 0 HB2 PHE A 123 -5.214 5.060 2.302 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -6.515 6.088 2.869 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -5.404 2.588 3.669 1.00 1.62 H new ATOM 0 HD2 PHE A 123 -6.408 6.459 5.131 1.00 2.11 H new ATOM 0 HE1 PHE A 123 -5.008 1.820 5.964 1.00 2.59 H new ATOM 0 HE2 PHE A 123 -6.024 5.691 7.432 1.00 3.16 H new ATOM 0 HZ PHE A 123 -5.319 3.370 7.854 1.00 3.31 H new ATOM 1936 N MET A 124 -6.689 1.844 2.064 1.00 0.37 N ATOM 1937 CA MET A 124 -6.137 0.601 1.545 1.00 0.38 C ATOM 1938 C MET A 124 -7.145 -0.123 0.650 1.00 0.38 C ATOM 1939 O MET A 124 -6.763 -0.809 -0.297 1.00 0.57 O ATOM 1940 CB MET A 124 -5.674 -0.301 2.692 1.00 0.50 C ATOM 1941 CG MET A 124 -4.499 0.281 3.463 1.00 0.90 C ATOM 1942 SD MET A 124 -3.934 -0.769 4.813 1.00 1.99 S ATOM 1943 CE MET A 124 -2.685 0.279 5.553 1.00 2.44 C ATOM 0 H MET A 124 -7.192 1.751 2.946 1.00 0.37 H new ATOM 0 HA MET A 124 -5.270 0.847 0.931 1.00 0.38 H new ATOM 0 HB2 MET A 124 -6.506 -0.466 3.377 1.00 0.50 H new ATOM 0 HB3 MET A 124 -5.393 -1.275 2.291 1.00 0.50 H new ATOM 0 HG2 MET A 124 -3.671 0.451 2.774 1.00 0.90 H new ATOM 0 HG3 MET A 124 -4.784 1.253 3.865 1.00 0.90 H new ATOM 0 HE1 MET A 124 -1.957 -0.338 6.079 1.00 2.44 H new ATOM 0 HE2 MET A 124 -2.180 0.850 4.773 1.00 2.44 H new ATOM 0 HE3 MET A 124 -3.156 0.965 6.257 1.00 2.44 H new ATOM 1953 N LEU A 125 -8.432 0.023 0.964 1.00 0.37 N ATOM 1954 CA LEU A 125 -9.501 -0.628 0.200 1.00 0.41 C ATOM 1955 C LEU A 125 -9.911 0.162 -1.046 1.00 0.34 C ATOM 1956 O LEU A 125 -9.845 -0.348 -2.165 1.00 0.40 O ATOM 1957 CB LEU A 125 -10.736 -0.833 1.081 1.00 0.53 C ATOM 1958 CG LEU A 125 -10.554 -1.763 2.279 1.00 0.61 C ATOM 1959 CD1 LEU A 125 -11.849 -1.871 3.069 1.00 0.85 C ATOM 1960 CD2 LEU A 125 -10.087 -3.140 1.826 1.00 0.76 C ATOM 0 H LEU A 125 -8.763 0.589 1.746 1.00 0.37 H new ATOM 0 HA LEU A 125 -9.100 -1.587 -0.128 1.00 0.41 H new ATOM 0 HB2 LEU A 125 -11.063 0.140 1.447 1.00 0.53 H new ATOM 0 HB3 LEU A 125 -11.541 -1.226 0.459 1.00 0.53 H new ATOM 0 HG LEU A 125 -9.787 -1.340 2.928 1.00 0.61 H new ATOM 0 HD11 LEU A 125 -11.702 -2.537 3.919 1.00 0.85 H new ATOM 0 HD12 LEU A 125 -12.140 -0.884 3.428 1.00 0.85 H new ATOM 0 HD13 LEU A 125 -12.635 -2.270 2.427 1.00 0.85 H new ATOM 0 HD21 LEU A 125 -9.964 -3.786 2.695 1.00 0.76 H new ATOM 0 HD22 LEU A 125 -10.828 -3.573 1.154 1.00 0.76 H new ATOM 0 HD23 LEU A 125 -9.134 -3.048 1.304 1.00 0.76 H new ATOM 1972 N TRP A 126 -10.382 1.391 -0.833 1.00 0.31 N ATOM 1973 CA TRP A 126 -10.861 2.246 -1.920 1.00 0.32 C ATOM 1974 C TRP A 126 -9.898 2.296 -3.119 1.00 0.29 C ATOM 1975 O TRP A 126 -10.294 1.952 -4.231 1.00 0.31 O ATOM 1976 CB TRP A 126 -11.146 3.645 -1.370 1.00 0.38 C ATOM 1977 CG TRP A 126 -11.465 4.673 -2.405 1.00 0.46 C ATOM 1978 CD1 TRP A 126 -10.999 5.949 -2.430 1.00 0.46 C ATOM 1979 CD2 TRP A 126 -12.319 4.532 -3.550 1.00 0.93 C ATOM 1980 NE1 TRP A 126 -11.501 6.618 -3.517 1.00 0.54 N ATOM 1981 CE2 TRP A 126 -12.314 5.769 -4.222 1.00 0.94 C ATOM 1982 CE3 TRP A 126 -13.083 3.484 -4.074 1.00 1.45 C ATOM 1983 CZ2 TRP A 126 -13.042 5.987 -5.388 1.00 1.42 C ATOM 1984 CZ3 TRP A 126 -13.806 3.702 -5.233 1.00 1.96 C ATOM 1985 CH2 TRP A 126 -13.781 4.944 -5.878 1.00 1.93 C ATOM 0 H TRP A 126 -10.442 1.820 0.091 1.00 0.31 H new ATOM 0 HA TRP A 126 -11.782 1.810 -2.308 1.00 0.32 H new ATOM 0 HB2 TRP A 126 -11.980 3.582 -0.672 1.00 0.38 H new ATOM 0 HB3 TRP A 126 -10.279 3.980 -0.801 1.00 0.38 H new ATOM 0 HD1 TRP A 126 -10.329 6.376 -1.698 1.00 0.46 H new ATOM 0 HE1 TRP A 126 -11.302 7.588 -3.761 1.00 0.54 H new ATOM 0 HE3 TRP A 126 -13.108 2.522 -3.583 1.00 1.45 H new ATOM 0 HZ2 TRP A 126 -13.025 6.944 -5.888 1.00 1.42 H new ATOM 0 HZ3 TRP A 126 -14.400 2.900 -5.647 1.00 1.96 H new ATOM 0 HH2 TRP A 126 -14.357 5.082 -6.781 1.00 1.93 H new ATOM 1996 N PRO A 127 -8.632 2.727 -2.940 1.00 0.28 N ATOM 1997 CA PRO A 127 -7.666 2.802 -4.052 1.00 0.29 C ATOM 1998 C PRO A 127 -7.366 1.439 -4.673 1.00 0.28 C ATOM 1999 O PRO A 127 -7.316 1.307 -5.896 1.00 0.31 O ATOM 2000 CB PRO A 127 -6.407 3.380 -3.400 1.00 0.30 C ATOM 2001 CG PRO A 127 -6.898 4.043 -2.161 1.00 0.31 C ATOM 2002 CD PRO A 127 -8.034 3.190 -1.678 1.00 0.29 C ATOM 0 HA PRO A 127 -8.053 3.404 -4.874 1.00 0.29 H new ATOM 0 HB2 PRO A 127 -5.684 2.597 -3.171 1.00 0.30 H new ATOM 0 HB3 PRO A 127 -5.909 4.091 -4.060 1.00 0.30 H new ATOM 0 HG2 PRO A 127 -6.109 4.109 -1.411 1.00 0.31 H new ATOM 0 HG3 PRO A 127 -7.230 5.061 -2.365 1.00 0.31 H new ATOM 0 HD2 PRO A 127 -7.687 2.360 -1.063 1.00 0.29 H new ATOM 0 HD3 PRO A 127 -8.743 3.758 -1.076 1.00 0.29 H new ATOM 2010 N LEU A 128 -7.168 0.433 -3.825 1.00 0.25 N ATOM 2011 CA LEU A 128 -6.873 -0.924 -4.289 1.00 0.26 C ATOM 2012 C LEU A 128 -7.969 -1.406 -5.235 1.00 0.27 C ATOM 2013 O LEU A 128 -7.736 -2.232 -6.118 1.00 0.29 O ATOM 2014 CB LEU A 128 -6.785 -1.871 -3.091 1.00 0.26 C ATOM 2015 CG LEU A 128 -5.671 -2.907 -3.130 1.00 0.29 C ATOM 2016 CD1 LEU A 128 -4.331 -2.261 -2.815 1.00 0.30 C ATOM 2017 CD2 LEU A 128 -5.967 -4.027 -2.145 1.00 0.44 C ATOM 0 H LEU A 128 -7.206 0.530 -2.810 1.00 0.25 H new ATOM 0 HA LEU A 128 -5.921 -0.915 -4.819 1.00 0.26 H new ATOM 0 HB2 LEU A 128 -6.663 -1.271 -2.189 1.00 0.26 H new ATOM 0 HB3 LEU A 128 -7.736 -2.395 -2.999 1.00 0.26 H new ATOM 0 HG LEU A 128 -5.619 -3.328 -4.134 1.00 0.29 H new ATOM 0 HD11 LEU A 128 -3.546 -3.017 -2.847 1.00 0.30 H new ATOM 0 HD12 LEU A 128 -4.119 -1.486 -3.551 1.00 0.30 H new ATOM 0 HD13 LEU A 128 -4.366 -1.817 -1.820 1.00 0.30 H new ATOM 0 HD21 LEU A 128 -5.164 -4.764 -2.180 1.00 0.44 H new ATOM 0 HD22 LEU A 128 -6.039 -3.616 -1.138 1.00 0.44 H new ATOM 0 HD23 LEU A 128 -6.910 -4.505 -2.410 1.00 0.44 H new ATOM 2029 N PHE A 129 -9.165 -0.870 -5.028 1.00 0.28 N ATOM 2030 CA PHE A 129 -10.341 -1.211 -5.829 1.00 0.30 C ATOM 2031 C PHE A 129 -10.096 -0.963 -7.319 1.00 0.30 C ATOM 2032 O PHE A 129 -10.873 -1.390 -8.170 1.00 0.32 O ATOM 2033 CB PHE A 129 -11.537 -0.374 -5.353 1.00 0.36 C ATOM 2034 CG PHE A 129 -12.812 -0.602 -6.118 1.00 0.42 C ATOM 2035 CD1 PHE A 129 -13.474 -1.815 -6.049 1.00 0.47 C ATOM 2036 CD2 PHE A 129 -13.352 0.409 -6.896 1.00 0.48 C ATOM 2037 CE1 PHE A 129 -14.649 -2.020 -6.745 1.00 0.55 C ATOM 2038 CE2 PHE A 129 -14.529 0.212 -7.594 1.00 0.56 C ATOM 2039 CZ PHE A 129 -15.178 -1.003 -7.519 1.00 0.58 C ATOM 0 H PHE A 129 -9.351 -0.183 -4.297 1.00 0.28 H new ATOM 0 HA PHE A 129 -10.550 -2.273 -5.698 1.00 0.30 H new ATOM 0 HB2 PHE A 129 -11.718 -0.591 -4.300 1.00 0.36 H new ATOM 0 HB3 PHE A 129 -11.273 0.681 -5.420 1.00 0.36 H new ATOM 0 HD1 PHE A 129 -13.067 -2.611 -5.443 1.00 0.47 H new ATOM 0 HD2 PHE A 129 -12.848 1.362 -6.958 1.00 0.48 H new ATOM 0 HE1 PHE A 129 -15.154 -2.973 -6.685 1.00 0.55 H new ATOM 0 HE2 PHE A 129 -14.940 1.008 -8.197 1.00 0.56 H new ATOM 0 HZ PHE A 129 -16.097 -1.160 -8.064 1.00 0.58 H new ATOM 2049 N GLU A 130 -9.023 -0.247 -7.629 1.00 0.29 N ATOM 2050 CA GLU A 130 -8.689 0.076 -9.011 1.00 0.31 C ATOM 2051 C GLU A 130 -7.530 -0.764 -9.530 1.00 0.29 C ATOM 2052 O GLU A 130 -7.442 -1.034 -10.728 1.00 0.32 O ATOM 2053 CB GLU A 130 -8.343 1.563 -9.136 1.00 0.36 C ATOM 2054 CG GLU A 130 -9.487 2.489 -8.762 1.00 0.93 C ATOM 2055 CD GLU A 130 -10.701 2.306 -9.653 1.00 1.41 C ATOM 2056 OE1 GLU A 130 -10.571 2.504 -10.879 1.00 1.52 O ATOM 2057 OE2 GLU A 130 -11.780 1.966 -9.124 1.00 2.43 O ATOM 0 H GLU A 130 -8.367 0.122 -6.940 1.00 0.29 H new ATOM 0 HA GLU A 130 -9.565 -0.152 -9.618 1.00 0.31 H new ATOM 0 HB2 GLU A 130 -7.486 1.783 -8.499 1.00 0.36 H new ATOM 0 HB3 GLU A 130 -8.039 1.771 -10.162 1.00 0.36 H new ATOM 0 HG2 GLU A 130 -9.771 2.309 -7.725 1.00 0.93 H new ATOM 0 HG3 GLU A 130 -9.148 3.523 -8.824 1.00 0.93 H new ATOM 2064 N ILE A 131 -6.627 -1.160 -8.636 1.00 0.26 N ATOM 2065 CA ILE A 131 -5.469 -1.944 -9.046 1.00 0.27 C ATOM 2066 C ILE A 131 -5.857 -3.389 -9.309 1.00 0.27 C ATOM 2067 O ILE A 131 -5.270 -4.054 -10.161 1.00 0.30 O ATOM 2068 CB ILE A 131 -4.355 -1.877 -7.980 1.00 0.27 C ATOM 2069 CG1 ILE A 131 -4.581 -2.890 -6.847 1.00 0.29 C ATOM 2070 CG2 ILE A 131 -4.293 -0.465 -7.417 1.00 0.32 C ATOM 2071 CD1 ILE A 131 -3.445 -2.938 -5.852 1.00 0.59 C ATOM 0 H ILE A 131 -6.674 -0.954 -7.638 1.00 0.26 H new ATOM 0 HA ILE A 131 -5.088 -1.515 -9.973 1.00 0.27 H new ATOM 0 HB ILE A 131 -3.409 -2.135 -8.456 1.00 0.27 H new ATOM 0 HG12 ILE A 131 -5.503 -2.639 -6.323 1.00 0.29 H new ATOM 0 HG13 ILE A 131 -4.719 -3.882 -7.278 1.00 0.29 H new ATOM 0 HG21 ILE A 131 -3.508 -0.408 -6.663 1.00 0.32 H new ATOM 0 HG22 ILE A 131 -4.075 0.238 -8.221 1.00 0.32 H new ATOM 0 HG23 ILE A 131 -5.251 -0.212 -6.963 1.00 0.32 H new ATOM 0 HD11 ILE A 131 -3.669 -3.673 -5.079 1.00 0.59 H new ATOM 0 HD12 ILE A 131 -2.525 -3.219 -6.364 1.00 0.59 H new ATOM 0 HD13 ILE A 131 -3.321 -1.957 -5.394 1.00 0.59 H new ATOM 2083 N ALA A 132 -6.884 -3.842 -8.600 1.00 0.24 N ATOM 2084 CA ALA A 132 -7.416 -5.196 -8.759 1.00 0.25 C ATOM 2085 C ALA A 132 -8.390 -5.551 -7.635 1.00 0.23 C ATOM 2086 O ALA A 132 -8.001 -6.100 -6.608 1.00 0.28 O ATOM 2087 CB ALA A 132 -6.298 -6.227 -8.835 1.00 0.30 C ATOM 0 H ALA A 132 -7.373 -3.285 -7.899 1.00 0.24 H new ATOM 0 HA ALA A 132 -7.963 -5.215 -9.702 1.00 0.25 H new ATOM 0 HB1 ALA A 132 -6.728 -7.222 -8.953 1.00 0.30 H new ATOM 0 HB2 ALA A 132 -5.656 -6.006 -9.688 1.00 0.30 H new ATOM 0 HB3 ALA A 132 -5.709 -6.193 -7.919 1.00 0.30 H new ATOM 2093 N PRO A 133 -9.676 -5.221 -7.817 1.00 0.25 N ATOM 2094 CA PRO A 133 -10.726 -5.470 -6.836 1.00 0.31 C ATOM 2095 C PRO A 133 -11.522 -6.746 -7.117 1.00 0.35 C ATOM 2096 O PRO A 133 -12.633 -6.917 -6.613 1.00 0.45 O ATOM 2097 CB PRO A 133 -11.593 -4.247 -7.044 1.00 0.37 C ATOM 2098 CG PRO A 133 -11.597 -4.083 -8.528 1.00 0.37 C ATOM 2099 CD PRO A 133 -10.232 -4.535 -9.001 1.00 0.29 C ATOM 0 HA PRO A 133 -10.346 -5.617 -5.825 1.00 0.31 H new ATOM 0 HB2 PRO A 133 -12.599 -4.395 -6.652 1.00 0.37 H new ATOM 0 HB3 PRO A 133 -11.181 -3.371 -6.543 1.00 0.37 H new ATOM 0 HG2 PRO A 133 -12.386 -4.681 -8.985 1.00 0.37 H new ATOM 0 HG3 PRO A 133 -11.782 -3.045 -8.805 1.00 0.37 H new ATOM 0 HD2 PRO A 133 -10.304 -5.205 -9.858 1.00 0.29 H new ATOM 0 HD3 PRO A 133 -9.612 -3.692 -9.306 1.00 0.29 H new ATOM 2107 N GLU A 134 -10.946 -7.640 -7.912 1.00 0.32 N ATOM 2108 CA GLU A 134 -11.597 -8.898 -8.254 1.00 0.37 C ATOM 2109 C GLU A 134 -10.910 -10.001 -7.489 1.00 0.37 C ATOM 2110 O GLU A 134 -11.355 -11.149 -7.454 1.00 0.52 O ATOM 2111 CB GLU A 134 -11.519 -9.159 -9.759 1.00 0.44 C ATOM 2112 CG GLU A 134 -10.097 -9.218 -10.297 1.00 0.46 C ATOM 2113 CD GLU A 134 -10.045 -9.453 -11.795 1.00 0.54 C ATOM 2114 OE1 GLU A 134 -11.123 -9.566 -12.415 1.00 1.14 O ATOM 2115 OE2 GLU A 134 -8.927 -9.524 -12.348 1.00 0.87 O ATOM 0 H GLU A 134 -10.025 -7.516 -8.333 1.00 0.32 H new ATOM 0 HA GLU A 134 -12.653 -8.855 -7.986 1.00 0.37 H new ATOM 0 HB2 GLU A 134 -12.022 -10.100 -9.982 1.00 0.44 H new ATOM 0 HB3 GLU A 134 -12.064 -8.374 -10.284 1.00 0.44 H new ATOM 0 HG2 GLU A 134 -9.585 -8.285 -10.062 1.00 0.46 H new ATOM 0 HG3 GLU A 134 -9.554 -10.015 -9.790 1.00 0.46 H new ATOM 2122 N LEU A 135 -9.819 -9.603 -6.867 1.00 0.30 N ATOM 2123 CA LEU A 135 -9.004 -10.476 -6.059 1.00 0.35 C ATOM 2124 C LEU A 135 -9.857 -11.267 -5.072 1.00 0.34 C ATOM 2125 O LEU A 135 -10.906 -10.800 -4.645 1.00 0.39 O ATOM 2126 CB LEU A 135 -8.003 -9.620 -5.301 1.00 0.41 C ATOM 2127 CG LEU A 135 -7.275 -10.347 -4.193 1.00 0.69 C ATOM 2128 CD1 LEU A 135 -6.350 -11.416 -4.755 1.00 1.27 C ATOM 2129 CD2 LEU A 135 -6.510 -9.373 -3.315 1.00 1.41 C ATOM 0 H LEU A 135 -9.471 -8.645 -6.912 1.00 0.30 H new ATOM 0 HA LEU A 135 -8.492 -11.191 -6.703 1.00 0.35 H new ATOM 0 HB2 LEU A 135 -7.270 -9.229 -6.006 1.00 0.41 H new ATOM 0 HB3 LEU A 135 -8.525 -8.763 -4.876 1.00 0.41 H new ATOM 0 HG LEU A 135 -8.021 -10.844 -3.573 1.00 0.69 H new ATOM 0 HD11 LEU A 135 -5.840 -11.923 -3.936 1.00 1.27 H new ATOM 0 HD12 LEU A 135 -6.934 -12.141 -5.322 1.00 1.27 H new ATOM 0 HD13 LEU A 135 -5.613 -10.952 -5.410 1.00 1.27 H new ATOM 0 HD21 LEU A 135 -5.995 -9.921 -2.526 1.00 1.41 H new ATOM 0 HD22 LEU A 135 -5.779 -8.835 -3.919 1.00 1.41 H new ATOM 0 HD23 LEU A 135 -7.205 -8.662 -2.869 1.00 1.41 H new ATOM 2141 N VAL A 136 -9.394 -12.457 -4.704 1.00 0.36 N ATOM 2142 CA VAL A 136 -10.116 -13.295 -3.754 1.00 0.38 C ATOM 2143 C VAL A 136 -9.160 -14.002 -2.794 1.00 0.42 C ATOM 2144 O VAL A 136 -8.047 -14.367 -3.168 1.00 0.53 O ATOM 2145 CB VAL A 136 -11.000 -14.331 -4.474 1.00 0.41 C ATOM 2146 CG1 VAL A 136 -10.186 -15.117 -5.491 1.00 0.46 C ATOM 2147 CG2 VAL A 136 -11.663 -15.269 -3.475 1.00 0.44 C ATOM 0 H VAL A 136 -8.524 -12.862 -5.049 1.00 0.36 H new ATOM 0 HA VAL A 136 -10.761 -12.634 -3.175 1.00 0.38 H new ATOM 0 HB VAL A 136 -11.786 -13.794 -5.005 1.00 0.41 H new ATOM 0 HG11 VAL A 136 -10.829 -15.843 -5.988 1.00 0.46 H new ATOM 0 HG12 VAL A 136 -9.770 -14.433 -6.231 1.00 0.46 H new ATOM 0 HG13 VAL A 136 -9.375 -15.638 -4.983 1.00 0.46 H new ATOM 0 HG21 VAL A 136 -12.281 -15.991 -4.009 1.00 0.44 H new ATOM 0 HG22 VAL A 136 -10.897 -15.797 -2.908 1.00 0.44 H new ATOM 0 HG23 VAL A 136 -12.286 -14.692 -2.792 1.00 0.44 H new ATOM 2157 N PHE A 137 -9.611 -14.191 -1.553 1.00 0.46 N ATOM 2158 CA PHE A 137 -8.807 -14.852 -0.535 1.00 0.53 C ATOM 2159 C PHE A 137 -8.998 -16.366 -0.616 1.00 0.57 C ATOM 2160 O PHE A 137 -9.936 -16.839 -1.255 1.00 0.60 O ATOM 2161 CB PHE A 137 -9.203 -14.347 0.859 1.00 0.59 C ATOM 2162 CG PHE A 137 -8.881 -12.895 1.112 1.00 0.58 C ATOM 2163 CD1 PHE A 137 -9.265 -11.925 0.200 1.00 0.55 C ATOM 2164 CD2 PHE A 137 -8.191 -12.502 2.249 1.00 0.66 C ATOM 2165 CE1 PHE A 137 -8.968 -10.591 0.415 1.00 0.59 C ATOM 2166 CE2 PHE A 137 -7.892 -11.170 2.471 1.00 0.68 C ATOM 2167 CZ PHE A 137 -8.293 -10.221 1.600 1.00 0.64 C ATOM 0 H PHE A 137 -10.532 -13.893 -1.232 1.00 0.46 H new ATOM 0 HA PHE A 137 -7.757 -14.619 -0.710 1.00 0.53 H new ATOM 0 HB2 PHE A 137 -10.274 -14.498 0.996 1.00 0.59 H new ATOM 0 HB3 PHE A 137 -8.697 -14.955 1.609 1.00 0.59 H new ATOM 0 HD1 PHE A 137 -9.803 -12.214 -0.690 1.00 0.55 H new ATOM 0 HD2 PHE A 137 -7.883 -13.245 2.970 1.00 0.66 H new ATOM 0 HE1 PHE A 137 -9.248 -9.843 -0.312 1.00 0.59 H new ATOM 0 HE2 PHE A 137 -7.332 -10.887 3.350 1.00 0.68 H new ATOM 0 HZ PHE A 137 -8.098 -9.179 1.808 1.00 0.64 H new ATOM 2177 N PRO A 138 -8.114 -17.152 0.032 1.00 0.60 N ATOM 2178 CA PRO A 138 -8.212 -18.616 0.022 1.00 0.66 C ATOM 2179 C PRO A 138 -9.600 -19.103 0.428 1.00 0.73 C ATOM 2180 O PRO A 138 -9.940 -20.274 0.250 1.00 0.78 O ATOM 2181 CB PRO A 138 -7.175 -19.054 1.058 1.00 0.70 C ATOM 2182 CG PRO A 138 -6.186 -17.943 1.102 1.00 0.75 C ATOM 2183 CD PRO A 138 -6.957 -16.683 0.823 1.00 0.62 C ATOM 0 HA PRO A 138 -8.039 -19.027 -0.973 1.00 0.66 H new ATOM 0 HB2 PRO A 138 -7.634 -19.213 2.034 1.00 0.70 H new ATOM 0 HB3 PRO A 138 -6.702 -19.993 0.771 1.00 0.70 H new ATOM 0 HG2 PRO A 138 -5.699 -17.894 2.076 1.00 0.75 H new ATOM 0 HG3 PRO A 138 -5.401 -18.091 0.360 1.00 0.75 H new ATOM 0 HD2 PRO A 138 -7.273 -16.194 1.744 1.00 0.62 H new ATOM 0 HD3 PRO A 138 -6.358 -15.961 0.268 1.00 0.62 H new ATOM 2191 N ASP A 139 -10.398 -18.193 0.980 1.00 0.77 N ATOM 2192 CA ASP A 139 -11.749 -18.514 1.424 1.00 0.87 C ATOM 2193 C ASP A 139 -12.773 -18.193 0.338 1.00 0.80 C ATOM 2194 O ASP A 139 -13.440 -19.084 -0.189 1.00 1.03 O ATOM 2195 CB ASP A 139 -12.079 -17.718 2.686 1.00 0.92 C ATOM 2196 CG ASP A 139 -13.303 -18.254 3.404 1.00 1.33 C ATOM 2197 OD1 ASP A 139 -13.284 -19.434 3.811 1.00 1.72 O ATOM 2198 OD2 ASP A 139 -14.282 -17.493 3.558 1.00 1.91 O ATOM 0 H ASP A 139 -10.129 -17.221 1.131 1.00 0.77 H new ATOM 0 HA ASP A 139 -11.794 -19.582 1.637 1.00 0.87 H new ATOM 0 HB2 ASP A 139 -11.224 -17.743 3.362 1.00 0.92 H new ATOM 0 HB3 ASP A 139 -12.245 -16.674 2.421 1.00 0.92 H new ATOM 2203 N GLY A 140 -12.889 -16.908 0.020 1.00 0.59 N ATOM 2204 CA GLY A 140 -13.832 -16.465 -0.991 1.00 0.59 C ATOM 2205 C GLY A 140 -13.944 -14.954 -1.033 1.00 0.61 C ATOM 2206 O GLY A 140 -14.385 -14.380 -2.028 1.00 0.95 O ATOM 0 H GLY A 140 -12.343 -16.160 0.448 1.00 0.59 H new ATOM 0 HA2 GLY A 140 -13.518 -16.833 -1.968 1.00 0.59 H new ATOM 0 HA3 GLY A 140 -14.812 -16.897 -0.788 1.00 0.59 H new ATOM 2210 N GLU A 141 -13.535 -14.314 0.060 1.00 0.51 N ATOM 2211 CA GLU A 141 -13.569 -12.861 0.178 1.00 0.62 C ATOM 2212 C GLU A 141 -12.890 -12.200 -1.018 1.00 0.53 C ATOM 2213 O GLU A 141 -12.050 -12.809 -1.671 1.00 0.59 O ATOM 2214 CB GLU A 141 -12.861 -12.439 1.462 1.00 0.86 C ATOM 2215 CG GLU A 141 -12.964 -10.957 1.762 1.00 1.38 C ATOM 2216 CD GLU A 141 -12.266 -10.572 3.053 1.00 2.15 C ATOM 2217 OE1 GLU A 141 -11.041 -10.795 3.154 1.00 2.76 O ATOM 2218 OE2 GLU A 141 -12.945 -10.049 3.961 1.00 2.53 O ATOM 0 H GLU A 141 -13.172 -14.788 0.887 1.00 0.51 H new ATOM 0 HA GLU A 141 -14.611 -12.541 0.204 1.00 0.62 H new ATOM 0 HB2 GLU A 141 -13.281 -12.999 2.298 1.00 0.86 H new ATOM 0 HB3 GLU A 141 -11.808 -12.713 1.392 1.00 0.86 H new ATOM 0 HG2 GLU A 141 -12.530 -10.392 0.937 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -14.015 -10.675 1.824 1.00 1.38 H new ATOM 2225 N MET A 142 -13.253 -10.951 -1.296 1.00 0.48 N ATOM 2226 CA MET A 142 -12.663 -10.218 -2.411 1.00 0.41 C ATOM 2227 C MET A 142 -12.469 -8.749 -2.053 1.00 0.37 C ATOM 2228 O MET A 142 -13.125 -8.239 -1.144 1.00 0.39 O ATOM 2229 CB MET A 142 -13.550 -10.334 -3.648 1.00 0.42 C ATOM 2230 CG MET A 142 -13.787 -11.765 -4.106 1.00 0.49 C ATOM 2231 SD MET A 142 -14.789 -11.863 -5.601 1.00 0.55 S ATOM 2232 CE MET A 142 -16.298 -11.066 -5.055 1.00 1.68 C ATOM 0 H MET A 142 -13.950 -10.427 -0.767 1.00 0.48 H new ATOM 0 HA MET A 142 -11.688 -10.656 -2.625 1.00 0.41 H new ATOM 0 HB2 MET A 142 -14.512 -9.866 -3.438 1.00 0.42 H new ATOM 0 HB3 MET A 142 -13.094 -9.773 -4.464 1.00 0.42 H new ATOM 0 HG2 MET A 142 -12.826 -12.248 -4.286 1.00 0.49 H new ATOM 0 HG3 MET A 142 -14.279 -12.321 -3.307 1.00 0.49 H new ATOM 0 HE1 MET A 142 -17.115 -11.338 -5.723 1.00 1.68 H new ATOM 0 HE2 MET A 142 -16.534 -11.390 -4.041 1.00 1.68 H new ATOM 0 HE3 MET A 142 -16.164 -9.984 -5.068 1.00 1.68 H new ATOM 2242 N LEU A 143 -11.578 -8.065 -2.774 1.00 0.38 N ATOM 2243 CA LEU A 143 -11.328 -6.657 -2.522 1.00 0.39 C ATOM 2244 C LEU A 143 -12.608 -5.854 -2.727 1.00 0.41 C ATOM 2245 O LEU A 143 -12.769 -4.765 -2.176 1.00 0.50 O ATOM 2246 CB LEU A 143 -10.223 -6.149 -3.445 1.00 0.44 C ATOM 2247 CG LEU A 143 -9.856 -4.675 -3.282 1.00 0.51 C ATOM 2248 CD1 LEU A 143 -9.422 -4.383 -1.852 1.00 1.38 C ATOM 2249 CD2 LEU A 143 -8.757 -4.307 -4.259 1.00 1.56 C ATOM 0 H LEU A 143 -11.024 -8.466 -3.531 1.00 0.38 H new ATOM 0 HA LEU A 143 -11.002 -6.532 -1.489 1.00 0.39 H new ATOM 0 HB2 LEU A 143 -9.329 -6.749 -3.277 1.00 0.44 H new ATOM 0 HB3 LEU A 143 -10.530 -6.317 -4.477 1.00 0.44 H new ATOM 0 HG LEU A 143 -10.736 -4.069 -3.497 1.00 0.51 H new ATOM 0 HD11 LEU A 143 -9.165 -3.328 -1.758 1.00 1.38 H new ATOM 0 HD12 LEU A 143 -10.237 -4.620 -1.169 1.00 1.38 H new ATOM 0 HD13 LEU A 143 -8.552 -4.992 -1.604 1.00 1.38 H new ATOM 0 HD21 LEU A 143 -8.500 -3.255 -4.138 1.00 1.56 H new ATOM 0 HD22 LEU A 143 -7.877 -4.920 -4.065 1.00 1.56 H new ATOM 0 HD23 LEU A 143 -9.103 -4.481 -5.278 1.00 1.56 H new ATOM 2261 N ARG A 144 -13.518 -6.417 -3.513 1.00 0.39 N ATOM 2262 CA ARG A 144 -14.796 -5.774 -3.790 1.00 0.47 C ATOM 2263 C ARG A 144 -15.776 -6.070 -2.660 1.00 0.49 C ATOM 2264 O ARG A 144 -16.433 -5.166 -2.140 1.00 0.56 O ATOM 2265 CB ARG A 144 -15.353 -6.271 -5.133 1.00 0.54 C ATOM 2266 CG ARG A 144 -16.553 -5.482 -5.647 1.00 0.77 C ATOM 2267 CD ARG A 144 -17.818 -5.766 -4.848 1.00 0.88 C ATOM 2268 NE ARG A 144 -18.227 -7.164 -4.947 1.00 1.47 N ATOM 2269 CZ ARG A 144 -19.312 -7.660 -4.358 1.00 2.12 C ATOM 2270 NH1 ARG A 144 -20.099 -6.872 -3.638 1.00 2.68 N ATOM 2271 NH2 ARG A 144 -19.612 -8.943 -4.492 1.00 2.83 N ATOM 0 H ARG A 144 -13.394 -7.320 -3.971 1.00 0.39 H new ATOM 0 HA ARG A 144 -14.652 -4.695 -3.854 1.00 0.47 H new ATOM 0 HB2 ARG A 144 -14.560 -6.230 -5.879 1.00 0.54 H new ATOM 0 HB3 ARG A 144 -15.639 -7.318 -5.029 1.00 0.54 H new ATOM 0 HG2 ARG A 144 -16.330 -4.416 -5.603 1.00 0.77 H new ATOM 0 HG3 ARG A 144 -16.725 -5.728 -6.695 1.00 0.77 H new ATOM 0 HD2 ARG A 144 -17.650 -5.511 -3.802 1.00 0.88 H new ATOM 0 HD3 ARG A 144 -18.624 -5.126 -5.207 1.00 0.88 H new ATOM 0 HE ARG A 144 -17.648 -7.797 -5.499 1.00 1.47 H new ATOM 0 HH11 ARG A 144 -19.873 -5.883 -3.535 1.00 2.68 H new ATOM 0 HH12 ARG A 144 -20.930 -7.255 -3.188 1.00 2.68 H new ATOM 0 HH21 ARG A 144 -19.011 -9.552 -5.047 1.00 2.83 H new ATOM 0 HH22 ARG A 144 -20.444 -9.322 -4.040 1.00 2.83 H new ATOM 2285 N GLN A 145 -15.863 -7.343 -2.282 1.00 0.47 N ATOM 2286 CA GLN A 145 -16.756 -7.766 -1.209 1.00 0.52 C ATOM 2287 C GLN A 145 -16.453 -7.004 0.077 1.00 0.48 C ATOM 2288 O GLN A 145 -17.359 -6.682 0.844 1.00 0.56 O ATOM 2289 CB GLN A 145 -16.634 -9.281 -0.990 1.00 0.57 C ATOM 2290 CG GLN A 145 -17.410 -9.805 0.211 1.00 0.64 C ATOM 2291 CD GLN A 145 -16.659 -9.647 1.523 1.00 0.60 C ATOM 2292 OE1 GLN A 145 -17.198 -9.924 2.595 1.00 0.67 O ATOM 2293 NE2 GLN A 145 -15.404 -9.213 1.448 1.00 0.52 N ATOM 0 H GLN A 145 -15.325 -8.100 -2.704 1.00 0.47 H new ATOM 0 HA GLN A 145 -17.782 -7.539 -1.497 1.00 0.52 H new ATOM 0 HB2 GLN A 145 -16.983 -9.795 -1.886 1.00 0.57 H new ATOM 0 HB3 GLN A 145 -15.581 -9.535 -0.866 1.00 0.57 H new ATOM 0 HG2 GLN A 145 -18.362 -9.278 0.279 1.00 0.64 H new ATOM 0 HG3 GLN A 145 -17.640 -10.859 0.056 1.00 0.64 H new ATOM 0 HE21 GLN A 145 -14.993 -8.994 0.540 1.00 0.52 H new ATOM 0 HE22 GLN A 145 -14.852 -9.099 2.298 1.00 0.52 H new ATOM 2302 N ILE A 146 -15.175 -6.712 0.303 1.00 0.40 N ATOM 2303 CA ILE A 146 -14.765 -5.978 1.493 1.00 0.40 C ATOM 2304 C ILE A 146 -15.312 -4.555 1.455 1.00 0.43 C ATOM 2305 O ILE A 146 -15.752 -4.020 2.472 1.00 0.53 O ATOM 2306 CB ILE A 146 -13.229 -5.932 1.637 1.00 0.42 C ATOM 2307 CG1 ILE A 146 -12.662 -7.349 1.739 1.00 0.43 C ATOM 2308 CG2 ILE A 146 -12.837 -5.111 2.857 1.00 0.50 C ATOM 2309 CD1 ILE A 146 -11.149 -7.398 1.799 1.00 0.78 C ATOM 0 H ILE A 146 -14.410 -6.972 -0.320 1.00 0.40 H new ATOM 0 HA ILE A 146 -15.174 -6.506 2.354 1.00 0.40 H new ATOM 0 HB ILE A 146 -12.809 -5.456 0.751 1.00 0.42 H new ATOM 0 HG12 ILE A 146 -13.068 -7.830 2.629 1.00 0.43 H new ATOM 0 HG13 ILE A 146 -13.002 -7.929 0.881 1.00 0.43 H new ATOM 0 HG21 ILE A 146 -11.751 -5.087 2.946 1.00 0.50 H new ATOM 0 HG22 ILE A 146 -13.214 -4.094 2.748 1.00 0.50 H new ATOM 0 HG23 ILE A 146 -13.265 -5.563 3.752 1.00 0.50 H new ATOM 0 HD11 ILE A 146 -10.821 -8.435 1.870 1.00 0.78 H new ATOM 0 HD12 ILE A 146 -10.734 -6.948 0.897 1.00 0.78 H new ATOM 0 HD13 ILE A 146 -10.801 -6.847 2.673 1.00 0.78 H new ATOM 2321 N LEU A 147 -15.297 -3.954 0.266 1.00 0.42 N ATOM 2322 CA LEU A 147 -15.806 -2.601 0.088 1.00 0.50 C ATOM 2323 C LEU A 147 -17.330 -2.597 0.111 1.00 0.59 C ATOM 2324 O LEU A 147 -17.958 -1.548 0.236 1.00 0.72 O ATOM 2325 CB LEU A 147 -15.306 -2.008 -1.231 1.00 0.55 C ATOM 2326 CG LEU A 147 -13.864 -1.505 -1.207 1.00 0.61 C ATOM 2327 CD1 LEU A 147 -13.428 -1.082 -2.600 1.00 0.76 C ATOM 2328 CD2 LEU A 147 -13.729 -0.344 -0.233 1.00 0.62 C ATOM 0 H LEU A 147 -14.938 -4.385 -0.586 1.00 0.42 H new ATOM 0 HA LEU A 147 -15.438 -1.989 0.911 1.00 0.50 H new ATOM 0 HB2 LEU A 147 -15.398 -2.765 -2.010 1.00 0.55 H new ATOM 0 HB3 LEU A 147 -15.959 -1.181 -1.511 1.00 0.55 H new ATOM 0 HG LEU A 147 -13.216 -2.316 -0.874 1.00 0.61 H new ATOM 0 HD11 LEU A 147 -12.398 -0.726 -2.567 1.00 0.76 H new ATOM 0 HD12 LEU A 147 -13.496 -1.934 -3.277 1.00 0.76 H new ATOM 0 HD13 LEU A 147 -14.077 -0.282 -2.957 1.00 0.76 H new ATOM 0 HD21 LEU A 147 -12.697 0.006 -0.225 1.00 0.62 H new ATOM 0 HD22 LEU A 147 -14.385 0.469 -0.543 1.00 0.62 H new ATOM 0 HD23 LEU A 147 -14.008 -0.674 0.768 1.00 0.62 H new ATOM 2340 N HIS A 148 -17.922 -3.782 -0.011 1.00 0.59 N ATOM 2341 CA HIS A 148 -19.372 -3.917 -0.001 1.00 0.73 C ATOM 2342 C HIS A 148 -19.902 -3.744 1.420 1.00 0.79 C ATOM 2343 O HIS A 148 -20.903 -3.063 1.644 1.00 0.90 O ATOM 2344 CB HIS A 148 -19.781 -5.287 -0.556 1.00 0.77 C ATOM 2345 CG HIS A 148 -21.258 -5.452 -0.753 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -21.828 -6.625 -1.203 1.00 1.36 N ATOM 2347 CD2 HIS A 148 -22.287 -4.587 -0.567 1.00 1.58 C ATOM 2348 CE1 HIS A 148 -23.138 -6.476 -1.286 1.00 1.28 C ATOM 2349 NE2 HIS A 148 -23.442 -5.249 -0.905 1.00 1.34 N ATOM 0 H HIS A 148 -17.418 -4.662 -0.118 1.00 0.59 H new ATOM 0 HA HIS A 148 -19.803 -3.142 -0.635 1.00 0.73 H new ATOM 0 HB2 HIS A 148 -19.278 -5.445 -1.510 1.00 0.77 H new ATOM 0 HB3 HIS A 148 -19.427 -6.063 0.123 1.00 0.77 H new ATOM 0 HD2 HIS A 148 -22.212 -3.568 -0.218 1.00 1.58 H new ATOM 0 HE1 HIS A 148 -23.841 -7.229 -1.610 1.00 1.28 H new ATOM 0 HE2 HIS A 148 -24.383 -4.856 -0.868 1.00 1.34 H new ATOM 2358 N THR A 149 -19.211 -4.358 2.374 1.00 0.77 N ATOM 2359 CA THR A 149 -19.596 -4.272 3.777 1.00 0.88 C ATOM 2360 C THR A 149 -19.111 -2.957 4.382 1.00 0.86 C ATOM 2361 O THR A 149 -19.846 -2.290 5.112 1.00 0.94 O ATOM 2362 CB THR A 149 -19.018 -5.456 4.556 1.00 0.90 C ATOM 2363 OG1 THR A 149 -19.516 -6.680 4.044 1.00 1.10 O ATOM 2364 CG2 THR A 149 -19.337 -5.415 6.035 1.00 1.18 C ATOM 0 H THR A 149 -18.379 -4.922 2.200 1.00 0.77 H new ATOM 0 HA THR A 149 -20.684 -4.305 3.842 1.00 0.88 H new ATOM 0 HB THR A 149 -17.937 -5.383 4.433 1.00 0.90 H new ATOM 0 HG1 THR A 149 -19.135 -7.426 4.552 1.00 1.10 H new ATOM 0 HG21 THR A 149 -18.897 -6.283 6.526 1.00 1.18 H new ATOM 0 HG22 THR A 149 -18.926 -4.504 6.471 1.00 1.18 H new ATOM 0 HG23 THR A 149 -20.418 -5.428 6.175 1.00 1.18 H new ATOM 2372 N ARG A 150 -17.874 -2.591 4.068 1.00 0.86 N ATOM 2373 CA ARG A 150 -17.286 -1.354 4.573 1.00 0.93 C ATOM 2374 C ARG A 150 -17.837 -0.141 3.830 1.00 0.95 C ATOM 2375 O ARG A 150 -18.430 0.752 4.437 1.00 1.05 O ATOM 2376 CB ARG A 150 -15.761 -1.397 4.437 1.00 0.99 C ATOM 2377 CG ARG A 150 -15.096 -2.440 5.322 1.00 0.96 C ATOM 2378 CD ARG A 150 -15.280 -2.117 6.797 1.00 1.26 C ATOM 2379 NE ARG A 150 -14.774 -3.184 7.659 1.00 2.01 N ATOM 2380 CZ ARG A 150 -14.781 -3.125 8.987 1.00 2.55 C ATOM 2381 NH1 ARG A 150 -15.265 -2.054 9.606 1.00 2.55 N ATOM 2382 NH2 ARG A 150 -14.305 -4.138 9.701 1.00 3.55 N ATOM 0 H ARG A 150 -17.256 -3.134 3.465 1.00 0.86 H new ATOM 0 HA ARG A 150 -17.551 -1.262 5.626 1.00 0.93 H new ATOM 0 HB2 ARG A 150 -15.504 -1.599 3.397 1.00 0.99 H new ATOM 0 HB3 ARG A 150 -15.356 -0.415 4.681 1.00 0.99 H new ATOM 0 HG2 ARG A 150 -15.517 -3.422 5.108 1.00 0.96 H new ATOM 0 HG3 ARG A 150 -14.032 -2.492 5.089 1.00 0.96 H new ATOM 0 HD2 ARG A 150 -14.764 -1.186 7.031 1.00 1.26 H new ATOM 0 HD3 ARG A 150 -16.338 -1.955 7.003 1.00 1.26 H new ATOM 0 HE ARG A 150 -14.394 -4.021 7.216 1.00 2.01 H new ATOM 0 HH11 ARG A 150 -15.633 -1.273 9.062 1.00 2.55 H new ATOM 0 HH12 ARG A 150 -15.269 -2.012 10.625 1.00 2.55 H new ATOM 0 HH21 ARG A 150 -13.933 -4.963 9.231 1.00 3.55 H new ATOM 0 HH22 ARG A 150 -14.311 -4.091 10.720 1.00 3.55 H new ATOM 2396 N ALA A 151 -17.633 -0.117 2.515 1.00 0.94 N ATOM 2397 CA ALA A 151 -18.099 0.988 1.681 1.00 1.04 C ATOM 2398 C ALA A 151 -17.381 2.282 2.047 1.00 1.11 C ATOM 2399 O ALA A 151 -18.013 3.271 2.421 1.00 1.59 O ATOM 2400 CB ALA A 151 -19.608 1.156 1.808 1.00 1.61 C ATOM 0 H ALA A 151 -17.146 -0.853 2.003 1.00 0.94 H new ATOM 0 HA ALA A 151 -17.866 0.753 0.642 1.00 1.04 H new ATOM 0 HB1 ALA A 151 -19.936 1.984 1.179 1.00 1.61 H new ATOM 0 HB2 ALA A 151 -20.104 0.239 1.489 1.00 1.61 H new ATOM 0 HB3 ALA A 151 -19.865 1.365 2.847 1.00 1.61 H new ATOM 2406 N PHE A 152 -16.055 2.268 1.940 1.00 1.09 N ATOM 2407 CA PHE A 152 -15.252 3.434 2.261 1.00 1.61 C ATOM 2408 C PHE A 152 -14.698 4.087 0.998 1.00 1.38 C ATOM 2409 O PHE A 152 -13.486 4.182 0.813 1.00 1.90 O ATOM 2410 CB PHE A 152 -14.109 3.055 3.212 1.00 2.51 C ATOM 2411 CG PHE A 152 -14.551 2.764 4.625 1.00 3.40 C ATOM 2412 CD1 PHE A 152 -15.678 1.996 4.865 1.00 3.42 C ATOM 2413 CD2 PHE A 152 -13.844 3.256 5.712 1.00 4.44 C ATOM 2414 CE1 PHE A 152 -16.093 1.724 6.155 1.00 4.40 C ATOM 2415 CE2 PHE A 152 -14.255 2.989 7.005 1.00 5.41 C ATOM 2416 CZ PHE A 152 -15.352 2.239 7.239 1.00 5.37 C ATOM 0 H PHE A 152 -15.517 1.458 1.632 1.00 1.09 H new ATOM 0 HA PHE A 152 -15.897 4.157 2.760 1.00 1.61 H new ATOM 0 HB2 PHE A 152 -13.597 2.178 2.816 1.00 2.51 H new ATOM 0 HB3 PHE A 152 -13.382 3.867 3.231 1.00 2.51 H new ATOM 0 HD1 PHE A 152 -16.241 1.604 4.031 1.00 3.42 H new ATOM 0 HD2 PHE A 152 -12.961 3.855 5.546 1.00 4.44 H new ATOM 0 HE1 PHE A 152 -16.974 1.124 6.331 1.00 4.40 H new ATOM 0 HE2 PHE A 152 -13.692 3.385 7.837 1.00 5.41 H new ATOM 0 HZ PHE A 152 -15.662 2.034 8.253 1.00 5.37 H new ATOM 2426 N ASP A 153 -15.605 4.559 0.144 1.00 1.04 N ATOM 2427 CA ASP A 153 -15.229 5.240 -1.093 1.00 1.18 C ATOM 2428 C ASP A 153 -14.634 6.608 -0.775 1.00 1.01 C ATOM 2429 O ASP A 153 -14.515 7.473 -1.641 1.00 1.40 O ATOM 2430 CB ASP A 153 -16.447 5.410 -1.998 1.00 1.46 C ATOM 2431 CG ASP A 153 -17.616 6.065 -1.286 1.00 2.05 C ATOM 2432 OD1 ASP A 153 -18.118 5.481 -0.303 1.00 2.54 O ATOM 2433 OD2 ASP A 153 -18.025 7.166 -1.712 1.00 2.52 O ATOM 0 H ASP A 153 -16.612 4.481 0.288 1.00 1.04 H new ATOM 0 HA ASP A 153 -14.485 4.634 -1.610 1.00 1.18 H new ATOM 0 HB2 ASP A 153 -16.171 6.012 -2.864 1.00 1.46 H new ATOM 0 HB3 ASP A 153 -16.755 4.434 -2.373 1.00 1.46 H new ATOM 2438 N LYS A 154 -14.288 6.776 0.491 1.00 0.68 N ATOM 2439 CA LYS A 154 -13.719 8.002 1.021 1.00 0.59 C ATOM 2440 C LYS A 154 -12.433 8.415 0.306 1.00 0.52 C ATOM 2441 O LYS A 154 -12.223 8.113 -0.867 1.00 0.67 O ATOM 2442 CB LYS A 154 -13.423 7.765 2.497 1.00 0.63 C ATOM 2443 CG LYS A 154 -14.602 7.195 3.262 1.00 0.79 C ATOM 2444 CD LYS A 154 -14.390 7.286 4.768 1.00 0.93 C ATOM 2445 CE LYS A 154 -13.161 6.505 5.216 1.00 0.94 C ATOM 2446 NZ LYS A 154 -12.909 6.659 6.675 1.00 1.77 N ATOM 0 H LYS A 154 -14.398 6.046 1.194 1.00 0.68 H new ATOM 0 HA LYS A 154 -14.433 8.812 0.871 1.00 0.59 H new ATOM 0 HB2 LYS A 154 -12.577 7.083 2.586 1.00 0.63 H new ATOM 0 HB3 LYS A 154 -13.122 8.707 2.956 1.00 0.63 H new ATOM 0 HG2 LYS A 154 -15.509 7.734 2.988 1.00 0.79 H new ATOM 0 HG3 LYS A 154 -14.752 6.154 2.977 1.00 0.79 H new ATOM 0 HD2 LYS A 154 -14.281 8.331 5.057 1.00 0.93 H new ATOM 0 HD3 LYS A 154 -15.271 6.903 5.283 1.00 0.93 H new ATOM 0 HE2 LYS A 154 -13.295 5.449 4.980 1.00 0.94 H new ATOM 0 HE3 LYS A 154 -12.289 6.848 4.659 1.00 0.94 H new ATOM 0 HZ1 LYS A 154 -11.889 6.582 6.861 1.00 1.77 H new ATOM 0 HZ2 LYS A 154 -13.249 7.590 6.990 1.00 1.77 H new ATOM 0 HZ3 LYS A 154 -13.413 5.912 7.195 1.00 1.77 H new ATOM 2460 N LEU A 155 -11.568 9.100 1.052 1.00 0.55 N ATOM 2461 CA LEU A 155 -10.281 9.561 0.548 1.00 0.57 C ATOM 2462 C LEU A 155 -10.435 10.349 -0.747 1.00 0.51 C ATOM 2463 O LEU A 155 -10.270 9.805 -1.837 1.00 0.61 O ATOM 2464 CB LEU A 155 -9.330 8.380 0.327 1.00 0.67 C ATOM 2465 CG LEU A 155 -9.209 7.391 1.498 1.00 0.81 C ATOM 2466 CD1 LEU A 155 -9.037 8.119 2.820 1.00 1.81 C ATOM 2467 CD2 LEU A 155 -10.417 6.473 1.552 1.00 1.95 C ATOM 0 H LEU A 155 -11.743 9.350 2.025 1.00 0.55 H new ATOM 0 HA LEU A 155 -9.858 10.224 1.302 1.00 0.57 H new ATOM 0 HB2 LEU A 155 -9.661 7.831 -0.555 1.00 0.67 H new ATOM 0 HB3 LEU A 155 -8.338 8.773 0.104 1.00 0.67 H new ATOM 0 HG LEU A 155 -8.319 6.785 1.329 1.00 0.81 H new ATOM 0 HD11 LEU A 155 -8.954 7.392 3.628 1.00 1.81 H new ATOM 0 HD12 LEU A 155 -8.133 8.727 2.786 1.00 1.81 H new ATOM 0 HD13 LEU A 155 -9.900 8.761 2.997 1.00 1.81 H new ATOM 0 HD21 LEU A 155 -10.311 5.781 2.388 1.00 1.95 H new ATOM 0 HD22 LEU A 155 -11.320 7.068 1.686 1.00 1.95 H new ATOM 0 HD23 LEU A 155 -10.488 5.910 0.621 1.00 1.95 H new ATOM 2479 N ASN A 156 -10.732 11.636 -0.617 1.00 0.54 N ATOM 2480 CA ASN A 156 -10.882 12.501 -1.781 1.00 0.54 C ATOM 2481 C ASN A 156 -9.565 12.560 -2.548 1.00 0.53 C ATOM 2482 O ASN A 156 -8.537 12.116 -2.046 1.00 0.75 O ATOM 2483 CB ASN A 156 -11.297 13.908 -1.346 1.00 0.63 C ATOM 2484 CG ASN A 156 -10.231 14.599 -0.515 1.00 1.07 C ATOM 2485 OD1 ASN A 156 -9.130 14.868 -0.998 1.00 2.09 O ATOM 2486 ND2 ASN A 156 -10.549 14.884 0.742 1.00 1.34 N ATOM 0 H ASN A 156 -10.873 12.103 0.279 1.00 0.54 H new ATOM 0 HA ASN A 156 -11.658 12.093 -2.429 1.00 0.54 H new ATOM 0 HB2 ASN A 156 -11.511 14.510 -2.230 1.00 0.63 H new ATOM 0 HB3 ASN A 156 -12.220 13.849 -0.770 1.00 0.63 H new ATOM 0 HD21 ASN A 156 -9.870 15.344 1.348 1.00 1.34 H new ATOM 0 HD22 ASN A 156 -11.473 14.643 1.101 1.00 1.34 H new ATOM 2493 N LYS A 157 -9.591 13.107 -3.759 1.00 0.46 N ATOM 2494 CA LYS A 157 -8.382 13.213 -4.565 1.00 0.46 C ATOM 2495 C LYS A 157 -7.613 14.490 -4.246 1.00 0.48 C ATOM 2496 O LYS A 157 -8.206 15.524 -3.940 1.00 0.64 O ATOM 2497 CB LYS A 157 -8.724 13.163 -6.055 1.00 0.54 C ATOM 2498 CG LYS A 157 -9.160 11.787 -6.529 1.00 0.60 C ATOM 2499 CD LYS A 157 -9.494 11.781 -8.014 1.00 1.33 C ATOM 2500 CE LYS A 157 -10.679 12.683 -8.325 1.00 1.77 C ATOM 2501 NZ LYS A 157 -11.006 12.688 -9.778 1.00 2.30 N ATOM 0 H LYS A 157 -10.431 13.481 -4.201 1.00 0.46 H new ATOM 0 HA LYS A 157 -7.745 12.363 -4.319 1.00 0.46 H new ATOM 0 HB2 LYS A 157 -9.519 13.879 -6.262 1.00 0.54 H new ATOM 0 HB3 LYS A 157 -7.854 13.478 -6.631 1.00 0.54 H new ATOM 0 HG2 LYS A 157 -8.366 11.066 -6.332 1.00 0.60 H new ATOM 0 HG3 LYS A 157 -10.032 11.465 -5.959 1.00 0.60 H new ATOM 0 HD2 LYS A 157 -8.626 12.111 -8.584 1.00 1.33 H new ATOM 0 HD3 LYS A 157 -9.717 10.763 -8.333 1.00 1.33 H new ATOM 0 HE2 LYS A 157 -11.548 12.349 -7.758 1.00 1.77 H new ATOM 0 HE3 LYS A 157 -10.457 13.699 -7.999 1.00 1.77 H new ATOM 0 HZ1 LYS A 157 -11.819 13.314 -9.949 1.00 2.30 H new ATOM 0 HZ2 LYS A 157 -10.185 13.031 -10.317 1.00 2.30 H new ATOM 0 HZ3 LYS A 157 -11.243 11.723 -10.084 1.00 2.30 H new ATOM 2515 N TRP A 158 -6.286 14.397 -4.321 1.00 0.45 N ATOM 2516 CA TRP A 158 -5.399 15.524 -4.047 1.00 0.54 C ATOM 2517 C TRP A 158 -5.970 16.827 -4.598 1.00 0.75 C ATOM 2518 O TRP A 158 -6.324 16.857 -5.797 1.00 1.21 O ATOM 2519 CB TRP A 158 -4.027 15.258 -4.668 1.00 0.62 C ATOM 2520 CG TRP A 158 -3.012 16.314 -4.361 1.00 0.71 C ATOM 2521 CD1 TRP A 158 -2.530 17.264 -5.214 1.00 0.98 C ATOM 2522 CD2 TRP A 158 -2.336 16.512 -3.116 1.00 0.72 C ATOM 2523 NE1 TRP A 158 -1.608 18.053 -4.571 1.00 1.04 N ATOM 2524 CE2 TRP A 158 -1.468 17.609 -3.283 1.00 0.89 C ATOM 2525 CE3 TRP A 158 -2.384 15.873 -1.875 1.00 0.81 C ATOM 2526 CZ2 TRP A 158 -0.657 18.078 -2.253 1.00 1.01 C ATOM 2527 CZ3 TRP A 158 -1.575 16.339 -0.854 1.00 1.03 C ATOM 2528 CH2 TRP A 158 -0.722 17.433 -1.050 1.00 1.07 C ATOM 2529 OXT TRP A 158 -6.061 17.806 -3.828 1.00 1.47 O ATOM 0 H TRP A 158 -5.797 13.538 -4.573 1.00 0.45 H new ATOM 0 HA TRP A 158 -5.303 15.628 -2.966 1.00 0.54 H new ATOM 0 HB2 TRP A 158 -3.657 14.297 -4.312 1.00 0.62 H new ATOM 0 HB3 TRP A 158 -4.137 15.176 -5.749 1.00 0.62 H new ATOM 0 HD1 TRP A 158 -2.830 17.379 -6.245 1.00 0.98 H new ATOM 0 HE1 TRP A 158 -1.109 18.841 -4.985 1.00 1.04 H new ATOM 0 HE3 TRP A 158 -3.041 15.031 -1.715 1.00 0.81 H new ATOM 0 HZ2 TRP A 158 0.001 18.922 -2.400 1.00 1.01 H new ATOM 0 HZ3 TRP A 158 -1.601 15.852 0.109 1.00 1.03 H new ATOM 0 HH2 TRP A 158 -0.103 17.774 -0.233 1.00 1.07 H new TER 2540 TRP A 158