USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=29 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 91 THR OG1 : rot 177:sc= 0.279 USER MOD Set 1.2: A 112 TYR OH : rot -140:sc= -2.79! USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-1.8,f=0) USER MOD Single : A 29 ASN : amide:sc= -0.015 K(o=-0.015,f=-0.59) USER MOD Single : A 30 THR OG1 : rot 66:sc= 1.26 USER MOD Single : A 34 THR OG1 : rot 2:sc= 0.554 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 :FLIP amide:sc= 0 F(o=-0.91,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.00725 USER MOD Single : A 42 TYR OH : rot -109:sc= 0.722 USER MOD Single : A 46 THR OG1 : rot 76:sc= 0.909 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 50 TYR OH : rot 132:sc= -0.38 USER MOD Single : A 51 LYS NZ :NH3+ -160:sc= -0.0761 (180deg=-0.422) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -105:sc= 1.34 USER MOD Single : A 61 ASN : amide:sc= 1.12 K(o=1.1,f=-0.0015) USER MOD Single : A 64 MET CE :methyl -109:sc= -0.7 (180deg=-2.09!) USER MOD Single : A 68 LYS NZ :NH3+ -148:sc= 1.06 (180deg=0.168) USER MOD Single : A 75 ASN : amide:sc= -1.06 K(o=-1.1,f=-4!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.61) USER MOD Single : A 82 LYS NZ :NH3+ 178:sc= 2.19 (180deg=2.16) USER MOD Single : A 87 HIS : no HD1:sc= -0.294 X(o=-0.29,f=0.053) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.25 USER MOD Single : A 97 THR OG1 : rot 92:sc= -2.62! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.617 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 155:sc= 0.409 (180deg=-0.912!) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.191 USER MOD Single : A 115 ASN : amide:sc= 0.497 K(o=0.5,f=-4.3!) 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= 0.0748 K(o=0.075,f=-2.7!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot -78:sc= 1.11 USER MOD Single : A 135 THR OG1 : rot 178:sc= 0.972 USER MOD Single : A 136 ASN : amide:sc= -0.73 X(o=-0.73,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.401 -0.852 2.540 1.00 0.00 N ATOM 2 CA ASP A 20 29.826 -1.999 1.884 1.00 0.00 C ATOM 3 C ASP A 20 28.984 -2.784 2.867 1.00 0.00 C ATOM 4 O ASP A 20 29.438 -3.135 3.972 1.00 0.00 O ATOM 5 CB ASP A 20 30.928 -2.894 1.288 1.00 0.00 C ATOM 6 CG ASP A 20 31.877 -2.143 0.363 1.00 0.00 C ATOM 7 OD1 ASP A 20 31.574 -1.967 -0.836 1.00 0.00 O ATOM 8 OD2 ASP A 20 32.957 -1.722 0.822 1.00 0.00 O ATOM 0 HA ASP A 20 29.191 -1.653 1.068 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.501 -3.342 2.099 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.464 -3.711 0.736 1.00 0.00 H new ATOM 13 N CYS A 21 27.783 -3.046 2.478 1.00 0.00 N ATOM 14 CA CYS A 21 26.814 -3.730 3.292 1.00 0.00 C ATOM 15 C CYS A 21 27.100 -5.213 3.313 1.00 0.00 C ATOM 16 O CYS A 21 27.479 -5.789 2.304 1.00 0.00 O ATOM 17 CB CYS A 21 25.418 -3.473 2.741 1.00 0.00 C ATOM 18 SG CYS A 21 24.959 -1.712 2.704 1.00 0.00 S ATOM 0 H CYS A 21 27.429 -2.786 1.558 1.00 0.00 H new ATOM 0 HA CYS A 21 26.874 -3.353 4.313 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.356 -3.877 1.731 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.692 -4.016 3.347 1.00 0.00 H new ATOM 23 N ASN A 22 26.948 -5.823 4.468 1.00 0.00 N ATOM 24 CA ASN A 22 27.177 -7.262 4.629 1.00 0.00 C ATOM 25 C ASN A 22 25.847 -7.962 4.779 1.00 0.00 C ATOM 26 O ASN A 22 25.750 -9.070 5.336 1.00 0.00 O ATOM 27 CB ASN A 22 28.054 -7.549 5.858 1.00 0.00 C ATOM 28 CG ASN A 22 29.533 -7.240 5.681 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.862 -6.235 4.919 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 30.383 -7.912 6.254 1.00 0.00 N flip ATOM 0 H ASN A 22 26.664 -5.348 5.325 1.00 0.00 H new ATOM 0 HA ASN A 22 27.698 -7.633 3.746 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.675 -6.968 6.699 1.00 0.00 H new ATOM 0 HB3 ASN A 22 27.948 -8.601 6.123 1.00 0.00 H new ATOM 0 HD21 ASN A 22 30.102 -8.694 6.845 1.00 0.00 H new ATOM 0 HD22 ASN A 22 31.372 -7.689 6.139 1.00 0.00 H new ATOM 37 N GLU A 23 24.850 -7.330 4.230 1.00 0.00 N ATOM 38 CA GLU A 23 23.479 -7.754 4.289 1.00 0.00 C ATOM 39 C GLU A 23 22.801 -7.169 3.126 1.00 0.00 C ATOM 40 O GLU A 23 23.267 -6.171 2.533 1.00 0.00 O ATOM 41 CB GLU A 23 22.827 -7.245 5.579 1.00 0.00 C ATOM 42 CG GLU A 23 22.846 -5.719 5.671 1.00 0.00 C ATOM 43 CD GLU A 23 22.247 -5.168 6.931 1.00 0.00 C ATOM 44 OE1 GLU A 23 21.016 -4.941 6.981 1.00 0.00 O ATOM 45 OE2 GLU A 23 23.005 -4.914 7.891 1.00 0.00 O ATOM 0 H GLU A 23 24.976 -6.465 3.705 1.00 0.00 H new ATOM 0 HA GLU A 23 23.408 -8.842 4.280 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.797 -7.598 5.627 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.349 -7.666 6.439 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.877 -5.375 5.592 1.00 0.00 H new ATOM 0 HG3 GLU A 23 22.307 -5.309 4.817 1.00 0.00 H new ATOM 52 N LEU A 24 21.775 -7.814 2.766 1.00 0.00 N ATOM 53 CA LEU A 24 20.973 -7.475 1.753 1.00 0.00 C ATOM 54 C LEU A 24 19.952 -6.529 2.286 1.00 0.00 C ATOM 55 O LEU A 24 19.708 -6.500 3.500 1.00 0.00 O ATOM 56 CB LEU A 24 20.366 -8.771 1.233 1.00 0.00 C ATOM 57 CG LEU A 24 21.400 -9.808 0.862 1.00 0.00 C ATOM 58 CD1 LEU A 24 22.523 -9.251 0.060 1.00 0.00 C ATOM 59 CD2 LEU A 24 21.846 -10.567 2.022 1.00 0.00 C ATOM 0 H LEU A 24 21.476 -8.667 3.238 1.00 0.00 H new ATOM 0 HA LEU A 24 21.486 -6.976 0.931 1.00 0.00 H new ATOM 0 HB2 LEU A 24 19.703 -9.184 1.993 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.752 -8.552 0.360 1.00 0.00 H new ATOM 0 HG LEU A 24 20.905 -10.518 0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 24 23.232 -10.045 -0.174 1.00 0.00 H new ATOM 0 HD12 LEU A 24 22.134 -8.827 -0.866 1.00 0.00 H new ATOM 0 HD13 LEU A 24 23.027 -8.472 0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 24 22.589 -11.302 1.712 1.00 0.00 H new ATOM 0 HD22 LEU A 24 22.288 -9.889 2.752 1.00 0.00 H new ATOM 0 HD23 LEU A 24 20.995 -11.079 2.471 1.00 0.00 H new ATOM 71 N PRO A 25 19.386 -5.741 1.421 1.00 0.00 N ATOM 72 CA PRO A 25 18.416 -4.725 1.790 1.00 0.00 C ATOM 73 C PRO A 25 17.266 -5.332 2.593 1.00 0.00 C ATOM 74 O PRO A 25 16.668 -6.332 2.178 1.00 0.00 O ATOM 75 CB PRO A 25 17.930 -4.168 0.452 1.00 0.00 C ATOM 76 CG PRO A 25 18.447 -5.108 -0.593 1.00 0.00 C ATOM 77 CD PRO A 25 19.624 -5.812 0.001 1.00 0.00 C ATOM 0 HA PRO A 25 18.842 -3.951 2.428 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.842 -4.112 0.424 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.305 -3.158 0.289 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.677 -5.822 -0.885 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.736 -4.564 -1.493 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.688 -6.844 -0.343 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.561 -5.326 -0.272 1.00 0.00 H new ATOM 85 N PRO A 26 16.992 -4.797 3.783 1.00 0.00 N ATOM 86 CA PRO A 26 15.970 -5.341 4.633 1.00 0.00 C ATOM 87 C PRO A 26 14.580 -4.987 4.151 1.00 0.00 C ATOM 88 O PRO A 26 14.162 -3.808 4.191 1.00 0.00 O ATOM 89 CB PRO A 26 16.247 -4.735 6.006 1.00 0.00 C ATOM 90 CG PRO A 26 17.056 -3.500 5.753 1.00 0.00 C ATOM 91 CD PRO A 26 17.648 -3.618 4.373 1.00 0.00 C ATOM 0 HA PRO A 26 15.998 -6.431 4.645 1.00 0.00 H new ATOM 0 HB2 PRO A 26 15.317 -4.494 6.522 1.00 0.00 H new ATOM 0 HB3 PRO A 26 16.791 -5.435 6.640 1.00 0.00 H new ATOM 0 HG2 PRO A 26 16.430 -2.611 5.826 1.00 0.00 H new ATOM 0 HG3 PRO A 26 17.843 -3.398 6.500 1.00 0.00 H new ATOM 0 HD2 PRO A 26 17.457 -2.722 3.782 1.00 0.00 H new ATOM 0 HD3 PRO A 26 18.729 -3.747 4.416 1.00 0.00 H new ATOM 99 N ARG A 27 13.869 -5.996 3.677 1.00 0.00 N ATOM 100 CA ARG A 27 12.528 -5.791 3.207 1.00 0.00 C ATOM 101 C ARG A 27 11.589 -5.543 4.348 1.00 0.00 C ATOM 102 O ARG A 27 11.895 -5.882 5.504 1.00 0.00 O ATOM 103 CB ARG A 27 12.051 -6.845 2.157 1.00 0.00 C ATOM 104 CG ARG A 27 12.207 -8.345 2.490 1.00 0.00 C ATOM 105 CD ARG A 27 11.055 -8.945 3.305 1.00 0.00 C ATOM 106 NE ARG A 27 11.009 -8.513 4.703 1.00 0.00 N ATOM 107 CZ ARG A 27 10.026 -8.832 5.566 1.00 0.00 C ATOM 108 NH1 ARG A 27 9.021 -9.620 5.189 1.00 0.00 N ATOM 109 NH2 ARG A 27 10.061 -8.372 6.807 1.00 0.00 N ATOM 0 H ARG A 27 14.204 -6.957 3.611 1.00 0.00 H new ATOM 0 HA ARG A 27 12.525 -4.873 2.620 1.00 0.00 H new ATOM 0 HB2 ARG A 27 10.996 -6.659 1.957 1.00 0.00 H new ATOM 0 HB3 ARG A 27 12.590 -6.654 1.229 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.303 -8.902 1.558 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.136 -8.486 3.042 1.00 0.00 H new ATOM 0 HD2 ARG A 27 10.112 -8.682 2.826 1.00 0.00 H new ATOM 0 HD3 ARG A 27 11.134 -10.032 3.276 1.00 0.00 H new ATOM 0 HE ARG A 27 11.773 -7.931 5.046 1.00 0.00 H new ATOM 0 HH11 ARG A 27 8.991 -9.988 4.238 1.00 0.00 H new ATOM 0 HH12 ARG A 27 8.282 -9.855 5.851 1.00 0.00 H new ATOM 0 HH21 ARG A 27 10.832 -7.776 7.109 1.00 0.00 H new ATOM 0 HH22 ARG A 27 9.317 -8.613 7.461 1.00 0.00 H new ATOM 123 N ARG A 28 10.467 -4.988 4.060 1.00 0.00 N ATOM 124 CA ARG A 28 9.614 -4.493 5.106 1.00 0.00 C ATOM 125 C ARG A 28 8.269 -5.148 5.003 1.00 0.00 C ATOM 126 O ARG A 28 8.078 -6.048 4.195 1.00 0.00 O ATOM 127 CB ARG A 28 9.486 -2.959 4.974 1.00 0.00 C ATOM 128 CG ARG A 28 10.830 -2.240 4.892 1.00 0.00 C ATOM 129 CD ARG A 28 10.683 -0.746 4.665 1.00 0.00 C ATOM 130 NE ARG A 28 10.196 -0.007 5.844 1.00 0.00 N ATOM 131 CZ ARG A 28 9.662 1.230 5.788 1.00 0.00 C ATOM 132 NH1 ARG A 28 9.116 1.669 4.663 1.00 0.00 N ATOM 133 NH2 ARG A 28 9.563 1.958 6.885 1.00 0.00 N ATOM 0 H ARG A 28 10.109 -4.860 3.113 1.00 0.00 H new ATOM 0 HA ARG A 28 10.041 -4.727 6.081 1.00 0.00 H new ATOM 0 HB2 ARG A 28 8.904 -2.726 4.082 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.929 -2.574 5.828 1.00 0.00 H new ATOM 0 HG2 ARG A 28 11.385 -2.410 5.814 1.00 0.00 H new ATOM 0 HG3 ARG A 28 11.419 -2.670 4.082 1.00 0.00 H new ATOM 0 HD2 ARG A 28 11.648 -0.337 4.366 1.00 0.00 H new ATOM 0 HD3 ARG A 28 9.996 -0.581 3.835 1.00 0.00 H new ATOM 0 HE ARG A 28 10.267 -0.458 6.756 1.00 0.00 H new ATOM 0 HH11 ARG A 28 9.099 1.071 3.837 1.00 0.00 H new ATOM 0 HH12 ARG A 28 8.713 2.605 4.623 1.00 0.00 H new ATOM 0 HH21 ARG A 28 9.891 1.585 7.776 1.00 0.00 H new ATOM 0 HH22 ARG A 28 9.159 2.894 6.841 1.00 0.00 H new ATOM 147 N ASN A 29 7.341 -4.715 5.811 1.00 0.00 N ATOM 148 CA ASN A 29 5.999 -5.251 5.745 1.00 0.00 C ATOM 149 C ASN A 29 5.188 -4.402 4.771 1.00 0.00 C ATOM 150 O ASN A 29 4.110 -4.775 4.337 1.00 0.00 O ATOM 151 CB ASN A 29 5.347 -5.261 7.135 1.00 0.00 C ATOM 152 CG ASN A 29 3.983 -5.939 7.153 1.00 0.00 C ATOM 153 OD1 ASN A 29 3.717 -6.879 6.398 1.00 0.00 O ATOM 154 ND2 ASN A 29 3.116 -5.476 7.997 1.00 0.00 N ATOM 0 H ASN A 29 7.482 -3.997 6.521 1.00 0.00 H new ATOM 0 HA ASN A 29 6.031 -6.283 5.395 1.00 0.00 H new ATOM 0 HB2 ASN A 29 6.008 -5.771 7.836 1.00 0.00 H new ATOM 0 HB3 ASN A 29 5.240 -4.235 7.487 1.00 0.00 H new ATOM 0 HD21 ASN A 29 2.185 -5.889 8.050 1.00 0.00 H new ATOM 0 HD22 ASN A 29 3.364 -4.698 8.608 1.00 0.00 H new ATOM 161 N THR A 30 5.724 -3.253 4.442 1.00 0.00 N ATOM 162 CA THR A 30 5.116 -2.358 3.498 1.00 0.00 C ATOM 163 C THR A 30 5.761 -2.472 2.110 1.00 0.00 C ATOM 164 O THR A 30 5.088 -2.364 1.105 1.00 0.00 O ATOM 165 CB THR A 30 5.202 -0.922 4.026 1.00 0.00 C ATOM 166 OG1 THR A 30 6.503 -0.729 4.640 1.00 0.00 O ATOM 167 CG2 THR A 30 4.107 -0.663 5.053 1.00 0.00 C ATOM 0 H THR A 30 6.604 -2.912 4.828 1.00 0.00 H new ATOM 0 HA THR A 30 4.068 -2.637 3.384 1.00 0.00 H new ATOM 0 HB THR A 30 5.069 -0.225 3.199 1.00 0.00 H new ATOM 0 HG1 THR A 30 7.201 -0.793 3.955 1.00 0.00 H new ATOM 0 HG21 THR A 30 4.184 0.362 5.417 1.00 0.00 H new ATOM 0 HG22 THR A 30 3.131 -0.811 4.590 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.221 -1.354 5.888 1.00 0.00 H new ATOM 175 N GLU A 31 7.057 -2.736 2.069 1.00 0.00 N ATOM 176 CA GLU A 31 7.769 -2.824 0.805 1.00 0.00 C ATOM 177 C GLU A 31 8.418 -4.171 0.611 1.00 0.00 C ATOM 178 O GLU A 31 8.925 -4.783 1.562 1.00 0.00 O ATOM 179 CB GLU A 31 8.841 -1.754 0.655 1.00 0.00 C ATOM 180 CG GLU A 31 8.355 -0.332 0.495 1.00 0.00 C ATOM 181 CD GLU A 31 7.796 0.246 1.765 1.00 0.00 C ATOM 182 OE1 GLU A 31 8.349 -0.028 2.838 1.00 0.00 O ATOM 183 OE2 GLU A 31 6.791 0.940 1.726 1.00 0.00 O ATOM 0 H GLU A 31 7.636 -2.893 2.894 1.00 0.00 H new ATOM 0 HA GLU A 31 7.005 -2.670 0.043 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.490 -1.796 1.529 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.455 -2.004 -0.210 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.181 0.291 0.152 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.589 -0.301 -0.279 1.00 0.00 H new ATOM 190 N ILE A 32 8.452 -4.596 -0.627 1.00 0.00 N ATOM 191 CA ILE A 32 9.020 -5.874 -1.009 1.00 0.00 C ATOM 192 C ILE A 32 10.179 -5.623 -1.986 1.00 0.00 C ATOM 193 O ILE A 32 10.107 -4.700 -2.800 1.00 0.00 O ATOM 194 CB ILE A 32 7.951 -6.773 -1.706 1.00 0.00 C ATOM 195 CG1 ILE A 32 6.701 -6.910 -0.830 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.528 -8.148 -1.986 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.592 -7.741 -1.459 1.00 0.00 C ATOM 0 H ILE A 32 8.082 -4.060 -1.412 1.00 0.00 H new ATOM 0 HA ILE A 32 9.372 -6.387 -0.114 1.00 0.00 H new ATOM 0 HB ILE A 32 7.670 -6.299 -2.647 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.984 -7.361 0.121 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.314 -5.915 -0.608 1.00 0.00 H new ATOM 0 HG21 ILE A 32 7.774 -8.767 -2.472 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.395 -8.052 -2.639 1.00 0.00 H new ATOM 0 HG23 ILE A 32 8.830 -8.614 -1.048 1.00 0.00 H new ATOM 0 HD11 ILE A 32 4.743 -7.790 -0.777 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.279 -7.280 -2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 32 5.959 -8.749 -1.655 1.00 0.00 H new ATOM 209 N LEU A 33 11.224 -6.427 -1.910 1.00 0.00 N ATOM 210 CA LEU A 33 12.383 -6.266 -2.774 1.00 0.00 C ATOM 211 C LEU A 33 12.140 -6.722 -4.183 1.00 0.00 C ATOM 212 O LEU A 33 11.660 -7.830 -4.413 1.00 0.00 O ATOM 213 CB LEU A 33 13.597 -7.012 -2.224 1.00 0.00 C ATOM 214 CG LEU A 33 14.379 -6.313 -1.143 1.00 0.00 C ATOM 215 CD1 LEU A 33 15.393 -7.267 -0.520 1.00 0.00 C ATOM 216 CD2 LEU A 33 15.084 -5.109 -1.744 1.00 0.00 C ATOM 0 H LEU A 33 11.295 -7.205 -1.254 1.00 0.00 H new ATOM 0 HA LEU A 33 12.578 -5.194 -2.792 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.260 -7.973 -1.835 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.273 -7.223 -3.053 1.00 0.00 H new ATOM 0 HG LEU A 33 13.700 -5.982 -0.358 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.950 -6.747 0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 33 14.871 -8.120 -0.086 1.00 0.00 H new ATOM 0 HD13 LEU A 33 16.083 -7.617 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 33 15.653 -4.596 -0.969 1.00 0.00 H new ATOM 0 HD22 LEU A 33 15.761 -5.439 -2.532 1.00 0.00 H new ATOM 0 HD23 LEU A 33 14.345 -4.426 -2.163 1.00 0.00 H new ATOM 228 N THR A 34 12.447 -5.856 -5.114 1.00 0.00 N ATOM 229 CA THR A 34 12.478 -6.207 -6.496 1.00 0.00 C ATOM 230 C THR A 34 13.919 -6.126 -6.961 1.00 0.00 C ATOM 231 O THR A 34 14.473 -5.036 -7.135 1.00 0.00 O ATOM 232 CB THR A 34 11.533 -5.325 -7.360 1.00 0.00 C ATOM 233 OG1 THR A 34 11.705 -3.924 -7.056 1.00 0.00 O ATOM 234 CG2 THR A 34 10.090 -5.713 -7.126 1.00 0.00 C ATOM 0 H THR A 34 12.683 -4.882 -4.925 1.00 0.00 H new ATOM 0 HA THR A 34 12.102 -7.223 -6.621 1.00 0.00 H new ATOM 0 HB THR A 34 11.791 -5.491 -8.406 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.415 -3.819 -6.389 1.00 0.00 H new ATOM 0 HG21 THR A 34 9.441 -5.087 -7.738 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.946 -6.759 -7.397 1.00 0.00 H new ATOM 0 HG23 THR A 34 9.842 -5.574 -6.074 1.00 0.00 H new ATOM 242 N GLY A 35 14.537 -7.270 -7.038 1.00 0.00 N ATOM 243 CA GLY A 35 15.918 -7.381 -7.382 1.00 0.00 C ATOM 244 C GLY A 35 16.456 -8.657 -6.806 1.00 0.00 C ATOM 245 O GLY A 35 15.766 -9.309 -6.012 1.00 0.00 O ATOM 0 H GLY A 35 14.083 -8.166 -6.859 1.00 0.00 H new ATOM 0 HA2 GLY A 35 16.039 -7.375 -8.465 1.00 0.00 H new ATOM 0 HA3 GLY A 35 16.474 -6.527 -6.994 1.00 0.00 H new ATOM 249 N SER A 36 17.644 -9.015 -7.162 1.00 0.00 N ATOM 250 CA SER A 36 18.211 -10.256 -6.712 1.00 0.00 C ATOM 251 C SER A 36 19.270 -10.023 -5.632 1.00 0.00 C ATOM 252 O SER A 36 20.343 -9.458 -5.891 1.00 0.00 O ATOM 253 CB SER A 36 18.783 -11.003 -7.909 1.00 0.00 C ATOM 254 OG SER A 36 17.772 -11.181 -8.905 1.00 0.00 O ATOM 0 H SER A 36 18.251 -8.465 -7.769 1.00 0.00 H new ATOM 0 HA SER A 36 17.431 -10.865 -6.256 1.00 0.00 H new ATOM 0 HB2 SER A 36 19.623 -10.448 -8.327 1.00 0.00 H new ATOM 0 HB3 SER A 36 19.168 -11.973 -7.593 1.00 0.00 H new ATOM 0 HG SER A 36 18.149 -11.661 -9.672 1.00 0.00 H new ATOM 260 N TRP A 37 18.958 -10.419 -4.414 1.00 0.00 N ATOM 261 CA TRP A 37 19.864 -10.255 -3.301 1.00 0.00 C ATOM 262 C TRP A 37 19.925 -11.566 -2.561 1.00 0.00 C ATOM 263 O TRP A 37 19.188 -11.788 -1.597 1.00 0.00 O ATOM 264 CB TRP A 37 19.394 -9.154 -2.330 1.00 0.00 C ATOM 265 CG TRP A 37 18.687 -8.009 -3.011 1.00 0.00 C ATOM 266 CD1 TRP A 37 17.350 -7.906 -3.232 1.00 0.00 C ATOM 267 CD2 TRP A 37 19.275 -6.831 -3.583 1.00 0.00 C ATOM 268 NE1 TRP A 37 17.063 -6.736 -3.876 1.00 0.00 N ATOM 269 CE2 TRP A 37 18.226 -6.059 -4.111 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.578 -6.354 -3.690 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.444 -4.838 -4.738 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.792 -5.144 -4.314 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.731 -4.400 -4.829 1.00 0.00 C ATOM 0 H TRP A 37 18.072 -10.862 -4.171 1.00 0.00 H new ATOM 0 HA TRP A 37 20.841 -9.960 -3.685 1.00 0.00 H new ATOM 0 HB2 TRP A 37 18.725 -9.595 -1.591 1.00 0.00 H new ATOM 0 HB3 TRP A 37 20.257 -8.767 -1.788 1.00 0.00 H new ATOM 0 HD1 TRP A 37 16.618 -8.645 -2.940 1.00 0.00 H new ATOM 0 HE1 TRP A 37 16.130 -6.419 -4.139 1.00 0.00 H new ATOM 0 HE3 TRP A 37 21.406 -6.921 -3.291 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.625 -4.259 -5.138 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.799 -4.765 -4.406 1.00 0.00 H new ATOM 0 HH2 TRP A 37 19.934 -3.455 -5.311 1.00 0.00 H new ATOM 284 N SER A 38 20.721 -12.449 -3.050 1.00 0.00 N ATOM 285 CA SER A 38 20.853 -13.749 -2.460 1.00 0.00 C ATOM 286 C SER A 38 22.192 -13.877 -1.772 1.00 0.00 C ATOM 287 O SER A 38 22.495 -14.908 -1.168 1.00 0.00 O ATOM 288 CB SER A 38 20.715 -14.812 -3.549 1.00 0.00 C ATOM 289 OG SER A 38 19.473 -14.676 -4.230 1.00 0.00 O ATOM 0 H SER A 38 21.304 -12.298 -3.873 1.00 0.00 H new ATOM 0 HA SER A 38 20.069 -13.890 -1.715 1.00 0.00 H new ATOM 0 HB2 SER A 38 21.537 -14.721 -4.259 1.00 0.00 H new ATOM 0 HB3 SER A 38 20.786 -15.805 -3.106 1.00 0.00 H new ATOM 0 HG SER A 38 19.404 -15.364 -4.924 1.00 0.00 H new ATOM 295 N ASP A 39 22.996 -12.836 -1.868 1.00 0.00 N ATOM 296 CA ASP A 39 24.327 -12.895 -1.300 1.00 0.00 C ATOM 297 C ASP A 39 24.340 -12.333 0.105 1.00 0.00 C ATOM 298 O ASP A 39 23.490 -12.688 0.897 1.00 0.00 O ATOM 299 CB ASP A 39 25.386 -12.264 -2.243 1.00 0.00 C ATOM 300 CG ASP A 39 26.835 -12.567 -1.855 1.00 0.00 C ATOM 301 OD1 ASP A 39 27.325 -13.664 -2.162 1.00 0.00 O ATOM 302 OD2 ASP A 39 27.490 -11.716 -1.209 1.00 0.00 O ATOM 0 H ASP A 39 22.757 -11.956 -2.325 1.00 0.00 H new ATOM 0 HA ASP A 39 24.619 -13.941 -1.209 1.00 0.00 H new ATOM 0 HB2 ASP A 39 25.211 -12.622 -3.258 1.00 0.00 H new ATOM 0 HB3 ASP A 39 25.244 -11.183 -2.258 1.00 0.00 H new ATOM 307 N GLN A 40 25.322 -11.540 0.419 1.00 0.00 N ATOM 308 CA GLN A 40 25.431 -10.860 1.670 1.00 0.00 C ATOM 309 C GLN A 40 26.032 -9.523 1.414 1.00 0.00 C ATOM 310 O GLN A 40 25.454 -8.502 1.711 1.00 0.00 O ATOM 311 CB GLN A 40 26.315 -11.608 2.679 1.00 0.00 C ATOM 312 CG GLN A 40 25.729 -12.894 3.245 1.00 0.00 C ATOM 313 CD GLN A 40 26.667 -13.567 4.227 1.00 0.00 C ATOM 314 OE1 GLN A 40 27.949 -13.505 3.969 1.00 0.00 O flip ATOM 315 NE2 GLN A 40 26.231 -14.190 5.191 1.00 0.00 N flip ATOM 0 H GLN A 40 26.096 -11.344 -0.215 1.00 0.00 H new ATOM 0 HA GLN A 40 24.433 -10.789 2.102 1.00 0.00 H new ATOM 0 HB2 GLN A 40 27.264 -11.844 2.198 1.00 0.00 H new ATOM 0 HB3 GLN A 40 26.537 -10.936 3.508 1.00 0.00 H new ATOM 0 HG2 GLN A 40 24.784 -12.673 3.741 1.00 0.00 H new ATOM 0 HG3 GLN A 40 25.507 -13.581 2.428 1.00 0.00 H new ATOM 0 HE21 GLN A 40 25.227 -14.220 5.367 1.00 0.00 H new ATOM 0 HE22 GLN A 40 26.873 -14.677 5.816 1.00 0.00 H new ATOM 324 N THR A 41 27.164 -9.527 0.799 1.00 0.00 N ATOM 325 CA THR A 41 27.888 -8.325 0.646 1.00 0.00 C ATOM 326 C THR A 41 27.579 -7.589 -0.646 1.00 0.00 C ATOM 327 O THR A 41 27.593 -8.170 -1.746 1.00 0.00 O ATOM 328 CB THR A 41 29.380 -8.571 0.827 1.00 0.00 C ATOM 329 OG1 THR A 41 29.789 -9.672 -0.012 1.00 0.00 O ATOM 330 CG2 THR A 41 29.684 -8.916 2.277 1.00 0.00 C ATOM 0 H THR A 41 27.604 -10.354 0.395 1.00 0.00 H new ATOM 0 HA THR A 41 27.554 -7.654 1.437 1.00 0.00 H new ATOM 0 HB THR A 41 29.922 -7.667 0.551 1.00 0.00 H new ATOM 0 HG1 THR A 41 30.749 -9.831 0.102 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.754 -9.090 2.393 1.00 0.00 H new ATOM 0 HG22 THR A 41 29.379 -8.090 2.919 1.00 0.00 H new ATOM 0 HG23 THR A 41 29.138 -9.816 2.559 1.00 0.00 H new ATOM 338 N TYR A 42 27.278 -6.329 -0.492 1.00 0.00 N ATOM 339 CA TYR A 42 27.006 -5.433 -1.577 1.00 0.00 C ATOM 340 C TYR A 42 27.763 -4.148 -1.388 1.00 0.00 C ATOM 341 O TYR A 42 27.797 -3.608 -0.283 1.00 0.00 O ATOM 342 CB TYR A 42 25.511 -5.154 -1.738 1.00 0.00 C ATOM 343 CG TYR A 42 24.817 -6.120 -2.657 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.759 -5.859 -4.017 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.232 -7.279 -2.185 1.00 0.00 C ATOM 346 CE1 TYR A 42 24.139 -6.717 -4.888 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.598 -8.161 -3.056 1.00 0.00 C ATOM 348 CZ TYR A 42 23.559 -7.866 -4.414 1.00 0.00 C ATOM 349 OH TYR A 42 22.933 -8.723 -5.309 1.00 0.00 O ATOM 0 H TYR A 42 27.214 -5.885 0.424 1.00 0.00 H new ATOM 0 HA TYR A 42 27.341 -5.919 -2.493 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.035 -5.191 -0.758 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.377 -4.142 -2.119 1.00 0.00 H new ATOM 0 HD1 TYR A 42 25.214 -4.957 -4.400 1.00 0.00 H new ATOM 0 HD2 TYR A 42 24.267 -7.503 -1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 42 24.107 -6.489 -5.943 1.00 0.00 H new ATOM 0 HE2 TYR A 42 23.141 -9.065 -2.681 1.00 0.00 H new ATOM 0 HH TYR A 42 21.963 -8.683 -5.176 1.00 0.00 H new ATOM 359 N PRO A 43 28.393 -3.655 -2.459 1.00 0.00 N ATOM 360 CA PRO A 43 29.190 -2.431 -2.426 1.00 0.00 C ATOM 361 C PRO A 43 28.380 -1.190 -2.023 1.00 0.00 C ATOM 362 O PRO A 43 27.164 -1.097 -2.306 1.00 0.00 O ATOM 363 CB PRO A 43 29.701 -2.291 -3.869 1.00 0.00 C ATOM 364 CG PRO A 43 28.810 -3.153 -4.688 1.00 0.00 C ATOM 365 CD PRO A 43 28.398 -4.275 -3.799 1.00 0.00 C ATOM 0 HA PRO A 43 29.981 -2.497 -1.679 1.00 0.00 H new ATOM 0 HB2 PRO A 43 29.659 -1.254 -4.202 1.00 0.00 H new ATOM 0 HB3 PRO A 43 30.740 -2.610 -3.951 1.00 0.00 H new ATOM 0 HG2 PRO A 43 27.942 -2.595 -5.040 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.330 -3.525 -5.571 1.00 0.00 H new ATOM 0 HD2 PRO A 43 27.415 -4.662 -4.068 1.00 0.00 H new ATOM 0 HD3 PRO A 43 29.096 -5.110 -3.854 1.00 0.00 H new ATOM 373 N GLU A 44 29.040 -0.245 -1.363 1.00 0.00 N ATOM 374 CA GLU A 44 28.404 0.995 -0.957 1.00 0.00 C ATOM 375 C GLU A 44 28.011 1.753 -2.213 1.00 0.00 C ATOM 376 O GLU A 44 28.800 1.843 -3.176 1.00 0.00 O ATOM 377 CB GLU A 44 29.329 1.878 -0.097 1.00 0.00 C ATOM 378 CG GLU A 44 28.573 3.008 0.608 1.00 0.00 C ATOM 379 CD GLU A 44 29.450 4.038 1.292 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.148 4.797 0.591 1.00 0.00 O ATOM 381 OE2 GLU A 44 29.385 4.166 2.537 1.00 0.00 O ATOM 0 H GLU A 44 30.022 -0.319 -1.098 1.00 0.00 H new ATOM 0 HA GLU A 44 27.535 0.752 -0.345 1.00 0.00 H new ATOM 0 HB2 GLU A 44 29.827 1.258 0.649 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.108 2.305 -0.728 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.945 3.516 -0.124 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.906 2.570 1.351 1.00 0.00 H new ATOM 388 N GLY A 45 26.824 2.264 -2.227 1.00 0.00 N ATOM 389 CA GLY A 45 26.338 2.942 -3.383 1.00 0.00 C ATOM 390 C GLY A 45 25.469 2.037 -4.209 1.00 0.00 C ATOM 391 O GLY A 45 25.215 2.304 -5.375 1.00 0.00 O ATOM 0 H GLY A 45 26.169 2.224 -1.446 1.00 0.00 H new ATOM 0 HA2 GLY A 45 25.770 3.822 -3.081 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.177 3.294 -3.983 1.00 0.00 H new ATOM 395 N THR A 46 25.054 0.931 -3.628 1.00 0.00 N ATOM 396 CA THR A 46 24.135 0.034 -4.312 1.00 0.00 C ATOM 397 C THR A 46 22.705 0.326 -3.940 1.00 0.00 C ATOM 398 O THR A 46 22.350 0.246 -2.779 1.00 0.00 O ATOM 399 CB THR A 46 24.469 -1.449 -4.063 1.00 0.00 C ATOM 400 OG1 THR A 46 25.808 -1.720 -4.484 1.00 0.00 O ATOM 401 CG2 THR A 46 23.500 -2.381 -4.785 1.00 0.00 C ATOM 0 H THR A 46 25.332 0.630 -2.694 1.00 0.00 H new ATOM 0 HA THR A 46 24.258 0.219 -5.379 1.00 0.00 H new ATOM 0 HB THR A 46 24.371 -1.636 -2.994 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.437 -1.362 -3.823 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.772 -3.417 -4.582 1.00 0.00 H new ATOM 0 HG22 THR A 46 22.486 -2.196 -4.431 1.00 0.00 H new ATOM 0 HG23 THR A 46 23.549 -2.196 -5.858 1.00 0.00 H new ATOM 409 N GLN A 47 21.904 0.678 -4.922 1.00 0.00 N ATOM 410 CA GLN A 47 20.532 1.010 -4.682 1.00 0.00 C ATOM 411 C GLN A 47 19.629 -0.216 -4.761 1.00 0.00 C ATOM 412 O GLN A 47 19.914 -1.177 -5.470 1.00 0.00 O ATOM 413 CB GLN A 47 20.072 2.123 -5.621 1.00 0.00 C ATOM 414 CG GLN A 47 20.074 1.769 -7.103 1.00 0.00 C ATOM 415 CD GLN A 47 19.918 2.996 -7.980 1.00 0.00 C ATOM 416 OE1 GLN A 47 19.277 4.015 -7.464 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 20.397 3.031 -9.110 1.00 0.00 N flip ATOM 0 H GLN A 47 22.190 0.739 -5.899 1.00 0.00 H new ATOM 0 HA GLN A 47 20.453 1.386 -3.662 1.00 0.00 H new ATOM 0 HB2 GLN A 47 19.063 2.421 -5.337 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.714 2.991 -5.471 1.00 0.00 H new ATOM 0 HG2 GLN A 47 21.005 1.261 -7.353 1.00 0.00 H new ATOM 0 HG3 GLN A 47 19.264 1.070 -7.310 1.00 0.00 H new ATOM 0 HE21 GLN A 47 20.890 2.219 -9.480 1.00 0.00 H new ATOM 0 HE22 GLN A 47 20.302 3.873 -9.678 1.00 0.00 H new ATOM 426 N ALA A 48 18.575 -0.173 -4.016 1.00 0.00 N ATOM 427 CA ALA A 48 17.605 -1.216 -3.956 1.00 0.00 C ATOM 428 C ALA A 48 16.261 -0.639 -4.304 1.00 0.00 C ATOM 429 O ALA A 48 15.872 0.416 -3.781 1.00 0.00 O ATOM 430 CB ALA A 48 17.572 -1.825 -2.569 1.00 0.00 C ATOM 0 H ALA A 48 18.357 0.618 -3.410 1.00 0.00 H new ATOM 0 HA ALA A 48 17.865 -2.003 -4.664 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.827 -2.620 -2.538 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.552 -2.237 -2.329 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.313 -1.057 -1.840 1.00 0.00 H new ATOM 436 N ILE A 49 15.576 -1.292 -5.193 1.00 0.00 N ATOM 437 CA ILE A 49 14.289 -0.847 -5.642 1.00 0.00 C ATOM 438 C ILE A 49 13.224 -1.672 -4.946 1.00 0.00 C ATOM 439 O ILE A 49 13.288 -2.915 -4.943 1.00 0.00 O ATOM 440 CB ILE A 49 14.159 -1.016 -7.175 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.308 -0.273 -7.874 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.808 -0.486 -7.657 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.380 -0.494 -9.372 1.00 0.00 C ATOM 0 H ILE A 49 15.896 -2.156 -5.632 1.00 0.00 H new ATOM 0 HA ILE A 49 14.167 0.209 -5.403 1.00 0.00 H new ATOM 0 HB ILE A 49 14.217 -2.076 -7.424 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.204 0.795 -7.682 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.252 -0.587 -7.427 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.732 -0.612 -8.737 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.005 -1.039 -7.170 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.722 0.572 -7.408 1.00 0.00 H new ATOM 0 HD11 ILE A 49 16.219 0.067 -9.783 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.518 -1.556 -9.577 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.454 -0.153 -9.835 1.00 0.00 H new ATOM 455 N TYR A 50 12.300 -1.006 -4.323 1.00 0.00 N ATOM 456 CA TYR A 50 11.242 -1.666 -3.622 1.00 0.00 C ATOM 457 C TYR A 50 9.908 -1.516 -4.301 1.00 0.00 C ATOM 458 O TYR A 50 9.593 -0.467 -4.886 1.00 0.00 O ATOM 459 CB TYR A 50 11.130 -1.145 -2.207 1.00 0.00 C ATOM 460 CG TYR A 50 12.194 -1.633 -1.270 1.00 0.00 C ATOM 461 CD1 TYR A 50 13.377 -0.941 -1.108 1.00 0.00 C ATOM 462 CD2 TYR A 50 12.001 -2.785 -0.526 1.00 0.00 C ATOM 463 CE1 TYR A 50 14.336 -1.387 -0.234 1.00 0.00 C ATOM 464 CE2 TYR A 50 12.956 -3.235 0.348 1.00 0.00 C ATOM 465 CZ TYR A 50 14.122 -2.529 0.493 1.00 0.00 C ATOM 466 OH TYR A 50 15.081 -2.963 1.369 1.00 0.00 O ATOM 0 H TYR A 50 12.259 0.013 -4.286 1.00 0.00 H new ATOM 0 HA TYR A 50 11.501 -2.725 -3.616 1.00 0.00 H new ATOM 0 HB2 TYR A 50 11.160 -0.056 -2.233 1.00 0.00 H new ATOM 0 HB3 TYR A 50 10.156 -1.428 -1.807 1.00 0.00 H new ATOM 0 HD1 TYR A 50 13.550 -0.038 -1.675 1.00 0.00 H new ATOM 0 HD2 TYR A 50 11.081 -3.339 -0.637 1.00 0.00 H new ATOM 0 HE1 TYR A 50 15.259 -0.838 -0.119 1.00 0.00 H new ATOM 0 HE2 TYR A 50 12.791 -4.138 0.917 1.00 0.00 H new ATOM 0 HH TYR A 50 14.666 -3.168 2.233 1.00 0.00 H new ATOM 476 N LYS A 51 9.145 -2.571 -4.228 1.00 0.00 N ATOM 477 CA LYS A 51 7.805 -2.606 -4.642 1.00 0.00 C ATOM 478 C LYS A 51 6.975 -2.278 -3.427 1.00 0.00 C ATOM 479 O LYS A 51 7.152 -2.884 -2.378 1.00 0.00 O ATOM 480 CB LYS A 51 7.500 -4.009 -5.148 1.00 0.00 C ATOM 481 CG LYS A 51 6.045 -4.309 -5.376 1.00 0.00 C ATOM 482 CD LYS A 51 5.869 -5.706 -5.909 1.00 0.00 C ATOM 483 CE LYS A 51 6.189 -5.812 -7.398 1.00 0.00 C ATOM 484 NZ LYS A 51 5.258 -5.015 -8.228 1.00 0.00 N ATOM 0 H LYS A 51 9.474 -3.463 -3.858 1.00 0.00 H new ATOM 0 HA LYS A 51 7.592 -1.898 -5.443 1.00 0.00 H new ATOM 0 HB2 LYS A 51 8.037 -4.164 -6.084 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.894 -4.729 -4.431 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.495 -4.198 -4.442 1.00 0.00 H new ATOM 0 HG3 LYS A 51 5.626 -3.590 -6.080 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.514 -6.387 -5.353 1.00 0.00 H new ATOM 0 HD3 LYS A 51 4.842 -6.029 -5.738 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.210 -5.473 -7.573 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.143 -6.857 -7.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.280 -5.364 -9.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.293 -5.104 -7.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 5.546 -4.016 -8.210 1.00 0.00 H new ATOM 498 N CYS A 52 6.085 -1.355 -3.578 1.00 0.00 N ATOM 499 CA CYS A 52 5.243 -0.844 -2.493 1.00 0.00 C ATOM 500 C CYS A 52 4.184 -1.827 -2.014 1.00 0.00 C ATOM 501 O CYS A 52 3.376 -1.467 -1.204 1.00 0.00 O ATOM 502 CB CYS A 52 4.515 0.379 -2.995 1.00 0.00 C ATOM 503 SG CYS A 52 5.567 1.782 -3.456 1.00 0.00 S ATOM 0 H CYS A 52 5.901 -0.908 -4.476 1.00 0.00 H new ATOM 0 HA CYS A 52 5.910 -0.641 -1.655 1.00 0.00 H new ATOM 0 HB2 CYS A 52 3.919 0.095 -3.862 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.819 0.708 -2.223 1.00 0.00 H new ATOM 508 N ARG A 53 4.226 -3.057 -2.498 1.00 0.00 N ATOM 509 CA ARG A 53 3.167 -4.062 -2.271 1.00 0.00 C ATOM 510 C ARG A 53 1.905 -3.725 -3.062 1.00 0.00 C ATOM 511 O ARG A 53 1.667 -2.564 -3.445 1.00 0.00 O ATOM 512 CB ARG A 53 2.777 -4.248 -0.780 1.00 0.00 C ATOM 513 CG ARG A 53 3.730 -5.046 0.062 1.00 0.00 C ATOM 514 CD ARG A 53 3.221 -5.129 1.485 1.00 0.00 C ATOM 515 NE ARG A 53 1.843 -5.646 1.559 1.00 0.00 N ATOM 516 CZ ARG A 53 1.007 -5.482 2.598 1.00 0.00 C ATOM 517 NH1 ARG A 53 1.441 -4.951 3.741 1.00 0.00 N ATOM 518 NH2 ARG A 53 -0.252 -5.892 2.494 1.00 0.00 N ATOM 0 H ARG A 53 4.999 -3.403 -3.067 1.00 0.00 H new ATOM 0 HA ARG A 53 3.600 -5.000 -2.618 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.666 -3.262 -0.330 1.00 0.00 H new ATOM 0 HB3 ARG A 53 1.800 -4.729 -0.739 1.00 0.00 H new ATOM 0 HG2 ARG A 53 3.842 -6.048 -0.352 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.717 -4.583 0.047 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.880 -5.774 2.067 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.260 -4.139 1.940 1.00 0.00 H new ATOM 0 HE ARG A 53 1.496 -6.171 0.756 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.416 -4.665 3.833 1.00 0.00 H new ATOM 0 HH12 ARG A 53 0.798 -4.831 4.524 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -0.577 -6.327 1.631 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.894 -5.772 3.278 1.00 0.00 H new ATOM 532 N PRO A 54 1.114 -4.737 -3.378 1.00 0.00 N ATOM 533 CA PRO A 54 -0.181 -4.531 -3.959 1.00 0.00 C ATOM 534 C PRO A 54 -1.111 -3.916 -2.910 1.00 0.00 C ATOM 535 O PRO A 54 -1.203 -4.395 -1.773 1.00 0.00 O ATOM 536 CB PRO A 54 -0.634 -5.940 -4.354 1.00 0.00 C ATOM 537 CG PRO A 54 0.141 -6.857 -3.493 1.00 0.00 C ATOM 538 CD PRO A 54 1.434 -6.166 -3.214 1.00 0.00 C ATOM 0 HA PRO A 54 -0.181 -3.853 -4.812 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.705 -6.066 -4.198 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.440 -6.134 -5.409 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.395 -7.070 -2.568 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.309 -7.812 -3.991 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.794 -6.382 -2.208 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.214 -6.483 -3.906 1.00 0.00 H new ATOM 546 N GLY A 55 -1.755 -2.852 -3.268 1.00 0.00 N ATOM 547 CA GLY A 55 -2.627 -2.175 -2.338 1.00 0.00 C ATOM 548 C GLY A 55 -1.997 -0.907 -1.819 1.00 0.00 C ATOM 549 O GLY A 55 -2.620 -0.127 -1.096 1.00 0.00 O ATOM 0 H GLY A 55 -1.700 -2.427 -4.194 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.572 -1.940 -2.828 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.857 -2.837 -1.503 1.00 0.00 H new ATOM 553 N TYR A 56 -0.767 -0.699 -2.170 1.00 0.00 N ATOM 554 CA TYR A 56 -0.071 0.500 -1.810 1.00 0.00 C ATOM 555 C TYR A 56 0.482 1.102 -3.082 1.00 0.00 C ATOM 556 O TYR A 56 0.427 0.469 -4.141 1.00 0.00 O ATOM 557 CB TYR A 56 1.078 0.225 -0.828 1.00 0.00 C ATOM 558 CG TYR A 56 0.714 -0.392 0.521 1.00 0.00 C ATOM 559 CD1 TYR A 56 0.362 -1.731 0.628 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.753 0.363 1.687 1.00 0.00 C ATOM 561 CE1 TYR A 56 0.054 -2.294 1.847 1.00 0.00 C ATOM 562 CE2 TYR A 56 0.450 -0.196 2.914 1.00 0.00 C ATOM 563 CZ TYR A 56 0.097 -1.527 2.989 1.00 0.00 C ATOM 564 OH TYR A 56 -0.196 -2.103 4.216 1.00 0.00 O ATOM 0 H TYR A 56 -0.213 -1.358 -2.717 1.00 0.00 H new ATOM 0 HA TYR A 56 -0.762 1.180 -1.311 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.791 -0.436 -1.320 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.594 1.167 -0.640 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.329 -2.343 -0.261 1.00 0.00 H new ATOM 0 HD2 TYR A 56 1.025 1.407 1.633 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.221 -3.337 1.907 1.00 0.00 H new ATOM 0 HE2 TYR A 56 0.489 0.406 3.810 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.119 -1.427 4.921 1.00 0.00 H new ATOM 574 N ARG A 57 0.988 2.294 -2.992 1.00 0.00 N ATOM 575 CA ARG A 57 1.571 2.981 -4.112 1.00 0.00 C ATOM 576 C ARG A 57 2.476 4.081 -3.605 1.00 0.00 C ATOM 577 O ARG A 57 2.588 4.295 -2.395 1.00 0.00 O ATOM 578 CB ARG A 57 0.499 3.581 -5.028 1.00 0.00 C ATOM 579 CG ARG A 57 -0.404 4.589 -4.348 1.00 0.00 C ATOM 580 CD ARG A 57 -1.362 5.239 -5.328 1.00 0.00 C ATOM 581 NE ARG A 57 -2.285 4.282 -5.972 1.00 0.00 N ATOM 582 CZ ARG A 57 -3.418 4.637 -6.617 1.00 0.00 C ATOM 583 NH1 ARG A 57 -3.753 5.924 -6.729 1.00 0.00 N ATOM 584 NH2 ARG A 57 -4.205 3.710 -7.142 1.00 0.00 N ATOM 0 H ARG A 57 1.009 2.829 -2.124 1.00 0.00 H new ATOM 0 HA ARG A 57 2.142 2.258 -4.695 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.988 4.061 -5.875 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.114 2.774 -5.429 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.971 4.095 -3.559 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.204 5.357 -3.870 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -1.944 5.998 -4.806 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.788 5.753 -6.099 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.052 3.290 -5.927 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.153 6.644 -6.327 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.609 6.188 -7.217 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.957 2.724 -7.060 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.059 3.982 -7.628 1.00 0.00 H new ATOM 598 N SER A 58 3.111 4.757 -4.491 1.00 0.00 N ATOM 599 CA SER A 58 3.960 5.833 -4.141 1.00 0.00 C ATOM 600 C SER A 58 4.076 6.777 -5.301 1.00 0.00 C ATOM 601 O SER A 58 3.467 6.562 -6.353 1.00 0.00 O ATOM 602 CB SER A 58 5.325 5.298 -3.733 1.00 0.00 C ATOM 603 OG SER A 58 5.874 4.475 -4.733 1.00 0.00 O ATOM 0 H SER A 58 3.054 4.575 -5.493 1.00 0.00 H new ATOM 0 HA SER A 58 3.539 6.376 -3.295 1.00 0.00 H new ATOM 0 HB2 SER A 58 5.999 6.131 -3.535 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.234 4.734 -2.805 1.00 0.00 H new ATOM 0 HG SER A 58 5.810 3.537 -4.456 1.00 0.00 H new ATOM 609 N LEU A 59 4.836 7.817 -5.102 1.00 0.00 N ATOM 610 CA LEU A 59 5.092 8.805 -6.117 1.00 0.00 C ATOM 611 C LEU A 59 6.093 8.251 -7.145 1.00 0.00 C ATOM 612 O LEU A 59 6.155 8.704 -8.289 1.00 0.00 O ATOM 613 CB LEU A 59 5.639 10.046 -5.443 1.00 0.00 C ATOM 614 CG LEU A 59 4.722 10.734 -4.423 1.00 0.00 C ATOM 615 CD1 LEU A 59 5.428 11.918 -3.797 1.00 0.00 C ATOM 616 CD2 LEU A 59 3.411 11.174 -5.068 1.00 0.00 C ATOM 0 H LEU A 59 5.304 8.007 -4.216 1.00 0.00 H new ATOM 0 HA LEU A 59 4.173 9.055 -6.648 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.568 9.779 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.892 10.771 -6.217 1.00 0.00 H new ATOM 0 HG LEU A 59 4.485 10.012 -3.641 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.766 12.397 -3.075 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.331 11.577 -3.290 1.00 0.00 H new ATOM 0 HD13 LEU A 59 5.696 12.634 -4.574 1.00 0.00 H new ATOM 0 HD21 LEU A 59 2.782 11.658 -4.321 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.620 11.875 -5.876 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.893 10.303 -5.469 1.00 0.00 H new ATOM 628 N GLY A 60 6.852 7.266 -6.716 1.00 0.00 N ATOM 629 CA GLY A 60 7.792 6.594 -7.563 1.00 0.00 C ATOM 630 C GLY A 60 7.994 5.194 -7.053 1.00 0.00 C ATOM 631 O GLY A 60 7.198 4.304 -7.337 1.00 0.00 O ATOM 0 H GLY A 60 6.828 6.912 -5.760 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.426 6.572 -8.589 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.740 7.131 -7.574 1.00 0.00 H new ATOM 635 N ASN A 61 9.034 5.015 -6.284 1.00 0.00 N ATOM 636 CA ASN A 61 9.353 3.762 -5.602 1.00 0.00 C ATOM 637 C ASN A 61 10.202 4.092 -4.410 1.00 0.00 C ATOM 638 O ASN A 61 10.847 5.158 -4.387 1.00 0.00 O ATOM 639 CB ASN A 61 10.158 2.771 -6.494 1.00 0.00 C ATOM 640 CG ASN A 61 9.348 2.045 -7.556 1.00 0.00 C ATOM 641 OD1 ASN A 61 9.210 2.509 -8.695 1.00 0.00 O ATOM 642 ND2 ASN A 61 8.859 0.877 -7.224 1.00 0.00 N ATOM 0 H ASN A 61 9.713 5.754 -6.100 1.00 0.00 H new ATOM 0 HA ASN A 61 8.411 3.282 -5.336 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.960 3.321 -6.986 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.629 2.029 -5.850 1.00 0.00 H new ATOM 0 HD21 ASN A 61 8.348 0.324 -7.912 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.989 0.520 -6.277 1.00 0.00 H new ATOM 649 N VAL A 62 10.192 3.240 -3.408 1.00 0.00 N ATOM 650 CA VAL A 62 11.109 3.400 -2.306 1.00 0.00 C ATOM 651 C VAL A 62 12.458 2.910 -2.761 1.00 0.00 C ATOM 652 O VAL A 62 12.663 1.712 -2.984 1.00 0.00 O ATOM 653 CB VAL A 62 10.662 2.652 -1.012 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.760 2.677 0.051 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.423 3.300 -0.449 1.00 0.00 C ATOM 0 H VAL A 62 9.566 2.438 -3.335 1.00 0.00 H new ATOM 0 HA VAL A 62 11.139 4.455 -2.033 1.00 0.00 H new ATOM 0 HB VAL A 62 10.457 1.616 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.418 2.148 0.940 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.655 2.191 -0.339 1.00 0.00 H new ATOM 0 HG13 VAL A 62 11.992 3.710 0.310 1.00 0.00 H new ATOM 0 HG21 VAL A 62 9.115 2.773 0.454 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.635 4.342 -0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.621 3.254 -1.186 1.00 0.00 H new ATOM 665 N ILE A 63 13.333 3.830 -2.989 1.00 0.00 N ATOM 666 CA ILE A 63 14.645 3.506 -3.427 1.00 0.00 C ATOM 667 C ILE A 63 15.591 3.647 -2.269 1.00 0.00 C ATOM 668 O ILE A 63 15.749 4.734 -1.696 1.00 0.00 O ATOM 669 CB ILE A 63 15.109 4.401 -4.612 1.00 0.00 C ATOM 670 CG1 ILE A 63 14.119 4.311 -5.788 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.514 4.009 -5.075 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.922 2.915 -6.337 1.00 0.00 C ATOM 0 H ILE A 63 13.157 4.828 -2.876 1.00 0.00 H new ATOM 0 HA ILE A 63 14.640 2.479 -3.791 1.00 0.00 H new ATOM 0 HB ILE A 63 15.136 5.432 -4.259 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.154 4.700 -5.464 1.00 0.00 H new ATOM 0 HG13 ILE A 63 14.470 4.958 -6.592 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.816 4.649 -5.904 1.00 0.00 H new ATOM 0 HG22 ILE A 63 17.216 4.129 -4.250 1.00 0.00 H new ATOM 0 HG23 ILE A 63 16.513 2.969 -5.401 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.210 2.945 -7.161 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.875 2.527 -6.695 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.539 2.265 -5.550 1.00 0.00 H new ATOM 684 N MET A 64 16.174 2.567 -1.900 1.00 0.00 N ATOM 685 CA MET A 64 17.131 2.560 -0.835 1.00 0.00 C ATOM 686 C MET A 64 18.484 2.361 -1.414 1.00 0.00 C ATOM 687 O MET A 64 18.596 2.051 -2.581 1.00 0.00 O ATOM 688 CB MET A 64 16.807 1.495 0.217 1.00 0.00 C ATOM 689 CG MET A 64 15.591 1.844 1.066 1.00 0.00 C ATOM 690 SD MET A 64 15.140 0.576 2.275 1.00 0.00 S ATOM 691 CE MET A 64 16.640 0.454 3.231 1.00 0.00 C ATOM 0 H MET A 64 16.007 1.654 -2.324 1.00 0.00 H new ATOM 0 HA MET A 64 17.095 3.518 -0.316 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.633 0.541 -0.282 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.671 1.361 0.868 1.00 0.00 H new ATOM 0 HG2 MET A 64 15.786 2.779 1.592 1.00 0.00 H new ATOM 0 HG3 MET A 64 14.741 2.020 0.407 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.132 -0.495 3.017 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.307 1.275 2.968 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.400 0.507 4.293 1.00 0.00 H new ATOM 701 N VAL A 65 19.493 2.569 -0.646 1.00 0.00 N ATOM 702 CA VAL A 65 20.834 2.385 -1.123 1.00 0.00 C ATOM 703 C VAL A 65 21.757 2.031 0.035 1.00 0.00 C ATOM 704 O VAL A 65 21.534 2.448 1.182 1.00 0.00 O ATOM 705 CB VAL A 65 21.355 3.641 -1.932 1.00 0.00 C ATOM 706 CG1 VAL A 65 21.566 4.815 -1.070 1.00 0.00 C ATOM 707 CG2 VAL A 65 22.620 3.373 -2.696 1.00 0.00 C ATOM 0 H VAL A 65 19.423 2.870 0.326 1.00 0.00 H new ATOM 0 HA VAL A 65 20.833 1.552 -1.826 1.00 0.00 H new ATOM 0 HB VAL A 65 20.559 3.853 -2.646 1.00 0.00 H new ATOM 0 HG11 VAL A 65 21.923 5.650 -1.673 1.00 0.00 H new ATOM 0 HG12 VAL A 65 20.626 5.089 -0.592 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.306 4.577 -0.306 1.00 0.00 H new ATOM 0 HG21 VAL A 65 22.922 4.275 -3.228 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.408 3.079 -2.003 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.449 2.570 -3.412 1.00 0.00 H new ATOM 717 N CYS A 66 22.697 1.184 -0.262 1.00 0.00 N ATOM 718 CA CYS A 66 23.719 0.762 0.657 1.00 0.00 C ATOM 719 C CYS A 66 24.644 1.925 0.914 1.00 0.00 C ATOM 720 O CYS A 66 25.259 2.440 -0.022 1.00 0.00 O ATOM 721 CB CYS A 66 24.506 -0.385 0.027 1.00 0.00 C ATOM 722 SG CYS A 66 25.872 -1.011 1.034 1.00 0.00 S ATOM 0 H CYS A 66 22.779 0.751 -1.182 1.00 0.00 H new ATOM 0 HA CYS A 66 23.274 0.428 1.595 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.820 -1.206 -0.181 1.00 0.00 H new ATOM 0 HB3 CYS A 66 24.903 -0.051 -0.932 1.00 0.00 H new ATOM 727 N ARG A 67 24.727 2.351 2.141 1.00 0.00 N ATOM 728 CA ARG A 67 25.524 3.481 2.502 1.00 0.00 C ATOM 729 C ARG A 67 25.994 3.310 3.937 1.00 0.00 C ATOM 730 O ARG A 67 25.179 3.273 4.856 1.00 0.00 O ATOM 731 CB ARG A 67 24.662 4.731 2.360 1.00 0.00 C ATOM 732 CG ARG A 67 25.360 6.055 2.567 1.00 0.00 C ATOM 733 CD ARG A 67 24.367 7.188 2.372 1.00 0.00 C ATOM 734 NE ARG A 67 24.957 8.509 2.576 1.00 0.00 N ATOM 735 CZ ARG A 67 24.374 9.660 2.210 1.00 0.00 C ATOM 736 NH1 ARG A 67 23.202 9.650 1.582 1.00 0.00 N ATOM 737 NH2 ARG A 67 24.963 10.818 2.469 1.00 0.00 N ATOM 0 H ARG A 67 24.238 1.918 2.924 1.00 0.00 H new ATOM 0 HA ARG A 67 26.399 3.571 1.858 1.00 0.00 H new ATOM 0 HB2 ARG A 67 24.220 4.730 1.364 1.00 0.00 H new ATOM 0 HB3 ARG A 67 23.841 4.663 3.073 1.00 0.00 H new ATOM 0 HG2 ARG A 67 25.787 6.100 3.569 1.00 0.00 H new ATOM 0 HG3 ARG A 67 26.186 6.156 1.863 1.00 0.00 H new ATOM 0 HD2 ARG A 67 23.955 7.132 1.364 1.00 0.00 H new ATOM 0 HD3 ARG A 67 23.535 7.057 3.064 1.00 0.00 H new ATOM 0 HE ARG A 67 25.871 8.559 3.026 1.00 0.00 H new ATOM 0 HH11 ARG A 67 22.741 8.764 1.376 1.00 0.00 H new ATOM 0 HH12 ARG A 67 22.764 10.529 1.306 1.00 0.00 H new ATOM 0 HH21 ARG A 67 25.863 10.836 2.948 1.00 0.00 H new ATOM 0 HH22 ARG A 67 24.516 11.691 2.189 1.00 0.00 H new ATOM 751 N LYS A 68 27.305 3.177 4.110 1.00 0.00 N ATOM 752 CA LYS A 68 27.958 2.981 5.429 1.00 0.00 C ATOM 753 C LYS A 68 27.660 1.635 6.027 1.00 0.00 C ATOM 754 O LYS A 68 27.688 1.459 7.242 1.00 0.00 O ATOM 755 CB LYS A 68 27.603 4.093 6.403 1.00 0.00 C ATOM 756 CG LYS A 68 28.109 5.446 5.947 1.00 0.00 C ATOM 757 CD LYS A 68 29.638 5.469 5.900 1.00 0.00 C ATOM 758 CE LYS A 68 30.154 6.640 5.105 1.00 0.00 C ATOM 759 NZ LYS A 68 29.664 6.594 3.708 1.00 0.00 N ATOM 0 H LYS A 68 27.967 3.201 3.334 1.00 0.00 H new ATOM 0 HA LYS A 68 29.031 3.021 5.244 1.00 0.00 H new ATOM 0 HB2 LYS A 68 26.520 4.135 6.523 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.023 3.862 7.382 1.00 0.00 H new ATOM 0 HG2 LYS A 68 27.707 5.675 4.960 1.00 0.00 H new ATOM 0 HG3 LYS A 68 27.750 6.220 6.625 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.032 5.516 6.915 1.00 0.00 H new ATOM 0 HD3 LYS A 68 30.002 4.541 5.459 1.00 0.00 H new ATOM 0 HE2 LYS A 68 29.836 7.571 5.575 1.00 0.00 H new ATOM 0 HE3 LYS A 68 31.244 6.636 5.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 30.378 7.009 3.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 29.490 5.606 3.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 28.779 7.135 3.633 1.00 0.00 H new ATOM 773 N GLY A 69 27.413 0.685 5.184 1.00 0.00 N ATOM 774 CA GLY A 69 27.175 -0.656 5.642 1.00 0.00 C ATOM 775 C GLY A 69 25.738 -0.892 6.012 1.00 0.00 C ATOM 776 O GLY A 69 25.360 -2.016 6.399 1.00 0.00 O ATOM 0 H GLY A 69 27.370 0.807 4.172 1.00 0.00 H new ATOM 0 HA2 GLY A 69 27.466 -1.360 4.862 1.00 0.00 H new ATOM 0 HA3 GLY A 69 27.807 -0.859 6.506 1.00 0.00 H new ATOM 780 N GLU A 70 24.936 0.140 5.934 1.00 0.00 N ATOM 781 CA GLU A 70 23.539 0.002 6.193 1.00 0.00 C ATOM 782 C GLU A 70 22.756 0.440 4.983 1.00 0.00 C ATOM 783 O GLU A 70 23.236 1.240 4.176 1.00 0.00 O ATOM 784 CB GLU A 70 23.133 0.795 7.437 1.00 0.00 C ATOM 785 CG GLU A 70 23.456 2.272 7.358 1.00 0.00 C ATOM 786 CD GLU A 70 23.153 3.010 8.625 1.00 0.00 C ATOM 787 OE1 GLU A 70 21.989 3.403 8.851 1.00 0.00 O ATOM 788 OE2 GLU A 70 24.095 3.238 9.427 1.00 0.00 O ATOM 0 H GLU A 70 25.235 1.085 5.692 1.00 0.00 H new ATOM 0 HA GLU A 70 23.315 -1.046 6.392 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.061 0.676 7.598 1.00 0.00 H new ATOM 0 HB3 GLU A 70 23.635 0.370 8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 70 24.512 2.394 7.118 1.00 0.00 H new ATOM 0 HG3 GLU A 70 22.889 2.718 6.541 1.00 0.00 H new ATOM 795 N TRP A 71 21.600 -0.096 4.833 1.00 0.00 N ATOM 796 CA TRP A 71 20.741 0.287 3.759 1.00 0.00 C ATOM 797 C TRP A 71 19.834 1.378 4.242 1.00 0.00 C ATOM 798 O TRP A 71 19.100 1.207 5.214 1.00 0.00 O ATOM 799 CB TRP A 71 19.950 -0.907 3.211 1.00 0.00 C ATOM 800 CG TRP A 71 20.796 -1.955 2.546 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.495 -2.957 3.147 1.00 0.00 C ATOM 802 CD2 TRP A 71 21.005 -2.113 1.137 1.00 0.00 C ATOM 803 NE1 TRP A 71 22.134 -3.716 2.199 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.857 -3.218 0.963 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.562 -1.426 0.011 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.274 -3.649 -0.296 1.00 0.00 C ATOM 807 CZ3 TRP A 71 20.971 -1.858 -1.231 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.820 -2.955 -1.374 1.00 0.00 C ATOM 0 H TRP A 71 21.217 -0.814 5.448 1.00 0.00 H new ATOM 0 HA TRP A 71 21.342 0.656 2.928 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.397 -1.368 4.029 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.214 -0.542 2.495 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.540 -3.129 4.212 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.724 -4.526 2.391 1.00 0.00 H new ATOM 0 HE3 TRP A 71 19.910 -0.571 0.109 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.930 -4.499 -0.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.627 -1.337 -2.112 1.00 0.00 H new ATOM 0 HH2 TRP A 71 22.124 -3.261 -2.364 1.00 0.00 H new ATOM 819 N VAL A 72 19.900 2.492 3.589 1.00 0.00 N ATOM 820 CA VAL A 72 19.134 3.659 3.955 1.00 0.00 C ATOM 821 C VAL A 72 18.353 4.134 2.756 1.00 0.00 C ATOM 822 O VAL A 72 18.551 3.623 1.664 1.00 0.00 O ATOM 823 CB VAL A 72 20.044 4.805 4.467 1.00 0.00 C ATOM 824 CG1 VAL A 72 20.762 4.399 5.737 1.00 0.00 C ATOM 825 CG2 VAL A 72 21.049 5.229 3.401 1.00 0.00 C ATOM 0 H VAL A 72 20.495 2.628 2.772 1.00 0.00 H new ATOM 0 HA VAL A 72 18.458 3.382 4.764 1.00 0.00 H new ATOM 0 HB VAL A 72 19.404 5.659 4.690 1.00 0.00 H new ATOM 0 HG11 VAL A 72 21.394 5.220 6.076 1.00 0.00 H new ATOM 0 HG12 VAL A 72 20.030 4.162 6.509 1.00 0.00 H new ATOM 0 HG13 VAL A 72 21.380 3.522 5.541 1.00 0.00 H new ATOM 0 HG21 VAL A 72 21.673 6.034 3.789 1.00 0.00 H new ATOM 0 HG22 VAL A 72 21.677 4.379 3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 72 20.516 5.577 2.516 1.00 0.00 H new ATOM 835 N ALA A 73 17.486 5.086 2.943 1.00 0.00 N ATOM 836 CA ALA A 73 16.697 5.604 1.858 1.00 0.00 C ATOM 837 C ALA A 73 17.526 6.569 1.028 1.00 0.00 C ATOM 838 O ALA A 73 18.039 7.555 1.553 1.00 0.00 O ATOM 839 CB ALA A 73 15.445 6.290 2.388 1.00 0.00 C ATOM 0 H ALA A 73 17.305 5.525 3.846 1.00 0.00 H new ATOM 0 HA ALA A 73 16.386 4.775 1.223 1.00 0.00 H new ATOM 0 HB1 ALA A 73 14.860 6.676 1.553 1.00 0.00 H new ATOM 0 HB2 ALA A 73 14.847 5.572 2.949 1.00 0.00 H new ATOM 0 HB3 ALA A 73 15.731 7.114 3.042 1.00 0.00 H new ATOM 845 N LEU A 74 17.701 6.245 -0.249 1.00 0.00 N ATOM 846 CA LEU A 74 18.403 7.106 -1.199 1.00 0.00 C ATOM 847 C LEU A 74 17.594 8.362 -1.318 1.00 0.00 C ATOM 848 O LEU A 74 18.098 9.480 -1.229 1.00 0.00 O ATOM 849 CB LEU A 74 18.469 6.395 -2.578 1.00 0.00 C ATOM 850 CG LEU A 74 19.365 7.022 -3.674 1.00 0.00 C ATOM 851 CD1 LEU A 74 19.610 6.031 -4.783 1.00 0.00 C ATOM 852 CD2 LEU A 74 18.775 8.290 -4.274 1.00 0.00 C ATOM 0 H LEU A 74 17.359 5.375 -0.657 1.00 0.00 H new ATOM 0 HA LEU A 74 19.419 7.323 -0.869 1.00 0.00 H new ATOM 0 HB2 LEU A 74 18.810 5.373 -2.411 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.454 6.332 -2.971 1.00 0.00 H new ATOM 0 HG LEU A 74 20.301 7.289 -3.183 1.00 0.00 H new ATOM 0 HD11 LEU A 74 20.241 6.487 -5.546 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.108 5.149 -4.380 1.00 0.00 H new ATOM 0 HD13 LEU A 74 18.658 5.739 -5.227 1.00 0.00 H new ATOM 0 HD21 LEU A 74 19.450 8.681 -5.035 1.00 0.00 H new ATOM 0 HD22 LEU A 74 17.810 8.063 -4.727 1.00 0.00 H new ATOM 0 HD23 LEU A 74 18.642 9.036 -3.490 1.00 0.00 H new ATOM 864 N ASN A 75 16.340 8.145 -1.530 1.00 0.00 N ATOM 865 CA ASN A 75 15.361 9.189 -1.627 1.00 0.00 C ATOM 866 C ASN A 75 14.511 9.197 -0.362 1.00 0.00 C ATOM 867 O ASN A 75 13.529 8.467 -0.269 1.00 0.00 O ATOM 868 CB ASN A 75 14.461 8.986 -2.860 1.00 0.00 C ATOM 869 CG ASN A 75 15.203 9.024 -4.178 1.00 0.00 C ATOM 870 OD1 ASN A 75 15.592 7.987 -4.714 1.00 0.00 O ATOM 871 ND2 ASN A 75 15.429 10.198 -4.695 1.00 0.00 N ATOM 0 H ASN A 75 15.950 7.209 -1.645 1.00 0.00 H new ATOM 0 HA ASN A 75 15.875 10.144 -1.735 1.00 0.00 H new ATOM 0 HB2 ASN A 75 13.950 8.027 -2.770 1.00 0.00 H new ATOM 0 HB3 ASN A 75 13.691 9.758 -2.866 1.00 0.00 H new ATOM 0 HD21 ASN A 75 15.944 10.279 -5.572 1.00 0.00 H new ATOM 0 HD22 ASN A 75 15.091 11.037 -4.223 1.00 0.00 H new ATOM 878 N PRO A 76 14.901 9.991 0.654 1.00 0.00 N ATOM 879 CA PRO A 76 14.181 10.053 1.931 1.00 0.00 C ATOM 880 C PRO A 76 12.861 10.827 1.837 1.00 0.00 C ATOM 881 O PRO A 76 12.115 10.927 2.811 1.00 0.00 O ATOM 882 CB PRO A 76 15.162 10.767 2.865 1.00 0.00 C ATOM 883 CG PRO A 76 16.023 11.588 1.963 1.00 0.00 C ATOM 884 CD PRO A 76 16.096 10.855 0.656 1.00 0.00 C ATOM 0 HA PRO A 76 13.892 9.060 2.275 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.636 11.393 3.587 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.756 10.053 3.435 1.00 0.00 H new ATOM 0 HG2 PRO A 76 15.601 12.584 1.826 1.00 0.00 H new ATOM 0 HG3 PRO A 76 17.017 11.719 2.390 1.00 0.00 H new ATOM 0 HD2 PRO A 76 16.089 11.545 -0.188 1.00 0.00 H new ATOM 0 HD3 PRO A 76 17.011 10.268 0.580 1.00 0.00 H new ATOM 892 N LEU A 77 12.578 11.381 0.667 1.00 0.00 N ATOM 893 CA LEU A 77 11.343 12.095 0.450 1.00 0.00 C ATOM 894 C LEU A 77 10.331 11.178 -0.215 1.00 0.00 C ATOM 895 O LEU A 77 9.259 11.615 -0.652 1.00 0.00 O ATOM 896 CB LEU A 77 11.553 13.359 -0.417 1.00 0.00 C ATOM 897 CG LEU A 77 12.504 14.452 0.113 1.00 0.00 C ATOM 898 CD1 LEU A 77 12.163 14.860 1.535 1.00 0.00 C ATOM 899 CD2 LEU A 77 13.972 14.066 -0.028 1.00 0.00 C ATOM 0 H LEU A 77 13.194 11.346 -0.145 1.00 0.00 H new ATOM 0 HA LEU A 77 10.970 12.418 1.422 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.923 13.038 -1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.578 13.817 -0.582 1.00 0.00 H new ATOM 0 HG LEU A 77 12.350 15.327 -0.519 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.857 15.631 1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 77 11.145 15.249 1.568 1.00 0.00 H new ATOM 0 HD13 LEU A 77 12.241 13.993 2.191 1.00 0.00 H new ATOM 0 HD21 LEU A 77 14.598 14.869 0.360 1.00 0.00 H new ATOM 0 HD22 LEU A 77 14.164 13.153 0.535 1.00 0.00 H new ATOM 0 HD23 LEU A 77 14.205 13.900 -1.080 1.00 0.00 H new ATOM 911 N ARG A 78 10.670 9.909 -0.312 1.00 0.00 N ATOM 912 CA ARG A 78 9.777 8.928 -0.892 1.00 0.00 C ATOM 913 C ARG A 78 9.438 7.866 0.121 1.00 0.00 C ATOM 914 O ARG A 78 10.231 7.570 1.004 1.00 0.00 O ATOM 915 CB ARG A 78 10.346 8.297 -2.178 1.00 0.00 C ATOM 916 CG ARG A 78 10.607 9.290 -3.306 1.00 0.00 C ATOM 917 CD ARG A 78 9.379 10.132 -3.595 1.00 0.00 C ATOM 918 NE ARG A 78 9.635 11.171 -4.581 1.00 0.00 N ATOM 919 CZ ARG A 78 9.382 12.481 -4.403 1.00 0.00 C ATOM 920 NH1 ARG A 78 9.002 12.946 -3.203 1.00 0.00 N ATOM 921 NH2 ARG A 78 9.549 13.322 -5.407 1.00 0.00 N ATOM 0 H ARG A 78 11.563 9.532 0.005 1.00 0.00 H new ATOM 0 HA ARG A 78 8.865 9.452 -1.178 1.00 0.00 H new ATOM 0 HB2 ARG A 78 11.279 7.788 -1.936 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.650 7.537 -2.533 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.440 9.939 -3.036 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.901 8.751 -4.207 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.576 9.487 -3.952 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.032 10.591 -2.670 1.00 0.00 H new ATOM 0 HE ARG A 78 10.036 10.885 -5.474 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.903 12.305 -2.416 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.813 13.940 -3.078 1.00 0.00 H new ATOM 0 HH21 ARG A 78 9.868 12.978 -6.313 1.00 0.00 H new ATOM 0 HH22 ARG A 78 9.359 14.316 -5.277 1.00 0.00 H new ATOM 935 N LYS A 79 8.246 7.328 -0.006 1.00 0.00 N ATOM 936 CA LYS A 79 7.715 6.313 0.874 1.00 0.00 C ATOM 937 C LYS A 79 6.563 5.669 0.131 1.00 0.00 C ATOM 938 O LYS A 79 6.061 6.268 -0.837 1.00 0.00 O ATOM 939 CB LYS A 79 7.180 6.968 2.160 1.00 0.00 C ATOM 940 CG LYS A 79 6.032 7.949 1.915 1.00 0.00 C ATOM 941 CD LYS A 79 5.530 8.595 3.190 1.00 0.00 C ATOM 942 CE LYS A 79 6.578 9.489 3.818 1.00 0.00 C ATOM 943 NZ LYS A 79 6.046 10.213 4.978 1.00 0.00 N ATOM 0 H LYS A 79 7.599 7.594 -0.749 1.00 0.00 H new ATOM 0 HA LYS A 79 8.480 5.587 1.147 1.00 0.00 H new ATOM 0 HB2 LYS A 79 6.841 6.188 2.841 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.996 7.493 2.657 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.364 8.726 1.226 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.209 7.424 1.430 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.636 9.180 2.974 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.240 7.821 3.900 1.00 0.00 H new ATOM 0 HE2 LYS A 79 7.434 8.887 4.125 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.939 10.203 3.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 6.791 10.815 5.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 5.245 10.806 4.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 5.724 9.532 5.695 1.00 0.00 H new ATOM 957 N CYS A 80 6.155 4.498 0.531 1.00 0.00 N ATOM 958 CA CYS A 80 5.001 3.877 -0.073 1.00 0.00 C ATOM 959 C CYS A 80 3.813 3.984 0.863 1.00 0.00 C ATOM 960 O CYS A 80 3.871 3.589 2.040 1.00 0.00 O ATOM 961 CB CYS A 80 5.266 2.423 -0.483 1.00 0.00 C ATOM 962 SG CYS A 80 6.581 2.213 -1.753 1.00 0.00 S ATOM 0 H CYS A 80 6.599 3.953 1.270 1.00 0.00 H new ATOM 0 HA CYS A 80 4.774 4.413 -0.995 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.542 1.854 0.404 1.00 0.00 H new ATOM 0 HB3 CYS A 80 4.340 1.992 -0.863 1.00 0.00 H new ATOM 967 N GLN A 81 2.768 4.552 0.369 1.00 0.00 N ATOM 968 CA GLN A 81 1.575 4.751 1.132 1.00 0.00 C ATOM 969 C GLN A 81 0.516 3.871 0.542 1.00 0.00 C ATOM 970 O GLN A 81 0.707 3.351 -0.540 1.00 0.00 O ATOM 971 CB GLN A 81 1.149 6.221 1.076 1.00 0.00 C ATOM 972 CG GLN A 81 2.231 7.194 1.533 1.00 0.00 C ATOM 973 CD GLN A 81 1.781 8.640 1.514 1.00 0.00 C ATOM 974 OE1 GLN A 81 0.611 8.948 1.716 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.699 9.536 1.277 1.00 0.00 N ATOM 0 H GLN A 81 2.713 4.898 -0.589 1.00 0.00 H new ATOM 0 HA GLN A 81 1.739 4.498 2.179 1.00 0.00 H new ATOM 0 HB2 GLN A 81 0.860 6.467 0.054 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.265 6.357 1.699 1.00 0.00 H new ATOM 0 HG2 GLN A 81 2.544 6.931 2.544 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.104 7.084 0.890 1.00 0.00 H new ATOM 0 HE21 GLN A 81 3.663 9.247 1.113 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.452 10.526 1.256 1.00 0.00 H new ATOM 984 N LYS A 82 -0.566 3.668 1.237 1.00 0.00 N ATOM 985 CA LYS A 82 -1.656 2.861 0.709 1.00 0.00 C ATOM 986 C LYS A 82 -2.221 3.479 -0.546 1.00 0.00 C ATOM 987 O LYS A 82 -2.065 4.678 -0.785 1.00 0.00 O ATOM 988 CB LYS A 82 -2.779 2.756 1.704 1.00 0.00 C ATOM 989 CG LYS A 82 -2.476 1.982 2.949 1.00 0.00 C ATOM 990 CD LYS A 82 -3.695 1.984 3.805 1.00 0.00 C ATOM 991 CE LYS A 82 -3.532 1.194 5.069 1.00 0.00 C ATOM 992 NZ LYS A 82 -4.802 1.165 5.802 1.00 0.00 N ATOM 0 H LYS A 82 -0.728 4.045 2.171 1.00 0.00 H new ATOM 0 HA LYS A 82 -1.245 1.874 0.497 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.082 3.763 1.990 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -3.634 2.294 1.211 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.187 0.961 2.701 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.637 2.430 3.481 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.951 3.013 4.058 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.531 1.578 3.236 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.213 0.178 4.836 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.753 1.638 5.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.694 0.588 6.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -5.072 2.134 6.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.542 0.752 5.199 1.00 0.00 H new ATOM 1006 N ARG A 83 -2.851 2.692 -1.349 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.513 3.242 -2.478 1.00 0.00 C ATOM 1008 C ARG A 83 -4.858 3.761 -2.023 1.00 0.00 C ATOM 1009 O ARG A 83 -5.474 3.193 -1.098 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.744 2.221 -3.596 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.633 1.070 -3.184 1.00 0.00 C ATOM 1012 CD ARG A 83 -5.166 0.306 -4.366 1.00 0.00 C ATOM 1013 NE ARG A 83 -6.018 1.153 -5.212 1.00 0.00 N ATOM 1014 CZ ARG A 83 -6.512 0.795 -6.399 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -6.330 -0.438 -6.852 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -7.207 1.665 -7.113 1.00 0.00 N ATOM 0 H ARG A 83 -2.921 1.680 -1.247 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.877 4.029 -2.884 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.190 2.726 -4.453 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.782 1.828 -3.923 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.071 0.393 -2.540 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.467 1.451 -2.595 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.335 -0.081 -4.956 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.737 -0.554 -4.017 1.00 0.00 H new ATOM 0 HE ARG A 83 -6.249 2.084 -4.866 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.811 -1.115 -6.293 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -6.709 -0.709 -7.760 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -7.364 2.607 -6.756 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -7.585 1.393 -8.020 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.303 4.854 -2.584 1.00 0.00 N ATOM 1031 CA PRO A 84 -6.640 5.299 -2.382 1.00 0.00 C ATOM 1032 C PRO A 84 -7.575 4.372 -3.166 1.00 0.00 C ATOM 1033 O PRO A 84 -7.150 3.696 -4.133 1.00 0.00 O ATOM 1034 CB PRO A 84 -6.663 6.713 -2.965 1.00 0.00 C ATOM 1035 CG PRO A 84 -5.554 6.729 -3.946 1.00 0.00 C ATOM 1036 CD PRO A 84 -4.529 5.762 -3.429 1.00 0.00 C ATOM 0 HA PRO A 84 -6.957 5.292 -1.339 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -7.618 6.930 -3.443 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.517 7.464 -2.189 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -5.904 6.434 -4.935 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.133 7.730 -4.042 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.035 5.229 -4.242 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.750 6.270 -2.861 1.00 0.00 H new ATOM 1044 N CYS A 85 -8.797 4.316 -2.768 1.00 0.00 N ATOM 1045 CA CYS A 85 -9.744 3.422 -3.400 1.00 0.00 C ATOM 1046 C CYS A 85 -10.652 4.194 -4.327 1.00 0.00 C ATOM 1047 O CYS A 85 -11.614 3.662 -4.879 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.544 2.756 -2.325 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.514 2.150 -0.974 1.00 0.00 S ATOM 0 H CYS A 85 -9.180 4.875 -2.006 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.217 2.674 -3.992 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.276 3.461 -1.932 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.102 1.924 -2.754 1.00 0.00 H new ATOM 1054 N GLY A 86 -10.337 5.449 -4.477 1.00 0.00 N ATOM 1055 CA GLY A 86 -11.096 6.320 -5.308 1.00 0.00 C ATOM 1056 C GLY A 86 -12.422 6.614 -4.698 1.00 0.00 C ATOM 1057 O GLY A 86 -12.502 7.063 -3.550 1.00 0.00 O ATOM 0 H GLY A 86 -9.540 5.893 -4.020 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -10.549 7.250 -5.463 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -11.235 5.864 -6.288 1.00 0.00 H new ATOM 1061 N HIS A 87 -13.449 6.304 -5.414 1.00 0.00 N ATOM 1062 CA HIS A 87 -14.783 6.550 -4.971 1.00 0.00 C ATOM 1063 C HIS A 87 -15.595 5.289 -5.147 1.00 0.00 C ATOM 1064 O HIS A 87 -15.664 4.760 -6.242 1.00 0.00 O ATOM 1065 CB HIS A 87 -15.418 7.702 -5.783 1.00 0.00 C ATOM 1066 CG HIS A 87 -16.799 8.102 -5.325 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -17.935 7.888 -6.068 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -17.211 8.723 -4.192 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -18.979 8.358 -5.421 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -18.569 8.869 -4.278 1.00 0.00 N ATOM 0 H HIS A 87 -13.387 5.868 -6.334 1.00 0.00 H new ATOM 0 HA HIS A 87 -14.768 6.839 -3.920 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -14.764 8.572 -5.728 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -15.468 7.407 -6.831 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -16.584 9.043 -3.373 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -20.001 8.330 -5.768 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -19.166 9.302 -3.573 1.00 0.00 H new ATOM 1079 N PRO A 88 -16.150 4.748 -4.066 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.081 3.640 -4.160 1.00 0.00 C ATOM 1081 C PRO A 88 -18.410 4.176 -4.636 1.00 0.00 C ATOM 1082 O PRO A 88 -18.813 5.279 -4.222 1.00 0.00 O ATOM 1083 CB PRO A 88 -17.181 3.125 -2.722 1.00 0.00 C ATOM 1084 CG PRO A 88 -16.820 4.285 -1.860 1.00 0.00 C ATOM 1085 CD PRO A 88 -15.914 5.171 -2.673 1.00 0.00 C ATOM 0 HA PRO A 88 -16.776 2.855 -4.852 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.188 2.770 -2.501 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.504 2.287 -2.557 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -17.713 4.827 -1.549 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -16.319 3.950 -0.952 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.154 6.225 -2.530 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -14.870 5.041 -2.389 1.00 0.00 H new ATOM 1093 N GLY A 89 -19.057 3.433 -5.518 1.00 0.00 N ATOM 1094 CA GLY A 89 -20.313 3.850 -6.099 1.00 0.00 C ATOM 1095 C GLY A 89 -21.322 4.334 -5.080 1.00 0.00 C ATOM 1096 O GLY A 89 -21.612 3.645 -4.081 1.00 0.00 O ATOM 0 H GLY A 89 -18.724 2.527 -5.848 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.124 4.647 -6.818 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -20.742 3.016 -6.654 1.00 0.00 H new ATOM 1100 N ASP A 90 -21.838 5.488 -5.322 1.00 0.00 N ATOM 1101 CA ASP A 90 -22.754 6.131 -4.425 1.00 0.00 C ATOM 1102 C ASP A 90 -24.162 5.892 -4.901 1.00 0.00 C ATOM 1103 O ASP A 90 -24.382 5.263 -5.942 1.00 0.00 O ATOM 1104 CB ASP A 90 -22.468 7.642 -4.309 1.00 0.00 C ATOM 1105 CG ASP A 90 -22.744 8.420 -5.582 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -22.051 8.203 -6.593 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -23.658 9.272 -5.590 1.00 0.00 O ATOM 0 H ASP A 90 -21.636 6.028 -6.163 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.626 5.703 -3.431 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -23.075 8.056 -3.503 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -21.425 7.784 -4.027 1.00 0.00 H new ATOM 1112 N THR A 91 -25.097 6.382 -4.167 1.00 0.00 N ATOM 1113 CA THR A 91 -26.473 6.160 -4.436 1.00 0.00 C ATOM 1114 C THR A 91 -27.275 7.374 -3.975 1.00 0.00 C ATOM 1115 O THR A 91 -26.871 8.061 -3.031 1.00 0.00 O ATOM 1116 CB THR A 91 -26.954 4.895 -3.669 1.00 0.00 C ATOM 1117 OG1 THR A 91 -28.381 4.738 -3.771 1.00 0.00 O ATOM 1118 CG2 THR A 91 -26.538 4.960 -2.205 1.00 0.00 C ATOM 0 H THR A 91 -24.923 6.961 -3.345 1.00 0.00 H new ATOM 0 HA THR A 91 -26.619 6.009 -5.506 1.00 0.00 H new ATOM 0 HB THR A 91 -26.479 4.029 -4.130 1.00 0.00 H new ATOM 0 HG1 THR A 91 -28.652 3.910 -3.323 1.00 0.00 H new ATOM 0 HG21 THR A 91 -26.885 4.065 -1.688 1.00 0.00 H new ATOM 0 HG22 THR A 91 -25.452 5.020 -2.138 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.979 5.842 -1.740 1.00 0.00 H new ATOM 1126 N PRO A 92 -28.374 7.711 -4.661 1.00 0.00 N ATOM 1127 CA PRO A 92 -29.266 8.768 -4.207 1.00 0.00 C ATOM 1128 C PRO A 92 -30.175 8.274 -3.066 1.00 0.00 C ATOM 1129 O PRO A 92 -30.707 9.066 -2.287 1.00 0.00 O ATOM 1130 CB PRO A 92 -30.098 9.095 -5.454 1.00 0.00 C ATOM 1131 CG PRO A 92 -30.095 7.841 -6.263 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.791 7.145 -5.970 1.00 0.00 C ATOM 0 HA PRO A 92 -28.729 9.630 -3.810 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -31.113 9.388 -5.185 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -29.664 9.925 -6.011 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.941 7.207 -5.998 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -30.185 8.065 -7.326 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -28.918 6.064 -5.916 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.050 7.341 -6.745 1.00 0.00 H new ATOM 1140 N PHE A 93 -30.295 6.959 -2.940 1.00 0.00 N ATOM 1141 CA PHE A 93 -31.195 6.352 -1.969 1.00 0.00 C ATOM 1142 C PHE A 93 -30.550 6.239 -0.603 1.00 0.00 C ATOM 1143 O PHE A 93 -31.239 6.210 0.418 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.634 4.957 -2.434 1.00 0.00 C ATOM 1145 CG PHE A 93 -32.363 4.937 -3.744 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -33.724 5.164 -3.791 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -31.684 4.690 -4.926 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -34.399 5.147 -4.991 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -32.353 4.672 -6.131 1.00 0.00 C ATOM 1150 CZ PHE A 93 -33.713 4.903 -6.163 1.00 0.00 C ATOM 0 H PHE A 93 -29.775 6.287 -3.504 1.00 0.00 H new ATOM 0 HA PHE A 93 -32.066 7.003 -1.891 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -30.753 4.321 -2.514 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.275 4.519 -1.669 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -34.265 5.357 -2.877 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -30.619 4.510 -4.903 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -35.464 5.324 -5.015 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -31.815 4.478 -7.047 1.00 0.00 H new ATOM 0 HZ PHE A 93 -34.240 4.893 -7.105 1.00 0.00 H new ATOM 1160 N GLY A 94 -29.241 6.183 -0.577 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.565 5.985 0.666 1.00 0.00 C ATOM 1162 C GLY A 94 -27.243 6.674 0.757 1.00 0.00 C ATOM 1163 O GLY A 94 -27.058 7.754 0.193 1.00 0.00 O ATOM 0 H GLY A 94 -28.636 6.271 -1.394 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -29.204 6.339 1.475 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -28.417 4.916 0.821 1.00 0.00 H new ATOM 1167 N THR A 95 -26.334 6.062 1.484 1.00 0.00 N ATOM 1168 CA THR A 95 -24.991 6.562 1.736 1.00 0.00 C ATOM 1169 C THR A 95 -24.119 5.298 2.036 1.00 0.00 C ATOM 1170 O THR A 95 -24.568 4.180 1.768 1.00 0.00 O ATOM 1171 CB THR A 95 -25.043 7.549 2.972 1.00 0.00 C ATOM 1172 OG1 THR A 95 -26.132 8.471 2.786 1.00 0.00 O ATOM 1173 CG2 THR A 95 -23.774 8.385 3.121 1.00 0.00 C ATOM 0 H THR A 95 -26.513 5.165 1.936 1.00 0.00 H new ATOM 0 HA THR A 95 -24.572 7.116 0.896 1.00 0.00 H new ATOM 0 HB THR A 95 -25.160 6.931 3.862 1.00 0.00 H new ATOM 0 HG1 THR A 95 -26.174 9.086 3.548 1.00 0.00 H new ATOM 0 HG21 THR A 95 -23.870 9.042 3.986 1.00 0.00 H new ATOM 0 HG22 THR A 95 -22.918 7.725 3.260 1.00 0.00 H new ATOM 0 HG23 THR A 95 -23.627 8.986 2.224 1.00 0.00 H new ATOM 1181 N PHE A 96 -22.909 5.453 2.506 1.00 0.00 N ATOM 1182 CA PHE A 96 -22.082 4.332 2.880 1.00 0.00 C ATOM 1183 C PHE A 96 -21.176 4.745 4.021 1.00 0.00 C ATOM 1184 O PHE A 96 -20.990 5.950 4.253 1.00 0.00 O ATOM 1185 CB PHE A 96 -21.264 3.826 1.674 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.381 4.860 1.032 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -19.139 5.157 1.562 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -20.796 5.523 -0.108 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.333 6.095 0.970 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -19.992 6.463 -0.708 1.00 0.00 C ATOM 1191 CZ PHE A 96 -18.759 6.750 -0.171 1.00 0.00 C ATOM 0 H PHE A 96 -22.467 6.362 2.641 1.00 0.00 H new ATOM 0 HA PHE A 96 -22.716 3.508 3.208 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.644 2.990 1.998 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.952 3.439 0.923 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.800 4.645 2.451 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -21.764 5.300 -0.532 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.366 6.322 1.394 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -20.328 6.974 -1.598 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.124 7.487 -0.640 1.00 0.00 H new ATOM 1201 N THR A 97 -20.626 3.792 4.731 1.00 0.00 N ATOM 1202 CA THR A 97 -19.748 4.092 5.830 1.00 0.00 C ATOM 1203 C THR A 97 -18.337 3.730 5.466 1.00 0.00 C ATOM 1204 O THR A 97 -18.061 3.317 4.344 1.00 0.00 O ATOM 1205 CB THR A 97 -20.121 3.216 7.016 1.00 0.00 C ATOM 1206 OG1 THR A 97 -19.912 1.897 6.639 1.00 0.00 O ATOM 1207 CG2 THR A 97 -21.556 3.427 7.465 1.00 0.00 C ATOM 0 H THR A 97 -20.773 2.796 4.565 1.00 0.00 H new ATOM 0 HA THR A 97 -19.835 5.153 6.065 1.00 0.00 H new ATOM 0 HB THR A 97 -19.500 3.483 7.871 1.00 0.00 H new ATOM 0 HG1 THR A 97 -19.004 1.626 6.887 1.00 0.00 H new ATOM 0 HG21 THR A 97 -21.771 2.778 8.314 1.00 0.00 H new ATOM 0 HG22 THR A 97 -21.696 4.467 7.759 1.00 0.00 H new ATOM 0 HG23 THR A 97 -22.233 3.187 6.645 1.00 0.00 H new ATOM 1215 N LEU A 98 -17.467 3.898 6.427 1.00 0.00 N ATOM 1216 CA LEU A 98 -16.120 3.443 6.396 1.00 0.00 C ATOM 1217 C LEU A 98 -15.791 3.011 7.798 1.00 0.00 C ATOM 1218 O LEU A 98 -16.544 3.307 8.731 1.00 0.00 O ATOM 1219 CB LEU A 98 -15.167 4.551 5.953 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.351 5.056 4.529 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.448 6.227 4.272 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.066 3.951 3.531 1.00 0.00 C ATOM 0 H LEU A 98 -17.701 4.382 7.294 1.00 0.00 H new ATOM 0 HA LEU A 98 -16.008 2.627 5.682 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -15.279 5.394 6.634 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -14.145 4.189 6.060 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.386 5.375 4.408 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.590 6.578 3.250 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.687 7.031 4.968 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.410 5.924 4.411 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.203 4.331 2.519 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.039 3.606 3.654 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.751 3.120 3.702 1.00 0.00 H new ATOM 1234 N THR A 99 -14.744 2.297 7.953 1.00 0.00 N ATOM 1235 CA THR A 99 -14.304 1.871 9.254 1.00 0.00 C ATOM 1236 C THR A 99 -12.910 2.434 9.474 1.00 0.00 C ATOM 1237 O THR A 99 -12.645 3.532 8.963 1.00 0.00 O ATOM 1238 CB THR A 99 -14.394 0.311 9.386 1.00 0.00 C ATOM 1239 OG1 THR A 99 -13.937 -0.139 10.661 1.00 0.00 O ATOM 1240 CG2 THR A 99 -13.617 -0.371 8.293 1.00 0.00 C ATOM 0 H THR A 99 -14.152 1.981 7.185 1.00 0.00 H new ATOM 0 HA THR A 99 -14.951 2.254 10.043 1.00 0.00 H new ATOM 0 HB THR A 99 -15.446 0.045 9.289 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.009 -1.115 10.708 1.00 0.00 H new ATOM 0 HG21 THR A 99 -13.697 -1.452 8.410 1.00 0.00 H new ATOM 0 HG22 THR A 99 -14.021 -0.080 7.323 1.00 0.00 H new ATOM 0 HG23 THR A 99 -12.569 -0.076 8.353 1.00 0.00 H new ATOM 1248 N GLY A 100 -12.068 1.720 10.232 1.00 0.00 N ATOM 1249 CA GLY A 100 -10.709 2.115 10.605 1.00 0.00 C ATOM 1250 C GLY A 100 -9.826 2.595 9.475 1.00 0.00 C ATOM 1251 O GLY A 100 -8.943 1.874 8.984 1.00 0.00 O ATOM 0 H GLY A 100 -12.329 0.812 10.617 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.774 2.907 11.351 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.223 1.265 11.084 1.00 0.00 H new ATOM 1255 N GLY A 101 -10.106 3.770 9.064 1.00 0.00 N ATOM 1256 CA GLY A 101 -9.343 4.481 8.099 1.00 0.00 C ATOM 1257 C GLY A 101 -9.987 5.809 7.879 1.00 0.00 C ATOM 1258 O GLY A 101 -9.313 6.834 7.786 1.00 0.00 O ATOM 0 H GLY A 101 -10.912 4.294 9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -8.317 4.609 8.445 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.297 3.922 7.164 1.00 0.00 H new ATOM 1262 N ASN A 102 -11.330 5.778 7.814 1.00 0.00 N ATOM 1263 CA ASN A 102 -12.196 6.971 7.670 1.00 0.00 C ATOM 1264 C ASN A 102 -11.959 7.771 6.393 1.00 0.00 C ATOM 1265 O ASN A 102 -12.493 8.863 6.233 1.00 0.00 O ATOM 1266 CB ASN A 102 -12.160 7.867 8.926 1.00 0.00 C ATOM 1267 CG ASN A 102 -12.966 7.286 10.084 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -12.466 6.473 10.877 1.00 0.00 O ATOM 1269 ND2 ASN A 102 -14.204 7.709 10.208 1.00 0.00 N ATOM 0 H ASN A 102 -11.858 4.907 7.861 1.00 0.00 H new ATOM 0 HA ASN A 102 -13.207 6.574 7.572 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.125 8.004 9.241 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -12.550 8.853 8.675 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -14.785 7.368 10.974 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -14.584 8.378 9.538 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.217 7.200 5.476 1.00 0.00 N ATOM 1277 CA VAL A 103 -10.928 7.785 4.175 1.00 0.00 C ATOM 1278 C VAL A 103 -10.830 6.652 3.189 1.00 0.00 C ATOM 1279 O VAL A 103 -10.921 5.487 3.589 1.00 0.00 O ATOM 1280 CB VAL A 103 -9.610 8.631 4.137 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -9.731 9.904 4.958 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -8.425 7.814 4.606 1.00 0.00 C ATOM 0 H VAL A 103 -10.781 6.288 5.611 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.730 8.482 3.932 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.446 8.918 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.796 10.461 4.905 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -10.541 10.516 4.562 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.943 9.649 5.996 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -7.524 8.426 4.569 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.595 7.480 5.629 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.301 6.947 3.957 1.00 0.00 H new ATOM 1292 N PHE A 104 -10.630 6.948 1.938 1.00 0.00 N ATOM 1293 CA PHE A 104 -10.591 5.910 0.945 1.00 0.00 C ATOM 1294 C PHE A 104 -9.198 5.397 0.741 1.00 0.00 C ATOM 1295 O PHE A 104 -8.455 5.895 -0.102 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.225 6.363 -0.364 1.00 0.00 C ATOM 1297 CG PHE A 104 -12.624 6.818 -0.158 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -13.546 5.956 0.382 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.012 8.107 -0.474 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -14.827 6.353 0.610 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.308 8.518 -0.254 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.217 7.639 0.292 1.00 0.00 C ATOM 0 H PHE A 104 -10.492 7.893 1.581 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.188 5.078 1.319 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -10.637 7.173 -0.794 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -11.209 5.542 -1.081 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.250 4.947 0.630 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.295 8.795 -0.896 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -15.538 5.663 1.039 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -14.610 9.523 -0.508 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.234 7.955 0.471 1.00 0.00 H new ATOM 1312 N GLU A 105 -8.842 4.431 1.532 1.00 0.00 N ATOM 1313 CA GLU A 105 -7.552 3.810 1.465 1.00 0.00 C ATOM 1314 C GLU A 105 -7.697 2.309 1.680 1.00 0.00 C ATOM 1315 O GLU A 105 -8.669 1.857 2.333 1.00 0.00 O ATOM 1316 CB GLU A 105 -6.600 4.409 2.508 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.089 4.258 3.955 1.00 0.00 C ATOM 1318 CD GLU A 105 -6.062 4.657 4.985 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -5.777 5.868 5.152 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -5.531 3.764 5.675 1.00 0.00 O ATOM 0 H GLU A 105 -9.449 4.045 2.255 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.126 3.994 0.479 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.625 3.931 2.413 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.459 5.468 2.291 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.984 4.865 4.092 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.378 3.221 4.125 1.00 0.00 H new ATOM 1327 N TYR A 106 -6.778 1.556 1.077 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.687 0.095 1.207 1.00 0.00 C ATOM 1329 C TYR A 106 -6.835 -0.331 2.667 1.00 0.00 C ATOM 1330 O TYR A 106 -6.033 0.038 3.529 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.339 -0.372 0.587 1.00 0.00 C ATOM 1332 CG TYR A 106 -4.908 -1.809 0.830 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.462 -2.849 0.123 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -3.894 -2.105 1.741 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.033 -4.151 0.305 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.463 -3.405 1.936 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.034 -4.427 1.212 1.00 0.00 C ATOM 1338 OH TYR A 106 -3.595 -5.735 1.387 1.00 0.00 O ATOM 0 H TYR A 106 -6.058 1.949 0.470 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.504 -0.384 0.667 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.394 -0.216 -0.490 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.553 0.282 0.964 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.248 -2.645 -0.589 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.437 -1.305 2.304 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -5.482 -4.952 -0.264 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -2.683 -3.617 2.652 1.00 0.00 H new ATOM 0 HH TYR A 106 -2.886 -5.754 2.063 1.00 0.00 H new ATOM 1348 N GLY A 107 -7.886 -1.047 2.947 1.00 0.00 N ATOM 1349 CA GLY A 107 -8.134 -1.459 4.292 1.00 0.00 C ATOM 1350 C GLY A 107 -9.536 -1.150 4.746 1.00 0.00 C ATOM 1351 O GLY A 107 -10.119 -1.923 5.518 1.00 0.00 O ATOM 0 H GLY A 107 -8.579 -1.354 2.265 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.957 -2.531 4.378 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.424 -0.965 4.956 1.00 0.00 H new ATOM 1355 N VAL A 108 -10.113 -0.045 4.276 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.444 0.311 4.739 1.00 0.00 C ATOM 1357 C VAL A 108 -12.535 -0.550 4.149 1.00 0.00 C ATOM 1358 O VAL A 108 -12.534 -0.906 2.959 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.852 1.815 4.591 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -10.971 2.742 5.382 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -11.972 2.249 3.137 1.00 0.00 C ATOM 0 H VAL A 108 -9.696 0.595 3.600 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.354 0.117 5.808 1.00 0.00 H new ATOM 0 HB VAL A 108 -12.849 1.892 5.026 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.303 3.770 5.239 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -11.030 2.485 6.440 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -9.940 2.643 5.041 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.257 3.300 3.093 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -11.014 2.112 2.636 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -12.731 1.646 2.639 1.00 0.00 H new ATOM 1371 N LYS A 109 -13.400 -0.929 5.016 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.622 -1.571 4.685 1.00 0.00 C ATOM 1373 C LYS A 109 -15.660 -0.479 4.589 1.00 0.00 C ATOM 1374 O LYS A 109 -15.894 0.241 5.566 1.00 0.00 O ATOM 1375 CB LYS A 109 -15.037 -2.543 5.800 1.00 0.00 C ATOM 1376 CG LYS A 109 -16.331 -3.281 5.512 1.00 0.00 C ATOM 1377 CD LYS A 109 -16.879 -4.047 6.732 1.00 0.00 C ATOM 1378 CE LYS A 109 -16.192 -5.396 7.012 1.00 0.00 C ATOM 1379 NZ LYS A 109 -14.751 -5.308 7.350 1.00 0.00 N ATOM 0 H LYS A 109 -13.272 -0.795 6.019 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.522 -2.134 3.757 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.240 -3.271 5.952 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -15.144 -1.989 6.732 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -17.081 -2.567 5.173 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -16.167 -3.983 4.694 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -16.779 -3.415 7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.945 -4.222 6.584 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -16.713 -5.888 7.833 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -16.306 -6.033 6.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -14.476 -6.137 7.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -14.190 -5.283 6.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -14.575 -4.442 7.898 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.227 -0.319 3.443 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.259 0.643 3.259 1.00 0.00 C ATOM 1395 C ALA A 110 -18.573 -0.074 3.387 1.00 0.00 C ATOM 1396 O ALA A 110 -18.906 -0.903 2.520 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.163 1.281 1.884 1.00 0.00 C ATOM 0 H ALA A 110 -15.988 -0.851 2.606 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.166 1.434 4.004 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -17.962 2.013 1.766 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.198 1.777 1.780 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.260 0.511 1.118 1.00 0.00 H new ATOM 1403 N VAL A 111 -19.299 0.159 4.449 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.567 -0.523 4.589 1.00 0.00 C ATOM 1405 C VAL A 111 -21.641 0.272 3.888 1.00 0.00 C ATOM 1406 O VAL A 111 -21.465 1.447 3.636 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.963 -0.867 6.056 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -19.813 -1.252 6.963 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -22.034 0.004 6.705 1.00 0.00 C ATOM 0 H VAL A 111 -19.050 0.793 5.208 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.455 -1.497 4.113 1.00 0.00 H new ATOM 0 HB VAL A 111 -21.505 -1.802 5.912 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -20.194 -1.472 7.960 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -19.313 -2.134 6.563 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -19.103 -0.427 7.020 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -22.216 -0.341 7.723 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -21.696 1.040 6.728 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -22.957 -0.064 6.129 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.708 -0.354 3.543 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.753 0.298 2.825 1.00 0.00 C ATOM 1421 C TYR A 112 -25.019 0.263 3.613 1.00 0.00 C ATOM 1422 O TYR A 112 -25.389 -0.762 4.196 1.00 0.00 O ATOM 1423 CB TYR A 112 -23.916 -0.358 1.457 1.00 0.00 C ATOM 1424 CG TYR A 112 -24.906 0.300 0.525 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -26.249 -0.025 0.573 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.487 1.218 -0.421 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -27.148 0.540 -0.283 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -25.385 1.796 -1.285 1.00 0.00 C ATOM 1429 CZ TYR A 112 -26.718 1.450 -1.211 1.00 0.00 C ATOM 1430 OH TYR A 112 -27.623 2.020 -2.069 1.00 0.00 O ATOM 0 H TYR A 112 -22.886 -1.337 3.750 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.497 1.346 2.669 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -22.943 -0.378 0.967 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -24.220 -1.394 1.606 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -26.594 -0.742 1.304 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.442 1.483 -0.481 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -28.193 0.271 -0.229 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -25.050 2.516 -2.017 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.227 2.091 -2.962 1.00 0.00 H new ATOM 1440 N THR A 113 -25.639 1.395 3.685 1.00 0.00 N ATOM 1441 CA THR A 113 -26.880 1.564 4.343 1.00 0.00 C ATOM 1442 C THR A 113 -27.563 2.743 3.661 1.00 0.00 C ATOM 1443 O THR A 113 -26.901 3.565 3.034 1.00 0.00 O ATOM 1444 CB THR A 113 -26.670 1.880 5.842 1.00 0.00 C ATOM 1445 OG1 THR A 113 -25.678 0.989 6.398 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.950 1.652 6.596 1.00 0.00 C ATOM 0 H THR A 113 -25.277 2.254 3.271 1.00 0.00 H new ATOM 0 HA THR A 113 -27.478 0.655 4.283 1.00 0.00 H new ATOM 0 HB THR A 113 -26.349 2.918 5.930 1.00 0.00 H new ATOM 0 HG1 THR A 113 -25.548 1.195 7.347 1.00 0.00 H new ATOM 0 HG21 THR A 113 -27.795 1.876 7.651 1.00 0.00 H new ATOM 0 HG22 THR A 113 -28.728 2.303 6.197 1.00 0.00 H new ATOM 0 HG23 THR A 113 -28.256 0.611 6.487 1.00 0.00 H new ATOM 1454 N CYS A 114 -28.832 2.832 3.759 1.00 0.00 N ATOM 1455 CA CYS A 114 -29.523 3.901 3.094 1.00 0.00 C ATOM 1456 C CYS A 114 -30.278 4.742 4.068 1.00 0.00 C ATOM 1457 O CYS A 114 -29.996 5.924 4.242 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.472 3.376 2.027 1.00 0.00 C ATOM 1459 SG CYS A 114 -29.703 2.511 0.630 1.00 0.00 S ATOM 0 H CYS A 114 -29.424 2.190 4.286 1.00 0.00 H new ATOM 0 HA CYS A 114 -28.765 4.516 2.609 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -31.181 2.698 2.502 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.047 4.216 1.636 1.00 0.00 H new ATOM 1464 N ASN A 115 -31.201 4.126 4.719 1.00 0.00 N ATOM 1465 CA ASN A 115 -32.075 4.778 5.623 1.00 0.00 C ATOM 1466 C ASN A 115 -32.477 3.689 6.594 1.00 0.00 C ATOM 1467 O ASN A 115 -31.721 2.740 6.781 1.00 0.00 O ATOM 1468 CB ASN A 115 -33.298 5.288 4.831 1.00 0.00 C ATOM 1469 CG ASN A 115 -34.093 6.345 5.565 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -34.998 6.035 6.334 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -33.767 7.578 5.338 1.00 0.00 N ATOM 0 H ASN A 115 -31.372 3.124 4.633 1.00 0.00 H new ATOM 0 HA ASN A 115 -31.632 5.632 6.135 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -32.960 5.695 3.878 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -33.951 4.445 4.604 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -34.269 8.333 5.806 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -33.008 7.794 4.691 1.00 0.00 H new ATOM 1478 N GLU A 116 -33.614 3.791 7.187 1.00 0.00 N ATOM 1479 CA GLU A 116 -34.077 2.763 8.058 1.00 0.00 C ATOM 1480 C GLU A 116 -34.951 1.794 7.277 1.00 0.00 C ATOM 1481 O GLU A 116 -34.775 0.573 7.347 1.00 0.00 O ATOM 1482 CB GLU A 116 -34.793 3.396 9.218 1.00 0.00 C ATOM 1483 CG GLU A 116 -35.279 2.452 10.278 1.00 0.00 C ATOM 1484 CD GLU A 116 -35.613 3.203 11.518 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -36.726 3.741 11.628 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -34.727 3.334 12.386 1.00 0.00 O ATOM 0 H GLU A 116 -34.248 4.583 7.085 1.00 0.00 H new ATOM 0 HA GLU A 116 -33.246 2.185 8.462 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -34.124 4.121 9.682 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -35.648 3.952 8.833 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -36.158 1.914 9.922 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -34.513 1.706 10.491 1.00 0.00 H new ATOM 1493 N GLY A 117 -35.861 2.348 6.506 1.00 0.00 N ATOM 1494 CA GLY A 117 -36.725 1.545 5.648 1.00 0.00 C ATOM 1495 C GLY A 117 -35.970 0.943 4.473 1.00 0.00 C ATOM 1496 O GLY A 117 -36.326 -0.118 3.965 1.00 0.00 O ATOM 0 H GLY A 117 -36.027 3.353 6.451 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -37.176 0.745 6.236 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -37.540 2.165 5.275 1.00 0.00 H new ATOM 1500 N TYR A 118 -34.939 1.626 4.045 1.00 0.00 N ATOM 1501 CA TYR A 118 -34.087 1.158 2.968 1.00 0.00 C ATOM 1502 C TYR A 118 -32.782 0.741 3.564 1.00 0.00 C ATOM 1503 O TYR A 118 -32.143 1.546 4.242 1.00 0.00 O ATOM 1504 CB TYR A 118 -33.773 2.277 1.984 1.00 0.00 C ATOM 1505 CG TYR A 118 -34.922 2.850 1.223 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -35.677 3.890 1.739 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -35.225 2.376 -0.035 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -36.711 4.439 1.019 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -36.258 2.916 -0.767 1.00 0.00 C ATOM 1510 CZ TYR A 118 -37.001 3.948 -0.236 1.00 0.00 C ATOM 1511 OH TYR A 118 -38.040 4.495 -0.966 1.00 0.00 O ATOM 0 H TYR A 118 -34.661 2.528 4.432 1.00 0.00 H new ATOM 0 HA TYR A 118 -34.600 0.347 2.452 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -33.293 3.087 2.533 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -33.044 1.902 1.266 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -35.450 4.275 2.722 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -34.643 1.568 -0.453 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -37.292 5.249 1.434 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -36.485 2.533 -1.751 1.00 0.00 H new ATOM 0 HH TYR A 118 -38.111 4.036 -1.829 1.00 0.00 H new ATOM 1521 N GLN A 119 -32.347 -0.441 3.307 1.00 0.00 N ATOM 1522 CA GLN A 119 -31.120 -0.863 3.817 1.00 0.00 C ATOM 1523 C GLN A 119 -30.379 -1.406 2.739 1.00 0.00 C ATOM 1524 O GLN A 119 -29.492 -0.753 2.186 1.00 0.00 O ATOM 1525 CB GLN A 119 -31.234 -1.939 4.895 1.00 0.00 C ATOM 1526 CG GLN A 119 -31.441 -1.423 6.290 1.00 0.00 C ATOM 1527 CD GLN A 119 -31.598 -2.540 7.302 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -32.710 -3.007 7.569 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -30.503 -2.983 7.869 1.00 0.00 N ATOM 0 H GLN A 119 -32.839 -1.130 2.738 1.00 0.00 H new ATOM 0 HA GLN A 119 -30.645 0.001 4.281 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -32.064 -2.599 4.641 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -30.328 -2.545 4.879 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -30.594 -0.797 6.572 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -32.327 -0.789 6.312 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -29.601 -2.574 7.625 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -30.553 -3.737 8.555 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.781 -2.587 2.356 1.00 0.00 N ATOM 1539 CA LEU A 120 -30.067 -3.285 1.552 1.00 0.00 C ATOM 1540 C LEU A 120 -30.835 -4.546 1.101 1.00 0.00 C ATOM 1541 O LEU A 120 -31.728 -5.023 1.811 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.932 -3.743 2.387 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.992 -4.316 1.574 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -26.890 -3.344 1.290 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -27.590 -5.703 1.934 1.00 0.00 C ATOM 0 H LEU A 120 -31.653 -3.027 2.652 1.00 0.00 H new ATOM 0 HA LEU A 120 -29.783 -2.713 0.668 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -28.500 -2.903 2.931 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -29.276 -4.461 3.131 1.00 0.00 H new ATOM 0 HG LEU A 120 -28.467 -4.518 0.614 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -26.149 -3.813 0.642 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -27.300 -2.464 0.795 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.417 -3.046 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.842 -6.060 1.226 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -27.170 -5.711 2.940 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -28.463 -6.355 1.900 1.00 0.00 H new ATOM 1557 N LEU A 121 -30.470 -5.045 -0.054 1.00 0.00 N ATOM 1558 CA LEU A 121 -30.828 -6.353 -0.534 1.00 0.00 C ATOM 1559 C LEU A 121 -29.555 -7.041 -0.975 1.00 0.00 C ATOM 1560 O LEU A 121 -28.744 -6.448 -1.704 1.00 0.00 O ATOM 1561 CB LEU A 121 -31.834 -6.314 -1.675 1.00 0.00 C ATOM 1562 CG LEU A 121 -33.295 -6.143 -1.296 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -34.140 -6.046 -2.547 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -33.766 -7.322 -0.456 1.00 0.00 C ATOM 0 H LEU A 121 -29.890 -4.526 -0.713 1.00 0.00 H new ATOM 0 HA LEU A 121 -31.317 -6.900 0.272 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -31.559 -5.498 -2.343 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -31.737 -7.238 -2.245 1.00 0.00 H new ATOM 0 HG LEU A 121 -33.399 -5.228 -0.713 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -35.187 -5.923 -2.270 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -33.818 -5.188 -3.138 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -34.024 -6.956 -3.136 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -34.815 -7.185 -0.192 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -33.653 -8.244 -1.027 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -33.168 -7.383 0.453 1.00 0.00 H new ATOM 1576 N GLY A 122 -29.366 -8.242 -0.510 1.00 0.00 N ATOM 1577 CA GLY A 122 -28.162 -8.982 -0.776 1.00 0.00 C ATOM 1578 C GLY A 122 -27.653 -9.565 0.512 1.00 0.00 C ATOM 1579 O GLY A 122 -28.371 -9.544 1.522 1.00 0.00 O ATOM 0 H GLY A 122 -30.044 -8.740 0.067 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -28.359 -9.776 -1.497 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -27.409 -8.330 -1.218 1.00 0.00 H new ATOM 1583 N GLU A 123 -26.445 -10.077 0.520 1.00 0.00 N ATOM 1584 CA GLU A 123 -25.911 -10.646 1.733 1.00 0.00 C ATOM 1585 C GLU A 123 -24.807 -9.776 2.264 1.00 0.00 C ATOM 1586 O GLU A 123 -24.701 -9.529 3.466 1.00 0.00 O ATOM 1587 CB GLU A 123 -25.386 -12.051 1.492 1.00 0.00 C ATOM 1588 CG GLU A 123 -26.406 -12.986 0.885 1.00 0.00 C ATOM 1589 CD GLU A 123 -25.952 -14.413 0.885 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -25.007 -14.764 0.152 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -26.526 -15.217 1.648 1.00 0.00 O ATOM 0 H GLU A 123 -25.822 -10.111 -0.287 1.00 0.00 H new ATOM 0 HA GLU A 123 -26.716 -10.701 2.466 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -24.519 -11.997 0.834 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -25.042 -12.468 2.439 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -27.341 -12.906 1.439 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -26.614 -12.675 -0.139 1.00 0.00 H new ATOM 1598 N ILE A 124 -24.013 -9.285 1.368 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.873 -8.507 1.720 1.00 0.00 C ATOM 1600 C ILE A 124 -23.231 -7.039 1.602 1.00 0.00 C ATOM 1601 O ILE A 124 -23.261 -6.473 0.507 1.00 0.00 O ATOM 1602 CB ILE A 124 -21.669 -8.849 0.806 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -21.449 -10.379 0.746 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -20.403 -8.145 1.286 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -21.119 -11.033 2.079 1.00 0.00 C ATOM 0 H ILE A 124 -24.140 -9.414 0.364 1.00 0.00 H new ATOM 0 HA ILE A 124 -22.582 -8.733 2.746 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.895 -8.492 -0.199 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -22.348 -10.845 0.342 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -20.640 -10.588 0.046 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -19.573 -8.401 0.628 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -20.559 -7.066 1.271 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -20.172 -8.464 2.302 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -20.983 -12.105 1.935 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -20.202 -10.601 2.479 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -21.936 -10.862 2.780 1.00 0.00 H new ATOM 1617 N ASN A 125 -23.507 -6.430 2.731 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.938 -5.028 2.802 1.00 0.00 C ATOM 1619 C ASN A 125 -22.747 -4.109 2.861 1.00 0.00 C ATOM 1620 O ASN A 125 -22.818 -3.022 3.416 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.827 -4.776 4.050 1.00 0.00 C ATOM 1622 CG ASN A 125 -24.116 -4.929 5.404 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -23.202 -5.747 5.568 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -24.517 -4.141 6.368 1.00 0.00 N ATOM 0 H ASN A 125 -23.442 -6.886 3.641 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.518 -4.822 1.902 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -25.238 -3.768 3.986 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -25.670 -5.466 4.021 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -24.074 -4.191 7.285 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -25.273 -3.477 6.202 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.681 -4.499 2.231 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.479 -3.747 2.303 1.00 0.00 C ATOM 1633 C TYR A 126 -19.562 -4.121 1.171 1.00 0.00 C ATOM 1634 O TYR A 126 -19.819 -5.067 0.415 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.774 -3.954 3.674 1.00 0.00 C ATOM 1636 CG TYR A 126 -19.118 -5.317 3.892 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -17.812 -5.548 3.475 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -19.785 -6.347 4.537 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -17.184 -6.754 3.682 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -19.163 -7.564 4.760 1.00 0.00 C ATOM 1641 CZ TYR A 126 -17.863 -7.762 4.330 1.00 0.00 C ATOM 1642 OH TYR A 126 -17.237 -8.963 4.568 1.00 0.00 O ATOM 0 H TYR A 126 -21.626 -5.341 1.659 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.730 -2.690 2.212 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -19.011 -3.184 3.788 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -20.507 -3.795 4.465 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -17.275 -4.757 2.974 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -20.802 -6.199 4.870 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -16.171 -6.909 3.341 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -19.692 -8.357 5.268 1.00 0.00 H new ATOM 0 HH TYR A 126 -17.853 -9.566 5.035 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.511 -3.392 1.079 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.485 -3.570 0.107 1.00 0.00 C ATOM 1654 C ARG A 127 -16.186 -3.169 0.758 1.00 0.00 C ATOM 1655 O ARG A 127 -16.127 -2.168 1.466 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.811 -2.709 -1.109 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.233 -1.312 -0.720 1.00 0.00 C ATOM 1658 CD ARG A 127 -18.789 -0.546 -1.867 1.00 0.00 C ATOM 1659 NE ARG A 127 -19.429 0.691 -1.409 1.00 0.00 N ATOM 1660 CZ ARG A 127 -20.168 1.488 -2.181 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -20.310 1.225 -3.469 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -20.744 2.569 -1.669 1.00 0.00 N ATOM 0 H ARG A 127 -18.330 -2.612 1.711 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.407 -4.602 -0.235 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -16.938 -2.655 -1.759 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -18.608 -3.181 -1.684 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.980 -1.369 0.072 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -17.376 -0.777 -0.311 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -17.992 -0.308 -2.571 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -19.515 -1.159 -2.402 1.00 0.00 H new ATOM 0 HE ARG A 127 -19.300 0.960 -0.434 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -19.853 0.409 -3.876 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -20.877 1.838 -4.055 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -20.622 2.793 -0.681 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -21.309 3.176 -2.263 1.00 0.00 H new ATOM 1676 N GLU A 128 -15.185 -3.946 0.585 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.931 -3.683 1.216 1.00 0.00 C ATOM 1678 C GLU A 128 -12.896 -3.308 0.199 1.00 0.00 C ATOM 1679 O GLU A 128 -12.925 -3.794 -0.926 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.512 -4.874 2.072 1.00 0.00 C ATOM 1681 CG GLU A 128 -14.310 -4.995 3.307 1.00 0.00 C ATOM 1682 CD GLU A 128 -13.771 -5.996 4.267 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -13.973 -7.198 4.092 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.146 -5.575 5.254 1.00 0.00 O ATOM 0 H GLU A 128 -15.202 -4.784 0.004 1.00 0.00 H new ATOM 0 HA GLU A 128 -14.035 -2.828 1.885 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.612 -5.789 1.488 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.458 -4.776 2.333 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -14.357 -4.022 3.797 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -15.332 -5.269 3.044 1.00 0.00 H new ATOM 1691 N CYS A 129 -12.035 -2.399 0.556 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.013 -1.962 -0.346 1.00 0.00 C ATOM 1693 C CYS A 129 -9.809 -2.869 -0.235 1.00 0.00 C ATOM 1694 O CYS A 129 -9.069 -2.841 0.769 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.628 -0.515 -0.086 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.428 0.149 -1.277 1.00 0.00 S ATOM 0 H CYS A 129 -12.022 -1.945 1.470 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.403 -2.016 -1.362 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.527 0.100 -0.109 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.212 -0.434 0.918 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.646 -3.690 -1.234 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.570 -4.638 -1.303 1.00 0.00 C ATOM 1703 C ASP A 130 -7.488 -4.071 -2.237 1.00 0.00 C ATOM 1704 O ASP A 130 -7.533 -2.896 -2.597 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.115 -5.971 -1.847 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.186 -7.161 -1.596 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -7.278 -7.417 -2.414 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -8.339 -7.841 -0.565 1.00 0.00 O ATOM 0 H ASP A 130 -10.271 -3.719 -2.040 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.138 -4.814 -0.318 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.083 -6.173 -1.387 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.285 -5.874 -2.919 1.00 0.00 H new ATOM 1713 N THR A 131 -6.550 -4.903 -2.634 1.00 0.00 N ATOM 1714 CA THR A 131 -5.437 -4.535 -3.483 1.00 0.00 C ATOM 1715 C THR A 131 -5.951 -4.066 -4.850 1.00 0.00 C ATOM 1716 O THR A 131 -5.486 -3.064 -5.414 1.00 0.00 O ATOM 1717 CB THR A 131 -4.516 -5.772 -3.680 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.299 -6.892 -4.158 1.00 0.00 O ATOM 1719 CG2 THR A 131 -3.854 -6.172 -2.381 1.00 0.00 C ATOM 0 H THR A 131 -6.540 -5.887 -2.366 1.00 0.00 H new ATOM 0 HA THR A 131 -4.880 -3.725 -3.013 1.00 0.00 H new ATOM 0 HB THR A 131 -3.747 -5.504 -4.405 1.00 0.00 H new ATOM 0 HG1 THR A 131 -5.796 -7.286 -3.411 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.216 -7.040 -2.550 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.250 -5.344 -2.011 1.00 0.00 H new ATOM 0 HG23 THR A 131 -4.618 -6.421 -1.645 1.00 0.00 H new ATOM 1727 N ASP A 132 -6.916 -4.813 -5.362 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.573 -4.527 -6.625 1.00 0.00 C ATOM 1729 C ASP A 132 -8.421 -3.294 -6.486 1.00 0.00 C ATOM 1730 O ASP A 132 -8.486 -2.450 -7.381 1.00 0.00 O ATOM 1731 CB ASP A 132 -8.470 -5.699 -7.004 1.00 0.00 C ATOM 1732 CG ASP A 132 -9.203 -5.493 -8.310 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -8.647 -5.851 -9.362 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -10.356 -5.008 -8.307 1.00 0.00 O ATOM 0 H ASP A 132 -7.271 -5.651 -4.901 1.00 0.00 H new ATOM 0 HA ASP A 132 -6.817 -4.370 -7.395 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.865 -6.603 -7.074 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -9.197 -5.863 -6.209 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.028 -3.182 -5.347 1.00 0.00 N ATOM 1740 CA GLY A 133 -9.916 -2.122 -5.065 1.00 0.00 C ATOM 1741 C GLY A 133 -11.092 -2.663 -4.326 1.00 0.00 C ATOM 1742 O GLY A 133 -10.953 -3.637 -3.594 1.00 0.00 O ATOM 0 H GLY A 133 -8.912 -3.842 -4.579 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -9.415 -1.358 -4.470 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -10.239 -1.644 -5.990 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.233 -2.088 -4.538 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.449 -2.499 -3.869 1.00 0.00 C ATOM 1748 C TRP A 134 -13.851 -3.899 -4.291 1.00 0.00 C ATOM 1749 O TRP A 134 -14.025 -4.179 -5.491 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.587 -1.507 -4.139 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.271 -0.113 -3.694 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -13.944 0.945 -4.488 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.228 0.366 -2.347 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -13.702 2.052 -3.721 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -13.871 1.723 -2.399 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.456 -0.223 -1.101 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -13.740 2.502 -1.251 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.324 0.550 0.031 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -13.968 1.897 -0.050 1.00 0.00 C ATOM 0 H TRP A 134 -12.359 -1.310 -5.186 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.254 -2.508 -2.797 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -14.808 -1.500 -5.206 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.487 -1.849 -3.629 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -13.884 0.914 -5.566 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -13.439 2.972 -4.074 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.731 -1.265 -1.027 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -13.468 3.546 -1.310 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.499 0.106 1.000 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -13.871 2.473 0.858 1.00 0.00 H new ATOM 1770 N THR A 135 -13.967 -4.771 -3.311 1.00 0.00 N ATOM 1771 CA THR A 135 -14.333 -6.158 -3.504 1.00 0.00 C ATOM 1772 C THR A 135 -15.709 -6.296 -4.151 1.00 0.00 C ATOM 1773 O THR A 135 -15.940 -7.191 -4.959 1.00 0.00 O ATOM 1774 CB THR A 135 -14.319 -6.890 -2.146 1.00 0.00 C ATOM 1775 OG1 THR A 135 -15.098 -6.136 -1.188 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.898 -7.048 -1.626 1.00 0.00 C ATOM 0 H THR A 135 -13.805 -4.528 -2.334 1.00 0.00 H new ATOM 0 HA THR A 135 -13.603 -6.607 -4.177 1.00 0.00 H new ATOM 0 HB THR A 135 -14.749 -7.882 -2.284 1.00 0.00 H new ATOM 0 HG1 THR A 135 -15.119 -6.615 -0.334 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.917 -7.567 -0.668 1.00 0.00 H new ATOM 0 HG22 THR A 135 -12.311 -7.626 -2.340 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.446 -6.064 -1.497 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.593 -5.374 -3.837 1.00 0.00 N ATOM 1785 CA ASN A 136 -17.940 -5.397 -4.326 1.00 0.00 C ATOM 1786 C ASN A 136 -18.295 -4.045 -4.851 1.00 0.00 C ATOM 1787 O ASN A 136 -17.584 -3.055 -4.593 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.940 -5.838 -3.233 1.00 0.00 C ATOM 1789 CG ASN A 136 -18.812 -7.301 -2.865 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -18.459 -8.143 -3.699 1.00 0.00 O ATOM 1791 ND2 ASN A 136 -19.081 -7.618 -1.637 1.00 0.00 N ATOM 0 H ASN A 136 -16.387 -4.582 -3.228 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.004 -6.131 -5.130 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.785 -5.231 -2.341 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -19.955 -5.644 -3.579 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -19.004 -8.588 -1.332 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -19.369 -6.897 -0.976 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.361 -3.991 -5.577 1.00 0.00 N ATOM 1799 CA ASP A 137 -19.818 -2.777 -6.188 1.00 0.00 C ATOM 1800 C ASP A 137 -20.928 -2.186 -5.303 1.00 0.00 C ATOM 1801 O ASP A 137 -20.848 -2.286 -4.077 1.00 0.00 O ATOM 1802 CB ASP A 137 -20.283 -3.115 -7.607 1.00 0.00 C ATOM 1803 CG ASP A 137 -20.588 -1.899 -8.455 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -19.646 -1.202 -8.885 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -21.779 -1.610 -8.673 1.00 0.00 O ATOM 0 H ASP A 137 -19.953 -4.800 -5.769 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.036 -2.022 -6.271 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -19.512 -3.707 -8.101 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -21.175 -3.739 -7.548 1.00 0.00 H new ATOM 1810 N ILE A 138 -21.920 -1.573 -5.876 1.00 0.00 N ATOM 1811 CA ILE A 138 -22.965 -0.939 -5.120 1.00 0.00 C ATOM 1812 C ILE A 138 -24.074 -1.967 -4.853 1.00 0.00 C ATOM 1813 O ILE A 138 -24.690 -2.466 -5.790 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.543 0.248 -5.923 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -22.398 1.103 -6.476 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -24.426 1.118 -5.011 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -22.789 1.924 -7.677 1.00 0.00 C ATOM 0 H ILE A 138 -22.030 -1.497 -6.887 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.565 -0.568 -4.176 1.00 0.00 H new ATOM 0 HB ILE A 138 -24.143 -0.141 -6.746 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -22.040 1.769 -5.691 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -21.566 0.452 -6.745 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -24.830 1.953 -5.584 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -25.246 0.517 -4.618 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -23.828 1.501 -4.184 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -21.931 2.504 -8.016 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -23.119 1.263 -8.478 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -23.600 2.600 -7.407 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.286 -2.351 -3.577 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.352 -3.291 -3.203 1.00 0.00 C ATOM 1831 C PRO A 139 -26.744 -2.688 -3.462 1.00 0.00 C ATOM 1832 O PRO A 139 -26.887 -1.463 -3.603 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.152 -3.533 -1.692 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.079 -2.598 -1.241 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.494 -1.903 -2.430 1.00 0.00 C ATOM 0 HA PRO A 139 -25.300 -4.210 -3.787 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.078 -3.351 -1.146 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -24.868 -4.568 -1.501 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.488 -1.867 -0.543 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.303 -3.147 -0.709 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -23.547 -0.820 -2.316 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.442 -2.160 -2.556 1.00 0.00 H new ATOM 1843 N ILE A 140 -27.756 -3.536 -3.523 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.112 -3.086 -3.798 1.00 0.00 C ATOM 1845 C ILE A 140 -29.671 -2.410 -2.550 1.00 0.00 C ATOM 1846 O ILE A 140 -29.475 -2.895 -1.445 1.00 0.00 O ATOM 1847 CB ILE A 140 -30.077 -4.258 -4.267 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.641 -4.889 -5.615 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.538 -3.793 -4.373 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -28.381 -5.737 -5.568 1.00 0.00 C ATOM 0 H ILE A 140 -27.665 -4.543 -3.386 1.00 0.00 H new ATOM 0 HA ILE A 140 -29.063 -2.382 -4.629 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.002 -5.021 -3.492 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -30.459 -5.506 -5.988 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -29.491 -4.088 -6.339 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -32.162 -4.626 -4.697 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -31.879 -3.440 -3.400 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -31.610 -2.982 -5.098 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -28.168 -6.128 -6.563 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -27.543 -5.126 -5.232 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.526 -6.566 -4.875 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.322 -1.304 -2.728 1.00 0.00 N ATOM 1863 CA CYS A 141 -30.884 -0.554 -1.641 1.00 0.00 C ATOM 1864 C CYS A 141 -32.383 -0.758 -1.592 1.00 0.00 C ATOM 1865 O CYS A 141 -33.128 -0.196 -2.415 1.00 0.00 O ATOM 1866 CB CYS A 141 -30.566 0.926 -1.813 1.00 0.00 C ATOM 1867 SG CYS A 141 -31.280 2.019 -0.545 1.00 0.00 S ATOM 0 H CYS A 141 -30.482 -0.887 -3.645 1.00 0.00 H new ATOM 0 HA CYS A 141 -30.448 -0.905 -0.705 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -29.483 1.052 -1.812 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -30.923 1.248 -2.791 1.00 0.00 H new ATOM 1872 N GLU A 142 -32.813 -1.584 -0.665 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.195 -1.893 -0.463 1.00 0.00 C ATOM 1874 C GLU A 142 -34.269 -2.694 0.839 1.00 0.00 C ATOM 1875 O GLU A 142 -34.721 -3.851 0.858 1.00 0.00 O ATOM 1876 CB GLU A 142 -34.729 -2.680 -1.686 1.00 0.00 C ATOM 1877 CG GLU A 142 -36.218 -2.976 -1.703 1.00 0.00 C ATOM 1878 CD GLU A 142 -37.074 -1.739 -1.569 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -37.388 -1.088 -2.595 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -37.478 -1.396 -0.430 1.00 0.00 O ATOM 1881 OXT GLU A 142 -33.776 -2.173 1.853 1.00 0.00 O ATOM 0 H GLU A 142 -32.189 -2.067 -0.019 1.00 0.00 H new ATOM 0 HA GLU A 142 -34.820 -1.004 -0.376 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -34.482 -2.119 -2.587 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -34.192 -3.627 -1.743 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -36.470 -3.485 -2.634 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -36.454 -3.663 -0.890 1.00 0.00 H new