USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 916 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 135 THR OG1 : rot 170:sc= 0.212 USER MOD Set 1.2: A 136 ASN : amide:sc= -1.46 K(o=-1.2,f=-0.41) USER MOD Set 2.1: A 91 THR OG1 : rot 70:sc= 1.25 USER MOD Set 2.2: A 112 TYR OH : rot 0:sc= 1.26 USER MOD Set 3.1: A 29 ASN : amide:sc= -0.157 K(o=0.88,f=-2.5!) USER MOD Set 3.2: A 30 THR OG1 : rot 25:sc= 1.04 USER MOD Single : A 22 ASN : amide:sc= -1.52 K(o=-1.5,f=-0.06) USER MOD Single : A 34 THR OG1 : rot -62:sc= 0.187 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 41 THR OG1 : rot 40:sc= 0.0419 USER MOD Single : A 42 TYR OH : rot 75:sc= 0.796 USER MOD Single : A 46 THR OG1 : rot 82:sc= 0.236 USER MOD Single : A 47 GLN : amide:sc= -1.22 K(o=-1.2,f=0) USER MOD Single : A 50 TYR OH : rot 150:sc= 0.308 USER MOD Single : A 51 LYS NZ :NH3+ -172:sc=-0.00739 (180deg=-0.0937) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -128:sc= 1.45 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 MET CE :methyl -113:sc= -0.82 (180deg=-1.28) USER MOD Single : A 68 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00721) USER MOD Single : A 75 ASN : amide:sc= -0.87 K(o=-0.87,f=-0.046) USER MOD Single : A 79 LYS NZ :NH3+ 151:sc= -1.17 (180deg=-2.6!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ -172:sc= 1.77 (180deg=1.59) USER MOD Single : A 87 HIS : no HD1:sc= -0.122 K(o=-0.12,f=-3.8!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 85:sc= -2.95! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.0168 X(o=-0.017,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 142:sc= -0.195 (180deg=-1.69!) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.12 USER MOD Single : A 115 ASN : amide:sc= 0.129 K(o=0.13,f=-7.1!) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.0349 X(o=-0.035,f=-0.2) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -80:sc= 1.16 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.313 -2.188 3.479 1.00 0.00 N ATOM 2 CA ASP A 20 29.621 -3.218 2.734 1.00 0.00 C ATOM 3 C ASP A 20 28.662 -3.929 3.664 1.00 0.00 C ATOM 4 O ASP A 20 29.041 -4.383 4.756 1.00 0.00 O ATOM 5 CB ASP A 20 30.581 -4.228 2.086 1.00 0.00 C ATOM 6 CG ASP A 20 31.668 -3.592 1.241 1.00 0.00 C ATOM 7 OD1 ASP A 20 31.380 -2.904 0.232 1.00 0.00 O ATOM 8 OD2 ASP A 20 32.852 -3.736 1.603 1.00 0.00 O ATOM 0 HA ASP A 20 29.080 -2.739 1.918 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.047 -4.825 2.870 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.005 -4.913 1.463 1.00 0.00 H new ATOM 13 N CYS A 21 27.442 -4.001 3.259 1.00 0.00 N ATOM 14 CA CYS A 21 26.387 -4.583 4.042 1.00 0.00 C ATOM 15 C CYS A 21 26.514 -6.083 4.036 1.00 0.00 C ATOM 16 O CYS A 21 26.715 -6.687 2.994 1.00 0.00 O ATOM 17 CB CYS A 21 25.040 -4.166 3.466 1.00 0.00 C ATOM 18 SG CYS A 21 24.811 -2.363 3.370 1.00 0.00 S ATOM 0 H CYS A 21 27.134 -3.650 2.352 1.00 0.00 H new ATOM 0 HA CYS A 21 26.460 -4.230 5.071 1.00 0.00 H new ATOM 0 HB2 CYS A 21 24.935 -4.590 2.467 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.245 -4.592 4.079 1.00 0.00 H new ATOM 23 N ASN A 22 26.417 -6.682 5.196 1.00 0.00 N ATOM 24 CA ASN A 22 26.519 -8.131 5.338 1.00 0.00 C ATOM 25 C ASN A 22 25.138 -8.716 5.515 1.00 0.00 C ATOM 26 O ASN A 22 24.940 -9.702 6.226 1.00 0.00 O ATOM 27 CB ASN A 22 27.405 -8.521 6.537 1.00 0.00 C ATOM 28 CG ASN A 22 28.905 -8.286 6.353 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.726 -9.059 6.849 1.00 0.00 O ATOM 30 ND2 ASN A 22 29.282 -7.221 5.697 1.00 0.00 N ATOM 0 H ASN A 22 26.265 -6.188 6.075 1.00 0.00 H new ATOM 0 HA ASN A 22 26.982 -8.530 4.435 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.072 -7.960 7.410 1.00 0.00 H new ATOM 0 HB3 ASN A 22 27.245 -9.577 6.756 1.00 0.00 H new ATOM 0 HD21 ASN A 22 30.275 -7.015 5.587 1.00 0.00 H new ATOM 0 HD22 ASN A 22 28.584 -6.596 5.295 1.00 0.00 H new ATOM 37 N GLU A 23 24.202 -8.136 4.830 1.00 0.00 N ATOM 38 CA GLU A 23 22.823 -8.513 4.918 1.00 0.00 C ATOM 39 C GLU A 23 22.095 -8.037 3.675 1.00 0.00 C ATOM 40 O GLU A 23 22.560 -7.106 2.988 1.00 0.00 O ATOM 41 CB GLU A 23 22.208 -7.862 6.153 1.00 0.00 C ATOM 42 CG GLU A 23 22.355 -6.357 6.146 1.00 0.00 C ATOM 43 CD GLU A 23 21.872 -5.718 7.399 1.00 0.00 C ATOM 44 OE1 GLU A 23 20.663 -5.496 7.545 1.00 0.00 O ATOM 45 OE2 GLU A 23 22.696 -5.412 8.272 1.00 0.00 O ATOM 0 H GLU A 23 24.378 -7.370 4.179 1.00 0.00 H new ATOM 0 HA GLU A 23 22.737 -9.597 4.995 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.151 -8.121 6.208 1.00 0.00 H new ATOM 0 HB3 GLU A 23 22.682 -8.266 7.047 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.404 -6.101 5.996 1.00 0.00 H new ATOM 0 HG3 GLU A 23 21.803 -5.948 5.300 1.00 0.00 H new ATOM 52 N LEU A 24 20.985 -8.665 3.396 1.00 0.00 N ATOM 53 CA LEU A 24 20.121 -8.283 2.304 1.00 0.00 C ATOM 54 C LEU A 24 19.264 -7.085 2.701 1.00 0.00 C ATOM 55 O LEU A 24 19.029 -6.864 3.905 1.00 0.00 O ATOM 56 CB LEU A 24 19.243 -9.476 1.877 1.00 0.00 C ATOM 57 CG LEU A 24 19.898 -10.528 0.959 1.00 0.00 C ATOM 58 CD1 LEU A 24 18.901 -11.596 0.583 1.00 0.00 C ATOM 59 CD2 LEU A 24 20.387 -9.841 -0.280 1.00 0.00 C ATOM 0 H LEU A 24 20.648 -9.468 3.926 1.00 0.00 H new ATOM 0 HA LEU A 24 20.735 -7.991 1.452 1.00 0.00 H new ATOM 0 HB2 LEU A 24 18.895 -9.981 2.778 1.00 0.00 H new ATOM 0 HB3 LEU A 24 18.361 -9.084 1.370 1.00 0.00 H new ATOM 0 HG LEU A 24 20.728 -11.001 1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 24 19.381 -12.330 -0.065 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.539 -12.090 1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 24 18.062 -11.141 0.057 1.00 0.00 H new ATOM 0 HD21 LEU A 24 20.854 -10.571 -0.941 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.546 -9.373 -0.792 1.00 0.00 H new ATOM 0 HD23 LEU A 24 21.117 -9.078 -0.009 1.00 0.00 H new ATOM 71 N PRO A 25 18.836 -6.262 1.712 1.00 0.00 N ATOM 72 CA PRO A 25 17.987 -5.106 1.967 1.00 0.00 C ATOM 73 C PRO A 25 16.675 -5.526 2.624 1.00 0.00 C ATOM 74 O PRO A 25 16.009 -6.465 2.160 1.00 0.00 O ATOM 75 CB PRO A 25 17.738 -4.505 0.575 1.00 0.00 C ATOM 76 CG PRO A 25 18.101 -5.577 -0.386 1.00 0.00 C ATOM 77 CD PRO A 25 19.156 -6.393 0.283 1.00 0.00 C ATOM 0 HA PRO A 25 18.448 -4.394 2.651 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.696 -4.207 0.456 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.345 -3.613 0.417 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.233 -6.189 -0.633 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.470 -5.154 -1.321 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.125 -7.433 -0.042 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.155 -6.019 0.059 1.00 0.00 H new ATOM 85 N PRO A 26 16.289 -4.846 3.701 1.00 0.00 N ATOM 86 CA PRO A 26 15.126 -5.219 4.482 1.00 0.00 C ATOM 87 C PRO A 26 13.813 -4.996 3.747 1.00 0.00 C ATOM 88 O PRO A 26 13.583 -3.946 3.145 1.00 0.00 O ATOM 89 CB PRO A 26 15.206 -4.309 5.707 1.00 0.00 C ATOM 90 CG PRO A 26 15.964 -3.116 5.244 1.00 0.00 C ATOM 91 CD PRO A 26 16.941 -3.626 4.226 1.00 0.00 C ATOM 0 HA PRO A 26 15.135 -6.283 4.717 1.00 0.00 H new ATOM 0 HB2 PRO A 26 14.213 -4.034 6.061 1.00 0.00 H new ATOM 0 HB3 PRO A 26 15.714 -4.804 6.535 1.00 0.00 H new ATOM 0 HG2 PRO A 26 15.296 -2.373 4.808 1.00 0.00 H new ATOM 0 HG3 PRO A 26 16.480 -2.633 6.074 1.00 0.00 H new ATOM 0 HD2 PRO A 26 17.117 -2.894 3.437 1.00 0.00 H new ATOM 0 HD3 PRO A 26 17.909 -3.850 4.675 1.00 0.00 H new ATOM 99 N ARG A 27 12.970 -5.985 3.783 1.00 0.00 N ATOM 100 CA ARG A 27 11.661 -5.861 3.233 1.00 0.00 C ATOM 101 C ARG A 27 10.835 -5.064 4.198 1.00 0.00 C ATOM 102 O ARG A 27 10.807 -5.350 5.405 1.00 0.00 O ATOM 103 CB ARG A 27 11.074 -7.222 2.933 1.00 0.00 C ATOM 104 CG ARG A 27 11.778 -7.889 1.772 1.00 0.00 C ATOM 105 CD ARG A 27 11.302 -9.296 1.545 1.00 0.00 C ATOM 106 NE ARG A 27 11.722 -10.206 2.622 1.00 0.00 N ATOM 107 CZ ARG A 27 12.572 -11.238 2.460 1.00 0.00 C ATOM 108 NH1 ARG A 27 13.250 -11.374 1.334 1.00 0.00 N ATOM 109 NH2 ARG A 27 12.786 -12.094 3.450 1.00 0.00 N ATOM 0 H ARG A 27 13.173 -6.896 4.194 1.00 0.00 H new ATOM 0 HA ARG A 27 11.685 -5.337 2.277 1.00 0.00 H new ATOM 0 HB2 ARG A 27 11.150 -7.855 3.817 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.013 -7.119 2.705 1.00 0.00 H new ATOM 0 HG2 ARG A 27 11.616 -7.303 0.867 1.00 0.00 H new ATOM 0 HG3 ARG A 27 12.852 -7.897 1.958 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.215 -9.302 1.470 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.689 -9.659 0.593 1.00 0.00 H new ATOM 0 HE ARG A 27 11.344 -10.044 3.555 1.00 0.00 H new ATOM 0 HH11 ARG A 27 13.131 -10.695 0.582 1.00 0.00 H new ATOM 0 HH12 ARG A 27 13.892 -12.158 1.217 1.00 0.00 H new ATOM 0 HH21 ARG A 27 12.305 -11.973 4.342 1.00 0.00 H new ATOM 0 HH22 ARG A 27 13.431 -12.873 3.320 1.00 0.00 H new ATOM 123 N ARG A 28 10.186 -4.067 3.699 1.00 0.00 N ATOM 124 CA ARG A 28 9.569 -3.092 4.557 1.00 0.00 C ATOM 125 C ARG A 28 8.081 -3.313 4.601 1.00 0.00 C ATOM 126 O ARG A 28 7.563 -4.195 3.906 1.00 0.00 O ATOM 127 CB ARG A 28 9.898 -1.660 4.083 1.00 0.00 C ATOM 128 CG ARG A 28 11.264 -1.534 3.402 1.00 0.00 C ATOM 129 CD ARG A 28 11.793 -0.111 3.389 1.00 0.00 C ATOM 130 NE ARG A 28 10.790 0.901 3.029 1.00 0.00 N ATOM 131 CZ ARG A 28 10.919 2.210 3.312 1.00 0.00 C ATOM 132 NH1 ARG A 28 12.010 2.647 3.941 1.00 0.00 N ATOM 133 NH2 ARG A 28 9.973 3.074 2.955 1.00 0.00 N ATOM 0 H ARG A 28 10.064 -3.899 2.700 1.00 0.00 H new ATOM 0 HA ARG A 28 9.968 -3.210 5.564 1.00 0.00 H new ATOM 0 HB2 ARG A 28 9.125 -1.330 3.389 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.866 -0.987 4.940 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.980 -2.177 3.915 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.187 -1.896 2.377 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.193 0.125 4.375 1.00 0.00 H new ATOM 0 HD3 ARG A 28 12.623 -0.050 2.685 1.00 0.00 H new ATOM 0 HE ARG A 28 9.950 0.594 2.538 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.744 1.990 4.206 1.00 0.00 H new ATOM 0 HH12 ARG A 28 12.111 3.639 4.157 1.00 0.00 H new ATOM 0 HH21 ARG A 28 9.142 2.746 2.463 1.00 0.00 H new ATOM 0 HH22 ARG A 28 10.078 4.065 3.173 1.00 0.00 H new ATOM 147 N ASN A 29 7.394 -2.510 5.383 1.00 0.00 N ATOM 148 CA ASN A 29 5.949 -2.624 5.563 1.00 0.00 C ATOM 149 C ASN A 29 5.205 -2.548 4.233 1.00 0.00 C ATOM 150 O ASN A 29 4.328 -3.367 3.953 1.00 0.00 O ATOM 151 CB ASN A 29 5.397 -1.559 6.548 1.00 0.00 C ATOM 152 CG ASN A 29 5.599 -0.109 6.102 1.00 0.00 C ATOM 153 OD1 ASN A 29 6.600 0.234 5.462 1.00 0.00 O ATOM 154 ND2 ASN A 29 4.647 0.732 6.410 1.00 0.00 N ATOM 0 H ASN A 29 7.817 -1.752 5.919 1.00 0.00 H new ATOM 0 HA ASN A 29 5.773 -3.608 5.998 1.00 0.00 H new ATOM 0 HB2 ASN A 29 4.331 -1.735 6.692 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.877 -1.697 7.517 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.715 1.708 6.121 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.836 0.412 6.939 1.00 0.00 H new ATOM 161 N THR A 30 5.585 -1.620 3.398 1.00 0.00 N ATOM 162 CA THR A 30 4.913 -1.425 2.140 1.00 0.00 C ATOM 163 C THR A 30 5.871 -1.487 0.978 1.00 0.00 C ATOM 164 O THR A 30 5.540 -1.084 -0.133 1.00 0.00 O ATOM 165 CB THR A 30 4.167 -0.088 2.154 1.00 0.00 C ATOM 166 OG1 THR A 30 5.029 0.937 2.690 1.00 0.00 O ATOM 167 CG2 THR A 30 2.917 -0.195 2.999 1.00 0.00 C ATOM 0 H THR A 30 6.363 -0.982 3.567 1.00 0.00 H new ATOM 0 HA THR A 30 4.197 -2.236 2.009 1.00 0.00 H new ATOM 0 HB THR A 30 3.881 0.170 1.134 1.00 0.00 H new ATOM 0 HG1 THR A 30 5.965 0.678 2.560 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.396 0.762 3.001 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.263 -0.963 2.586 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.190 -0.461 4.020 1.00 0.00 H new ATOM 175 N GLU A 31 7.023 -2.044 1.214 1.00 0.00 N ATOM 176 CA GLU A 31 8.029 -2.090 0.203 1.00 0.00 C ATOM 177 C GLU A 31 8.680 -3.446 0.120 1.00 0.00 C ATOM 178 O GLU A 31 9.040 -4.049 1.137 1.00 0.00 O ATOM 179 CB GLU A 31 9.092 -0.996 0.354 1.00 0.00 C ATOM 180 CG GLU A 31 8.621 0.438 0.123 1.00 0.00 C ATOM 181 CD GLU A 31 8.021 1.127 1.350 1.00 0.00 C ATOM 182 OE1 GLU A 31 7.723 0.458 2.350 1.00 0.00 O ATOM 183 OE2 GLU A 31 7.879 2.378 1.353 1.00 0.00 O ATOM 0 H GLU A 31 7.286 -2.473 2.101 1.00 0.00 H new ATOM 0 HA GLU A 31 7.505 -1.898 -0.733 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.511 -1.061 1.358 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.902 -1.207 -0.344 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.466 1.029 -0.230 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.877 0.436 -0.674 1.00 0.00 H new ATOM 190 N ILE A 32 8.821 -3.909 -1.090 1.00 0.00 N ATOM 191 CA ILE A 32 9.413 -5.220 -1.410 1.00 0.00 C ATOM 192 C ILE A 32 10.464 -4.935 -2.428 1.00 0.00 C ATOM 193 O ILE A 32 10.494 -3.864 -2.972 1.00 0.00 O ATOM 194 CB ILE A 32 8.330 -6.185 -2.015 1.00 0.00 C ATOM 195 CG1 ILE A 32 7.024 -6.112 -1.211 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.831 -7.634 -2.035 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.872 -6.871 -1.835 1.00 0.00 C ATOM 0 H ILE A 32 8.527 -3.388 -1.916 1.00 0.00 H new ATOM 0 HA ILE A 32 9.816 -5.707 -0.522 1.00 0.00 H new ATOM 0 HB ILE A 32 8.141 -5.861 -3.038 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.204 -6.504 -0.210 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.737 -5.066 -1.097 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.061 -8.279 -2.459 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.734 -7.699 -2.643 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.055 -7.956 -1.018 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.987 -6.770 -1.207 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.663 -6.465 -2.825 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.136 -7.925 -1.923 1.00 0.00 H new ATOM 209 N LEU A 33 11.307 -5.843 -2.671 1.00 0.00 N ATOM 210 CA LEU A 33 12.379 -5.614 -3.562 1.00 0.00 C ATOM 211 C LEU A 33 12.033 -5.977 -4.976 1.00 0.00 C ATOM 212 O LEU A 33 11.311 -6.947 -5.231 1.00 0.00 O ATOM 213 CB LEU A 33 13.576 -6.406 -3.138 1.00 0.00 C ATOM 214 CG LEU A 33 14.440 -5.883 -2.018 1.00 0.00 C ATOM 215 CD1 LEU A 33 14.998 -4.503 -2.282 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.804 -5.999 -0.678 1.00 0.00 C ATOM 0 H LEU A 33 11.283 -6.776 -2.261 1.00 0.00 H new ATOM 0 HA LEU A 33 12.596 -4.546 -3.529 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.229 -7.398 -2.850 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.213 -6.533 -4.013 1.00 0.00 H new ATOM 0 HG LEU A 33 15.302 -6.550 -1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.609 -4.190 -1.436 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.610 -4.524 -3.184 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.177 -3.798 -2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.480 -5.605 0.081 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.874 -5.431 -0.666 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.592 -7.047 -0.465 1.00 0.00 H new ATOM 228 N THR A 34 12.529 -5.192 -5.881 1.00 0.00 N ATOM 229 CA THR A 34 12.433 -5.507 -7.268 1.00 0.00 C ATOM 230 C THR A 34 13.754 -6.129 -7.649 1.00 0.00 C ATOM 231 O THR A 34 14.815 -5.567 -7.327 1.00 0.00 O ATOM 232 CB THR A 34 12.167 -4.254 -8.128 1.00 0.00 C ATOM 233 OG1 THR A 34 13.171 -3.258 -7.867 1.00 0.00 O ATOM 234 CG2 THR A 34 10.790 -3.675 -7.838 1.00 0.00 C ATOM 0 H THR A 34 13.011 -4.316 -5.677 1.00 0.00 H new ATOM 0 HA THR A 34 11.596 -6.182 -7.445 1.00 0.00 H new ATOM 0 HB THR A 34 12.206 -4.548 -9.177 1.00 0.00 H new ATOM 0 HG1 THR A 34 13.121 -2.981 -6.928 1.00 0.00 H new ATOM 0 HG21 THR A 34 10.628 -2.793 -8.458 1.00 0.00 H new ATOM 0 HG22 THR A 34 10.027 -4.421 -8.062 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.727 -3.396 -6.786 1.00 0.00 H new ATOM 242 N GLY A 35 13.715 -7.267 -8.255 1.00 0.00 N ATOM 243 CA GLY A 35 14.921 -7.947 -8.572 1.00 0.00 C ATOM 244 C GLY A 35 14.971 -9.249 -7.852 1.00 0.00 C ATOM 245 O GLY A 35 13.954 -9.718 -7.335 1.00 0.00 O ATOM 0 H GLY A 35 12.860 -7.745 -8.540 1.00 0.00 H new ATOM 0 HA2 GLY A 35 14.983 -8.113 -9.647 1.00 0.00 H new ATOM 0 HA3 GLY A 35 15.778 -7.334 -8.294 1.00 0.00 H new ATOM 249 N SER A 36 16.108 -9.838 -7.806 1.00 0.00 N ATOM 250 CA SER A 36 16.291 -11.065 -7.107 1.00 0.00 C ATOM 251 C SER A 36 17.508 -10.938 -6.218 1.00 0.00 C ATOM 252 O SER A 36 18.577 -10.579 -6.684 1.00 0.00 O ATOM 253 CB SER A 36 16.446 -12.212 -8.098 1.00 0.00 C ATOM 254 OG SER A 36 15.289 -12.316 -8.935 1.00 0.00 O ATOM 0 H SER A 36 16.951 -9.482 -8.256 1.00 0.00 H new ATOM 0 HA SER A 36 15.420 -11.281 -6.488 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.332 -12.052 -8.712 1.00 0.00 H new ATOM 0 HB3 SER A 36 16.597 -13.147 -7.559 1.00 0.00 H new ATOM 0 HG SER A 36 15.407 -13.057 -9.566 1.00 0.00 H new ATOM 260 N TRP A 37 17.335 -11.184 -4.952 1.00 0.00 N ATOM 261 CA TRP A 37 18.415 -11.067 -4.005 1.00 0.00 C ATOM 262 C TRP A 37 18.596 -12.389 -3.306 1.00 0.00 C ATOM 263 O TRP A 37 17.647 -12.902 -2.701 1.00 0.00 O ATOM 264 CB TRP A 37 18.098 -10.018 -2.949 1.00 0.00 C ATOM 265 CG TRP A 37 17.790 -8.639 -3.448 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.568 -8.156 -3.758 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.713 -7.562 -3.662 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.654 -6.849 -4.143 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.962 -6.457 -4.102 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.093 -7.421 -3.524 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.544 -5.228 -4.405 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.672 -6.202 -3.825 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.899 -5.120 -4.260 1.00 0.00 C ATOM 0 H TRP A 37 16.445 -11.471 -4.544 1.00 0.00 H new ATOM 0 HA TRP A 37 19.317 -10.777 -4.544 1.00 0.00 H new ATOM 0 HB2 TRP A 37 17.246 -10.368 -2.365 1.00 0.00 H new ATOM 0 HB3 TRP A 37 18.946 -9.953 -2.267 1.00 0.00 H new ATOM 0 HD1 TRP A 37 15.651 -8.724 -3.708 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.868 -6.260 -4.417 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.699 -8.249 -3.188 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.948 -4.393 -4.741 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.741 -6.083 -3.722 1.00 0.00 H new ATOM 0 HH2 TRP A 37 20.382 -4.181 -4.486 1.00 0.00 H new ATOM 284 N SER A 38 19.768 -12.959 -3.404 1.00 0.00 N ATOM 285 CA SER A 38 20.036 -14.218 -2.749 1.00 0.00 C ATOM 286 C SER A 38 21.369 -14.164 -1.991 1.00 0.00 C ATOM 287 O SER A 38 21.801 -15.157 -1.390 1.00 0.00 O ATOM 288 CB SER A 38 20.081 -15.323 -3.807 1.00 0.00 C ATOM 289 OG SER A 38 18.951 -15.236 -4.686 1.00 0.00 O ATOM 0 H SER A 38 20.553 -12.575 -3.930 1.00 0.00 H new ATOM 0 HA SER A 38 19.246 -14.423 -2.027 1.00 0.00 H new ATOM 0 HB2 SER A 38 21.002 -15.243 -4.384 1.00 0.00 H new ATOM 0 HB3 SER A 38 20.094 -16.298 -3.320 1.00 0.00 H new ATOM 0 HG SER A 38 19.001 -15.951 -5.355 1.00 0.00 H new ATOM 295 N ASP A 39 22.012 -13.002 -1.989 1.00 0.00 N ATOM 296 CA ASP A 39 23.340 -12.900 -1.389 1.00 0.00 C ATOM 297 C ASP A 39 23.302 -12.413 0.031 1.00 0.00 C ATOM 298 O ASP A 39 22.255 -12.376 0.660 1.00 0.00 O ATOM 299 CB ASP A 39 24.331 -12.071 -2.233 1.00 0.00 C ATOM 300 CG ASP A 39 24.645 -12.643 -3.592 1.00 0.00 C ATOM 301 OD1 ASP A 39 25.483 -13.574 -3.686 1.00 0.00 O ATOM 302 OD2 ASP A 39 24.086 -12.164 -4.597 1.00 0.00 O ATOM 0 H ASP A 39 21.648 -12.136 -2.385 1.00 0.00 H new ATOM 0 HA ASP A 39 23.717 -13.922 -1.373 1.00 0.00 H new ATOM 0 HB2 ASP A 39 23.924 -11.068 -2.363 1.00 0.00 H new ATOM 0 HB3 ASP A 39 25.262 -11.967 -1.675 1.00 0.00 H new ATOM 307 N GLN A 40 24.459 -12.106 0.546 1.00 0.00 N ATOM 308 CA GLN A 40 24.602 -11.640 1.884 1.00 0.00 C ATOM 309 C GLN A 40 25.356 -10.323 1.877 1.00 0.00 C ATOM 310 O GLN A 40 24.839 -9.306 2.295 1.00 0.00 O ATOM 311 CB GLN A 40 25.345 -12.688 2.714 1.00 0.00 C ATOM 312 CG GLN A 40 25.460 -12.354 4.186 1.00 0.00 C ATOM 313 CD GLN A 40 26.202 -13.418 4.954 1.00 0.00 C ATOM 314 OE1 GLN A 40 27.091 -14.087 4.428 1.00 0.00 O ATOM 315 NE2 GLN A 40 25.856 -13.589 6.187 1.00 0.00 N ATOM 0 H GLN A 40 25.339 -12.176 0.035 1.00 0.00 H new ATOM 0 HA GLN A 40 23.621 -11.479 2.331 1.00 0.00 H new ATOM 0 HB2 GLN A 40 24.834 -13.645 2.610 1.00 0.00 H new ATOM 0 HB3 GLN A 40 26.347 -12.815 2.304 1.00 0.00 H new ATOM 0 HG2 GLN A 40 25.974 -11.400 4.301 1.00 0.00 H new ATOM 0 HG3 GLN A 40 24.463 -12.232 4.608 1.00 0.00 H new ATOM 0 HE21 GLN A 40 25.115 -13.018 6.593 1.00 0.00 H new ATOM 0 HE22 GLN A 40 26.324 -14.295 6.755 1.00 0.00 H new ATOM 324 N THR A 41 26.553 -10.340 1.367 1.00 0.00 N ATOM 325 CA THR A 41 27.370 -9.167 1.371 1.00 0.00 C ATOM 326 C THR A 41 27.238 -8.375 0.081 1.00 0.00 C ATOM 327 O THR A 41 27.429 -8.912 -1.011 1.00 0.00 O ATOM 328 CB THR A 41 28.840 -9.531 1.643 1.00 0.00 C ATOM 329 OG1 THR A 41 29.286 -10.529 0.701 1.00 0.00 O ATOM 330 CG2 THR A 41 28.985 -10.078 3.053 1.00 0.00 C ATOM 0 H THR A 41 26.985 -11.160 0.941 1.00 0.00 H new ATOM 0 HA THR A 41 27.015 -8.526 2.178 1.00 0.00 H new ATOM 0 HB THR A 41 29.447 -8.632 1.534 1.00 0.00 H new ATOM 0 HG1 THR A 41 28.922 -10.327 -0.186 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.028 -10.334 3.239 1.00 0.00 H new ATOM 0 HG22 THR A 41 28.663 -9.324 3.771 1.00 0.00 H new ATOM 0 HG23 THR A 41 28.368 -10.970 3.163 1.00 0.00 H new ATOM 338 N TYR A 42 26.891 -7.123 0.213 1.00 0.00 N ATOM 339 CA TYR A 42 26.774 -6.229 -0.911 1.00 0.00 C ATOM 340 C TYR A 42 27.615 -5.004 -0.698 1.00 0.00 C ATOM 341 O TYR A 42 27.675 -4.479 0.414 1.00 0.00 O ATOM 342 CB TYR A 42 25.321 -5.854 -1.213 1.00 0.00 C ATOM 343 CG TYR A 42 24.569 -6.946 -1.918 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.614 -7.054 -3.302 1.00 0.00 C ATOM 345 CD2 TYR A 42 23.835 -7.873 -1.216 1.00 0.00 C ATOM 346 CE1 TYR A 42 23.938 -8.057 -3.963 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.162 -8.873 -1.865 1.00 0.00 C ATOM 348 CZ TYR A 42 23.213 -8.969 -3.231 1.00 0.00 C ATOM 349 OH TYR A 42 22.514 -9.981 -3.864 1.00 0.00 O ATOM 0 H TYR A 42 26.679 -6.689 1.112 1.00 0.00 H new ATOM 0 HA TYR A 42 27.146 -6.761 -1.786 1.00 0.00 H new ATOM 0 HB2 TYR A 42 24.812 -5.613 -0.280 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.304 -4.953 -1.827 1.00 0.00 H new ATOM 0 HD1 TYR A 42 25.189 -6.339 -3.871 1.00 0.00 H new ATOM 0 HD2 TYR A 42 23.789 -7.811 -0.139 1.00 0.00 H new ATOM 0 HE1 TYR A 42 23.977 -8.126 -5.040 1.00 0.00 H new ATOM 0 HE2 TYR A 42 22.588 -9.590 -1.297 1.00 0.00 H new ATOM 0 HH TYR A 42 23.141 -10.666 -4.176 1.00 0.00 H new ATOM 359 N PRO A 43 28.288 -4.545 -1.757 1.00 0.00 N ATOM 360 CA PRO A 43 29.190 -3.398 -1.695 1.00 0.00 C ATOM 361 C PRO A 43 28.486 -2.105 -1.285 1.00 0.00 C ATOM 362 O PRO A 43 27.321 -1.865 -1.670 1.00 0.00 O ATOM 363 CB PRO A 43 29.730 -3.279 -3.124 1.00 0.00 C ATOM 364 CG PRO A 43 28.752 -4.016 -3.970 1.00 0.00 C ATOM 365 CD PRO A 43 28.222 -5.115 -3.115 1.00 0.00 C ATOM 0 HA PRO A 43 29.964 -3.546 -0.942 1.00 0.00 H new ATOM 0 HB2 PRO A 43 29.809 -2.236 -3.430 1.00 0.00 H new ATOM 0 HB3 PRO A 43 30.727 -3.712 -3.206 1.00 0.00 H new ATOM 0 HG2 PRO A 43 27.949 -3.358 -4.303 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.231 -4.413 -4.865 1.00 0.00 H new ATOM 0 HD2 PRO A 43 27.202 -5.383 -3.390 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.824 -6.019 -3.202 1.00 0.00 H new ATOM 373 N GLU A 44 29.175 -1.294 -0.499 1.00 0.00 N ATOM 374 CA GLU A 44 28.652 -0.011 -0.069 1.00 0.00 C ATOM 375 C GLU A 44 28.420 0.849 -1.303 1.00 0.00 C ATOM 376 O GLU A 44 29.285 0.924 -2.190 1.00 0.00 O ATOM 377 CB GLU A 44 29.615 0.712 0.878 1.00 0.00 C ATOM 378 CG GLU A 44 28.946 1.859 1.612 1.00 0.00 C ATOM 379 CD GLU A 44 29.888 2.761 2.355 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.655 3.500 1.700 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.809 2.809 3.582 1.00 0.00 O ATOM 0 H GLU A 44 30.107 -1.506 -0.144 1.00 0.00 H new ATOM 0 HA GLU A 44 27.722 -0.181 0.474 1.00 0.00 H new ATOM 0 HB2 GLU A 44 30.011 0.001 1.603 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.463 1.093 0.309 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.385 2.455 0.892 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.224 1.449 2.318 1.00 0.00 H new ATOM 388 N GLY A 45 27.273 1.468 -1.377 1.00 0.00 N ATOM 389 CA GLY A 45 26.922 2.231 -2.543 1.00 0.00 C ATOM 390 C GLY A 45 25.940 1.480 -3.399 1.00 0.00 C ATOM 391 O GLY A 45 25.615 1.889 -4.507 1.00 0.00 O ATOM 0 H GLY A 45 26.565 1.459 -0.643 1.00 0.00 H new ATOM 0 HA2 GLY A 45 26.492 3.186 -2.242 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.819 2.453 -3.121 1.00 0.00 H new ATOM 395 N THR A 46 25.470 0.368 -2.890 1.00 0.00 N ATOM 396 CA THR A 46 24.499 -0.415 -3.613 1.00 0.00 C ATOM 397 C THR A 46 23.081 -0.013 -3.303 1.00 0.00 C ATOM 398 O THR A 46 22.632 -0.136 -2.173 1.00 0.00 O ATOM 399 CB THR A 46 24.723 -1.928 -3.454 1.00 0.00 C ATOM 400 OG1 THR A 46 25.997 -2.277 -4.002 1.00 0.00 O ATOM 401 CG2 THR A 46 23.617 -2.748 -4.111 1.00 0.00 C ATOM 0 H THR A 46 25.742 -0.013 -1.984 1.00 0.00 H new ATOM 0 HA THR A 46 24.658 -0.189 -4.667 1.00 0.00 H new ATOM 0 HB THR A 46 24.700 -2.163 -2.390 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.698 -2.093 -3.343 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.820 -3.810 -3.972 1.00 0.00 H new ATOM 0 HG22 THR A 46 22.659 -2.499 -3.655 1.00 0.00 H new ATOM 0 HG23 THR A 46 23.581 -2.522 -5.177 1.00 0.00 H new ATOM 409 N GLN A 47 22.397 0.493 -4.310 1.00 0.00 N ATOM 410 CA GLN A 47 21.060 0.935 -4.152 1.00 0.00 C ATOM 411 C GLN A 47 20.069 -0.191 -4.403 1.00 0.00 C ATOM 412 O GLN A 47 20.283 -1.066 -5.251 1.00 0.00 O ATOM 413 CB GLN A 47 20.790 2.148 -5.043 1.00 0.00 C ATOM 414 CG GLN A 47 20.831 1.877 -6.537 1.00 0.00 C ATOM 415 CD GLN A 47 20.785 3.150 -7.352 1.00 0.00 C ATOM 416 OE1 GLN A 47 21.314 3.211 -8.463 1.00 0.00 O ATOM 417 NE2 GLN A 47 20.198 4.180 -6.816 1.00 0.00 N ATOM 0 H GLN A 47 22.768 0.602 -5.254 1.00 0.00 H new ATOM 0 HA GLN A 47 20.921 1.247 -3.117 1.00 0.00 H new ATOM 0 HB2 GLN A 47 19.810 2.553 -4.790 1.00 0.00 H new ATOM 0 HB3 GLN A 47 21.523 2.920 -4.810 1.00 0.00 H new ATOM 0 HG2 GLN A 47 21.739 1.326 -6.779 1.00 0.00 H new ATOM 0 HG3 GLN A 47 19.989 1.241 -6.812 1.00 0.00 H new ATOM 0 HE21 GLN A 47 19.768 4.100 -5.894 1.00 0.00 H new ATOM 0 HE22 GLN A 47 20.167 5.068 -7.317 1.00 0.00 H new ATOM 426 N ALA A 48 19.017 -0.167 -3.652 1.00 0.00 N ATOM 427 CA ALA A 48 17.965 -1.125 -3.730 1.00 0.00 C ATOM 428 C ALA A 48 16.709 -0.418 -4.159 1.00 0.00 C ATOM 429 O ALA A 48 16.347 0.620 -3.589 1.00 0.00 O ATOM 430 CB ALA A 48 17.757 -1.794 -2.383 1.00 0.00 C ATOM 0 H ALA A 48 18.862 0.548 -2.941 1.00 0.00 H new ATOM 0 HA ALA A 48 18.223 -1.898 -4.454 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.950 -2.523 -2.459 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.675 -2.299 -2.082 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.496 -1.041 -1.639 1.00 0.00 H new ATOM 436 N ILE A 49 16.080 -0.941 -5.168 1.00 0.00 N ATOM 437 CA ILE A 49 14.866 -0.378 -5.690 1.00 0.00 C ATOM 438 C ILE A 49 13.693 -1.157 -5.110 1.00 0.00 C ATOM 439 O ILE A 49 13.687 -2.408 -5.128 1.00 0.00 O ATOM 440 CB ILE A 49 14.846 -0.473 -7.235 1.00 0.00 C ATOM 441 CG1 ILE A 49 16.120 0.173 -7.806 1.00 0.00 C ATOM 442 CG2 ILE A 49 13.604 0.228 -7.785 1.00 0.00 C ATOM 443 CD1 ILE A 49 16.303 -0.009 -9.302 1.00 0.00 C ATOM 0 H ILE A 49 16.396 -1.778 -5.658 1.00 0.00 H new ATOM 0 HA ILE A 49 14.798 0.674 -5.413 1.00 0.00 H new ATOM 0 HB ILE A 49 14.814 -1.521 -7.533 1.00 0.00 H new ATOM 0 HG12 ILE A 49 16.103 1.240 -7.582 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.986 -0.246 -7.293 1.00 0.00 H new ATOM 0 HG21 ILE A 49 13.598 0.157 -8.873 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.710 -0.249 -7.385 1.00 0.00 H new ATOM 0 HG23 ILE A 49 13.618 1.277 -7.490 1.00 0.00 H new ATOM 0 HD11 ILE A 49 17.226 0.478 -9.618 1.00 0.00 H new ATOM 0 HD12 ILE A 49 16.356 -1.072 -9.535 1.00 0.00 H new ATOM 0 HD13 ILE A 49 15.459 0.437 -9.829 1.00 0.00 H new ATOM 455 N TYR A 50 12.749 -0.452 -4.553 1.00 0.00 N ATOM 456 CA TYR A 50 11.614 -1.088 -3.942 1.00 0.00 C ATOM 457 C TYR A 50 10.331 -1.036 -4.767 1.00 0.00 C ATOM 458 O TYR A 50 10.163 -0.209 -5.689 1.00 0.00 O ATOM 459 CB TYR A 50 11.386 -0.566 -2.526 1.00 0.00 C ATOM 460 CG TYR A 50 12.391 -1.090 -1.527 1.00 0.00 C ATOM 461 CD1 TYR A 50 13.600 -0.457 -1.323 1.00 0.00 C ATOM 462 CD2 TYR A 50 12.136 -2.248 -0.812 1.00 0.00 C ATOM 463 CE1 TYR A 50 14.515 -0.959 -0.433 1.00 0.00 C ATOM 464 CE2 TYR A 50 13.041 -2.752 0.074 1.00 0.00 C ATOM 465 CZ TYR A 50 14.233 -2.103 0.265 1.00 0.00 C ATOM 466 OH TYR A 50 15.151 -2.605 1.148 1.00 0.00 O ATOM 0 H TYR A 50 12.742 0.567 -4.509 1.00 0.00 H new ATOM 0 HA TYR A 50 11.873 -2.146 -3.893 1.00 0.00 H new ATOM 0 HB2 TYR A 50 11.428 0.523 -2.536 1.00 0.00 H new ATOM 0 HB3 TYR A 50 10.383 -0.843 -2.201 1.00 0.00 H new ATOM 0 HD1 TYR A 50 13.829 0.445 -1.871 1.00 0.00 H new ATOM 0 HD2 TYR A 50 11.199 -2.764 -0.960 1.00 0.00 H new ATOM 0 HE1 TYR A 50 15.457 -0.453 -0.283 1.00 0.00 H new ATOM 0 HE2 TYR A 50 12.820 -3.656 0.622 1.00 0.00 H new ATOM 0 HH TYR A 50 14.686 -3.068 1.876 1.00 0.00 H new ATOM 476 N LYS A 51 9.472 -1.974 -4.438 1.00 0.00 N ATOM 477 CA LYS A 51 8.155 -2.152 -4.980 1.00 0.00 C ATOM 478 C LYS A 51 7.179 -1.703 -3.922 1.00 0.00 C ATOM 479 O LYS A 51 7.371 -2.008 -2.752 1.00 0.00 O ATOM 480 CB LYS A 51 7.900 -3.635 -5.265 1.00 0.00 C ATOM 481 CG LYS A 51 6.654 -3.866 -6.057 1.00 0.00 C ATOM 482 CD LYS A 51 6.409 -5.326 -6.335 1.00 0.00 C ATOM 483 CE LYS A 51 5.239 -5.508 -7.290 1.00 0.00 C ATOM 484 NZ LYS A 51 3.979 -4.908 -6.782 1.00 0.00 N ATOM 0 H LYS A 51 9.696 -2.679 -3.735 1.00 0.00 H new ATOM 0 HA LYS A 51 8.047 -1.586 -5.905 1.00 0.00 H new ATOM 0 HB2 LYS A 51 8.751 -4.048 -5.806 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.830 -4.175 -4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.802 -3.455 -5.516 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.722 -3.326 -7.001 1.00 0.00 H new ATOM 0 HD2 LYS A 51 7.306 -5.774 -6.763 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.206 -5.849 -5.401 1.00 0.00 H new ATOM 0 HE2 LYS A 51 5.488 -5.058 -8.251 1.00 0.00 H new ATOM 0 HE3 LYS A 51 5.083 -6.572 -7.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 3.191 -5.178 -7.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.794 -5.254 -5.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.069 -3.872 -6.767 1.00 0.00 H new ATOM 498 N CYS A 52 6.123 -1.077 -4.326 1.00 0.00 N ATOM 499 CA CYS A 52 5.183 -0.471 -3.402 1.00 0.00 C ATOM 500 C CYS A 52 3.995 -1.339 -3.075 1.00 0.00 C ATOM 501 O CYS A 52 2.901 -0.820 -2.900 1.00 0.00 O ATOM 502 CB CYS A 52 4.697 0.825 -3.975 1.00 0.00 C ATOM 503 SG CYS A 52 5.958 2.107 -3.988 1.00 0.00 S ATOM 0 H CYS A 52 5.874 -0.963 -5.309 1.00 0.00 H new ATOM 0 HA CYS A 52 5.724 -0.321 -2.468 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.348 0.657 -4.994 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.840 1.172 -3.398 1.00 0.00 H new ATOM 508 N ARG A 53 4.218 -2.645 -2.934 1.00 0.00 N ATOM 509 CA ARG A 53 3.140 -3.614 -2.601 1.00 0.00 C ATOM 510 C ARG A 53 2.056 -3.659 -3.696 1.00 0.00 C ATOM 511 O ARG A 53 1.993 -2.808 -4.585 1.00 0.00 O ATOM 512 CB ARG A 53 2.441 -3.215 -1.271 1.00 0.00 C ATOM 513 CG ARG A 53 3.251 -3.304 -0.003 1.00 0.00 C ATOM 514 CD ARG A 53 3.400 -4.709 0.464 1.00 0.00 C ATOM 515 NE ARG A 53 4.379 -4.864 1.536 1.00 0.00 N ATOM 516 CZ ARG A 53 4.971 -6.017 1.841 1.00 0.00 C ATOM 517 NH1 ARG A 53 4.508 -7.157 1.333 1.00 0.00 N ATOM 518 NH2 ARG A 53 5.983 -6.043 2.696 1.00 0.00 N ATOM 0 H ARG A 53 5.138 -3.072 -3.043 1.00 0.00 H new ATOM 0 HA ARG A 53 3.616 -4.591 -2.514 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.087 -2.189 -1.372 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.560 -3.846 -1.152 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.237 -2.871 -0.171 1.00 0.00 H new ATOM 0 HG3 ARG A 53 2.771 -2.712 0.776 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.433 -5.073 0.810 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.693 -5.335 -0.379 1.00 0.00 H new ATOM 0 HE ARG A 53 4.624 -4.040 2.084 1.00 0.00 H new ATOM 0 HH11 ARG A 53 3.700 -7.147 0.710 1.00 0.00 H new ATOM 0 HH12 ARG A 53 4.961 -8.041 1.566 1.00 0.00 H new ATOM 0 HH21 ARG A 53 6.312 -5.177 3.124 1.00 0.00 H new ATOM 0 HH22 ARG A 53 6.433 -6.929 2.927 1.00 0.00 H new ATOM 532 N PRO A 54 1.245 -4.688 -3.698 1.00 0.00 N ATOM 533 CA PRO A 54 0.064 -4.693 -4.483 1.00 0.00 C ATOM 534 C PRO A 54 -1.089 -4.091 -3.666 1.00 0.00 C ATOM 535 O PRO A 54 -1.656 -4.740 -2.771 1.00 0.00 O ATOM 536 CB PRO A 54 -0.160 -6.162 -4.816 1.00 0.00 C ATOM 537 CG PRO A 54 0.590 -6.938 -3.776 1.00 0.00 C ATOM 538 CD PRO A 54 1.451 -5.963 -3.001 1.00 0.00 C ATOM 0 HA PRO A 54 0.132 -4.096 -5.392 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.221 -6.409 -4.798 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.205 -6.396 -5.816 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.103 -7.450 -3.108 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.208 -7.705 -4.243 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.146 -5.902 -1.956 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.500 -6.260 -3.010 1.00 0.00 H new ATOM 546 N GLY A 55 -1.383 -2.839 -3.936 1.00 0.00 N ATOM 547 CA GLY A 55 -2.387 -2.131 -3.185 1.00 0.00 C ATOM 548 C GLY A 55 -1.949 -0.729 -2.809 1.00 0.00 C ATOM 549 O GLY A 55 -2.712 0.036 -2.230 1.00 0.00 O ATOM 0 H GLY A 55 -0.938 -2.292 -4.673 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.304 -2.077 -3.772 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.621 -2.691 -2.279 1.00 0.00 H new ATOM 553 N TYR A 56 -0.730 -0.373 -3.145 1.00 0.00 N ATOM 554 CA TYR A 56 -0.231 0.959 -2.850 1.00 0.00 C ATOM 555 C TYR A 56 0.389 1.546 -4.116 1.00 0.00 C ATOM 556 O TYR A 56 0.337 0.912 -5.178 1.00 0.00 O ATOM 557 CB TYR A 56 0.812 0.932 -1.716 1.00 0.00 C ATOM 558 CG TYR A 56 0.345 0.350 -0.393 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.234 -1.014 -0.227 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.066 1.157 0.690 1.00 0.00 C ATOM 561 CE1 TYR A 56 -0.145 -1.573 0.960 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.326 0.612 1.898 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.429 -0.759 2.027 1.00 0.00 C ATOM 564 OH TYR A 56 -0.811 -1.314 3.228 1.00 0.00 O ATOM 0 H TYR A 56 -0.065 -0.982 -3.621 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.064 1.578 -2.516 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.675 0.360 -2.057 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.155 1.952 -1.540 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.454 -1.662 -1.063 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.155 2.229 0.593 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.220 -2.646 1.058 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -0.551 1.255 2.736 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.974 -0.601 3.880 1.00 0.00 H new ATOM 574 N ARG A 57 0.934 2.739 -4.011 1.00 0.00 N ATOM 575 CA ARG A 57 1.580 3.429 -5.117 1.00 0.00 C ATOM 576 C ARG A 57 2.626 4.379 -4.573 1.00 0.00 C ATOM 577 O ARG A 57 2.856 4.429 -3.361 1.00 0.00 O ATOM 578 CB ARG A 57 0.572 4.234 -5.954 1.00 0.00 C ATOM 579 CG ARG A 57 -0.238 5.255 -5.159 1.00 0.00 C ATOM 580 CD ARG A 57 -1.016 6.191 -6.069 1.00 0.00 C ATOM 581 NE ARG A 57 -1.862 5.477 -7.031 1.00 0.00 N ATOM 582 CZ ARG A 57 -2.937 5.989 -7.637 1.00 0.00 C ATOM 583 NH1 ARG A 57 -3.327 7.229 -7.375 1.00 0.00 N ATOM 584 NH2 ARG A 57 -3.606 5.254 -8.508 1.00 0.00 N ATOM 0 H ARG A 57 0.943 3.270 -3.140 1.00 0.00 H new ATOM 0 HA ARG A 57 2.036 2.675 -5.758 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.110 4.754 -6.747 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.116 3.540 -6.437 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.930 4.734 -4.497 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.432 5.837 -4.526 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.639 6.846 -5.461 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.317 6.828 -6.610 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.610 4.514 -7.255 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.805 7.797 -6.708 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.149 7.614 -7.841 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.301 4.303 -8.714 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.428 5.638 -8.975 1.00 0.00 H new ATOM 598 N SER A 58 3.246 5.131 -5.450 1.00 0.00 N ATOM 599 CA SER A 58 4.218 6.105 -5.065 1.00 0.00 C ATOM 600 C SER A 58 4.426 7.097 -6.199 1.00 0.00 C ATOM 601 O SER A 58 3.984 6.854 -7.333 1.00 0.00 O ATOM 602 CB SER A 58 5.519 5.406 -4.707 1.00 0.00 C ATOM 603 OG SER A 58 5.954 4.568 -5.774 1.00 0.00 O ATOM 0 H SER A 58 3.084 5.078 -6.456 1.00 0.00 H new ATOM 0 HA SER A 58 3.867 6.654 -4.191 1.00 0.00 H new ATOM 0 HB2 SER A 58 6.286 6.148 -4.485 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.381 4.811 -3.804 1.00 0.00 H new ATOM 0 HG SER A 58 6.138 3.669 -5.430 1.00 0.00 H new ATOM 609 N LEU A 59 5.054 8.212 -5.887 1.00 0.00 N ATOM 610 CA LEU A 59 5.374 9.239 -6.872 1.00 0.00 C ATOM 611 C LEU A 59 6.776 9.010 -7.417 1.00 0.00 C ATOM 612 O LEU A 59 7.178 9.601 -8.415 1.00 0.00 O ATOM 613 CB LEU A 59 5.278 10.656 -6.260 1.00 0.00 C ATOM 614 CG LEU A 59 3.879 11.196 -5.879 1.00 0.00 C ATOM 615 CD1 LEU A 59 2.946 11.200 -7.073 1.00 0.00 C ATOM 616 CD2 LEU A 59 3.264 10.447 -4.699 1.00 0.00 C ATOM 0 H LEU A 59 5.360 8.438 -4.941 1.00 0.00 H new ATOM 0 HA LEU A 59 4.647 9.169 -7.681 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.897 10.674 -5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.723 11.355 -6.968 1.00 0.00 H new ATOM 0 HG LEU A 59 4.020 12.228 -5.557 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.972 11.585 -6.772 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.360 11.834 -7.857 1.00 0.00 H new ATOM 0 HD13 LEU A 59 2.834 10.184 -7.451 1.00 0.00 H new ATOM 0 HD21 LEU A 59 2.283 10.866 -4.473 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.158 9.392 -4.953 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.911 10.547 -3.827 1.00 0.00 H new ATOM 628 N GLY A 60 7.510 8.168 -6.735 1.00 0.00 N ATOM 629 CA GLY A 60 8.831 7.809 -7.119 1.00 0.00 C ATOM 630 C GLY A 60 9.215 6.575 -6.377 1.00 0.00 C ATOM 631 O GLY A 60 8.589 6.270 -5.354 1.00 0.00 O ATOM 0 H GLY A 60 7.190 7.709 -5.882 1.00 0.00 H new ATOM 0 HA2 GLY A 60 8.880 7.636 -8.194 1.00 0.00 H new ATOM 0 HA3 GLY A 60 9.525 8.619 -6.894 1.00 0.00 H new ATOM 635 N ASN A 61 10.212 5.871 -6.844 1.00 0.00 N ATOM 636 CA ASN A 61 10.599 4.621 -6.213 1.00 0.00 C ATOM 637 C ASN A 61 11.330 4.860 -4.931 1.00 0.00 C ATOM 638 O ASN A 61 12.101 5.817 -4.806 1.00 0.00 O ATOM 639 CB ASN A 61 11.471 3.740 -7.116 1.00 0.00 C ATOM 640 CG ASN A 61 10.758 3.211 -8.328 1.00 0.00 C ATOM 641 OD1 ASN A 61 10.774 3.824 -9.393 1.00 0.00 O ATOM 642 ND2 ASN A 61 10.143 2.066 -8.193 1.00 0.00 N ATOM 0 H ASN A 61 10.773 6.133 -7.654 1.00 0.00 H new ATOM 0 HA ASN A 61 9.665 4.095 -6.017 1.00 0.00 H new ATOM 0 HB2 ASN A 61 12.338 4.316 -7.440 1.00 0.00 H new ATOM 0 HB3 ASN A 61 11.847 2.899 -6.533 1.00 0.00 H new ATOM 0 HD21 ASN A 61 9.655 1.653 -8.987 1.00 0.00 H new ATOM 0 HD22 ASN A 61 10.151 1.586 -7.293 1.00 0.00 H new ATOM 649 N VAL A 62 11.076 4.005 -3.977 1.00 0.00 N ATOM 650 CA VAL A 62 11.783 4.037 -2.736 1.00 0.00 C ATOM 651 C VAL A 62 13.126 3.418 -2.987 1.00 0.00 C ATOM 652 O VAL A 62 13.230 2.218 -3.281 1.00 0.00 O ATOM 653 CB VAL A 62 11.045 3.252 -1.634 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.777 3.342 -0.299 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.633 3.748 -1.503 1.00 0.00 C ATOM 0 H VAL A 62 10.373 3.269 -4.043 1.00 0.00 H new ATOM 0 HA VAL A 62 11.868 5.066 -2.386 1.00 0.00 H new ATOM 0 HB VAL A 62 11.023 2.201 -1.923 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.229 2.777 0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.780 2.928 -0.405 1.00 0.00 H new ATOM 0 HG13 VAL A 62 11.846 4.385 0.008 1.00 0.00 H new ATOM 0 HG21 VAL A 62 9.121 3.186 -0.722 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.642 4.806 -1.243 1.00 0.00 H new ATOM 0 HG23 VAL A 62 9.110 3.612 -2.450 1.00 0.00 H new ATOM 665 N ILE A 63 14.123 4.231 -2.972 1.00 0.00 N ATOM 666 CA ILE A 63 15.440 3.780 -3.232 1.00 0.00 C ATOM 667 C ILE A 63 16.225 3.788 -1.950 1.00 0.00 C ATOM 668 O ILE A 63 16.297 4.813 -1.252 1.00 0.00 O ATOM 669 CB ILE A 63 16.154 4.671 -4.294 1.00 0.00 C ATOM 670 CG1 ILE A 63 15.341 4.740 -5.603 1.00 0.00 C ATOM 671 CG2 ILE A 63 17.565 4.162 -4.577 1.00 0.00 C ATOM 672 CD1 ILE A 63 15.089 3.399 -6.256 1.00 0.00 C ATOM 0 H ILE A 63 14.046 5.229 -2.778 1.00 0.00 H new ATOM 0 HA ILE A 63 15.383 2.768 -3.634 1.00 0.00 H new ATOM 0 HB ILE A 63 16.225 5.677 -3.881 1.00 0.00 H new ATOM 0 HG12 ILE A 63 14.382 5.215 -5.396 1.00 0.00 H new ATOM 0 HG13 ILE A 63 15.868 5.381 -6.310 1.00 0.00 H new ATOM 0 HG21 ILE A 63 18.040 4.801 -5.321 1.00 0.00 H new ATOM 0 HG22 ILE A 63 18.149 4.179 -3.657 1.00 0.00 H new ATOM 0 HG23 ILE A 63 17.514 3.141 -4.955 1.00 0.00 H new ATOM 0 HD11 ILE A 63 14.511 3.542 -7.169 1.00 0.00 H new ATOM 0 HD12 ILE A 63 16.041 2.928 -6.499 1.00 0.00 H new ATOM 0 HD13 ILE A 63 14.532 2.760 -5.571 1.00 0.00 H new ATOM 684 N MET A 64 16.758 2.663 -1.610 1.00 0.00 N ATOM 685 CA MET A 64 17.633 2.568 -0.466 1.00 0.00 C ATOM 686 C MET A 64 18.998 2.276 -0.957 1.00 0.00 C ATOM 687 O MET A 64 19.164 2.004 -2.124 1.00 0.00 O ATOM 688 CB MET A 64 17.179 1.527 0.558 1.00 0.00 C ATOM 689 CG MET A 64 15.892 1.912 1.259 1.00 0.00 C ATOM 690 SD MET A 64 15.308 0.694 2.462 1.00 0.00 S ATOM 691 CE MET A 64 16.677 0.665 3.614 1.00 0.00 C ATOM 0 H MET A 64 16.608 1.784 -2.105 1.00 0.00 H new ATOM 0 HA MET A 64 17.610 3.519 0.066 1.00 0.00 H new ATOM 0 HB2 MET A 64 17.042 0.568 0.058 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.964 1.389 1.301 1.00 0.00 H new ATOM 0 HG2 MET A 64 16.039 2.865 1.767 1.00 0.00 H new ATOM 0 HG3 MET A 64 15.116 2.067 0.510 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.171 -0.306 3.568 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.390 1.447 3.352 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.306 0.836 4.625 1.00 0.00 H new ATOM 701 N VAL A 65 19.961 2.369 -0.121 1.00 0.00 N ATOM 702 CA VAL A 65 21.309 2.096 -0.525 1.00 0.00 C ATOM 703 C VAL A 65 22.131 1.608 0.663 1.00 0.00 C ATOM 704 O VAL A 65 21.879 1.980 1.816 1.00 0.00 O ATOM 705 CB VAL A 65 21.976 3.344 -1.211 1.00 0.00 C ATOM 706 CG1 VAL A 65 22.255 4.422 -0.247 1.00 0.00 C ATOM 707 CG2 VAL A 65 23.241 3.012 -1.954 1.00 0.00 C ATOM 0 H VAL A 65 19.852 2.633 0.858 1.00 0.00 H new ATOM 0 HA VAL A 65 21.282 1.302 -1.272 1.00 0.00 H new ATOM 0 HB VAL A 65 21.239 3.687 -1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 65 22.715 5.263 -0.765 1.00 0.00 H new ATOM 0 HG12 VAL A 65 21.323 4.747 0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.934 4.055 0.523 1.00 0.00 H new ATOM 0 HG21 VAL A 65 23.648 3.918 -2.403 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.970 2.591 -1.261 1.00 0.00 H new ATOM 0 HG23 VAL A 65 23.023 2.286 -2.737 1.00 0.00 H new ATOM 717 N CYS A 66 23.028 0.728 0.372 1.00 0.00 N ATOM 718 CA CYS A 66 23.949 0.185 1.323 1.00 0.00 C ATOM 719 C CYS A 66 24.965 1.259 1.680 1.00 0.00 C ATOM 720 O CYS A 66 25.651 1.789 0.790 1.00 0.00 O ATOM 721 CB CYS A 66 24.646 -1.011 0.680 1.00 0.00 C ATOM 722 SG CYS A 66 25.867 -1.830 1.723 1.00 0.00 S ATOM 0 H CYS A 66 23.148 0.351 -0.568 1.00 0.00 H new ATOM 0 HA CYS A 66 23.437 -0.137 2.230 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.890 -1.741 0.390 1.00 0.00 H new ATOM 0 HB3 CYS A 66 25.136 -0.678 -0.235 1.00 0.00 H new ATOM 727 N ARG A 67 25.041 1.617 2.938 1.00 0.00 N ATOM 728 CA ARG A 67 25.950 2.637 3.378 1.00 0.00 C ATOM 729 C ARG A 67 26.330 2.385 4.822 1.00 0.00 C ATOM 730 O ARG A 67 25.456 2.344 5.693 1.00 0.00 O ATOM 731 CB ARG A 67 25.295 4.013 3.235 1.00 0.00 C ATOM 732 CG ARG A 67 26.231 5.181 3.476 1.00 0.00 C ATOM 733 CD ARG A 67 25.521 6.516 3.286 1.00 0.00 C ATOM 734 NE ARG A 67 24.913 6.653 1.948 1.00 0.00 N ATOM 735 CZ ARG A 67 25.419 7.367 0.924 1.00 0.00 C ATOM 736 NH1 ARG A 67 26.620 7.924 1.023 1.00 0.00 N ATOM 737 NH2 ARG A 67 24.708 7.515 -0.201 1.00 0.00 N ATOM 0 H ARG A 67 24.474 1.209 3.681 1.00 0.00 H new ATOM 0 HA ARG A 67 26.850 2.613 2.763 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.876 4.100 2.232 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.462 4.080 3.935 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.634 5.123 4.487 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.077 5.117 2.792 1.00 0.00 H new ATOM 0 HD2 ARG A 67 24.746 6.622 4.045 1.00 0.00 H new ATOM 0 HD3 ARG A 67 26.233 7.327 3.442 1.00 0.00 H new ATOM 0 HE ARG A 67 24.033 6.164 1.785 1.00 0.00 H new ATOM 0 HH11 ARG A 67 27.165 7.812 1.878 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.998 8.463 0.244 1.00 0.00 H new ATOM 0 HH21 ARG A 67 23.785 7.088 -0.281 1.00 0.00 H new ATOM 0 HH22 ARG A 67 25.089 8.055 -0.978 1.00 0.00 H new ATOM 751 N LYS A 68 27.625 2.202 5.066 1.00 0.00 N ATOM 752 CA LYS A 68 28.189 1.949 6.405 1.00 0.00 C ATOM 753 C LYS A 68 27.720 0.642 6.992 1.00 0.00 C ATOM 754 O LYS A 68 27.657 0.474 8.203 1.00 0.00 O ATOM 755 CB LYS A 68 27.905 3.104 7.346 1.00 0.00 C ATOM 756 CG LYS A 68 28.538 4.418 6.881 1.00 0.00 C ATOM 757 CD LYS A 68 30.056 4.272 6.759 1.00 0.00 C ATOM 758 CE LYS A 68 30.739 5.542 6.282 1.00 0.00 C ATOM 759 NZ LYS A 68 30.641 6.645 7.251 1.00 0.00 N ATOM 0 H LYS A 68 28.331 2.224 4.331 1.00 0.00 H new ATOM 0 HA LYS A 68 29.269 1.868 6.280 1.00 0.00 H new ATOM 0 HB2 LYS A 68 26.827 3.237 7.435 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.279 2.857 8.340 1.00 0.00 H new ATOM 0 HG2 LYS A 68 28.117 4.710 5.919 1.00 0.00 H new ATOM 0 HG3 LYS A 68 28.299 5.213 7.588 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.467 3.987 7.728 1.00 0.00 H new ATOM 0 HD3 LYS A 68 30.283 3.462 6.066 1.00 0.00 H new ATOM 0 HE2 LYS A 68 31.790 5.331 6.085 1.00 0.00 H new ATOM 0 HE3 LYS A 68 30.294 5.855 5.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 31.153 7.474 6.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 29.641 6.892 7.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 31.059 6.350 8.156 1.00 0.00 H new ATOM 773 N GLY A 69 27.414 -0.285 6.138 1.00 0.00 N ATOM 774 CA GLY A 69 27.033 -1.588 6.583 1.00 0.00 C ATOM 775 C GLY A 69 25.555 -1.736 6.736 1.00 0.00 C ATOM 776 O GLY A 69 25.058 -2.859 6.834 1.00 0.00 O ATOM 0 H GLY A 69 27.421 -0.162 5.125 1.00 0.00 H new ATOM 0 HA2 GLY A 69 27.397 -2.331 5.873 1.00 0.00 H new ATOM 0 HA3 GLY A 69 27.516 -1.797 7.538 1.00 0.00 H new ATOM 780 N GLU A 70 24.845 -0.631 6.771 1.00 0.00 N ATOM 781 CA GLU A 70 23.413 -0.697 6.904 1.00 0.00 C ATOM 782 C GLU A 70 22.747 -0.256 5.615 1.00 0.00 C ATOM 783 O GLU A 70 23.358 0.432 4.782 1.00 0.00 O ATOM 784 CB GLU A 70 22.937 0.175 8.075 1.00 0.00 C ATOM 785 CG GLU A 70 23.163 1.659 7.869 1.00 0.00 C ATOM 786 CD GLU A 70 22.872 2.496 9.083 1.00 0.00 C ATOM 787 OE1 GLU A 70 21.762 2.406 9.648 1.00 0.00 O ATOM 788 OE2 GLU A 70 23.769 3.257 9.505 1.00 0.00 O ATOM 0 H GLU A 70 25.232 0.311 6.710 1.00 0.00 H new ATOM 0 HA GLU A 70 23.133 -1.730 7.109 1.00 0.00 H new ATOM 0 HB2 GLU A 70 21.874 -0.001 8.237 1.00 0.00 H new ATOM 0 HB3 GLU A 70 23.454 -0.139 8.982 1.00 0.00 H new ATOM 0 HG2 GLU A 70 24.198 1.820 7.569 1.00 0.00 H new ATOM 0 HG3 GLU A 70 22.536 2.001 7.046 1.00 0.00 H new ATOM 795 N TRP A 71 21.535 -0.660 5.441 1.00 0.00 N ATOM 796 CA TRP A 71 20.749 -0.239 4.322 1.00 0.00 C ATOM 797 C TRP A 71 19.946 0.974 4.739 1.00 0.00 C ATOM 798 O TRP A 71 19.111 0.901 5.642 1.00 0.00 O ATOM 799 CB TRP A 71 19.843 -1.374 3.809 1.00 0.00 C ATOM 800 CG TRP A 71 20.591 -2.496 3.127 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.124 -3.614 3.703 1.00 0.00 C ATOM 802 CD2 TRP A 71 20.875 -2.594 1.727 1.00 0.00 C ATOM 803 NE1 TRP A 71 21.724 -4.398 2.742 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.591 -3.791 1.524 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.595 -1.785 0.627 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.031 -4.191 0.260 1.00 0.00 C ATOM 807 CZ3 TRP A 71 21.029 -2.185 -0.617 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.741 -3.375 -0.792 1.00 0.00 C ATOM 0 H TRP A 71 21.053 -1.298 6.075 1.00 0.00 H new ATOM 0 HA TRP A 71 21.403 0.024 3.490 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.280 -1.783 4.648 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.117 -0.958 3.111 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.081 -3.849 4.756 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.192 -5.288 2.912 1.00 0.00 H new ATOM 0 HE3 TRP A 71 20.048 -0.862 0.748 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.580 -5.111 0.122 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.815 -1.566 -1.476 1.00 0.00 H new ATOM 0 HH2 TRP A 71 22.068 -3.654 -1.783 1.00 0.00 H new ATOM 819 N VAL A 72 20.221 2.085 4.114 1.00 0.00 N ATOM 820 CA VAL A 72 19.595 3.337 4.443 1.00 0.00 C ATOM 821 C VAL A 72 18.968 3.974 3.244 1.00 0.00 C ATOM 822 O VAL A 72 19.364 3.730 2.112 1.00 0.00 O ATOM 823 CB VAL A 72 20.549 4.310 5.249 1.00 0.00 C ATOM 824 CG1 VAL A 72 22.006 3.969 5.020 1.00 0.00 C ATOM 825 CG2 VAL A 72 20.356 5.789 4.910 1.00 0.00 C ATOM 0 H VAL A 72 20.895 2.148 3.351 1.00 0.00 H new ATOM 0 HA VAL A 72 18.779 3.113 5.130 1.00 0.00 H new ATOM 0 HB VAL A 72 20.272 4.160 6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 72 22.634 4.656 5.588 1.00 0.00 H new ATOM 0 HG12 VAL A 72 22.197 2.947 5.349 1.00 0.00 H new ATOM 0 HG13 VAL A 72 22.238 4.058 3.959 1.00 0.00 H new ATOM 0 HG21 VAL A 72 21.045 6.391 5.503 1.00 0.00 H new ATOM 0 HG22 VAL A 72 20.554 5.948 3.850 1.00 0.00 H new ATOM 0 HG23 VAL A 72 19.331 6.083 5.135 1.00 0.00 H new ATOM 835 N ALA A 73 17.957 4.718 3.513 1.00 0.00 N ATOM 836 CA ALA A 73 17.194 5.420 2.533 1.00 0.00 C ATOM 837 C ALA A 73 18.029 6.450 1.770 1.00 0.00 C ATOM 838 O ALA A 73 18.474 7.461 2.338 1.00 0.00 O ATOM 839 CB ALA A 73 16.034 6.092 3.211 1.00 0.00 C ATOM 0 H ALA A 73 17.620 4.864 4.464 1.00 0.00 H new ATOM 0 HA ALA A 73 16.839 4.697 1.798 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.443 6.632 2.471 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.410 5.340 3.695 1.00 0.00 H new ATOM 0 HB3 ALA A 73 16.406 6.792 3.960 1.00 0.00 H new ATOM 845 N LEU A 74 18.277 6.144 0.504 1.00 0.00 N ATOM 846 CA LEU A 74 18.889 7.050 -0.439 1.00 0.00 C ATOM 847 C LEU A 74 17.927 8.202 -0.558 1.00 0.00 C ATOM 848 O LEU A 74 18.286 9.364 -0.373 1.00 0.00 O ATOM 849 CB LEU A 74 18.981 6.335 -1.806 1.00 0.00 C ATOM 850 CG LEU A 74 19.811 6.964 -2.955 1.00 0.00 C ATOM 851 CD1 LEU A 74 19.415 8.380 -3.340 1.00 0.00 C ATOM 852 CD2 LEU A 74 21.290 6.834 -2.721 1.00 0.00 C ATOM 0 H LEU A 74 18.050 5.235 0.101 1.00 0.00 H new ATOM 0 HA LEU A 74 19.884 7.372 -0.131 1.00 0.00 H new ATOM 0 HB2 LEU A 74 19.382 5.338 -1.624 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.963 6.207 -2.174 1.00 0.00 H new ATOM 0 HG LEU A 74 19.555 6.366 -3.830 1.00 0.00 H new ATOM 0 HD11 LEU A 74 20.054 8.729 -4.151 1.00 0.00 H new ATOM 0 HD12 LEU A 74 18.375 8.391 -3.667 1.00 0.00 H new ATOM 0 HD13 LEU A 74 19.531 9.037 -2.478 1.00 0.00 H new ATOM 0 HD21 LEU A 74 21.831 7.288 -3.551 1.00 0.00 H new ATOM 0 HD22 LEU A 74 21.557 7.340 -1.793 1.00 0.00 H new ATOM 0 HD23 LEU A 74 21.556 5.779 -2.649 1.00 0.00 H new ATOM 864 N ASN A 75 16.688 7.843 -0.832 1.00 0.00 N ATOM 865 CA ASN A 75 15.617 8.785 -0.967 1.00 0.00 C ATOM 866 C ASN A 75 14.661 8.627 0.200 1.00 0.00 C ATOM 867 O ASN A 75 13.772 7.790 0.151 1.00 0.00 O ATOM 868 CB ASN A 75 14.847 8.565 -2.279 1.00 0.00 C ATOM 869 CG ASN A 75 15.624 8.911 -3.532 1.00 0.00 C ATOM 870 OD1 ASN A 75 15.499 8.235 -4.545 1.00 0.00 O ATOM 871 ND2 ASN A 75 16.361 9.988 -3.509 1.00 0.00 N ATOM 0 H ASN A 75 16.403 6.873 -0.967 1.00 0.00 H new ATOM 0 HA ASN A 75 16.043 9.788 -0.978 1.00 0.00 H new ATOM 0 HB2 ASN A 75 14.541 7.520 -2.334 1.00 0.00 H new ATOM 0 HB3 ASN A 75 13.936 9.164 -2.255 1.00 0.00 H new ATOM 0 HD21 ASN A 75 16.853 10.288 -4.351 1.00 0.00 H new ATOM 0 HD22 ASN A 75 16.445 10.530 -2.649 1.00 0.00 H new ATOM 878 N PRO A 76 14.842 9.393 1.289 1.00 0.00 N ATOM 879 CA PRO A 76 13.969 9.298 2.478 1.00 0.00 C ATOM 880 C PRO A 76 12.592 9.903 2.202 1.00 0.00 C ATOM 881 O PRO A 76 11.591 9.587 2.861 1.00 0.00 O ATOM 882 CB PRO A 76 14.724 10.132 3.520 1.00 0.00 C ATOM 883 CG PRO A 76 15.500 11.119 2.710 1.00 0.00 C ATOM 884 CD PRO A 76 15.919 10.392 1.475 1.00 0.00 C ATOM 0 HA PRO A 76 13.782 8.271 2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.037 10.631 4.204 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.382 9.510 4.127 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.890 11.988 2.464 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.366 11.483 3.262 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.998 11.063 0.620 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.892 9.917 1.598 1.00 0.00 H new ATOM 892 N LEU A 77 12.557 10.752 1.192 1.00 0.00 N ATOM 893 CA LEU A 77 11.369 11.449 0.774 1.00 0.00 C ATOM 894 C LEU A 77 10.449 10.521 0.045 1.00 0.00 C ATOM 895 O LEU A 77 9.225 10.702 0.014 1.00 0.00 O ATOM 896 CB LEU A 77 11.768 12.565 -0.122 1.00 0.00 C ATOM 897 CG LEU A 77 12.756 13.526 0.493 1.00 0.00 C ATOM 898 CD1 LEU A 77 12.980 14.628 -0.442 1.00 0.00 C ATOM 899 CD2 LEU A 77 12.261 14.042 1.835 1.00 0.00 C ATOM 0 H LEU A 77 13.378 10.977 0.630 1.00 0.00 H new ATOM 0 HA LEU A 77 10.845 11.835 1.648 1.00 0.00 H new ATOM 0 HB2 LEU A 77 12.200 12.149 -1.032 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.876 13.117 -0.416 1.00 0.00 H new ATOM 0 HG LEU A 77 13.696 13.007 0.680 1.00 0.00 H new ATOM 0 HD11 LEU A 77 13.692 15.332 -0.011 1.00 0.00 H new ATOM 0 HD12 LEU A 77 13.378 14.236 -1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.037 15.139 -0.635 1.00 0.00 H new ATOM 0 HD21 LEU A 77 12.994 14.732 2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 77 11.312 14.561 1.698 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.121 13.204 2.518 1.00 0.00 H new ATOM 911 N ARG A 78 11.038 9.517 -0.518 1.00 0.00 N ATOM 912 CA ARG A 78 10.304 8.514 -1.226 1.00 0.00 C ATOM 913 C ARG A 78 9.884 7.401 -0.315 1.00 0.00 C ATOM 914 O ARG A 78 10.681 6.850 0.432 1.00 0.00 O ATOM 915 CB ARG A 78 11.059 7.971 -2.436 1.00 0.00 C ATOM 916 CG ARG A 78 11.231 8.975 -3.561 1.00 0.00 C ATOM 917 CD ARG A 78 9.888 9.570 -3.955 1.00 0.00 C ATOM 918 NE ARG A 78 9.977 10.415 -5.132 1.00 0.00 N ATOM 919 CZ ARG A 78 9.089 11.346 -5.478 1.00 0.00 C ATOM 920 NH1 ARG A 78 8.073 11.659 -4.655 1.00 0.00 N ATOM 921 NH2 ARG A 78 9.230 11.977 -6.631 1.00 0.00 N ATOM 0 H ARG A 78 12.047 9.367 -0.501 1.00 0.00 H new ATOM 0 HA ARG A 78 9.408 9.003 -1.608 1.00 0.00 H new ATOM 0 HB2 ARG A 78 12.043 7.630 -2.114 1.00 0.00 H new ATOM 0 HB3 ARG A 78 10.530 7.099 -2.820 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.909 9.769 -3.247 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.687 8.489 -4.423 1.00 0.00 H new ATOM 0 HD2 ARG A 78 9.179 8.764 -4.143 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.494 10.153 -3.122 1.00 0.00 H new ATOM 0 HE ARG A 78 10.784 10.286 -5.743 1.00 0.00 H new ATOM 0 HH11 ARG A 78 7.978 11.183 -3.758 1.00 0.00 H new ATOM 0 HH12 ARG A 78 7.397 12.373 -4.927 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.012 11.749 -7.245 1.00 0.00 H new ATOM 0 HH22 ARG A 78 8.557 12.692 -6.907 1.00 0.00 H new ATOM 935 N LYS A 79 8.624 7.110 -0.367 1.00 0.00 N ATOM 936 CA LYS A 79 8.018 6.059 0.397 1.00 0.00 C ATOM 937 C LYS A 79 6.809 5.622 -0.370 1.00 0.00 C ATOM 938 O LYS A 79 6.306 6.393 -1.219 1.00 0.00 O ATOM 939 CB LYS A 79 7.580 6.557 1.778 1.00 0.00 C ATOM 940 CG LYS A 79 6.506 7.639 1.731 1.00 0.00 C ATOM 941 CD LYS A 79 6.025 8.077 3.119 1.00 0.00 C ATOM 942 CE LYS A 79 5.030 7.088 3.769 1.00 0.00 C ATOM 943 NZ LYS A 79 5.602 5.749 4.093 1.00 0.00 N ATOM 0 H LYS A 79 7.964 7.612 -0.961 1.00 0.00 H new ATOM 0 HA LYS A 79 8.729 5.247 0.549 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.206 5.712 2.357 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.451 6.945 2.307 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.897 8.506 1.199 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.655 7.271 1.158 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.889 8.194 3.774 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.552 9.056 3.038 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.643 7.534 4.685 1.00 0.00 H new ATOM 0 HE3 LYS A 79 4.182 6.953 3.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 5.101 5.346 4.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 5.493 5.117 3.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.612 5.849 4.321 1.00 0.00 H new ATOM 957 N CYS A 80 6.354 4.444 -0.132 1.00 0.00 N ATOM 958 CA CYS A 80 5.160 3.995 -0.768 1.00 0.00 C ATOM 959 C CYS A 80 3.957 4.383 0.068 1.00 0.00 C ATOM 960 O CYS A 80 4.017 4.377 1.310 1.00 0.00 O ATOM 961 CB CYS A 80 5.232 2.504 -1.051 1.00 0.00 C ATOM 962 SG CYS A 80 6.682 2.069 -2.094 1.00 0.00 S ATOM 0 H CYS A 80 6.788 3.770 0.499 1.00 0.00 H new ATOM 0 HA CYS A 80 5.051 4.484 -1.736 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.287 1.959 -0.109 1.00 0.00 H new ATOM 0 HB3 CYS A 80 4.317 2.186 -1.551 1.00 0.00 H new ATOM 967 N GLN A 81 2.908 4.802 -0.600 1.00 0.00 N ATOM 968 CA GLN A 81 1.698 5.271 0.046 1.00 0.00 C ATOM 969 C GLN A 81 0.490 4.637 -0.589 1.00 0.00 C ATOM 970 O GLN A 81 0.599 4.021 -1.643 1.00 0.00 O ATOM 971 CB GLN A 81 1.621 6.791 -0.035 1.00 0.00 C ATOM 972 CG GLN A 81 2.665 7.474 0.814 1.00 0.00 C ATOM 973 CD GLN A 81 2.732 8.950 0.592 1.00 0.00 C ATOM 974 OE1 GLN A 81 2.033 9.728 1.237 1.00 0.00 O ATOM 975 NE2 GLN A 81 3.585 9.357 -0.298 1.00 0.00 N ATOM 0 H GLN A 81 2.867 4.828 -1.619 1.00 0.00 H new ATOM 0 HA GLN A 81 1.719 4.983 1.097 1.00 0.00 H new ATOM 0 HB2 GLN A 81 1.742 7.102 -1.073 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.631 7.118 0.282 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.452 7.281 1.865 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.640 7.037 0.601 1.00 0.00 H new ATOM 0 HE21 GLN A 81 4.147 8.679 -0.813 1.00 0.00 H new ATOM 0 HE22 GLN A 81 3.693 10.354 -0.482 1.00 0.00 H new ATOM 984 N LYS A 82 -0.645 4.782 0.031 1.00 0.00 N ATOM 985 CA LYS A 82 -1.856 4.160 -0.448 1.00 0.00 C ATOM 986 C LYS A 82 -2.395 4.800 -1.707 1.00 0.00 C ATOM 987 O LYS A 82 -2.068 5.947 -2.050 1.00 0.00 O ATOM 988 CB LYS A 82 -2.935 4.162 0.608 1.00 0.00 C ATOM 989 CG LYS A 82 -2.604 3.363 1.835 1.00 0.00 C ATOM 990 CD LYS A 82 -3.803 3.282 2.718 1.00 0.00 C ATOM 991 CE LYS A 82 -3.533 2.504 3.976 1.00 0.00 C ATOM 992 NZ LYS A 82 -4.770 2.343 4.752 1.00 0.00 N ATOM 0 H LYS A 82 -0.763 5.333 0.882 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.578 3.133 -0.686 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.135 5.192 0.903 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -3.854 3.771 0.172 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.280 2.361 1.552 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.776 3.827 2.371 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.128 4.289 2.979 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.622 2.814 2.173 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.123 1.526 3.726 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.784 3.019 4.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.547 1.925 5.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.217 3.272 4.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.423 1.718 4.238 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.217 4.047 -2.381 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.882 4.486 -3.568 1.00 0.00 C ATOM 1008 C ARG A 83 -5.371 4.634 -3.261 1.00 0.00 C ATOM 1009 O ARG A 83 -5.939 3.828 -2.501 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.627 3.488 -4.712 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.114 2.089 -4.424 1.00 0.00 C ATOM 1012 CD ARG A 83 -3.371 1.057 -5.243 1.00 0.00 C ATOM 1013 NE ARG A 83 -3.621 1.126 -6.681 1.00 0.00 N ATOM 1014 CZ ARG A 83 -2.738 0.766 -7.624 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -1.449 0.599 -7.321 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -3.141 0.595 -8.869 1.00 0.00 N ATOM 0 H ARG A 83 -3.446 3.090 -2.112 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.495 5.452 -3.892 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.116 3.853 -5.615 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.557 3.454 -4.920 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -3.988 1.871 -3.363 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.181 2.024 -4.638 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -2.302 1.174 -5.067 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.645 0.064 -4.887 1.00 0.00 H new ATOM 0 HE ARG A 83 -4.530 1.472 -6.989 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -1.127 0.745 -6.364 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -0.786 0.325 -8.046 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -4.122 0.737 -9.112 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.472 0.321 -9.589 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.986 5.705 -3.748 1.00 0.00 N ATOM 1031 CA PRO A 84 -7.408 5.939 -3.560 1.00 0.00 C ATOM 1032 C PRO A 84 -8.280 4.977 -4.379 1.00 0.00 C ATOM 1033 O PRO A 84 -7.903 4.542 -5.482 1.00 0.00 O ATOM 1034 CB PRO A 84 -7.643 7.377 -4.027 1.00 0.00 C ATOM 1035 CG PRO A 84 -6.403 7.800 -4.758 1.00 0.00 C ATOM 1036 CD PRO A 84 -5.322 6.782 -4.481 1.00 0.00 C ATOM 0 HA PRO A 84 -7.684 5.775 -2.518 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -8.515 7.435 -4.678 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -7.835 8.033 -3.178 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.597 7.867 -5.829 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -6.087 8.790 -4.429 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.881 6.414 -5.408 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.513 7.217 -3.894 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.434 4.670 -3.847 1.00 0.00 N ATOM 1045 CA CYS A 85 -10.357 3.740 -4.477 1.00 0.00 C ATOM 1046 C CYS A 85 -11.357 4.452 -5.378 1.00 0.00 C ATOM 1047 O CYS A 85 -11.463 4.143 -6.576 1.00 0.00 O ATOM 1048 CB CYS A 85 -11.086 2.953 -3.408 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.963 2.164 -2.237 1.00 0.00 S ATOM 0 H CYS A 85 -9.768 5.054 -2.963 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.778 3.064 -5.107 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.759 3.619 -2.868 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.705 2.191 -3.882 1.00 0.00 H new ATOM 1054 N GLY A 86 -12.068 5.411 -4.824 1.00 0.00 N ATOM 1055 CA GLY A 86 -13.074 6.111 -5.579 1.00 0.00 C ATOM 1056 C GLY A 86 -14.402 6.130 -4.868 1.00 0.00 C ATOM 1057 O GLY A 86 -14.458 5.949 -3.661 1.00 0.00 O ATOM 0 H GLY A 86 -11.966 5.720 -3.857 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.745 7.134 -5.760 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.191 5.637 -6.553 1.00 0.00 H new ATOM 1061 N HIS A 87 -15.455 6.288 -5.626 1.00 0.00 N ATOM 1062 CA HIS A 87 -16.809 6.419 -5.108 1.00 0.00 C ATOM 1063 C HIS A 87 -17.430 5.011 -4.945 1.00 0.00 C ATOM 1064 O HIS A 87 -17.730 4.342 -5.930 1.00 0.00 O ATOM 1065 CB HIS A 87 -17.616 7.281 -6.105 1.00 0.00 C ATOM 1066 CG HIS A 87 -18.958 7.776 -5.641 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -19.107 8.801 -4.748 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -20.207 7.432 -6.012 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -20.381 9.071 -4.587 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -21.076 8.259 -5.344 1.00 0.00 N ATOM 0 H HIS A 87 -15.404 6.331 -6.644 1.00 0.00 H new ATOM 0 HA HIS A 87 -16.816 6.901 -4.131 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -17.010 8.146 -6.375 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -17.764 6.699 -7.015 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -20.475 6.650 -6.707 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -20.788 9.834 -3.940 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -22.093 8.244 -5.424 1.00 0.00 H new ATOM 1079 N PRO A 88 -17.667 4.569 -3.684 1.00 0.00 N ATOM 1080 CA PRO A 88 -18.140 3.187 -3.362 1.00 0.00 C ATOM 1081 C PRO A 88 -19.601 2.965 -3.632 1.00 0.00 C ATOM 1082 O PRO A 88 -20.178 1.952 -3.213 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.884 3.083 -1.862 1.00 0.00 C ATOM 1084 CG PRO A 88 -18.026 4.479 -1.361 1.00 0.00 C ATOM 1085 CD PRO A 88 -17.490 5.375 -2.452 1.00 0.00 C ATOM 0 HA PRO A 88 -17.629 2.447 -3.977 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.599 2.415 -1.383 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.890 2.687 -1.656 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -19.069 4.711 -1.144 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -17.469 4.618 -0.434 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -18.040 6.315 -2.505 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.443 5.627 -2.285 1.00 0.00 H new ATOM 1093 N GLY A 89 -20.207 3.880 -4.269 1.00 0.00 N ATOM 1094 CA GLY A 89 -21.559 3.724 -4.585 1.00 0.00 C ATOM 1095 C GLY A 89 -22.287 5.002 -4.553 1.00 0.00 C ATOM 1096 O GLY A 89 -22.082 5.812 -3.648 1.00 0.00 O ATOM 0 H GLY A 89 -19.783 4.752 -4.584 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -21.650 3.280 -5.576 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -22.017 3.029 -3.882 1.00 0.00 H new ATOM 1100 N ASP A 90 -23.097 5.209 -5.532 1.00 0.00 N ATOM 1101 CA ASP A 90 -23.901 6.383 -5.604 1.00 0.00 C ATOM 1102 C ASP A 90 -25.285 5.939 -5.278 1.00 0.00 C ATOM 1103 O ASP A 90 -25.908 5.206 -6.051 1.00 0.00 O ATOM 1104 CB ASP A 90 -23.836 6.994 -6.997 1.00 0.00 C ATOM 1105 CG ASP A 90 -24.131 8.462 -6.975 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -23.226 9.227 -6.590 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -25.241 8.892 -7.357 1.00 0.00 O ATOM 0 H ASP A 90 -23.223 4.564 -6.312 1.00 0.00 H new ATOM 0 HA ASP A 90 -23.557 7.153 -4.914 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -22.845 6.829 -7.420 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -24.549 6.490 -7.649 1.00 0.00 H new ATOM 1112 N THR A 91 -25.736 6.296 -4.127 1.00 0.00 N ATOM 1113 CA THR A 91 -26.959 5.791 -3.636 1.00 0.00 C ATOM 1114 C THR A 91 -27.927 6.903 -3.252 1.00 0.00 C ATOM 1115 O THR A 91 -27.602 7.803 -2.462 1.00 0.00 O ATOM 1116 CB THR A 91 -26.732 4.852 -2.425 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.995 4.452 -1.881 1.00 0.00 O ATOM 1118 CG2 THR A 91 -25.873 5.520 -1.344 1.00 0.00 C ATOM 0 H THR A 91 -25.262 6.948 -3.502 1.00 0.00 H new ATOM 0 HA THR A 91 -27.407 5.220 -4.449 1.00 0.00 H new ATOM 0 HB THR A 91 -26.192 3.972 -2.774 1.00 0.00 H new ATOM 0 HG1 THR A 91 -28.444 3.847 -2.507 1.00 0.00 H new ATOM 0 HG21 THR A 91 -25.736 4.831 -0.511 1.00 0.00 H new ATOM 0 HG22 THR A 91 -24.901 5.782 -1.762 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.371 6.423 -0.990 1.00 0.00 H new ATOM 1126 N PRO A 92 -29.118 6.882 -3.816 1.00 0.00 N ATOM 1127 CA PRO A 92 -30.152 7.808 -3.456 1.00 0.00 C ATOM 1128 C PRO A 92 -31.028 7.287 -2.307 1.00 0.00 C ATOM 1129 O PRO A 92 -31.975 7.953 -1.897 1.00 0.00 O ATOM 1130 CB PRO A 92 -30.966 7.930 -4.739 1.00 0.00 C ATOM 1131 CG PRO A 92 -30.822 6.608 -5.417 1.00 0.00 C ATOM 1132 CD PRO A 92 -29.532 5.995 -4.923 1.00 0.00 C ATOM 0 HA PRO A 92 -29.751 8.755 -3.095 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -32.011 8.151 -4.523 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -30.593 8.738 -5.368 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -31.669 5.962 -5.186 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -30.801 6.730 -6.500 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -29.682 4.971 -4.580 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.779 5.960 -5.710 1.00 0.00 H new ATOM 1140 N PHE A 93 -30.707 6.112 -1.764 1.00 0.00 N ATOM 1141 CA PHE A 93 -31.561 5.537 -0.722 1.00 0.00 C ATOM 1142 C PHE A 93 -30.787 4.934 0.456 1.00 0.00 C ATOM 1143 O PHE A 93 -31.392 4.357 1.356 1.00 0.00 O ATOM 1144 CB PHE A 93 -32.549 4.499 -1.319 1.00 0.00 C ATOM 1145 CG PHE A 93 -31.907 3.311 -2.011 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -31.570 3.375 -3.353 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -31.656 2.133 -1.320 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -30.992 2.298 -3.993 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -31.078 1.049 -1.955 1.00 0.00 C ATOM 1150 CZ PHE A 93 -30.745 1.132 -3.294 1.00 0.00 C ATOM 0 H PHE A 93 -29.891 5.555 -2.016 1.00 0.00 H new ATOM 0 HA PHE A 93 -32.126 6.374 -0.312 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -33.188 4.129 -0.518 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -33.196 5.008 -2.034 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -31.763 4.282 -3.907 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -31.915 2.063 -0.274 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -30.733 2.366 -5.039 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -30.887 0.139 -1.406 1.00 0.00 H new ATOM 0 HZ PHE A 93 -30.293 0.287 -3.793 1.00 0.00 H new ATOM 1160 N GLY A 94 -29.484 5.071 0.473 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.726 4.500 1.559 1.00 0.00 C ATOM 1162 C GLY A 94 -27.535 5.331 1.940 1.00 0.00 C ATOM 1163 O GLY A 94 -27.392 6.459 1.481 1.00 0.00 O ATOM 0 H GLY A 94 -28.936 5.561 -0.235 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -29.375 4.385 2.427 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -28.391 3.502 1.276 1.00 0.00 H new ATOM 1167 N THR A 95 -26.689 4.776 2.772 1.00 0.00 N ATOM 1168 CA THR A 95 -25.484 5.436 3.242 1.00 0.00 C ATOM 1169 C THR A 95 -24.353 4.429 3.356 1.00 0.00 C ATOM 1170 O THR A 95 -24.605 3.206 3.378 1.00 0.00 O ATOM 1171 CB THR A 95 -25.713 6.080 4.625 1.00 0.00 C ATOM 1172 OG1 THR A 95 -26.456 5.169 5.469 1.00 0.00 O ATOM 1173 CG2 THR A 95 -26.436 7.415 4.520 1.00 0.00 C ATOM 0 H THR A 95 -26.815 3.838 3.151 1.00 0.00 H new ATOM 0 HA THR A 95 -25.225 6.213 2.523 1.00 0.00 H new ATOM 0 HB THR A 95 -24.737 6.277 5.069 1.00 0.00 H new ATOM 0 HG1 THR A 95 -26.599 5.580 6.347 1.00 0.00 H new ATOM 0 HG21 THR A 95 -26.576 7.832 5.517 1.00 0.00 H new ATOM 0 HG22 THR A 95 -25.843 8.104 3.918 1.00 0.00 H new ATOM 0 HG23 THR A 95 -27.408 7.266 4.049 1.00 0.00 H new ATOM 1181 N PHE A 96 -23.137 4.913 3.439 1.00 0.00 N ATOM 1182 CA PHE A 96 -21.993 4.050 3.577 1.00 0.00 C ATOM 1183 C PHE A 96 -21.117 4.515 4.716 1.00 0.00 C ATOM 1184 O PHE A 96 -21.147 5.691 5.076 1.00 0.00 O ATOM 1185 CB PHE A 96 -21.178 3.972 2.273 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.527 5.258 1.834 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -19.284 5.631 2.335 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -21.146 6.083 0.917 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.687 6.801 1.933 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.549 7.255 0.514 1.00 0.00 C ATOM 1191 CZ PHE A 96 -19.322 7.613 1.019 1.00 0.00 C ATOM 0 H PHE A 96 -22.915 5.908 3.413 1.00 0.00 H new ATOM 0 HA PHE A 96 -22.361 3.048 3.798 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.402 3.216 2.395 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.836 3.628 1.475 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.783 4.993 3.048 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -22.108 5.806 0.512 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.724 7.083 2.332 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -21.045 7.895 -0.200 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.855 8.533 0.699 1.00 0.00 H new ATOM 1201 N THR A 97 -20.375 3.617 5.288 1.00 0.00 N ATOM 1202 CA THR A 97 -19.459 3.964 6.344 1.00 0.00 C ATOM 1203 C THR A 97 -18.038 3.739 5.879 1.00 0.00 C ATOM 1204 O THR A 97 -17.825 3.315 4.756 1.00 0.00 O ATOM 1205 CB THR A 97 -19.710 3.042 7.518 1.00 0.00 C ATOM 1206 OG1 THR A 97 -19.533 1.746 7.060 1.00 0.00 O ATOM 1207 CG2 THR A 97 -21.109 3.215 8.091 1.00 0.00 C ATOM 0 H THR A 97 -20.383 2.627 5.042 1.00 0.00 H new ATOM 0 HA THR A 97 -19.603 5.008 6.621 1.00 0.00 H new ATOM 0 HB THR A 97 -19.017 3.277 8.326 1.00 0.00 H new ATOM 0 HG1 THR A 97 -18.582 1.512 7.101 1.00 0.00 H new ATOM 0 HG21 THR A 97 -21.245 2.534 8.931 1.00 0.00 H new ATOM 0 HG22 THR A 97 -21.238 4.242 8.432 1.00 0.00 H new ATOM 0 HG23 THR A 97 -21.848 2.993 7.321 1.00 0.00 H new ATOM 1215 N LEU A 98 -17.089 4.051 6.739 1.00 0.00 N ATOM 1216 CA LEU A 98 -15.696 3.749 6.547 1.00 0.00 C ATOM 1217 C LEU A 98 -15.123 3.381 7.893 1.00 0.00 C ATOM 1218 O LEU A 98 -15.519 3.958 8.910 1.00 0.00 O ATOM 1219 CB LEU A 98 -14.936 4.939 5.974 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.359 5.401 4.591 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.597 6.640 4.212 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.129 4.304 3.563 1.00 0.00 C ATOM 0 H LEU A 98 -17.278 4.537 7.616 1.00 0.00 H new ATOM 0 HA LEU A 98 -15.597 2.930 5.835 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -15.042 5.777 6.663 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -13.876 4.685 5.941 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.425 5.630 4.610 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.905 6.967 3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.804 7.430 4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.529 6.423 4.208 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.439 4.656 2.579 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.071 4.044 3.539 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.712 3.424 3.833 1.00 0.00 H new ATOM 1234 N THR A 99 -14.238 2.421 7.916 1.00 0.00 N ATOM 1235 CA THR A 99 -13.649 1.993 9.166 1.00 0.00 C ATOM 1236 C THR A 99 -12.099 1.984 9.105 1.00 0.00 C ATOM 1237 O THR A 99 -11.433 2.510 9.992 1.00 0.00 O ATOM 1238 CB THR A 99 -14.234 0.606 9.624 1.00 0.00 C ATOM 1239 OG1 THR A 99 -13.704 0.209 10.882 1.00 0.00 O ATOM 1240 CG2 THR A 99 -13.963 -0.481 8.603 1.00 0.00 C ATOM 0 H THR A 99 -13.907 1.920 7.091 1.00 0.00 H new ATOM 0 HA THR A 99 -13.922 2.726 9.925 1.00 0.00 H new ATOM 0 HB THR A 99 -15.312 0.740 9.717 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.087 -0.655 11.140 1.00 0.00 H new ATOM 0 HG21 THR A 99 -14.382 -1.424 8.955 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.424 -0.211 7.653 1.00 0.00 H new ATOM 0 HG23 THR A 99 -12.887 -0.591 8.466 1.00 0.00 H new ATOM 1248 N GLY A 100 -11.529 1.442 8.034 1.00 0.00 N ATOM 1249 CA GLY A 100 -10.082 1.358 7.924 1.00 0.00 C ATOM 1250 C GLY A 100 -9.494 2.570 7.258 1.00 0.00 C ATOM 1251 O GLY A 100 -8.712 2.459 6.311 1.00 0.00 O ATOM 0 H GLY A 100 -12.042 1.059 7.240 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.649 1.246 8.918 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.813 0.467 7.357 1.00 0.00 H new ATOM 1255 N GLY A 101 -9.864 3.714 7.748 1.00 0.00 N ATOM 1256 CA GLY A 101 -9.447 4.957 7.184 1.00 0.00 C ATOM 1257 C GLY A 101 -10.592 5.920 7.208 1.00 0.00 C ATOM 1258 O GLY A 101 -11.668 5.584 7.713 1.00 0.00 O ATOM 0 H GLY A 101 -10.472 3.809 8.561 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.605 5.361 7.747 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.104 4.808 6.160 1.00 0.00 H new ATOM 1262 N ASN A 102 -10.395 7.087 6.669 1.00 0.00 N ATOM 1263 CA ASN A 102 -11.452 8.110 6.643 1.00 0.00 C ATOM 1264 C ASN A 102 -11.747 8.498 5.245 1.00 0.00 C ATOM 1265 O ASN A 102 -12.477 9.458 4.990 1.00 0.00 O ATOM 1266 CB ASN A 102 -11.032 9.372 7.416 1.00 0.00 C ATOM 1267 CG ASN A 102 -9.824 10.095 6.828 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -8.678 9.779 7.158 1.00 0.00 O ATOM 1269 ND2 ASN A 102 -10.061 11.081 5.994 1.00 0.00 N ATOM 0 H ASN A 102 -9.518 7.375 6.235 1.00 0.00 H new ATOM 0 HA ASN A 102 -12.335 7.679 7.115 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.875 10.063 7.446 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -10.809 9.095 8.447 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -9.285 11.612 5.598 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -11.021 11.316 5.742 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.224 7.765 4.325 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.349 8.164 2.999 1.00 0.00 C ATOM 1278 C VAL A 103 -11.440 6.970 2.135 1.00 0.00 C ATOM 1279 O VAL A 103 -11.658 5.872 2.599 1.00 0.00 O ATOM 1280 CB VAL A 103 -10.156 9.066 2.621 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -8.840 8.394 2.254 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -10.523 10.301 1.844 1.00 0.00 C ATOM 0 H VAL A 103 -10.713 6.896 4.480 1.00 0.00 H new ATOM 0 HA VAL A 103 -12.261 8.745 2.859 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.865 9.457 3.596 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.098 9.155 2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -8.488 7.798 3.096 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.990 7.747 1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -9.622 10.873 1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -11.008 10.013 0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.205 10.913 2.434 1.00 0.00 H new ATOM 1292 N PHE A 104 -11.258 7.185 0.926 1.00 0.00 N ATOM 1293 CA PHE A 104 -11.360 6.130 -0.045 1.00 0.00 C ATOM 1294 C PHE A 104 -9.988 5.667 -0.397 1.00 0.00 C ATOM 1295 O PHE A 104 -9.400 6.116 -1.373 1.00 0.00 O ATOM 1296 CB PHE A 104 -12.150 6.569 -1.273 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.492 7.111 -0.905 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -14.363 6.357 -0.141 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.869 8.381 -1.288 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.581 6.855 0.228 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -15.091 8.887 -0.916 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.947 8.123 -0.159 1.00 0.00 C ATOM 0 H PHE A 104 -11.029 8.099 0.536 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.915 5.296 0.384 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.587 7.329 -1.815 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.273 5.722 -1.948 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.078 5.362 0.168 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -13.199 8.982 -1.885 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.254 6.255 0.822 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -15.379 9.883 -1.218 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.909 8.519 0.132 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.470 4.814 0.430 1.00 0.00 N ATOM 1313 CA GLU A 105 -8.119 4.353 0.330 1.00 0.00 C ATOM 1314 C GLU A 105 -8.079 2.853 0.552 1.00 0.00 C ATOM 1315 O GLU A 105 -8.990 2.288 1.201 1.00 0.00 O ATOM 1316 CB GLU A 105 -7.289 5.042 1.422 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.777 4.675 2.841 1.00 0.00 C ATOM 1318 CD GLU A 105 -7.042 5.336 3.976 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -5.965 4.827 4.392 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -7.553 6.323 4.532 1.00 0.00 O ATOM 0 H GLU A 105 -9.986 4.409 1.211 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.718 4.585 -0.657 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.242 4.758 1.314 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.342 6.123 1.289 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -8.834 4.931 2.919 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.701 3.595 2.963 1.00 0.00 H new ATOM 1327 N TYR A 106 -7.052 2.218 0.004 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.785 0.801 0.215 1.00 0.00 C ATOM 1329 C TYR A 106 -6.785 0.487 1.717 1.00 0.00 C ATOM 1330 O TYR A 106 -5.943 0.980 2.478 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.427 0.425 -0.428 1.00 0.00 C ATOM 1332 CG TYR A 106 -4.968 -1.017 -0.210 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.457 -2.058 -0.988 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -4.029 -1.323 0.767 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.027 -3.360 -0.798 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.594 -2.619 0.965 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.096 -3.633 0.183 1.00 0.00 C ATOM 1338 OH TYR A 106 -3.659 -4.929 0.383 1.00 0.00 O ATOM 0 H TYR A 106 -6.374 2.676 -0.605 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.568 0.208 -0.258 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.490 0.609 -1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.662 1.094 -0.035 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.187 -1.848 -1.756 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.631 -0.531 1.384 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -5.418 -4.157 -1.414 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.863 -2.835 1.730 1.00 0.00 H new ATOM 0 HH TYR A 106 -3.003 -4.944 1.111 1.00 0.00 H new ATOM 1348 N GLY A 107 -7.754 -0.273 2.143 1.00 0.00 N ATOM 1349 CA GLY A 107 -7.836 -0.623 3.522 1.00 0.00 C ATOM 1350 C GLY A 107 -9.198 -0.364 4.113 1.00 0.00 C ATOM 1351 O GLY A 107 -9.593 -1.047 5.058 1.00 0.00 O ATOM 0 H GLY A 107 -8.492 -0.658 1.554 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.589 -1.678 3.639 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.090 -0.058 4.080 1.00 0.00 H new ATOM 1355 N VAL A 108 -9.940 0.604 3.570 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.250 0.902 4.138 1.00 0.00 C ATOM 1357 C VAL A 108 -12.282 -0.134 3.759 1.00 0.00 C ATOM 1358 O VAL A 108 -12.093 -0.940 2.832 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.832 2.327 3.814 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -10.913 3.435 4.209 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -12.295 2.475 2.371 1.00 0.00 C ATOM 0 H VAL A 108 -9.668 1.174 2.769 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.054 0.882 5.210 1.00 0.00 H new ATOM 0 HB VAL A 108 -12.722 2.414 4.437 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.370 4.393 3.960 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.728 3.389 5.282 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -9.969 3.333 3.673 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.685 3.481 2.215 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -11.454 2.304 1.700 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -13.078 1.746 2.164 1.00 0.00 H new ATOM 1371 N LYS A 109 -13.349 -0.094 4.480 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.477 -0.911 4.272 1.00 0.00 C ATOM 1373 C LYS A 109 -15.642 0.019 4.302 1.00 0.00 C ATOM 1374 O LYS A 109 -15.878 0.661 5.331 1.00 0.00 O ATOM 1375 CB LYS A 109 -14.632 -1.935 5.400 1.00 0.00 C ATOM 1376 CG LYS A 109 -15.820 -2.849 5.216 1.00 0.00 C ATOM 1377 CD LYS A 109 -16.089 -3.777 6.411 1.00 0.00 C ATOM 1378 CE LYS A 109 -15.083 -4.940 6.561 1.00 0.00 C ATOM 1379 NZ LYS A 109 -13.742 -4.551 7.070 1.00 0.00 N ATOM 0 H LYS A 109 -13.456 0.544 5.268 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.393 -1.464 3.337 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -13.725 -2.537 5.463 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.731 -1.408 6.349 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.707 -2.242 5.034 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.662 -3.458 4.326 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -16.077 -3.183 7.325 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.092 -4.192 6.313 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -15.509 -5.684 7.235 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -14.961 -5.422 5.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -13.388 -5.287 7.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -13.085 -4.445 6.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -13.813 -3.648 7.582 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.319 0.147 3.208 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.441 0.991 3.154 1.00 0.00 C ATOM 1395 C ALA A 110 -18.657 0.159 3.420 1.00 0.00 C ATOM 1396 O ALA A 110 -19.084 -0.601 2.540 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.536 1.674 1.795 1.00 0.00 C ATOM 0 H ALA A 110 -16.101 -0.334 2.335 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.357 1.777 3.904 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.412 2.323 1.774 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.639 2.269 1.623 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.625 0.919 1.014 1.00 0.00 H new ATOM 1403 N VAL A 111 -19.198 0.215 4.618 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.367 -0.609 4.895 1.00 0.00 C ATOM 1405 C VAL A 111 -21.584 0.064 4.300 1.00 0.00 C ATOM 1406 O VAL A 111 -21.518 1.227 3.932 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.590 -0.986 6.402 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -19.331 -1.285 7.198 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -21.649 -0.183 7.153 1.00 0.00 C ATOM 0 H VAL A 111 -18.869 0.794 5.390 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.186 -1.575 4.423 1.00 0.00 H new ATOM 0 HB VAL A 111 -21.065 -1.962 6.307 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -19.600 -1.533 8.225 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -18.806 -2.127 6.747 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -18.682 -0.409 7.195 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -21.711 -0.535 8.183 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -21.378 0.873 7.146 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -22.616 -0.312 6.667 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.644 -0.645 4.125 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.806 -0.068 3.539 1.00 0.00 C ATOM 1421 C TYR A 112 -25.009 -0.350 4.381 1.00 0.00 C ATOM 1422 O TYR A 112 -25.180 -1.455 4.900 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.971 -0.573 2.107 1.00 0.00 C ATOM 1424 CG TYR A 112 -25.046 0.124 1.328 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -24.812 1.358 0.744 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -26.291 -0.439 1.177 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -25.798 2.003 0.041 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -27.272 0.199 0.471 1.00 0.00 C ATOM 1429 CZ TYR A 112 -27.028 1.414 -0.090 1.00 0.00 C ATOM 1430 OH TYR A 112 -28.032 2.055 -0.774 1.00 0.00 O ATOM 0 H TYR A 112 -22.732 -1.629 4.380 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.693 1.015 3.495 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -23.023 -0.456 1.581 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -24.191 -1.640 2.133 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -23.840 1.819 0.843 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -26.497 -1.401 1.623 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -25.606 2.967 -0.406 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -28.242 -0.262 0.358 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.705 2.919 -1.102 1.00 0.00 H new ATOM 1440 N THR A 113 -25.795 0.670 4.587 1.00 0.00 N ATOM 1441 CA THR A 113 -27.002 0.560 5.339 1.00 0.00 C ATOM 1442 C THR A 113 -27.995 1.606 4.814 1.00 0.00 C ATOM 1443 O THR A 113 -27.582 2.634 4.243 1.00 0.00 O ATOM 1444 CB THR A 113 -26.744 0.831 6.839 1.00 0.00 C ATOM 1445 OG1 THR A 113 -25.487 0.252 7.250 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.819 0.183 7.653 1.00 0.00 C ATOM 0 H THR A 113 -25.609 1.608 4.232 1.00 0.00 H new ATOM 0 HA THR A 113 -27.398 -0.450 5.230 1.00 0.00 H new ATOM 0 HB THR A 113 -26.728 1.910 6.990 1.00 0.00 H new ATOM 0 HG1 THR A 113 -25.339 0.434 8.201 1.00 0.00 H new ATOM 0 HG21 THR A 113 -27.639 0.373 8.711 1.00 0.00 H new ATOM 0 HG22 THR A 113 -28.788 0.595 7.370 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.815 -0.892 7.472 1.00 0.00 H new ATOM 1454 N CYS A 114 -29.261 1.342 5.001 1.00 0.00 N ATOM 1455 CA CYS A 114 -30.338 2.243 4.595 1.00 0.00 C ATOM 1456 C CYS A 114 -31.279 2.424 5.754 1.00 0.00 C ATOM 1457 O CYS A 114 -31.767 3.514 6.024 1.00 0.00 O ATOM 1458 CB CYS A 114 -31.120 1.668 3.423 1.00 0.00 C ATOM 1459 SG CYS A 114 -30.133 1.339 1.936 1.00 0.00 S ATOM 0 H CYS A 114 -29.591 0.485 5.445 1.00 0.00 H new ATOM 0 HA CYS A 114 -29.900 3.194 4.292 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -31.593 0.739 3.741 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.921 2.361 3.164 1.00 0.00 H new ATOM 1464 N ASN A 115 -31.542 1.339 6.436 1.00 0.00 N ATOM 1465 CA ASN A 115 -32.366 1.360 7.593 1.00 0.00 C ATOM 1466 C ASN A 115 -31.918 0.194 8.424 1.00 0.00 C ATOM 1467 O ASN A 115 -30.984 -0.512 8.034 1.00 0.00 O ATOM 1468 CB ASN A 115 -33.836 1.186 7.226 1.00 0.00 C ATOM 1469 CG ASN A 115 -34.809 1.643 8.310 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -35.197 0.861 9.176 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -35.206 2.883 8.267 1.00 0.00 N ATOM 0 H ASN A 115 -31.183 0.416 6.194 1.00 0.00 H new ATOM 0 HA ASN A 115 -32.277 2.311 8.119 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -34.039 1.744 6.312 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -34.022 0.135 7.006 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -35.860 3.234 8.967 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -34.863 3.503 7.534 1.00 0.00 H new ATOM 1478 N GLU A 116 -32.572 -0.028 9.499 1.00 0.00 N ATOM 1479 CA GLU A 116 -32.226 -1.060 10.406 1.00 0.00 C ATOM 1480 C GLU A 116 -33.210 -2.205 10.326 1.00 0.00 C ATOM 1481 O GLU A 116 -32.826 -3.381 10.385 1.00 0.00 O ATOM 1482 CB GLU A 116 -32.220 -0.452 11.752 1.00 0.00 C ATOM 1483 CG GLU A 116 -31.784 -1.357 12.851 1.00 0.00 C ATOM 1484 CD GLU A 116 -31.718 -0.638 14.158 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -30.883 0.272 14.302 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -32.512 -0.952 15.060 1.00 0.00 O ATOM 0 H GLU A 116 -33.386 0.516 9.783 1.00 0.00 H new ATOM 0 HA GLU A 116 -31.249 -1.480 10.167 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -31.565 0.419 11.738 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -33.224 -0.092 11.976 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -32.477 -2.195 12.930 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -30.805 -1.774 12.614 1.00 0.00 H new ATOM 1493 N GLY A 117 -34.473 -1.855 10.199 1.00 0.00 N ATOM 1494 CA GLY A 117 -35.525 -2.846 10.069 1.00 0.00 C ATOM 1495 C GLY A 117 -35.343 -3.665 8.813 1.00 0.00 C ATOM 1496 O GLY A 117 -35.575 -4.875 8.798 1.00 0.00 O ATOM 0 H GLY A 117 -34.799 -0.888 10.183 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -35.521 -3.502 10.939 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -36.496 -2.351 10.047 1.00 0.00 H new ATOM 1500 N TYR A 118 -34.897 -3.009 7.774 1.00 0.00 N ATOM 1501 CA TYR A 118 -34.574 -3.677 6.555 1.00 0.00 C ATOM 1502 C TYR A 118 -33.144 -3.369 6.229 1.00 0.00 C ATOM 1503 O TYR A 118 -32.742 -2.194 6.204 1.00 0.00 O ATOM 1504 CB TYR A 118 -35.541 -3.331 5.390 1.00 0.00 C ATOM 1505 CG TYR A 118 -35.562 -1.903 4.896 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -36.304 -0.929 5.545 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -34.859 -1.540 3.756 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -36.339 0.363 5.076 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -34.892 -0.251 3.281 1.00 0.00 C ATOM 1510 CZ TYR A 118 -35.634 0.695 3.945 1.00 0.00 C ATOM 1511 OH TYR A 118 -35.671 1.976 3.476 1.00 0.00 O ATOM 0 H TYR A 118 -34.750 -2.000 7.755 1.00 0.00 H new ATOM 0 HA TYR A 118 -34.700 -4.751 6.691 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -35.293 -3.974 4.546 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -36.552 -3.592 5.704 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -36.863 -1.189 6.432 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -34.276 -2.283 3.233 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -36.918 1.113 5.594 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -34.339 0.016 2.393 1.00 0.00 H new ATOM 0 HH TYR A 118 -35.119 2.045 2.669 1.00 0.00 H new ATOM 1521 N GLN A 119 -32.367 -4.394 6.034 1.00 0.00 N ATOM 1522 CA GLN A 119 -30.973 -4.225 5.802 1.00 0.00 C ATOM 1523 C GLN A 119 -30.668 -4.303 4.341 1.00 0.00 C ATOM 1524 O GLN A 119 -30.730 -3.301 3.664 1.00 0.00 O ATOM 1525 CB GLN A 119 -30.121 -5.212 6.596 1.00 0.00 C ATOM 1526 CG GLN A 119 -30.220 -5.052 8.095 1.00 0.00 C ATOM 1527 CD GLN A 119 -29.313 -6.009 8.825 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -28.150 -5.698 9.106 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -29.819 -7.162 9.148 1.00 0.00 N ATOM 0 H GLN A 119 -32.685 -5.363 6.032 1.00 0.00 H new ATOM 0 HA GLN A 119 -30.709 -3.230 6.160 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -30.418 -6.226 6.330 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -29.079 -5.096 6.298 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -29.963 -4.029 8.368 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -31.250 -5.217 8.410 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -30.783 -7.384 8.899 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -29.252 -7.845 9.650 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.398 -5.503 3.842 1.00 0.00 N ATOM 1539 CA LEU A 120 -30.018 -5.700 2.461 1.00 0.00 C ATOM 1540 C LEU A 120 -29.991 -7.175 2.083 1.00 0.00 C ATOM 1541 O LEU A 120 -29.962 -8.045 2.952 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.695 -4.951 2.141 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.583 -5.064 3.184 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -26.872 -6.387 3.110 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -26.620 -3.902 3.076 1.00 0.00 C ATOM 0 H LEU A 120 -30.438 -6.363 4.389 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.786 -5.257 1.827 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -28.312 -5.324 1.191 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.925 -3.895 2.000 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.051 -5.018 4.167 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.090 -6.423 3.869 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -27.585 -7.193 3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.425 -6.505 2.123 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -25.839 -4.006 3.829 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -26.169 -3.894 2.084 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -27.158 -2.968 3.238 1.00 0.00 H new ATOM 1557 N LEU A 121 -30.040 -7.426 0.794 1.00 0.00 N ATOM 1558 CA LEU A 121 -30.116 -8.775 0.231 1.00 0.00 C ATOM 1559 C LEU A 121 -28.818 -9.552 0.367 1.00 0.00 C ATOM 1560 O LEU A 121 -28.787 -10.638 0.963 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.488 -8.679 -1.237 1.00 0.00 C ATOM 1562 CG LEU A 121 -31.820 -8.035 -1.554 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -31.939 -7.866 -3.040 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.963 -8.876 -1.017 1.00 0.00 C ATOM 0 H LEU A 121 -30.028 -6.692 0.086 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.874 -9.317 0.796 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -29.707 -8.119 -1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.487 -9.685 -1.656 1.00 0.00 H new ATOM 0 HG LEU A 121 -31.874 -7.058 -1.073 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -32.896 -7.402 -3.278 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -31.129 -7.232 -3.400 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -31.878 -8.841 -3.523 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.912 -8.395 -1.256 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.933 -9.865 -1.474 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.867 -8.972 0.064 1.00 0.00 H new ATOM 1576 N GLY A 122 -27.786 -9.022 -0.245 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.459 -9.649 -0.237 1.00 0.00 C ATOM 1578 C GLY A 122 -25.884 -9.885 1.158 1.00 0.00 C ATOM 1579 O GLY A 122 -26.270 -9.225 2.116 1.00 0.00 O ATOM 0 H GLY A 122 -27.828 -8.146 -0.765 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.518 -10.604 -0.759 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -25.769 -9.020 -0.800 1.00 0.00 H new ATOM 1583 N GLU A 123 -24.944 -10.814 1.269 1.00 0.00 N ATOM 1584 CA GLU A 123 -24.328 -11.140 2.554 1.00 0.00 C ATOM 1585 C GLU A 123 -23.236 -10.159 2.861 1.00 0.00 C ATOM 1586 O GLU A 123 -22.891 -9.902 4.029 1.00 0.00 O ATOM 1587 CB GLU A 123 -23.752 -12.552 2.544 1.00 0.00 C ATOM 1588 CG GLU A 123 -24.794 -13.651 2.596 1.00 0.00 C ATOM 1589 CD GLU A 123 -24.183 -15.026 2.585 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -23.643 -15.464 3.628 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -24.217 -15.694 1.523 1.00 0.00 O ATOM 0 H GLU A 123 -24.588 -11.358 0.483 1.00 0.00 H new ATOM 0 HA GLU A 123 -25.100 -11.085 3.322 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -23.150 -12.680 1.644 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -23.080 -12.664 3.395 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -25.398 -13.532 3.496 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -25.467 -13.549 1.745 1.00 0.00 H new ATOM 1598 N ILE A 124 -22.694 -9.608 1.826 1.00 0.00 N ATOM 1599 CA ILE A 124 -21.647 -8.667 1.951 1.00 0.00 C ATOM 1600 C ILE A 124 -22.267 -7.285 2.006 1.00 0.00 C ATOM 1601 O ILE A 124 -22.598 -6.686 0.992 1.00 0.00 O ATOM 1602 CB ILE A 124 -20.645 -8.793 0.780 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.163 -10.260 0.646 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -19.461 -7.862 0.993 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -19.427 -10.810 1.859 1.00 0.00 C ATOM 0 H ILE A 124 -22.972 -9.804 0.865 1.00 0.00 H new ATOM 0 HA ILE A 124 -21.081 -8.852 2.864 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.148 -8.505 -0.143 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.027 -10.893 0.447 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -19.507 -10.333 -0.222 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -18.765 -7.962 0.160 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -19.813 -6.832 1.049 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -18.955 -8.123 1.922 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -19.131 -11.841 1.668 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -18.539 -10.207 2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -20.083 -10.776 2.729 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.464 -6.816 3.206 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.126 -5.543 3.471 1.00 0.00 C ATOM 1619 C ASN A 125 -22.143 -4.390 3.410 1.00 0.00 C ATOM 1620 O ASN A 125 -22.352 -3.345 4.031 1.00 0.00 O ATOM 1621 CB ASN A 125 -23.794 -5.594 4.861 1.00 0.00 C ATOM 1622 CG ASN A 125 -22.820 -5.772 6.019 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -22.488 -6.895 6.384 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -22.388 -4.696 6.612 1.00 0.00 N ATOM 0 H ASN A 125 -22.169 -7.306 4.050 1.00 0.00 H new ATOM 0 HA ASN A 125 -23.882 -5.379 2.703 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.358 -4.674 5.014 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.512 -6.414 4.876 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -21.753 -4.772 7.407 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -22.685 -3.778 6.282 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.124 -4.535 2.610 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.058 -3.580 2.578 1.00 0.00 C ATOM 1633 C TYR A 126 -19.249 -3.721 1.313 1.00 0.00 C ATOM 1634 O TYR A 126 -19.467 -4.621 0.519 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.149 -3.760 3.822 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.357 -5.077 3.848 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -17.210 -5.238 3.077 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -18.758 -6.141 4.635 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -16.495 -6.402 3.083 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -18.033 -7.327 4.648 1.00 0.00 C ATOM 1641 CZ TYR A 126 -16.898 -7.442 3.863 1.00 0.00 C ATOM 1642 OH TYR A 126 -16.169 -8.608 3.859 1.00 0.00 O ATOM 0 H TYR A 126 -21.011 -5.317 1.965 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.489 -2.579 2.594 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.447 -2.928 3.867 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -19.766 -3.704 4.719 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -16.876 -4.420 2.456 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -19.644 -6.050 5.246 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -15.611 -6.497 2.470 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -18.353 -8.153 5.266 1.00 0.00 H new ATOM 0 HH TYR A 126 -16.583 -9.255 4.467 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.327 -2.814 1.146 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.406 -2.809 0.051 1.00 0.00 C ATOM 1654 C ARG A 127 -16.042 -2.544 0.603 1.00 0.00 C ATOM 1655 O ARG A 127 -15.844 -1.554 1.270 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.745 -1.711 -0.971 1.00 0.00 C ATOM 1657 CG ARG A 127 -19.092 -1.848 -1.636 1.00 0.00 C ATOM 1658 CD ARG A 127 -20.244 -1.258 -0.824 1.00 0.00 C ATOM 1659 NE ARG A 127 -20.414 0.187 -1.059 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.946 1.064 -0.201 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -21.049 0.767 1.087 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -21.293 2.272 -0.638 1.00 0.00 N ATOM 0 H ARG A 127 -18.194 -2.035 1.790 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.458 -3.771 -0.458 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.702 -0.744 -0.470 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -16.975 -1.705 -1.743 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -19.058 -1.358 -2.609 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -19.291 -2.904 -1.817 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -21.168 -1.776 -1.080 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -20.064 -1.432 0.237 1.00 0.00 H new ATOM 0 HE ARG A 127 -20.097 0.551 -1.958 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -20.721 -0.136 1.430 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -21.456 1.441 1.735 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.152 2.520 -1.617 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -21.700 2.950 0.006 1.00 0.00 H new ATOM 1676 N GLU A 128 -15.125 -3.413 0.375 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.792 -3.187 0.839 1.00 0.00 C ATOM 1678 C GLU A 128 -12.906 -2.768 -0.284 1.00 0.00 C ATOM 1679 O GLU A 128 -13.157 -3.109 -1.445 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.222 -4.395 1.559 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.671 -4.494 2.990 1.00 0.00 C ATOM 1682 CD GLU A 128 -12.923 -5.525 3.778 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -11.809 -5.241 4.221 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.445 -6.616 4.007 1.00 0.00 O ATOM 0 H GLU A 128 -15.266 -4.289 -0.129 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.837 -2.376 1.566 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.518 -5.300 1.028 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.133 -4.349 1.528 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.550 -3.523 3.469 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.735 -4.730 3.014 1.00 0.00 H new ATOM 1691 N CYS A 129 -11.918 -1.999 0.038 1.00 0.00 N ATOM 1692 CA CYS A 129 -10.948 -1.595 -0.931 1.00 0.00 C ATOM 1693 C CYS A 129 -9.913 -2.654 -1.155 1.00 0.00 C ATOM 1694 O CYS A 129 -9.228 -3.094 -0.218 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.268 -0.301 -0.551 1.00 0.00 C ATOM 1696 SG CYS A 129 -11.196 1.187 -0.957 1.00 0.00 S ATOM 0 H CYS A 129 -11.759 -1.633 0.977 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.498 -1.437 -1.859 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -10.074 -0.310 0.522 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -9.300 -0.256 -1.049 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.816 -3.073 -2.379 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.805 -3.985 -2.819 1.00 0.00 C ATOM 1703 C ASP A 130 -7.710 -3.107 -3.412 1.00 0.00 C ATOM 1704 O ASP A 130 -7.658 -1.915 -3.115 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.372 -4.958 -3.897 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.477 -6.178 -4.142 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -7.552 -6.110 -4.982 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -8.670 -7.210 -3.487 1.00 0.00 O ATOM 0 H ASP A 130 -10.455 -2.783 -3.119 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.434 -4.606 -2.004 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.360 -5.297 -3.587 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.501 -4.416 -4.834 1.00 0.00 H new ATOM 1713 N THR A 131 -6.890 -3.668 -4.229 1.00 0.00 N ATOM 1714 CA THR A 131 -5.781 -3.006 -4.831 1.00 0.00 C ATOM 1715 C THR A 131 -6.200 -1.771 -5.654 1.00 0.00 C ATOM 1716 O THR A 131 -5.829 -0.651 -5.341 1.00 0.00 O ATOM 1717 CB THR A 131 -5.007 -4.021 -5.697 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.927 -4.702 -6.594 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.357 -5.054 -4.809 1.00 0.00 C ATOM 0 H THR A 131 -6.976 -4.645 -4.510 1.00 0.00 H new ATOM 0 HA THR A 131 -5.135 -2.627 -4.039 1.00 0.00 H new ATOM 0 HB THR A 131 -4.249 -3.488 -6.271 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.391 -5.415 -6.107 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.811 -5.770 -5.423 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.666 -4.562 -4.124 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.124 -5.577 -4.238 1.00 0.00 H new ATOM 1727 N ASP A 132 -6.980 -1.982 -6.675 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.380 -0.916 -7.541 1.00 0.00 C ATOM 1729 C ASP A 132 -8.753 -0.360 -7.227 1.00 0.00 C ATOM 1730 O ASP A 132 -9.043 0.802 -7.550 1.00 0.00 O ATOM 1731 CB ASP A 132 -7.343 -1.386 -8.970 1.00 0.00 C ATOM 1732 CG ASP A 132 -5.995 -1.196 -9.652 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -5.632 -0.036 -9.995 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -5.282 -2.200 -9.882 1.00 0.00 O ATOM 0 H ASP A 132 -7.355 -2.896 -6.928 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.671 -0.104 -7.380 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.608 -2.443 -9.001 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -8.104 -0.850 -9.537 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.595 -1.136 -6.608 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.939 -0.667 -6.400 1.00 0.00 C ATOM 1741 C GLY A 133 -11.660 -1.394 -5.323 1.00 0.00 C ATOM 1742 O GLY A 133 -11.050 -1.881 -4.395 1.00 0.00 O ATOM 0 H GLY A 133 -9.388 -2.067 -6.248 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -10.911 0.395 -6.155 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -11.498 -0.765 -7.331 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.954 -1.490 -5.459 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.779 -2.110 -4.452 1.00 0.00 C ATOM 1748 C TRP A 134 -13.988 -3.571 -4.776 1.00 0.00 C ATOM 1749 O TRP A 134 -14.000 -3.962 -5.946 1.00 0.00 O ATOM 1750 CB TRP A 134 -15.121 -1.382 -4.340 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.963 0.082 -4.065 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.938 1.079 -4.988 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.789 0.709 -2.790 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.756 2.285 -4.374 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.660 2.090 -3.022 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.729 0.239 -1.478 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.475 3.005 -1.990 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.549 1.146 -0.456 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.423 2.515 -0.715 1.00 0.00 C ATOM 0 H TRP A 134 -13.468 -1.142 -6.268 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.272 -2.040 -3.490 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.680 -1.515 -5.266 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.710 -1.836 -3.543 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -15.046 0.938 -6.053 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -14.700 3.187 -4.847 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.822 -0.816 -1.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -14.376 4.062 -2.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.504 0.793 0.564 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.282 3.199 0.109 1.00 0.00 H new ATOM 1770 N THR A 135 -14.108 -4.369 -3.752 1.00 0.00 N ATOM 1771 CA THR A 135 -14.310 -5.791 -3.890 1.00 0.00 C ATOM 1772 C THR A 135 -15.765 -6.128 -4.256 1.00 0.00 C ATOM 1773 O THR A 135 -16.050 -7.165 -4.870 1.00 0.00 O ATOM 1774 CB THR A 135 -13.925 -6.488 -2.577 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.609 -5.844 -1.469 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.415 -6.419 -2.356 1.00 0.00 C ATOM 0 H THR A 135 -14.068 -4.050 -2.784 1.00 0.00 H new ATOM 0 HA THR A 135 -13.677 -6.147 -4.702 1.00 0.00 H new ATOM 0 HB THR A 135 -14.222 -7.535 -2.635 1.00 0.00 H new ATOM 0 HG1 THR A 135 -14.495 -6.381 -0.657 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.161 -6.918 -1.421 1.00 0.00 H new ATOM 0 HG22 THR A 135 -11.903 -6.913 -3.182 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.102 -5.376 -2.308 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.668 -5.240 -3.908 1.00 0.00 N ATOM 1785 CA ASN A 136 -18.084 -5.439 -4.126 1.00 0.00 C ATOM 1786 C ASN A 136 -18.706 -4.167 -4.586 1.00 0.00 C ATOM 1787 O ASN A 136 -18.055 -3.117 -4.594 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.803 -5.938 -2.852 1.00 0.00 C ATOM 1789 CG ASN A 136 -18.565 -7.402 -2.557 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -19.317 -8.263 -3.025 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -17.545 -7.699 -1.787 1.00 0.00 N ATOM 0 H ASN A 136 -16.439 -4.352 -3.462 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.194 -6.208 -4.891 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.469 -5.345 -2.000 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -19.874 -5.767 -2.959 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -17.348 -8.672 -1.554 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -16.949 -6.957 -1.421 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.946 -4.247 -4.952 1.00 0.00 N ATOM 1799 CA ASP A 137 -20.691 -3.112 -5.421 1.00 0.00 C ATOM 1800 C ASP A 137 -21.706 -2.751 -4.329 1.00 0.00 C ATOM 1801 O ASP A 137 -21.509 -3.113 -3.176 1.00 0.00 O ATOM 1802 CB ASP A 137 -21.363 -3.477 -6.757 1.00 0.00 C ATOM 1803 CG ASP A 137 -21.985 -2.297 -7.480 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -21.262 -1.532 -8.124 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -23.222 -2.114 -7.395 1.00 0.00 O ATOM 0 H ASP A 137 -20.482 -5.115 -4.935 1.00 0.00 H new ATOM 0 HA ASP A 137 -20.057 -2.245 -5.608 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -20.623 -3.940 -7.409 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -22.135 -4.224 -6.571 1.00 0.00 H new ATOM 1810 N ILE A 138 -22.745 -2.070 -4.671 1.00 0.00 N ATOM 1811 CA ILE A 138 -23.709 -1.591 -3.721 1.00 0.00 C ATOM 1812 C ILE A 138 -24.744 -2.693 -3.449 1.00 0.00 C ATOM 1813 O ILE A 138 -25.408 -3.163 -4.390 1.00 0.00 O ATOM 1814 CB ILE A 138 -24.419 -0.353 -4.321 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -23.392 0.669 -4.808 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -25.359 0.310 -3.309 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -23.997 1.690 -5.726 1.00 0.00 C ATOM 0 H ILE A 138 -22.959 -1.822 -5.637 1.00 0.00 H new ATOM 0 HA ILE A 138 -23.215 -1.322 -2.787 1.00 0.00 H new ATOM 0 HB ILE A 138 -25.016 -0.701 -5.164 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -22.949 1.173 -3.949 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -22.584 0.151 -5.326 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -25.838 1.175 -3.769 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -26.122 -0.404 -2.998 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -24.788 0.632 -2.438 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -23.228 2.394 -6.045 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -24.417 1.191 -6.599 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -24.786 2.228 -5.202 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.831 -3.184 -2.200 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.864 -4.134 -1.809 1.00 0.00 C ATOM 1831 C PRO A 139 -27.227 -3.423 -1.764 1.00 0.00 C ATOM 1832 O PRO A 139 -27.313 -2.254 -1.406 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.435 -4.596 -0.405 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.540 -3.526 0.104 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.912 -2.873 -1.089 1.00 0.00 C ATOM 0 HA PRO A 139 -25.968 -4.970 -2.500 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.299 -4.729 0.246 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -24.917 -5.554 -0.447 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -25.103 -2.799 0.689 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.777 -3.942 0.762 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -23.810 -1.797 -0.946 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.913 -3.266 -1.277 1.00 0.00 H new ATOM 1843 N ILE A 140 -28.265 -4.107 -2.148 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.577 -3.495 -2.221 1.00 0.00 C ATOM 1845 C ILE A 140 -30.389 -3.735 -0.934 1.00 0.00 C ATOM 1846 O ILE A 140 -30.570 -4.883 -0.509 1.00 0.00 O ATOM 1847 CB ILE A 140 -30.384 -3.953 -3.498 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.797 -3.381 -4.817 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.841 -3.573 -3.392 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -28.452 -3.934 -5.241 1.00 0.00 C ATOM 0 H ILE A 140 -28.237 -5.090 -2.418 1.00 0.00 H new ATOM 0 HA ILE A 140 -29.412 -2.422 -2.316 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.293 -5.039 -3.534 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -30.512 -3.564 -5.619 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -29.706 -2.300 -4.712 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -32.369 -3.902 -4.287 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -32.279 -4.051 -2.516 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -31.929 -2.491 -3.297 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -28.142 -3.462 -6.174 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -27.713 -3.727 -4.467 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.531 -5.011 -5.388 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.846 -2.641 -0.333 1.00 0.00 N ATOM 1863 CA CYS A 141 -31.648 -2.650 0.893 1.00 0.00 C ATOM 1864 C CYS A 141 -33.089 -3.019 0.601 1.00 0.00 C ATOM 1865 O CYS A 141 -33.813 -2.234 -0.016 1.00 0.00 O ATOM 1866 CB CYS A 141 -31.614 -1.268 1.538 1.00 0.00 C ATOM 1867 SG CYS A 141 -29.944 -0.680 1.925 1.00 0.00 S ATOM 0 H CYS A 141 -30.667 -1.702 -0.689 1.00 0.00 H new ATOM 0 HA CYS A 141 -31.224 -3.394 1.568 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -32.094 -0.554 0.869 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -32.202 -1.291 2.455 1.00 0.00 H new ATOM 1872 N GLU A 142 -33.506 -4.190 1.059 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.840 -4.719 0.807 1.00 0.00 C ATOM 1874 C GLU A 142 -35.254 -5.571 1.993 1.00 0.00 C ATOM 1875 O GLU A 142 -36.165 -5.185 2.741 1.00 0.00 O ATOM 1876 CB GLU A 142 -34.846 -5.574 -0.474 1.00 0.00 C ATOM 1877 CG GLU A 142 -34.605 -4.813 -1.763 1.00 0.00 C ATOM 1878 CD GLU A 142 -35.807 -4.075 -2.307 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.169 -3.003 -1.789 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -36.374 -4.534 -3.320 1.00 0.00 O ATOM 1881 OXT GLU A 142 -34.620 -6.630 2.219 1.00 0.00 O ATOM 0 H GLU A 142 -32.922 -4.807 1.623 1.00 0.00 H new ATOM 0 HA GLU A 142 -35.540 -3.894 0.673 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -34.082 -6.346 -0.379 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -35.807 -6.083 -0.546 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -33.802 -4.095 -1.598 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -34.255 -5.514 -2.521 1.00 0.00 H new TER 1888 GLU A 142