USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1063 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 39 THR OG1 : rot 168:sc= -1.78! USER MOD Set 1.2: A 40 THR OG1 : rot -140:sc= -0.0623 USER MOD Set 1.3: A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 15 ASN : amide:sc=-0.00046 X(o=-0.036,f=0.059) USER MOD Set 2.2: A 117 LYS NZ :NH3+ -117:sc= -0.0352 (180deg=0) USER MOD Set 3.1: A 8 GLN : amide:sc= 0.383 K(o=0.93,f=-6.6!) USER MOD Set 3.2: A 124 TYR OH : rot 104:sc= 0.544 USER MOD Single : A 1 HIS : no HD1:sc= 0.459 K(o=0.46,f=-2.3!) USER MOD Single : A 1 HIS N :NH3+ -179:sc= 0.553 (180deg=0.534) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0747 USER MOD Single : A 12 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0597) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 53:sc= -0.934 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 21 LYS NZ :NH3+ -132:sc= -1.6 (180deg=-5.34!) USER MOD Single : A 22 THR OG1 : rot -148:sc=-0.00508 USER MOD Single : A 25 THR OG1 : rot -170:sc= -0.334 USER MOD Single : A 28 THR OG1 : rot 41:sc= 0.137 USER MOD Single : A 30 THR OG1 : rot -160:sc= -1.95! USER MOD Single : A 36 SER OG : rot 180:sc= -0.598 USER MOD Single : A 37 LYS NZ :NH3+ -113:sc= -0.0234 (180deg=-0.16) USER MOD Single : A 38 ASN : amide:sc= 0.00237 X(o=0.0024,f=0) USER MOD Single : A 44 THR OG1 : rot 100:sc=-0.000807 USER MOD Single : A 50 THR OG1 : rot -170:sc= -0.13 USER MOD Single : A 54 GLN : amide:sc= -0.301 K(o=-0.3,f=-1.9!) USER MOD Single : A 56 TYR OH : rot 180:sc= -3.54! USER MOD Single : A 57 SER OG : rot -47:sc= 0.482 USER MOD Single : A 58 HIS : no HD1:sc= -0.0234 X(o=-0.023,f=-0.0034) USER MOD Single : A 59 HIS : no HD1:sc= -1.13! C(o=-1.1!,f=-2.9!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.0793 USER MOD Single : A 71 GLN : amide:sc= -0.0242 X(o=-0.024,f=-0.096) USER MOD Single : A 72 GLN : amide:sc= -0.0373 K(o=-0.037,f=-0.93) USER MOD Single : A 74 HIS : no HE2:sc= -0.304 X(o=-0.3,f=-0.56) USER MOD Single : A 76 HIS : no HE2:sc= -5.89! K(o=-5.9!,f=-5.3) USER MOD Single : A 77 LYS NZ :NH3+ 135:sc= -0.0814 (180deg=-0.305) USER MOD Single : A 78 GLN : amide:sc= -0.0132 X(o=-0.013,f=-0.15) USER MOD Single : A 84 LYS NZ :NH3+ 167:sc= -0.317 (180deg=-0.427) USER MOD Single : A 89 ASN : amide:sc= -0.0309 K(o=-0.031,f=-1.7!) USER MOD Single : A 97 ASN : amide:sc= -1.86 K(o=-1.9,f=-0.61) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.299 K(o=-0.3,f=-6!) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.51 X(o=-0.51,f=-0.052) USER MOD Single : A 118 THR OG1 : rot 67:sc= 0.189 USER MOD Single : A 120 MET CE :methyl -130:sc= -2.21 (180deg=-8.73!) USER MOD Single : A 123 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.054) USER MOD Single : A 125 SER OG : rot 14:sc= 0.863 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot -48:sc= 0.0774 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 13.841 -4.084 -27.265 1.00 0.00 N ATOM 2 CA HIS A 1 15.232 -3.558 -27.170 1.00 0.00 C ATOM 3 C HIS A 1 15.357 -2.292 -28.021 1.00 0.00 C ATOM 4 O HIS A 1 16.252 -2.165 -28.836 1.00 0.00 O ATOM 5 CB HIS A 1 16.213 -4.615 -27.680 1.00 0.00 C ATOM 6 CG HIS A 1 16.159 -5.822 -26.784 1.00 0.00 C ATOM 7 ND1 HIS A 1 15.374 -5.858 -25.641 1.00 0.00 N ATOM 8 CD2 HIS A 1 16.785 -7.042 -26.849 1.00 0.00 C ATOM 9 CE1 HIS A 1 15.547 -7.064 -25.070 1.00 0.00 C ATOM 10 NE2 HIS A 1 16.397 -7.825 -25.765 1.00 0.00 N ATOM 0 H1 HIS A 1 13.750 -4.935 -26.674 1.00 0.00 H new ATOM 0 H2 HIS A 1 13.172 -3.359 -26.934 1.00 0.00 H new ATOM 0 H3 HIS A 1 13.628 -4.326 -28.254 1.00 0.00 H new ATOM 0 HA HIS A 1 15.461 -3.322 -26.131 1.00 0.00 H new ATOM 0 HB2 HIS A 1 15.962 -4.896 -28.703 1.00 0.00 H new ATOM 0 HB3 HIS A 1 17.224 -4.209 -27.700 1.00 0.00 H new ATOM 0 HD2 HIS A 1 17.473 -7.348 -27.623 1.00 0.00 H new ATOM 0 HE1 HIS A 1 15.058 -7.379 -24.160 1.00 0.00 H new ATOM 0 HE2 HIS A 1 16.697 -8.775 -25.548 1.00 0.00 H new ATOM 20 N LYS A 2 14.469 -1.355 -27.842 1.00 0.00 N ATOM 21 CA LYS A 2 14.537 -0.098 -28.639 1.00 0.00 C ATOM 22 C LYS A 2 14.823 1.082 -27.709 1.00 0.00 C ATOM 23 O LYS A 2 14.708 0.977 -26.504 1.00 0.00 O ATOM 24 CB LYS A 2 13.202 0.125 -29.353 1.00 0.00 C ATOM 25 CG LYS A 2 13.457 0.410 -30.834 1.00 0.00 C ATOM 26 CD LYS A 2 12.172 0.932 -31.482 1.00 0.00 C ATOM 27 CE LYS A 2 12.093 0.443 -32.930 1.00 0.00 C ATOM 28 NZ LYS A 2 10.677 0.126 -33.269 1.00 0.00 N ATOM 0 H LYS A 2 13.697 -1.405 -27.177 1.00 0.00 H new ATOM 0 HA LYS A 2 15.335 -0.178 -29.377 1.00 0.00 H new ATOM 0 HB2 LYS A 2 12.568 -0.755 -29.245 1.00 0.00 H new ATOM 0 HB3 LYS A 2 12.669 0.960 -28.898 1.00 0.00 H new ATOM 0 HG2 LYS A 2 14.255 1.144 -30.942 1.00 0.00 H new ATOM 0 HG3 LYS A 2 13.788 -0.498 -31.338 1.00 0.00 H new ATOM 0 HD2 LYS A 2 11.303 0.585 -30.922 1.00 0.00 H new ATOM 0 HD3 LYS A 2 12.155 2.022 -31.454 1.00 0.00 H new ATOM 0 HE2 LYS A 2 12.478 1.207 -33.605 1.00 0.00 H new ATOM 0 HE3 LYS A 2 12.717 -0.441 -33.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 10.622 -0.206 -34.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 10.326 -0.617 -32.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 10.094 0.980 -33.159 1.00 0.00 H new ATOM 42 N CYS A 3 15.189 2.207 -28.259 1.00 0.00 N ATOM 43 CA CYS A 3 15.477 3.391 -27.407 1.00 0.00 C ATOM 44 C CYS A 3 14.370 4.429 -27.591 1.00 0.00 C ATOM 45 O CYS A 3 13.786 4.547 -28.650 1.00 0.00 O ATOM 46 CB CYS A 3 16.810 4.002 -27.815 1.00 0.00 C ATOM 47 SG CYS A 3 17.995 3.824 -26.460 1.00 0.00 S ATOM 0 H CYS A 3 15.301 2.356 -29.262 1.00 0.00 H new ATOM 0 HA CYS A 3 15.523 3.082 -26.363 1.00 0.00 H new ATOM 0 HB2 CYS A 3 17.189 3.510 -28.711 1.00 0.00 H new ATOM 0 HB3 CYS A 3 16.679 5.056 -28.062 1.00 0.00 H new ATOM 52 N ASP A 4 14.072 5.180 -26.566 1.00 0.00 N ATOM 53 CA ASP A 4 13.002 6.202 -26.684 1.00 0.00 C ATOM 54 C ASP A 4 13.471 7.517 -26.060 1.00 0.00 C ATOM 55 O ASP A 4 14.474 7.576 -25.378 1.00 0.00 O ATOM 56 CB ASP A 4 11.757 5.717 -25.949 1.00 0.00 C ATOM 57 CG ASP A 4 10.512 6.346 -26.577 1.00 0.00 C ATOM 58 OD1 ASP A 4 10.125 5.906 -27.647 1.00 0.00 O ATOM 59 OD2 ASP A 4 9.967 7.258 -25.976 1.00 0.00 O ATOM 0 H ASP A 4 14.525 5.128 -25.654 1.00 0.00 H new ATOM 0 HA ASP A 4 12.773 6.361 -27.738 1.00 0.00 H new ATOM 0 HB2 ASP A 4 11.693 4.630 -26.000 1.00 0.00 H new ATOM 0 HB3 ASP A 4 11.818 5.983 -24.894 1.00 0.00 H new ATOM 64 N ILE A 5 12.749 8.573 -26.300 1.00 0.00 N ATOM 65 CA ILE A 5 13.115 9.894 -25.754 1.00 0.00 C ATOM 66 C ILE A 5 12.898 9.926 -24.238 1.00 0.00 C ATOM 67 O ILE A 5 13.563 10.649 -23.522 1.00 0.00 O ATOM 68 CB ILE A 5 12.202 10.909 -26.421 1.00 0.00 C ATOM 69 CG1 ILE A 5 12.012 10.525 -27.890 1.00 0.00 C ATOM 70 CG2 ILE A 5 12.808 12.309 -26.319 1.00 0.00 C ATOM 71 CD1 ILE A 5 10.554 10.131 -28.130 1.00 0.00 C ATOM 0 H ILE A 5 11.901 8.569 -26.866 1.00 0.00 H new ATOM 0 HA ILE A 5 14.165 10.113 -25.946 1.00 0.00 H new ATOM 0 HB ILE A 5 11.235 10.913 -25.918 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.284 11.361 -28.534 1.00 0.00 H new ATOM 0 HG13 ILE A 5 12.671 9.696 -28.148 1.00 0.00 H new ATOM 0 HG21 ILE A 5 12.145 13.028 -26.800 1.00 0.00 H new ATOM 0 HG22 ILE A 5 12.933 12.576 -25.270 1.00 0.00 H new ATOM 0 HG23 ILE A 5 13.779 12.322 -26.814 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.419 9.857 -29.176 1.00 0.00 H new ATOM 0 HD12 ILE A 5 10.298 9.282 -27.497 1.00 0.00 H new ATOM 0 HD13 ILE A 5 9.905 10.973 -27.888 1.00 0.00 H new ATOM 83 N THR A 6 11.955 9.169 -23.743 1.00 0.00 N ATOM 84 CA THR A 6 11.679 9.180 -22.278 1.00 0.00 C ATOM 85 C THR A 6 12.960 8.888 -21.497 1.00 0.00 C ATOM 86 O THR A 6 13.311 9.602 -20.580 1.00 0.00 O ATOM 87 CB THR A 6 10.630 8.117 -21.949 1.00 0.00 C ATOM 88 OG1 THR A 6 9.717 8.003 -23.032 1.00 0.00 O ATOM 89 CG2 THR A 6 9.875 8.517 -20.682 1.00 0.00 C ATOM 0 H THR A 6 11.364 8.544 -24.291 1.00 0.00 H new ATOM 0 HA THR A 6 11.307 10.165 -21.995 1.00 0.00 H new ATOM 0 HB THR A 6 11.123 7.158 -21.787 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.045 7.321 -22.823 1.00 0.00 H new ATOM 0 HG21 THR A 6 9.128 7.758 -20.449 1.00 0.00 H new ATOM 0 HG22 THR A 6 10.576 8.602 -19.852 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.381 9.476 -20.840 1.00 0.00 H new ATOM 97 N LEU A 7 13.655 7.840 -21.834 1.00 0.00 N ATOM 98 CA LEU A 7 14.893 7.522 -21.085 1.00 0.00 C ATOM 99 C LEU A 7 15.935 8.618 -21.293 1.00 0.00 C ATOM 100 O LEU A 7 16.480 9.143 -20.347 1.00 0.00 O ATOM 101 CB LEU A 7 15.483 6.163 -21.503 1.00 0.00 C ATOM 102 CG LEU A 7 15.467 5.907 -23.022 1.00 0.00 C ATOM 103 CD1 LEU A 7 16.497 4.822 -23.337 1.00 0.00 C ATOM 104 CD2 LEU A 7 14.089 5.407 -23.461 1.00 0.00 C ATOM 0 H LEU A 7 13.420 7.196 -22.590 1.00 0.00 H new ATOM 0 HA LEU A 7 14.627 7.464 -20.030 1.00 0.00 H new ATOM 0 HB2 LEU A 7 16.511 6.101 -21.146 1.00 0.00 H new ATOM 0 HB3 LEU A 7 14.925 5.369 -21.006 1.00 0.00 H new ATOM 0 HG LEU A 7 15.698 6.834 -23.547 1.00 0.00 H new ATOM 0 HD11 LEU A 7 16.502 4.625 -24.409 1.00 0.00 H new ATOM 0 HD12 LEU A 7 17.486 5.158 -23.025 1.00 0.00 H new ATOM 0 HD13 LEU A 7 16.238 3.908 -22.802 1.00 0.00 H new ATOM 0 HD21 LEU A 7 14.092 5.230 -24.537 1.00 0.00 H new ATOM 0 HD22 LEU A 7 13.857 4.478 -22.941 1.00 0.00 H new ATOM 0 HD23 LEU A 7 13.336 6.157 -23.219 1.00 0.00 H new ATOM 116 N GLN A 8 16.212 8.984 -22.508 1.00 0.00 N ATOM 117 CA GLN A 8 17.214 10.060 -22.722 1.00 0.00 C ATOM 118 C GLN A 8 16.848 11.236 -21.831 1.00 0.00 C ATOM 119 O GLN A 8 17.687 11.991 -21.379 1.00 0.00 O ATOM 120 CB GLN A 8 17.206 10.496 -24.190 1.00 0.00 C ATOM 121 CG GLN A 8 17.065 9.263 -25.087 1.00 0.00 C ATOM 122 CD GLN A 8 18.053 9.365 -26.252 1.00 0.00 C ATOM 123 OE1 GLN A 8 18.610 8.372 -26.678 1.00 0.00 O ATOM 124 NE2 GLN A 8 18.293 10.529 -26.788 1.00 0.00 N ATOM 0 H GLN A 8 15.795 8.592 -23.353 1.00 0.00 H new ATOM 0 HA GLN A 8 18.212 9.698 -22.474 1.00 0.00 H new ATOM 0 HB2 GLN A 8 16.383 11.187 -24.371 1.00 0.00 H new ATOM 0 HB3 GLN A 8 18.127 11.029 -24.428 1.00 0.00 H new ATOM 0 HG2 GLN A 8 17.257 8.357 -24.512 1.00 0.00 H new ATOM 0 HG3 GLN A 8 16.046 9.190 -25.466 1.00 0.00 H new ATOM 0 HE21 GLN A 8 17.825 11.362 -26.430 1.00 0.00 H new ATOM 0 HE22 GLN A 8 18.949 10.607 -27.565 1.00 0.00 H new ATOM 133 N GLU A 9 15.589 11.377 -21.577 1.00 0.00 N ATOM 134 CA GLU A 9 15.101 12.483 -20.709 1.00 0.00 C ATOM 135 C GLU A 9 15.498 12.227 -19.250 1.00 0.00 C ATOM 136 O GLU A 9 16.014 13.098 -18.580 1.00 0.00 O ATOM 137 CB GLU A 9 13.578 12.579 -20.812 1.00 0.00 C ATOM 138 CG GLU A 9 13.203 13.637 -21.851 1.00 0.00 C ATOM 139 CD GLU A 9 11.765 13.407 -22.321 1.00 0.00 C ATOM 140 OE1 GLU A 9 11.373 12.256 -22.418 1.00 0.00 O ATOM 141 OE2 GLU A 9 11.082 14.385 -22.574 1.00 0.00 O ATOM 0 H GLU A 9 14.858 10.764 -21.938 1.00 0.00 H new ATOM 0 HA GLU A 9 15.552 13.418 -21.041 1.00 0.00 H new ATOM 0 HB2 GLU A 9 13.160 11.613 -21.094 1.00 0.00 H new ATOM 0 HB3 GLU A 9 13.153 12.839 -19.843 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.301 14.634 -21.421 1.00 0.00 H new ATOM 0 HG3 GLU A 9 13.886 13.587 -22.699 1.00 0.00 H new ATOM 148 N ILE A 10 15.248 11.044 -18.745 1.00 0.00 N ATOM 149 CA ILE A 10 15.602 10.760 -17.324 1.00 0.00 C ATOM 150 C ILE A 10 17.110 10.893 -17.127 1.00 0.00 C ATOM 151 O ILE A 10 17.556 11.566 -16.230 1.00 0.00 O ATOM 152 CB ILE A 10 15.139 9.337 -16.957 1.00 0.00 C ATOM 153 CG1 ILE A 10 13.659 9.358 -16.561 1.00 0.00 C ATOM 154 CG2 ILE A 10 15.957 8.805 -15.774 1.00 0.00 C ATOM 155 CD1 ILE A 10 12.872 10.257 -17.518 1.00 0.00 C ATOM 0 H ILE A 10 14.818 10.270 -19.252 1.00 0.00 H new ATOM 0 HA ILE A 10 15.102 11.478 -16.674 1.00 0.00 H new ATOM 0 HB ILE A 10 15.283 8.691 -17.823 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.254 8.346 -16.584 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.553 9.721 -15.539 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.622 7.799 -15.523 1.00 0.00 H new ATOM 0 HG22 ILE A 10 17.013 8.779 -16.044 1.00 0.00 H new ATOM 0 HG23 ILE A 10 15.819 9.459 -14.913 1.00 0.00 H new ATOM 0 HD11 ILE A 10 11.821 10.265 -17.228 1.00 0.00 H new ATOM 0 HD12 ILE A 10 13.269 11.271 -17.473 1.00 0.00 H new ATOM 0 HD13 ILE A 10 12.965 9.875 -18.535 1.00 0.00 H new ATOM 167 N ILE A 11 17.904 10.265 -17.944 1.00 0.00 N ATOM 168 CA ILE A 11 19.376 10.386 -17.759 1.00 0.00 C ATOM 169 C ILE A 11 19.763 11.861 -17.854 1.00 0.00 C ATOM 170 O ILE A 11 20.699 12.308 -17.222 1.00 0.00 O ATOM 171 CB ILE A 11 20.104 9.576 -18.838 1.00 0.00 C ATOM 172 CG1 ILE A 11 20.050 8.089 -18.478 1.00 0.00 C ATOM 173 CG2 ILE A 11 21.567 10.022 -18.924 1.00 0.00 C ATOM 174 CD1 ILE A 11 20.842 7.285 -19.512 1.00 0.00 C ATOM 0 H ILE A 11 17.604 9.679 -18.723 1.00 0.00 H new ATOM 0 HA ILE A 11 19.662 9.996 -16.782 1.00 0.00 H new ATOM 0 HB ILE A 11 19.619 9.741 -19.800 1.00 0.00 H new ATOM 0 HG12 ILE A 11 20.464 7.930 -17.482 1.00 0.00 H new ATOM 0 HG13 ILE A 11 19.015 7.748 -18.451 1.00 0.00 H new ATOM 0 HG21 ILE A 11 22.079 9.443 -19.692 1.00 0.00 H new ATOM 0 HG22 ILE A 11 21.610 11.081 -19.178 1.00 0.00 H new ATOM 0 HG23 ILE A 11 22.054 9.860 -17.962 1.00 0.00 H new ATOM 0 HD11 ILE A 11 20.804 6.226 -19.256 1.00 0.00 H new ATOM 0 HD12 ILE A 11 20.408 7.435 -20.500 1.00 0.00 H new ATOM 0 HD13 ILE A 11 21.879 7.620 -19.517 1.00 0.00 H new ATOM 186 N LYS A 12 19.046 12.622 -18.631 1.00 0.00 N ATOM 187 CA LYS A 12 19.371 14.068 -18.750 1.00 0.00 C ATOM 188 C LYS A 12 19.175 14.741 -17.389 1.00 0.00 C ATOM 189 O LYS A 12 19.986 15.536 -16.956 1.00 0.00 O ATOM 190 CB LYS A 12 18.444 14.717 -19.780 1.00 0.00 C ATOM 191 CG LYS A 12 18.865 16.173 -19.999 1.00 0.00 C ATOM 192 CD LYS A 12 18.285 17.046 -18.884 1.00 0.00 C ATOM 193 CE LYS A 12 18.099 18.474 -19.397 1.00 0.00 C ATOM 194 NZ LYS A 12 19.432 19.073 -19.690 1.00 0.00 N ATOM 0 H LYS A 12 18.251 12.306 -19.187 1.00 0.00 H new ATOM 0 HA LYS A 12 20.406 14.186 -19.072 1.00 0.00 H new ATOM 0 HB2 LYS A 12 18.488 14.169 -20.721 1.00 0.00 H new ATOM 0 HB3 LYS A 12 17.411 14.674 -19.434 1.00 0.00 H new ATOM 0 HG2 LYS A 12 19.952 16.251 -20.008 1.00 0.00 H new ATOM 0 HG3 LYS A 12 18.513 16.522 -20.969 1.00 0.00 H new ATOM 0 HD2 LYS A 12 17.330 16.641 -18.551 1.00 0.00 H new ATOM 0 HD3 LYS A 12 18.951 17.042 -18.021 1.00 0.00 H new ATOM 0 HE2 LYS A 12 17.484 18.472 -20.297 1.00 0.00 H new ATOM 0 HE3 LYS A 12 17.574 19.074 -18.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 19.322 20.090 -19.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 20.061 18.936 -18.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 19.844 18.611 -20.526 1.00 0.00 H new ATOM 208 N THR A 13 18.102 14.430 -16.709 1.00 0.00 N ATOM 209 CA THR A 13 17.854 15.054 -15.377 1.00 0.00 C ATOM 210 C THR A 13 18.853 14.509 -14.350 1.00 0.00 C ATOM 211 O THR A 13 19.497 15.253 -13.639 1.00 0.00 O ATOM 212 CB THR A 13 16.425 14.731 -14.931 1.00 0.00 C ATOM 213 OG1 THR A 13 15.505 15.397 -15.787 1.00 0.00 O ATOM 214 CG2 THR A 13 16.213 15.201 -13.491 1.00 0.00 C ATOM 0 H THR A 13 17.388 13.771 -17.019 1.00 0.00 H new ATOM 0 HA THR A 13 17.980 16.134 -15.452 1.00 0.00 H new ATOM 0 HB THR A 13 16.264 13.654 -14.984 1.00 0.00 H new ATOM 0 HG1 THR A 13 14.589 15.191 -15.506 1.00 0.00 H new ATOM 0 HG21 THR A 13 15.195 14.969 -13.179 1.00 0.00 H new ATOM 0 HG22 THR A 13 16.919 14.692 -12.835 1.00 0.00 H new ATOM 0 HG23 THR A 13 16.374 16.277 -13.432 1.00 0.00 H new ATOM 222 N LEU A 14 18.985 13.216 -14.269 1.00 0.00 N ATOM 223 CA LEU A 14 19.934 12.611 -13.294 1.00 0.00 C ATOM 224 C LEU A 14 21.342 13.162 -13.538 1.00 0.00 C ATOM 225 O LEU A 14 22.146 13.266 -12.634 1.00 0.00 O ATOM 226 CB LEU A 14 19.942 11.087 -13.484 1.00 0.00 C ATOM 227 CG LEU A 14 18.686 10.459 -12.857 1.00 0.00 C ATOM 228 CD1 LEU A 14 17.468 11.356 -13.099 1.00 0.00 C ATOM 229 CD2 LEU A 14 18.432 9.085 -13.493 1.00 0.00 C ATOM 0 H LEU A 14 18.472 12.546 -14.842 1.00 0.00 H new ATOM 0 HA LEU A 14 19.623 12.856 -12.278 1.00 0.00 H new ATOM 0 HB2 LEU A 14 19.984 10.847 -14.547 1.00 0.00 H new ATOM 0 HB3 LEU A 14 20.835 10.662 -13.026 1.00 0.00 H new ATOM 0 HG LEU A 14 18.844 10.351 -11.784 1.00 0.00 H new ATOM 0 HD11 LEU A 14 16.585 10.900 -12.650 1.00 0.00 H new ATOM 0 HD12 LEU A 14 17.641 12.333 -12.648 1.00 0.00 H new ATOM 0 HD13 LEU A 14 17.310 11.474 -14.171 1.00 0.00 H new ATOM 0 HD21 LEU A 14 17.542 8.638 -13.050 1.00 0.00 H new ATOM 0 HD22 LEU A 14 18.283 9.203 -14.566 1.00 0.00 H new ATOM 0 HD23 LEU A 14 19.290 8.437 -13.315 1.00 0.00 H new ATOM 241 N ASN A 15 21.648 13.506 -14.760 1.00 0.00 N ATOM 242 CA ASN A 15 23.005 14.041 -15.074 1.00 0.00 C ATOM 243 C ASN A 15 23.168 15.458 -14.483 1.00 0.00 C ATOM 244 O ASN A 15 24.146 15.741 -13.821 1.00 0.00 O ATOM 245 CB ASN A 15 23.181 14.108 -16.591 1.00 0.00 C ATOM 246 CG ASN A 15 24.531 13.498 -16.976 1.00 0.00 C ATOM 247 OD1 ASN A 15 25.564 14.106 -16.777 1.00 0.00 O ATOM 248 ND2 ASN A 15 24.566 12.313 -17.521 1.00 0.00 N ATOM 0 H ASN A 15 21.015 13.439 -15.557 1.00 0.00 H new ATOM 0 HA ASN A 15 23.757 13.383 -14.638 1.00 0.00 H new ATOM 0 HB2 ASN A 15 22.372 13.570 -17.086 1.00 0.00 H new ATOM 0 HB3 ASN A 15 23.128 15.143 -16.929 1.00 0.00 H new ATOM 0 HD21 ASN A 15 25.461 11.897 -17.780 1.00 0.00 H new ATOM 0 HD22 ASN A 15 23.699 11.803 -17.688 1.00 0.00 H new ATOM 255 N SER A 16 22.233 16.365 -14.726 1.00 0.00 N ATOM 256 CA SER A 16 22.390 17.743 -14.179 1.00 0.00 C ATOM 257 C SER A 16 22.367 17.713 -12.649 1.00 0.00 C ATOM 258 O SER A 16 23.205 18.303 -11.997 1.00 0.00 O ATOM 259 CB SER A 16 21.243 18.621 -14.684 1.00 0.00 C ATOM 260 OG SER A 16 21.715 19.946 -14.884 1.00 0.00 O ATOM 0 H SER A 16 21.386 16.203 -15.271 1.00 0.00 H new ATOM 0 HA SER A 16 23.345 18.149 -14.511 1.00 0.00 H new ATOM 0 HB2 SER A 16 20.847 18.220 -15.617 1.00 0.00 H new ATOM 0 HB3 SER A 16 20.425 18.620 -13.964 1.00 0.00 H new ATOM 0 HG SER A 16 20.982 20.509 -15.209 1.00 0.00 H new ATOM 266 N LEU A 17 21.411 17.041 -12.069 1.00 0.00 N ATOM 267 CA LEU A 17 21.334 16.990 -10.582 1.00 0.00 C ATOM 268 C LEU A 17 22.638 16.436 -10.007 1.00 0.00 C ATOM 269 O LEU A 17 23.044 16.795 -8.921 1.00 0.00 O ATOM 270 CB LEU A 17 20.168 16.093 -10.162 1.00 0.00 C ATOM 271 CG LEU A 17 18.895 16.552 -10.876 1.00 0.00 C ATOM 272 CD1 LEU A 17 17.684 15.813 -10.300 1.00 0.00 C ATOM 273 CD2 LEU A 17 18.721 18.059 -10.673 1.00 0.00 C ATOM 0 H LEU A 17 20.681 16.526 -12.560 1.00 0.00 H new ATOM 0 HA LEU A 17 21.177 17.998 -10.199 1.00 0.00 H new ATOM 0 HB2 LEU A 17 20.385 15.054 -10.412 1.00 0.00 H new ATOM 0 HB3 LEU A 17 20.030 16.139 -9.082 1.00 0.00 H new ATOM 0 HG LEU A 17 18.974 16.332 -11.941 1.00 0.00 H new ATOM 0 HD11 LEU A 17 16.780 16.143 -10.811 1.00 0.00 H new ATOM 0 HD12 LEU A 17 17.811 14.740 -10.443 1.00 0.00 H new ATOM 0 HD13 LEU A 17 17.598 16.030 -9.235 1.00 0.00 H new ATOM 0 HD21 LEU A 17 17.815 18.392 -11.180 1.00 0.00 H new ATOM 0 HD22 LEU A 17 18.642 18.276 -9.608 1.00 0.00 H new ATOM 0 HD23 LEU A 17 19.582 18.584 -11.087 1.00 0.00 H new ATOM 285 N THR A 18 23.299 15.564 -10.716 1.00 0.00 N ATOM 286 CA THR A 18 24.569 14.999 -10.182 1.00 0.00 C ATOM 287 C THR A 18 25.633 16.085 -10.148 1.00 0.00 C ATOM 288 O THR A 18 26.277 16.315 -9.144 1.00 0.00 O ATOM 289 CB THR A 18 25.035 13.842 -11.068 1.00 0.00 C ATOM 290 OG1 THR A 18 24.424 13.950 -12.347 1.00 0.00 O ATOM 291 CG2 THR A 18 24.639 12.512 -10.423 1.00 0.00 C ATOM 0 H THR A 18 23.018 15.221 -11.634 1.00 0.00 H new ATOM 0 HA THR A 18 24.402 14.627 -9.171 1.00 0.00 H new ATOM 0 HB THR A 18 26.119 13.882 -11.178 1.00 0.00 H new ATOM 0 HG1 THR A 18 24.582 14.846 -12.710 1.00 0.00 H new ATOM 0 HG21 THR A 18 24.971 11.688 -11.055 1.00 0.00 H new ATOM 0 HG22 THR A 18 25.108 12.429 -9.442 1.00 0.00 H new ATOM 0 HG23 THR A 18 23.555 12.470 -10.312 1.00 0.00 H new ATOM 299 N GLU A 19 25.801 16.763 -11.231 1.00 0.00 N ATOM 300 CA GLU A 19 26.809 17.861 -11.271 1.00 0.00 C ATOM 301 C GLU A 19 26.451 18.856 -10.179 1.00 0.00 C ATOM 302 O GLU A 19 27.291 19.509 -9.592 1.00 0.00 O ATOM 303 CB GLU A 19 26.777 18.548 -12.638 1.00 0.00 C ATOM 304 CG GLU A 19 26.944 17.498 -13.739 1.00 0.00 C ATOM 305 CD GLU A 19 28.241 16.719 -13.509 1.00 0.00 C ATOM 306 OE1 GLU A 19 29.237 17.347 -13.189 1.00 0.00 O ATOM 307 OE2 GLU A 19 28.215 15.509 -13.656 1.00 0.00 O ATOM 0 H GLU A 19 25.287 16.612 -12.099 1.00 0.00 H new ATOM 0 HA GLU A 19 27.812 17.466 -11.112 1.00 0.00 H new ATOM 0 HB2 GLU A 19 25.835 19.080 -12.768 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.573 19.289 -12.703 1.00 0.00 H new ATOM 0 HG2 GLU A 19 26.093 16.817 -13.739 1.00 0.00 H new ATOM 0 HG3 GLU A 19 26.965 17.980 -14.716 1.00 0.00 H new ATOM 314 N GLN A 20 25.195 18.939 -9.905 1.00 0.00 N ATOM 315 CA GLN A 20 24.690 19.851 -8.839 1.00 0.00 C ATOM 316 C GLN A 20 23.393 19.259 -8.284 1.00 0.00 C ATOM 317 O GLN A 20 22.402 19.170 -8.980 1.00 0.00 O ATOM 318 CB GLN A 20 24.413 21.235 -9.431 1.00 0.00 C ATOM 319 CG GLN A 20 25.599 21.667 -10.296 1.00 0.00 C ATOM 320 CD GLN A 20 25.461 23.148 -10.649 1.00 0.00 C ATOM 321 OE1 GLN A 20 24.368 23.639 -10.847 1.00 0.00 O ATOM 322 NE2 GLN A 20 26.533 23.889 -10.735 1.00 0.00 N ATOM 0 H GLN A 20 24.470 18.403 -10.382 1.00 0.00 H new ATOM 0 HA GLN A 20 25.431 19.952 -8.046 1.00 0.00 H new ATOM 0 HB2 GLN A 20 23.502 21.211 -10.030 1.00 0.00 H new ATOM 0 HB3 GLN A 20 24.250 21.958 -8.632 1.00 0.00 H new ATOM 0 HG2 GLN A 20 26.534 21.495 -9.762 1.00 0.00 H new ATOM 0 HG3 GLN A 20 25.637 21.068 -11.206 1.00 0.00 H new ATOM 0 HE21 GLN A 20 27.452 23.478 -10.569 1.00 0.00 H new ATOM 0 HE22 GLN A 20 26.452 24.879 -10.968 1.00 0.00 H new ATOM 331 N LYS A 21 23.385 18.833 -7.048 1.00 0.00 N ATOM 332 CA LYS A 21 22.142 18.229 -6.496 1.00 0.00 C ATOM 333 C LYS A 21 21.679 19.012 -5.266 1.00 0.00 C ATOM 334 O LYS A 21 21.106 18.458 -4.348 1.00 0.00 O ATOM 335 CB LYS A 21 22.418 16.773 -6.110 1.00 0.00 C ATOM 336 CG LYS A 21 21.091 16.031 -5.933 1.00 0.00 C ATOM 337 CD LYS A 21 21.260 14.573 -6.363 1.00 0.00 C ATOM 338 CE LYS A 21 22.387 13.929 -5.553 1.00 0.00 C ATOM 339 NZ LYS A 21 21.977 12.557 -5.138 1.00 0.00 N ATOM 0 H LYS A 21 24.176 18.877 -6.406 1.00 0.00 H new ATOM 0 HA LYS A 21 21.357 18.265 -7.251 1.00 0.00 H new ATOM 0 HB2 LYS A 21 23.018 16.289 -6.881 1.00 0.00 H new ATOM 0 HB3 LYS A 21 22.995 16.734 -5.186 1.00 0.00 H new ATOM 0 HG2 LYS A 21 20.771 16.079 -4.892 1.00 0.00 H new ATOM 0 HG3 LYS A 21 20.313 16.509 -6.528 1.00 0.00 H new ATOM 0 HD2 LYS A 21 20.329 14.027 -6.209 1.00 0.00 H new ATOM 0 HD3 LYS A 21 21.487 14.521 -7.428 1.00 0.00 H new ATOM 0 HE2 LYS A 21 23.298 13.883 -6.149 1.00 0.00 H new ATOM 0 HE3 LYS A 21 22.611 14.535 -4.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 22.171 12.428 -4.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 20.960 12.430 -5.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 22.513 11.854 -5.685 1.00 0.00 H new ATOM 353 N THR A 22 21.914 20.297 -5.236 1.00 0.00 N ATOM 354 CA THR A 22 21.476 21.099 -4.061 1.00 0.00 C ATOM 355 C THR A 22 22.063 20.495 -2.775 1.00 0.00 C ATOM 356 O THR A 22 21.639 20.831 -1.687 1.00 0.00 O ATOM 357 CB THR A 22 19.949 21.061 -3.974 1.00 0.00 C ATOM 358 OG1 THR A 22 19.396 21.676 -5.131 1.00 0.00 O ATOM 359 CG2 THR A 22 19.493 21.809 -2.718 1.00 0.00 C ATOM 0 H THR A 22 22.388 20.822 -5.971 1.00 0.00 H new ATOM 0 HA THR A 22 21.822 22.127 -4.173 1.00 0.00 H new ATOM 0 HB THR A 22 19.608 20.027 -3.919 1.00 0.00 H new ATOM 0 HG1 THR A 22 18.550 22.112 -4.897 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.405 21.783 -2.654 1.00 0.00 H new ATOM 0 HG22 THR A 22 19.920 21.332 -1.836 1.00 0.00 H new ATOM 0 HG23 THR A 22 19.829 22.845 -2.769 1.00 0.00 H new ATOM 367 N LEU A 23 23.042 19.615 -2.879 1.00 0.00 N ATOM 368 CA LEU A 23 23.639 19.014 -1.663 1.00 0.00 C ATOM 369 C LEU A 23 22.554 18.725 -0.625 1.00 0.00 C ATOM 370 O LEU A 23 22.781 18.809 0.566 1.00 0.00 O ATOM 371 CB LEU A 23 24.656 19.998 -1.121 1.00 0.00 C ATOM 372 CG LEU A 23 25.837 19.239 -0.511 1.00 0.00 C ATOM 373 CD1 LEU A 23 26.645 18.572 -1.626 1.00 0.00 C ATOM 374 CD2 LEU A 23 26.731 20.216 0.253 1.00 0.00 C ATOM 0 H LEU A 23 23.444 19.296 -3.761 1.00 0.00 H new ATOM 0 HA LEU A 23 24.122 18.066 -1.899 1.00 0.00 H new ATOM 0 HB2 LEU A 23 25.006 20.651 -1.920 1.00 0.00 H new ATOM 0 HB3 LEU A 23 24.193 20.636 -0.368 1.00 0.00 H new ATOM 0 HG LEU A 23 25.465 18.477 0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 23 27.486 18.031 -1.192 1.00 0.00 H new ATOM 0 HD12 LEU A 23 26.008 17.875 -2.170 1.00 0.00 H new ATOM 0 HD13 LEU A 23 27.018 19.334 -2.311 1.00 0.00 H new ATOM 0 HD21 LEU A 23 27.572 19.676 0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 23 27.104 20.979 -0.431 1.00 0.00 H new ATOM 0 HD23 LEU A 23 26.155 20.691 1.047 1.00 0.00 H new ATOM 386 N CYS A 24 21.379 18.367 -1.069 1.00 0.00 N ATOM 387 CA CYS A 24 20.285 18.052 -0.114 1.00 0.00 C ATOM 388 C CYS A 24 20.576 16.701 0.529 1.00 0.00 C ATOM 389 O CYS A 24 21.126 16.635 1.609 1.00 0.00 O ATOM 390 CB CYS A 24 18.949 17.993 -0.861 1.00 0.00 C ATOM 391 SG CYS A 24 17.641 17.496 0.287 1.00 0.00 S ATOM 0 H CYS A 24 21.132 18.280 -2.055 1.00 0.00 H new ATOM 0 HA CYS A 24 20.225 18.824 0.653 1.00 0.00 H new ATOM 0 HB2 CYS A 24 18.718 18.967 -1.293 1.00 0.00 H new ATOM 0 HB3 CYS A 24 19.012 17.284 -1.687 1.00 0.00 H new ATOM 396 N THR A 25 20.224 15.630 -0.142 1.00 0.00 N ATOM 397 CA THR A 25 20.477 14.259 0.403 1.00 0.00 C ATOM 398 C THR A 25 20.421 14.294 1.937 1.00 0.00 C ATOM 399 O THR A 25 19.544 14.908 2.505 1.00 0.00 O ATOM 400 CB THR A 25 21.849 13.773 -0.079 1.00 0.00 C ATOM 401 OG1 THR A 25 22.013 12.394 0.239 1.00 0.00 O ATOM 402 CG2 THR A 25 22.957 14.593 0.590 1.00 0.00 C ATOM 0 H THR A 25 19.767 15.648 -1.054 1.00 0.00 H new ATOM 0 HA THR A 25 19.712 13.569 0.047 1.00 0.00 H new ATOM 0 HB THR A 25 21.912 13.901 -1.160 1.00 0.00 H new ATOM 0 HG1 THR A 25 22.942 12.129 0.074 1.00 0.00 H new ATOM 0 HG21 THR A 25 23.929 14.242 0.243 1.00 0.00 H new ATOM 0 HG22 THR A 25 22.837 15.645 0.332 1.00 0.00 H new ATOM 0 HG23 THR A 25 22.894 14.476 1.672 1.00 0.00 H new ATOM 410 N GLU A 26 21.334 13.648 2.620 1.00 0.00 N ATOM 411 CA GLU A 26 21.288 13.667 4.114 1.00 0.00 C ATOM 412 C GLU A 26 19.883 13.261 4.558 1.00 0.00 C ATOM 413 O GLU A 26 19.450 13.549 5.656 1.00 0.00 O ATOM 414 CB GLU A 26 21.598 15.078 4.619 1.00 0.00 C ATOM 415 CG GLU A 26 23.031 15.454 4.238 1.00 0.00 C ATOM 416 CD GLU A 26 23.577 16.469 5.243 1.00 0.00 C ATOM 417 OE1 GLU A 26 23.774 16.093 6.387 1.00 0.00 O ATOM 418 OE2 GLU A 26 23.790 17.605 4.851 1.00 0.00 O ATOM 0 H GLU A 26 22.101 13.114 2.212 1.00 0.00 H new ATOM 0 HA GLU A 26 22.025 12.975 4.521 1.00 0.00 H new ATOM 0 HB2 GLU A 26 20.897 15.792 4.188 1.00 0.00 H new ATOM 0 HB3 GLU A 26 21.474 15.124 5.701 1.00 0.00 H new ATOM 0 HG2 GLU A 26 23.660 14.564 4.225 1.00 0.00 H new ATOM 0 HG3 GLU A 26 23.053 15.874 3.232 1.00 0.00 H new ATOM 425 N LEU A 27 19.175 12.597 3.693 1.00 0.00 N ATOM 426 CA LEU A 27 17.793 12.155 3.997 1.00 0.00 C ATOM 427 C LEU A 27 17.658 10.710 3.510 1.00 0.00 C ATOM 428 O LEU A 27 18.418 10.262 2.674 1.00 0.00 O ATOM 429 CB LEU A 27 16.825 13.092 3.259 1.00 0.00 C ATOM 430 CG LEU A 27 17.092 14.545 3.707 1.00 0.00 C ATOM 431 CD1 LEU A 27 16.764 15.527 2.578 1.00 0.00 C ATOM 432 CD2 LEU A 27 16.226 14.866 4.927 1.00 0.00 C ATOM 0 H LEU A 27 19.507 12.336 2.764 1.00 0.00 H new ATOM 0 HA LEU A 27 17.566 12.193 5.062 1.00 0.00 H new ATOM 0 HB2 LEU A 27 16.960 13.000 2.181 1.00 0.00 H new ATOM 0 HB3 LEU A 27 15.794 12.815 3.476 1.00 0.00 H new ATOM 0 HG LEU A 27 18.147 14.645 3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 27 16.959 16.546 2.914 1.00 0.00 H new ATOM 0 HD12 LEU A 27 17.386 15.305 1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 27 15.713 15.430 2.305 1.00 0.00 H new ATOM 0 HD21 LEU A 27 16.412 15.892 5.246 1.00 0.00 H new ATOM 0 HD22 LEU A 27 15.174 14.753 4.666 1.00 0.00 H new ATOM 0 HD23 LEU A 27 16.474 14.183 5.739 1.00 0.00 H new ATOM 444 N THR A 28 16.745 9.956 4.052 1.00 0.00 N ATOM 445 CA THR A 28 16.640 8.528 3.635 1.00 0.00 C ATOM 446 C THR A 28 15.438 8.284 2.721 1.00 0.00 C ATOM 447 O THR A 28 14.330 8.699 2.997 1.00 0.00 O ATOM 448 CB THR A 28 16.506 7.651 4.882 1.00 0.00 C ATOM 449 OG1 THR A 28 15.347 8.037 5.606 1.00 0.00 O ATOM 450 CG2 THR A 28 17.743 7.821 5.763 1.00 0.00 C ATOM 0 H THR A 28 16.074 10.260 4.757 1.00 0.00 H new ATOM 0 HA THR A 28 17.542 8.275 3.077 1.00 0.00 H new ATOM 0 HB THR A 28 16.418 6.606 4.585 1.00 0.00 H new ATOM 0 HG1 THR A 28 14.615 8.217 4.980 1.00 0.00 H new ATOM 0 HG21 THR A 28 17.646 7.196 6.651 1.00 0.00 H new ATOM 0 HG22 THR A 28 18.631 7.524 5.205 1.00 0.00 H new ATOM 0 HG23 THR A 28 17.836 8.865 6.063 1.00 0.00 H new ATOM 458 N VAL A 29 15.660 7.578 1.644 1.00 0.00 N ATOM 459 CA VAL A 29 14.549 7.247 0.705 1.00 0.00 C ATOM 460 C VAL A 29 14.192 5.771 0.883 1.00 0.00 C ATOM 461 O VAL A 29 15.009 4.980 1.315 1.00 0.00 O ATOM 462 CB VAL A 29 15.006 7.467 -0.741 1.00 0.00 C ATOM 463 CG1 VAL A 29 15.157 8.959 -1.032 1.00 0.00 C ATOM 464 CG2 VAL A 29 16.350 6.775 -0.954 1.00 0.00 C ATOM 0 H VAL A 29 16.573 7.213 1.372 1.00 0.00 H new ATOM 0 HA VAL A 29 13.690 7.884 0.915 1.00 0.00 H new ATOM 0 HB VAL A 29 14.258 7.050 -1.415 1.00 0.00 H new ATOM 0 HG11 VAL A 29 15.482 9.098 -2.063 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.199 9.457 -0.884 1.00 0.00 H new ATOM 0 HG13 VAL A 29 15.898 9.388 -0.357 1.00 0.00 H new ATOM 0 HG21 VAL A 29 16.680 6.929 -1.982 1.00 0.00 H new ATOM 0 HG22 VAL A 29 17.088 7.194 -0.270 1.00 0.00 H new ATOM 0 HG23 VAL A 29 16.244 5.707 -0.763 1.00 0.00 H new ATOM 474 N THR A 30 12.993 5.380 0.553 1.00 0.00 N ATOM 475 CA THR A 30 12.623 3.945 0.706 1.00 0.00 C ATOM 476 C THR A 30 13.726 3.083 0.081 1.00 0.00 C ATOM 477 O THR A 30 14.159 3.328 -1.027 1.00 0.00 O ATOM 478 CB THR A 30 11.293 3.670 -0.001 1.00 0.00 C ATOM 479 OG1 THR A 30 10.492 4.842 0.029 1.00 0.00 O ATOM 480 CG2 THR A 30 10.562 2.529 0.706 1.00 0.00 C ATOM 0 H THR A 30 12.259 5.986 0.187 1.00 0.00 H new ATOM 0 HA THR A 30 12.515 3.704 1.764 1.00 0.00 H new ATOM 0 HB THR A 30 11.483 3.387 -1.036 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.554 4.601 -0.123 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.616 2.335 0.201 1.00 0.00 H new ATOM 0 HG22 THR A 30 11.178 1.630 0.679 1.00 0.00 H new ATOM 0 HG23 THR A 30 10.370 2.807 1.742 1.00 0.00 H new ATOM 488 N ASP A 31 14.192 2.090 0.785 1.00 0.00 N ATOM 489 CA ASP A 31 15.276 1.227 0.230 1.00 0.00 C ATOM 490 C ASP A 31 14.707 0.292 -0.842 1.00 0.00 C ATOM 491 O ASP A 31 14.439 -0.866 -0.588 1.00 0.00 O ATOM 492 CB ASP A 31 15.888 0.394 1.358 1.00 0.00 C ATOM 493 CG ASP A 31 16.888 -0.605 0.770 1.00 0.00 C ATOM 494 OD1 ASP A 31 17.982 -0.186 0.429 1.00 0.00 O ATOM 495 OD2 ASP A 31 16.543 -1.771 0.670 1.00 0.00 O ATOM 0 H ASP A 31 13.871 1.837 1.720 1.00 0.00 H new ATOM 0 HA ASP A 31 16.042 1.860 -0.219 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.387 1.045 2.076 1.00 0.00 H new ATOM 0 HB3 ASP A 31 15.104 -0.136 1.900 1.00 0.00 H new ATOM 500 N ILE A 32 14.522 0.784 -2.037 1.00 0.00 N ATOM 501 CA ILE A 32 13.970 -0.083 -3.121 1.00 0.00 C ATOM 502 C ILE A 32 15.111 -0.796 -3.851 1.00 0.00 C ATOM 503 O ILE A 32 15.072 -0.978 -5.052 1.00 0.00 O ATOM 504 CB ILE A 32 13.201 0.791 -4.124 1.00 0.00 C ATOM 505 CG1 ILE A 32 14.159 1.817 -4.739 1.00 0.00 C ATOM 506 CG2 ILE A 32 12.080 1.523 -3.390 1.00 0.00 C ATOM 507 CD1 ILE A 32 13.951 1.865 -6.255 1.00 0.00 C ATOM 0 H ILE A 32 14.728 1.745 -2.310 1.00 0.00 H new ATOM 0 HA ILE A 32 13.303 -0.825 -2.682 1.00 0.00 H new ATOM 0 HB ILE A 32 12.780 0.167 -4.912 1.00 0.00 H new ATOM 0 HG12 ILE A 32 13.982 2.801 -4.306 1.00 0.00 H new ATOM 0 HG13 ILE A 32 15.191 1.549 -4.511 1.00 0.00 H new ATOM 0 HG21 ILE A 32 11.529 2.146 -4.095 1.00 0.00 H new ATOM 0 HG22 ILE A 32 11.403 0.796 -2.942 1.00 0.00 H new ATOM 0 HG23 ILE A 32 12.507 2.151 -2.608 1.00 0.00 H new ATOM 0 HD11 ILE A 32 14.632 2.595 -6.693 1.00 0.00 H new ATOM 0 HD12 ILE A 32 14.150 0.882 -6.681 1.00 0.00 H new ATOM 0 HD13 ILE A 32 12.922 2.153 -6.472 1.00 0.00 H new ATOM 519 N PHE A 33 16.133 -1.192 -3.143 1.00 0.00 N ATOM 520 CA PHE A 33 17.275 -1.882 -3.813 1.00 0.00 C ATOM 521 C PHE A 33 17.800 -3.033 -2.934 1.00 0.00 C ATOM 522 O PHE A 33 18.989 -3.278 -2.887 1.00 0.00 O ATOM 523 CB PHE A 33 18.399 -0.869 -4.039 1.00 0.00 C ATOM 524 CG PHE A 33 17.969 0.125 -5.094 1.00 0.00 C ATOM 525 CD1 PHE A 33 17.619 -0.320 -6.374 1.00 0.00 C ATOM 526 CD2 PHE A 33 17.917 1.492 -4.790 1.00 0.00 C ATOM 527 CE1 PHE A 33 17.216 0.599 -7.350 1.00 0.00 C ATOM 528 CE2 PHE A 33 17.515 2.411 -5.767 1.00 0.00 C ATOM 529 CZ PHE A 33 17.164 1.963 -7.047 1.00 0.00 C ATOM 0 H PHE A 33 16.228 -1.069 -2.135 1.00 0.00 H new ATOM 0 HA PHE A 33 16.936 -2.293 -4.764 1.00 0.00 H new ATOM 0 HB2 PHE A 33 18.631 -0.352 -3.108 1.00 0.00 H new ATOM 0 HB3 PHE A 33 19.308 -1.381 -4.354 1.00 0.00 H new ATOM 0 HD1 PHE A 33 17.660 -1.373 -6.609 1.00 0.00 H new ATOM 0 HD2 PHE A 33 18.187 1.837 -3.803 1.00 0.00 H new ATOM 0 HE1 PHE A 33 16.945 0.254 -8.337 1.00 0.00 H new ATOM 0 HE2 PHE A 33 17.476 3.465 -5.534 1.00 0.00 H new ATOM 0 HZ PHE A 33 16.853 2.672 -7.800 1.00 0.00 H new ATOM 539 N ALA A 34 16.943 -3.749 -2.235 1.00 0.00 N ATOM 540 CA ALA A 34 17.443 -4.863 -1.382 1.00 0.00 C ATOM 541 C ALA A 34 16.296 -5.831 -1.084 1.00 0.00 C ATOM 542 O ALA A 34 15.847 -5.948 0.039 1.00 0.00 O ATOM 543 CB ALA A 34 17.987 -4.297 -0.069 1.00 0.00 C ATOM 0 H ALA A 34 15.933 -3.607 -2.223 1.00 0.00 H new ATOM 0 HA ALA A 34 18.239 -5.392 -1.906 1.00 0.00 H new ATOM 0 HB1 ALA A 34 18.353 -5.113 0.555 1.00 0.00 H new ATOM 0 HB2 ALA A 34 18.804 -3.608 -0.281 1.00 0.00 H new ATOM 0 HB3 ALA A 34 17.192 -3.767 0.456 1.00 0.00 H new ATOM 549 N ALA A 35 15.819 -6.523 -2.081 1.00 0.00 N ATOM 550 CA ALA A 35 14.701 -7.482 -1.854 1.00 0.00 C ATOM 551 C ALA A 35 14.276 -8.091 -3.191 1.00 0.00 C ATOM 552 O ALA A 35 13.274 -7.712 -3.765 1.00 0.00 O ATOM 553 CB ALA A 35 13.515 -6.744 -1.230 1.00 0.00 C ATOM 0 H ALA A 35 16.154 -6.466 -3.043 1.00 0.00 H new ATOM 0 HA ALA A 35 15.031 -8.274 -1.181 1.00 0.00 H new ATOM 0 HB1 ALA A 35 12.697 -7.445 -1.064 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.818 -6.308 -0.278 1.00 0.00 H new ATOM 0 HB3 ALA A 35 13.184 -5.953 -1.903 1.00 0.00 H new ATOM 559 N SER A 36 15.029 -9.030 -3.691 1.00 0.00 N ATOM 560 CA SER A 36 14.668 -9.659 -4.992 1.00 0.00 C ATOM 561 C SER A 36 14.519 -8.572 -6.058 1.00 0.00 C ATOM 562 O SER A 36 13.553 -8.541 -6.794 1.00 0.00 O ATOM 563 CB SER A 36 13.348 -10.416 -4.843 1.00 0.00 C ATOM 564 OG SER A 36 12.988 -10.477 -3.471 1.00 0.00 O ATOM 0 H SER A 36 15.879 -9.389 -3.255 1.00 0.00 H new ATOM 0 HA SER A 36 15.452 -10.355 -5.291 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.564 -9.917 -5.413 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.446 -11.423 -5.249 1.00 0.00 H new ATOM 0 HG SER A 36 12.141 -10.961 -3.376 1.00 0.00 H new ATOM 570 N LYS A 37 15.466 -7.680 -6.145 1.00 0.00 N ATOM 571 CA LYS A 37 15.377 -6.595 -7.162 1.00 0.00 C ATOM 572 C LYS A 37 15.860 -7.120 -8.516 1.00 0.00 C ATOM 573 O LYS A 37 16.015 -6.375 -9.462 1.00 0.00 O ATOM 574 CB LYS A 37 16.252 -5.416 -6.732 1.00 0.00 C ATOM 575 CG LYS A 37 15.826 -4.159 -7.495 1.00 0.00 C ATOM 576 CD LYS A 37 17.028 -3.592 -8.253 1.00 0.00 C ATOM 577 CE LYS A 37 16.919 -3.962 -9.733 1.00 0.00 C ATOM 578 NZ LYS A 37 17.531 -2.884 -10.561 1.00 0.00 N ATOM 0 H LYS A 37 16.298 -7.655 -5.556 1.00 0.00 H new ATOM 0 HA LYS A 37 14.341 -6.266 -7.248 1.00 0.00 H new ATOM 0 HB2 LYS A 37 16.158 -5.252 -5.659 1.00 0.00 H new ATOM 0 HB3 LYS A 37 17.301 -5.637 -6.930 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.023 -4.398 -8.192 1.00 0.00 H new ATOM 0 HG3 LYS A 37 15.435 -3.414 -6.802 1.00 0.00 H new ATOM 0 HD2 LYS A 37 17.064 -2.508 -8.140 1.00 0.00 H new ATOM 0 HD3 LYS A 37 17.954 -3.987 -7.836 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.424 -4.910 -9.920 1.00 0.00 H new ATOM 0 HE3 LYS A 37 15.873 -4.098 -10.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 16.791 -2.411 -11.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.994 -2.190 -9.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 18.236 -3.298 -11.204 1.00 0.00 H new ATOM 592 N ASN A 38 16.099 -8.399 -8.618 1.00 0.00 N ATOM 593 CA ASN A 38 16.570 -8.969 -9.911 1.00 0.00 C ATOM 594 C ASN A 38 15.450 -8.868 -10.949 1.00 0.00 C ATOM 595 O ASN A 38 15.650 -9.132 -12.119 1.00 0.00 O ATOM 596 CB ASN A 38 16.951 -10.438 -9.713 1.00 0.00 C ATOM 597 CG ASN A 38 18.075 -10.810 -10.681 1.00 0.00 C ATOM 598 OD1 ASN A 38 19.237 -10.767 -10.327 1.00 0.00 O ATOM 599 ND2 ASN A 38 17.777 -11.175 -11.897 1.00 0.00 N ATOM 0 H ASN A 38 15.988 -9.074 -7.861 1.00 0.00 H new ATOM 0 HA ASN A 38 17.440 -8.412 -10.259 1.00 0.00 H new ATOM 0 HB2 ASN A 38 17.272 -10.606 -8.685 1.00 0.00 H new ATOM 0 HB3 ASN A 38 16.084 -11.076 -9.884 1.00 0.00 H new ATOM 0 HD21 ASN A 38 18.519 -11.424 -12.551 1.00 0.00 H new ATOM 0 HD22 ASN A 38 16.802 -11.211 -12.194 1.00 0.00 H new ATOM 606 N THR A 39 14.272 -8.492 -10.533 1.00 0.00 N ATOM 607 CA THR A 39 13.143 -8.376 -11.495 1.00 0.00 C ATOM 608 C THR A 39 13.547 -7.463 -12.654 1.00 0.00 C ATOM 609 O THR A 39 14.616 -6.886 -12.659 1.00 0.00 O ATOM 610 CB THR A 39 11.923 -7.787 -10.782 1.00 0.00 C ATOM 611 OG1 THR A 39 10.937 -7.434 -11.744 1.00 0.00 O ATOM 612 CG2 THR A 39 12.340 -6.542 -9.997 1.00 0.00 C ATOM 0 H THR A 39 14.043 -8.260 -9.566 1.00 0.00 H new ATOM 0 HA THR A 39 12.896 -9.364 -11.883 1.00 0.00 H new ATOM 0 HB THR A 39 11.512 -8.527 -10.095 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.089 -7.245 -11.290 1.00 0.00 H new ATOM 0 HG21 THR A 39 11.471 -6.124 -9.490 1.00 0.00 H new ATOM 0 HG22 THR A 39 13.095 -6.813 -9.259 1.00 0.00 H new ATOM 0 HG23 THR A 39 12.752 -5.801 -10.682 1.00 0.00 H new ATOM 620 N THR A 40 12.698 -7.328 -13.635 1.00 0.00 N ATOM 621 CA THR A 40 13.028 -6.455 -14.797 1.00 0.00 C ATOM 622 C THR A 40 13.400 -5.055 -14.298 1.00 0.00 C ATOM 623 O THR A 40 12.908 -4.596 -13.286 1.00 0.00 O ATOM 624 CB THR A 40 11.812 -6.366 -15.723 1.00 0.00 C ATOM 625 OG1 THR A 40 10.654 -6.807 -15.026 1.00 0.00 O ATOM 626 CG2 THR A 40 12.039 -7.251 -16.949 1.00 0.00 C ATOM 0 H THR A 40 11.788 -7.786 -13.682 1.00 0.00 H new ATOM 0 HA THR A 40 13.872 -6.877 -15.343 1.00 0.00 H new ATOM 0 HB THR A 40 11.672 -5.333 -16.043 1.00 0.00 H new ATOM 0 HG1 THR A 40 10.094 -7.341 -15.627 1.00 0.00 H new ATOM 0 HG21 THR A 40 11.173 -7.188 -17.609 1.00 0.00 H new ATOM 0 HG22 THR A 40 12.927 -6.913 -17.483 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.178 -8.284 -16.631 1.00 0.00 H new ATOM 634 N GLU A 41 14.265 -4.374 -15.000 1.00 0.00 N ATOM 635 CA GLU A 41 14.664 -3.005 -14.562 1.00 0.00 C ATOM 636 C GLU A 41 13.418 -2.124 -14.481 1.00 0.00 C ATOM 637 O GLU A 41 13.231 -1.381 -13.539 1.00 0.00 O ATOM 638 CB GLU A 41 15.646 -2.407 -15.572 1.00 0.00 C ATOM 639 CG GLU A 41 16.743 -3.428 -15.885 1.00 0.00 C ATOM 640 CD GLU A 41 16.925 -3.533 -17.401 1.00 0.00 C ATOM 641 OE1 GLU A 41 15.926 -3.615 -18.093 1.00 0.00 O ATOM 642 OE2 GLU A 41 18.064 -3.531 -17.840 1.00 0.00 O ATOM 0 H GLU A 41 14.712 -4.705 -15.855 1.00 0.00 H new ATOM 0 HA GLU A 41 15.143 -3.059 -13.584 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.120 -2.131 -16.486 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.087 -1.495 -15.170 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.680 -3.127 -15.416 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.478 -4.401 -15.472 1.00 0.00 H new ATOM 649 N LYS A 42 12.561 -2.208 -15.460 1.00 0.00 N ATOM 650 CA LYS A 42 11.324 -1.380 -15.437 1.00 0.00 C ATOM 651 C LYS A 42 10.638 -1.536 -14.079 1.00 0.00 C ATOM 652 O LYS A 42 9.998 -0.629 -13.586 1.00 0.00 O ATOM 653 CB LYS A 42 10.377 -1.845 -16.545 1.00 0.00 C ATOM 654 CG LYS A 42 10.297 -3.372 -16.538 1.00 0.00 C ATOM 655 CD LYS A 42 9.070 -3.824 -17.333 1.00 0.00 C ATOM 656 CE LYS A 42 9.187 -5.316 -17.650 1.00 0.00 C ATOM 657 NZ LYS A 42 8.013 -6.038 -17.083 1.00 0.00 N ATOM 0 H LYS A 42 12.664 -2.814 -16.274 1.00 0.00 H new ATOM 0 HA LYS A 42 11.581 -0.333 -15.598 1.00 0.00 H new ATOM 0 HB2 LYS A 42 9.386 -1.417 -16.394 1.00 0.00 H new ATOM 0 HB3 LYS A 42 10.732 -1.493 -17.514 1.00 0.00 H new ATOM 0 HG2 LYS A 42 11.202 -3.796 -16.974 1.00 0.00 H new ATOM 0 HG3 LYS A 42 10.235 -3.739 -15.513 1.00 0.00 H new ATOM 0 HD2 LYS A 42 8.162 -3.633 -16.760 1.00 0.00 H new ATOM 0 HD3 LYS A 42 8.991 -3.251 -18.257 1.00 0.00 H new ATOM 0 HE2 LYS A 42 9.234 -5.467 -18.728 1.00 0.00 H new ATOM 0 HE3 LYS A 42 10.110 -5.716 -17.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 8.092 -7.052 -17.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 7.988 -5.904 -16.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 7.139 -5.662 -17.503 1.00 0.00 H new ATOM 671 N GLU A 43 10.769 -2.684 -13.466 1.00 0.00 N ATOM 672 CA GLU A 43 10.125 -2.896 -12.137 1.00 0.00 C ATOM 673 C GLU A 43 10.791 -1.992 -11.100 1.00 0.00 C ATOM 674 O GLU A 43 10.124 -1.360 -10.309 1.00 0.00 O ATOM 675 CB GLU A 43 10.281 -4.359 -11.717 1.00 0.00 C ATOM 676 CG GLU A 43 9.239 -5.212 -12.446 1.00 0.00 C ATOM 677 CD GLU A 43 8.164 -5.661 -11.456 1.00 0.00 C ATOM 678 OE1 GLU A 43 8.488 -6.440 -10.573 1.00 0.00 O ATOM 679 OE2 GLU A 43 7.036 -5.220 -11.597 1.00 0.00 O ATOM 0 H GLU A 43 11.293 -3.481 -13.828 1.00 0.00 H new ATOM 0 HA GLU A 43 9.065 -2.652 -12.205 1.00 0.00 H new ATOM 0 HB2 GLU A 43 11.285 -4.711 -11.953 1.00 0.00 H new ATOM 0 HB3 GLU A 43 10.155 -4.455 -10.639 1.00 0.00 H new ATOM 0 HG2 GLU A 43 8.786 -4.639 -13.255 1.00 0.00 H new ATOM 0 HG3 GLU A 43 9.717 -6.081 -12.899 1.00 0.00 H new ATOM 686 N THR A 44 12.095 -1.907 -11.096 1.00 0.00 N ATOM 687 CA THR A 44 12.747 -1.012 -10.094 1.00 0.00 C ATOM 688 C THR A 44 12.246 0.403 -10.345 1.00 0.00 C ATOM 689 O THR A 44 12.154 1.209 -9.450 1.00 0.00 O ATOM 690 CB THR A 44 14.288 -1.060 -10.187 1.00 0.00 C ATOM 691 OG1 THR A 44 14.835 -0.702 -8.926 1.00 0.00 O ATOM 692 CG2 THR A 44 14.793 -0.075 -11.247 1.00 0.00 C ATOM 0 H THR A 44 12.724 -2.405 -11.726 1.00 0.00 H new ATOM 0 HA THR A 44 12.487 -1.347 -9.090 1.00 0.00 H new ATOM 0 HB THR A 44 14.596 -2.068 -10.466 1.00 0.00 H new ATOM 0 HG1 THR A 44 15.096 -1.512 -8.441 1.00 0.00 H new ATOM 0 HG21 THR A 44 15.881 -0.122 -11.299 1.00 0.00 H new ATOM 0 HG22 THR A 44 14.372 -0.337 -12.217 1.00 0.00 H new ATOM 0 HG23 THR A 44 14.486 0.936 -10.980 1.00 0.00 H new ATOM 700 N PHE A 45 11.919 0.692 -11.566 1.00 0.00 N ATOM 701 CA PHE A 45 11.396 2.043 -11.909 1.00 0.00 C ATOM 702 C PHE A 45 9.979 2.190 -11.348 1.00 0.00 C ATOM 703 O PHE A 45 9.562 3.262 -10.957 1.00 0.00 O ATOM 704 CB PHE A 45 11.361 2.222 -13.424 1.00 0.00 C ATOM 705 CG PHE A 45 12.794 2.263 -13.972 1.00 0.00 C ATOM 706 CD1 PHE A 45 13.847 2.792 -13.194 1.00 0.00 C ATOM 707 CD2 PHE A 45 13.079 1.763 -15.257 1.00 0.00 C ATOM 708 CE1 PHE A 45 15.152 2.814 -13.698 1.00 0.00 C ATOM 709 CE2 PHE A 45 14.389 1.793 -15.752 1.00 0.00 C ATOM 710 CZ PHE A 45 15.422 2.317 -14.973 1.00 0.00 C ATOM 0 H PHE A 45 11.991 0.046 -12.352 1.00 0.00 H new ATOM 0 HA PHE A 45 12.048 2.801 -11.476 1.00 0.00 H new ATOM 0 HB2 PHE A 45 10.808 1.403 -13.884 1.00 0.00 H new ATOM 0 HB3 PHE A 45 10.837 3.143 -13.679 1.00 0.00 H new ATOM 0 HD1 PHE A 45 13.644 3.181 -12.207 1.00 0.00 H new ATOM 0 HD2 PHE A 45 12.284 1.355 -15.864 1.00 0.00 H new ATOM 0 HE1 PHE A 45 15.954 3.218 -13.097 1.00 0.00 H new ATOM 0 HE2 PHE A 45 14.600 1.410 -16.739 1.00 0.00 H new ATOM 0 HZ PHE A 45 16.431 2.338 -15.358 1.00 0.00 H new ATOM 720 N CYS A 46 9.228 1.114 -11.318 1.00 0.00 N ATOM 721 CA CYS A 46 7.835 1.193 -10.799 1.00 0.00 C ATOM 722 C CYS A 46 7.869 1.421 -9.285 1.00 0.00 C ATOM 723 O CYS A 46 7.261 2.339 -8.773 1.00 0.00 O ATOM 724 CB CYS A 46 7.127 -0.134 -11.119 1.00 0.00 C ATOM 725 SG CYS A 46 5.414 -0.101 -10.519 1.00 0.00 S ATOM 0 H CYS A 46 9.523 0.189 -11.631 1.00 0.00 H new ATOM 0 HA CYS A 46 7.299 2.020 -11.265 1.00 0.00 H new ATOM 0 HB2 CYS A 46 7.138 -0.309 -12.195 1.00 0.00 H new ATOM 0 HB3 CYS A 46 7.665 -0.961 -10.656 1.00 0.00 H new ATOM 730 N ARG A 47 8.587 0.601 -8.571 1.00 0.00 N ATOM 731 CA ARG A 47 8.680 0.777 -7.093 1.00 0.00 C ATOM 732 C ARG A 47 9.518 2.017 -6.783 1.00 0.00 C ATOM 733 O ARG A 47 9.336 2.679 -5.782 1.00 0.00 O ATOM 734 CB ARG A 47 9.356 -0.449 -6.482 1.00 0.00 C ATOM 735 CG ARG A 47 9.240 -0.390 -4.958 1.00 0.00 C ATOM 736 CD ARG A 47 8.734 -1.734 -4.431 1.00 0.00 C ATOM 737 NE ARG A 47 9.532 -2.133 -3.239 1.00 0.00 N ATOM 738 CZ ARG A 47 10.663 -2.769 -3.392 1.00 0.00 C ATOM 739 NH1 ARG A 47 11.475 -2.431 -4.355 1.00 0.00 N ATOM 740 NH2 ARG A 47 10.979 -3.740 -2.581 1.00 0.00 N ATOM 0 H ARG A 47 9.115 -0.186 -8.947 1.00 0.00 H new ATOM 0 HA ARG A 47 7.680 0.895 -6.675 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.889 -1.360 -6.858 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.405 -0.483 -6.776 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.210 -0.157 -4.518 1.00 0.00 H new ATOM 0 HG3 ARG A 47 8.557 0.408 -4.665 1.00 0.00 H new ATOM 0 HD2 ARG A 47 7.679 -1.659 -4.167 1.00 0.00 H new ATOM 0 HD3 ARG A 47 8.815 -2.495 -5.207 1.00 0.00 H new ATOM 0 HE ARG A 47 9.196 -1.910 -2.302 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.227 -1.671 -4.988 1.00 0.00 H new ATOM 0 HH12 ARG A 47 12.358 -2.927 -4.475 1.00 0.00 H new ATOM 0 HH21 ARG A 47 10.343 -4.003 -1.828 1.00 0.00 H new ATOM 0 HH22 ARG A 47 11.862 -4.237 -2.700 1.00 0.00 H new ATOM 754 N ALA A 48 10.449 2.318 -7.643 1.00 0.00 N ATOM 755 CA ALA A 48 11.337 3.502 -7.421 1.00 0.00 C ATOM 756 C ALA A 48 10.530 4.776 -7.537 1.00 0.00 C ATOM 757 O ALA A 48 10.831 5.774 -6.930 1.00 0.00 O ATOM 758 CB ALA A 48 12.491 3.535 -8.433 1.00 0.00 C ATOM 0 H ALA A 48 10.638 1.794 -8.497 1.00 0.00 H new ATOM 0 HA ALA A 48 11.762 3.420 -6.420 1.00 0.00 H new ATOM 0 HB1 ALA A 48 13.116 4.407 -8.243 1.00 0.00 H new ATOM 0 HB2 ALA A 48 13.090 2.630 -8.331 1.00 0.00 H new ATOM 0 HB3 ALA A 48 12.087 3.591 -9.444 1.00 0.00 H new ATOM 764 N ALA A 49 9.509 4.749 -8.307 1.00 0.00 N ATOM 765 CA ALA A 49 8.670 5.967 -8.447 1.00 0.00 C ATOM 766 C ALA A 49 7.896 6.161 -7.150 1.00 0.00 C ATOM 767 O ALA A 49 7.613 7.267 -6.739 1.00 0.00 O ATOM 768 CB ALA A 49 7.703 5.817 -9.624 1.00 0.00 C ATOM 0 H ALA A 49 9.206 3.942 -8.853 1.00 0.00 H new ATOM 0 HA ALA A 49 9.301 6.834 -8.641 1.00 0.00 H new ATOM 0 HB1 ALA A 49 7.096 6.718 -9.713 1.00 0.00 H new ATOM 0 HB2 ALA A 49 8.269 5.669 -10.544 1.00 0.00 H new ATOM 0 HB3 ALA A 49 7.055 4.957 -9.455 1.00 0.00 H new ATOM 774 N THR A 50 7.562 5.083 -6.496 1.00 0.00 N ATOM 775 CA THR A 50 6.820 5.191 -5.212 1.00 0.00 C ATOM 776 C THR A 50 7.761 5.752 -4.145 1.00 0.00 C ATOM 777 O THR A 50 7.382 6.584 -3.350 1.00 0.00 O ATOM 778 CB THR A 50 6.325 3.807 -4.782 1.00 0.00 C ATOM 779 OG1 THR A 50 6.583 2.866 -5.816 1.00 0.00 O ATOM 780 CG2 THR A 50 4.822 3.863 -4.507 1.00 0.00 C ATOM 0 H THR A 50 7.772 4.131 -6.797 1.00 0.00 H new ATOM 0 HA THR A 50 5.962 5.852 -5.337 1.00 0.00 H new ATOM 0 HB THR A 50 6.848 3.502 -3.876 1.00 0.00 H new ATOM 0 HG1 THR A 50 6.129 2.022 -5.611 1.00 0.00 H new ATOM 0 HG21 THR A 50 4.471 2.877 -4.201 1.00 0.00 H new ATOM 0 HG22 THR A 50 4.624 4.582 -3.712 1.00 0.00 H new ATOM 0 HG23 THR A 50 4.298 4.170 -5.412 1.00 0.00 H new ATOM 788 N VAL A 51 8.983 5.288 -4.117 1.00 0.00 N ATOM 789 CA VAL A 51 9.949 5.790 -3.091 1.00 0.00 C ATOM 790 C VAL A 51 10.347 7.229 -3.403 1.00 0.00 C ATOM 791 O VAL A 51 10.237 8.098 -2.566 1.00 0.00 O ATOM 792 CB VAL A 51 11.198 4.892 -3.090 1.00 0.00 C ATOM 793 CG1 VAL A 51 11.769 4.784 -4.505 1.00 0.00 C ATOM 794 CG2 VAL A 51 12.272 5.490 -2.187 1.00 0.00 C ATOM 0 H VAL A 51 9.354 4.586 -4.757 1.00 0.00 H new ATOM 0 HA VAL A 51 9.477 5.763 -2.109 1.00 0.00 H new ATOM 0 HB VAL A 51 10.909 3.906 -2.727 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.653 4.146 -4.493 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.019 4.353 -5.168 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.043 5.776 -4.864 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.152 4.847 -2.193 1.00 0.00 H new ATOM 0 HG22 VAL A 51 12.544 6.481 -2.552 1.00 0.00 H new ATOM 0 HG23 VAL A 51 11.889 5.571 -1.170 1.00 0.00 H new ATOM 804 N LEU A 52 10.781 7.503 -4.599 1.00 0.00 N ATOM 805 CA LEU A 52 11.142 8.899 -4.938 1.00 0.00 C ATOM 806 C LEU A 52 9.879 9.748 -4.823 1.00 0.00 C ATOM 807 O LEU A 52 9.932 10.924 -4.551 1.00 0.00 O ATOM 808 CB LEU A 52 11.685 8.967 -6.367 1.00 0.00 C ATOM 809 CG LEU A 52 12.139 10.396 -6.673 1.00 0.00 C ATOM 810 CD1 LEU A 52 13.322 10.759 -5.774 1.00 0.00 C ATOM 811 CD2 LEU A 52 12.565 10.492 -8.140 1.00 0.00 C ATOM 0 H LEU A 52 10.900 6.824 -5.350 1.00 0.00 H new ATOM 0 HA LEU A 52 11.913 9.267 -4.261 1.00 0.00 H new ATOM 0 HB2 LEU A 52 12.520 8.276 -6.483 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.915 8.659 -7.075 1.00 0.00 H new ATOM 0 HG LEU A 52 11.316 11.086 -6.487 1.00 0.00 H new ATOM 0 HD11 LEU A 52 13.646 11.777 -5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 52 13.019 10.690 -4.729 1.00 0.00 H new ATOM 0 HD13 LEU A 52 14.145 10.069 -5.960 1.00 0.00 H new ATOM 0 HD21 LEU A 52 12.889 11.510 -8.359 1.00 0.00 H new ATOM 0 HD22 LEU A 52 13.388 9.802 -8.326 1.00 0.00 H new ATOM 0 HD23 LEU A 52 11.722 10.233 -8.781 1.00 0.00 H new ATOM 823 N ARG A 53 8.740 9.151 -5.035 1.00 0.00 N ATOM 824 CA ARG A 53 7.472 9.916 -4.933 1.00 0.00 C ATOM 825 C ARG A 53 7.249 10.329 -3.478 1.00 0.00 C ATOM 826 O ARG A 53 6.894 11.454 -3.198 1.00 0.00 O ATOM 827 CB ARG A 53 6.308 9.040 -5.402 1.00 0.00 C ATOM 828 CG ARG A 53 4.982 9.697 -5.010 1.00 0.00 C ATOM 829 CD ARG A 53 3.832 9.002 -5.742 1.00 0.00 C ATOM 830 NE ARG A 53 2.585 9.801 -5.578 1.00 0.00 N ATOM 831 CZ ARG A 53 2.484 10.976 -6.134 1.00 0.00 C ATOM 832 NH1 ARG A 53 2.126 11.077 -7.386 1.00 0.00 N ATOM 833 NH2 ARG A 53 2.740 12.052 -5.441 1.00 0.00 N ATOM 0 H ARG A 53 8.635 8.165 -5.275 1.00 0.00 H new ATOM 0 HA ARG A 53 7.529 10.806 -5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.353 8.905 -6.483 1.00 0.00 H new ATOM 0 HB3 ARG A 53 6.381 8.049 -4.954 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.835 9.629 -3.932 1.00 0.00 H new ATOM 0 HG3 ARG A 53 5.000 10.757 -5.263 1.00 0.00 H new ATOM 0 HD2 ARG A 53 4.072 8.895 -6.800 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.688 7.997 -5.345 1.00 0.00 H new ATOM 0 HE ARG A 53 1.810 9.428 -5.030 1.00 0.00 H new ATOM 0 HH11 ARG A 53 1.926 10.237 -7.928 1.00 0.00 H new ATOM 0 HH12 ARG A 53 2.047 11.996 -7.821 1.00 0.00 H new ATOM 0 HH21 ARG A 53 3.020 11.974 -4.463 1.00 0.00 H new ATOM 0 HH22 ARG A 53 2.661 12.971 -5.877 1.00 0.00 H new ATOM 847 N GLN A 54 7.442 9.433 -2.541 1.00 0.00 N ATOM 848 CA GLN A 54 7.219 9.813 -1.111 1.00 0.00 C ATOM 849 C GLN A 54 8.304 10.777 -0.633 1.00 0.00 C ATOM 850 O GLN A 54 8.073 11.647 0.183 1.00 0.00 O ATOM 851 CB GLN A 54 7.230 8.555 -0.240 1.00 0.00 C ATOM 852 CG GLN A 54 6.247 7.531 -0.813 1.00 0.00 C ATOM 853 CD GLN A 54 5.284 7.075 0.286 1.00 0.00 C ATOM 854 OE1 GLN A 54 5.592 7.173 1.457 1.00 0.00 O ATOM 855 NE2 GLN A 54 4.124 6.579 -0.045 1.00 0.00 N ATOM 0 H GLN A 54 7.739 8.470 -2.700 1.00 0.00 H new ATOM 0 HA GLN A 54 6.252 10.310 -1.029 1.00 0.00 H new ATOM 0 HB2 GLN A 54 8.234 8.132 -0.206 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.955 8.806 0.784 1.00 0.00 H new ATOM 0 HG2 GLN A 54 5.689 7.970 -1.640 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.790 6.675 -1.213 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.866 6.497 -1.028 1.00 0.00 H new ATOM 0 HE22 GLN A 54 3.475 6.273 0.680 1.00 0.00 H new ATOM 864 N PHE A 55 9.482 10.600 -1.120 1.00 0.00 N ATOM 865 CA PHE A 55 10.628 11.460 -0.708 1.00 0.00 C ATOM 866 C PHE A 55 10.487 12.887 -1.261 1.00 0.00 C ATOM 867 O PHE A 55 10.571 13.859 -0.538 1.00 0.00 O ATOM 868 CB PHE A 55 11.891 10.832 -1.304 1.00 0.00 C ATOM 869 CG PHE A 55 13.104 11.602 -0.862 1.00 0.00 C ATOM 870 CD1 PHE A 55 13.454 12.785 -1.522 1.00 0.00 C ATOM 871 CD2 PHE A 55 13.877 11.135 0.203 1.00 0.00 C ATOM 872 CE1 PHE A 55 14.583 13.504 -1.114 1.00 0.00 C ATOM 873 CE2 PHE A 55 15.006 11.852 0.612 1.00 0.00 C ATOM 874 CZ PHE A 55 15.358 13.035 -0.046 1.00 0.00 C ATOM 0 H PHE A 55 9.716 9.881 -1.804 1.00 0.00 H new ATOM 0 HA PHE A 55 10.666 11.522 0.380 1.00 0.00 H new ATOM 0 HB2 PHE A 55 11.975 9.792 -0.988 1.00 0.00 H new ATOM 0 HB3 PHE A 55 11.828 10.830 -2.392 1.00 0.00 H new ATOM 0 HD1 PHE A 55 12.854 13.143 -2.345 1.00 0.00 H new ATOM 0 HD2 PHE A 55 13.603 10.222 0.710 1.00 0.00 H new ATOM 0 HE1 PHE A 55 14.856 14.418 -1.621 1.00 0.00 H new ATOM 0 HE2 PHE A 55 15.606 11.493 1.435 1.00 0.00 H new ATOM 0 HZ PHE A 55 16.230 13.588 0.270 1.00 0.00 H new ATOM 884 N TYR A 56 10.294 13.007 -2.540 1.00 0.00 N ATOM 885 CA TYR A 56 10.166 14.332 -3.187 1.00 0.00 C ATOM 886 C TYR A 56 8.808 14.981 -2.817 1.00 0.00 C ATOM 887 O TYR A 56 8.766 16.124 -2.412 1.00 0.00 O ATOM 888 CB TYR A 56 10.310 14.050 -4.709 1.00 0.00 C ATOM 889 CG TYR A 56 9.101 14.458 -5.532 1.00 0.00 C ATOM 890 CD1 TYR A 56 8.520 15.724 -5.402 1.00 0.00 C ATOM 891 CD2 TYR A 56 8.570 13.541 -6.451 1.00 0.00 C ATOM 892 CE1 TYR A 56 7.409 16.069 -6.180 1.00 0.00 C ATOM 893 CE2 TYR A 56 7.462 13.886 -7.230 1.00 0.00 C ATOM 894 CZ TYR A 56 6.880 15.150 -7.095 1.00 0.00 C ATOM 895 OH TYR A 56 5.785 15.491 -7.861 1.00 0.00 O ATOM 0 H TYR A 56 10.218 12.217 -3.180 1.00 0.00 H new ATOM 0 HA TYR A 56 10.922 15.045 -2.858 1.00 0.00 H new ATOM 0 HB2 TYR A 56 11.187 14.578 -5.084 1.00 0.00 H new ATOM 0 HB3 TYR A 56 10.493 12.985 -4.855 1.00 0.00 H new ATOM 0 HD1 TYR A 56 8.929 16.436 -4.700 1.00 0.00 H new ATOM 0 HD2 TYR A 56 9.019 12.565 -6.557 1.00 0.00 H new ATOM 0 HE1 TYR A 56 6.959 17.045 -6.075 1.00 0.00 H new ATOM 0 HE2 TYR A 56 7.056 13.177 -7.936 1.00 0.00 H new ATOM 0 HH TYR A 56 5.547 14.740 -8.444 1.00 0.00 H new ATOM 905 N SER A 57 7.691 14.284 -2.968 1.00 0.00 N ATOM 906 CA SER A 57 6.374 14.918 -2.640 1.00 0.00 C ATOM 907 C SER A 57 6.175 15.090 -1.127 1.00 0.00 C ATOM 908 O SER A 57 5.750 16.131 -0.665 1.00 0.00 O ATOM 909 CB SER A 57 5.235 14.056 -3.194 1.00 0.00 C ATOM 910 OG SER A 57 5.176 12.832 -2.479 1.00 0.00 O ATOM 0 H SER A 57 7.642 13.320 -3.299 1.00 0.00 H new ATOM 0 HA SER A 57 6.367 15.907 -3.098 1.00 0.00 H new ATOM 0 HB2 SER A 57 4.287 14.587 -3.106 1.00 0.00 H new ATOM 0 HB3 SER A 57 5.394 13.862 -4.255 1.00 0.00 H new ATOM 0 HG SER A 57 6.076 12.452 -2.406 1.00 0.00 H new ATOM 916 N HIS A 58 6.416 14.068 -0.354 1.00 0.00 N ATOM 917 CA HIS A 58 6.177 14.173 1.115 1.00 0.00 C ATOM 918 C HIS A 58 7.206 15.077 1.795 1.00 0.00 C ATOM 919 O HIS A 58 6.863 15.960 2.555 1.00 0.00 O ATOM 920 CB HIS A 58 6.260 12.776 1.732 1.00 0.00 C ATOM 921 CG HIS A 58 5.155 12.605 2.736 1.00 0.00 C ATOM 922 ND1 HIS A 58 5.407 12.423 4.087 1.00 0.00 N ATOM 923 CD2 HIS A 58 3.788 12.585 2.605 1.00 0.00 C ATOM 924 CE1 HIS A 58 4.219 12.303 4.709 1.00 0.00 C ATOM 925 NE2 HIS A 58 3.200 12.394 3.850 1.00 0.00 N ATOM 0 H HIS A 58 6.768 13.166 -0.674 1.00 0.00 H new ATOM 0 HA HIS A 58 5.190 14.610 1.267 1.00 0.00 H new ATOM 0 HB2 HIS A 58 6.179 12.018 0.953 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.228 12.636 2.213 1.00 0.00 H new ATOM 0 HD2 HIS A 58 3.251 12.700 1.675 1.00 0.00 H new ATOM 0 HE1 HIS A 58 4.104 12.152 5.772 1.00 0.00 H new ATOM 0 HE2 HIS A 58 2.204 12.336 4.062 1.00 0.00 H new ATOM 933 N HIS A 59 8.463 14.837 1.565 1.00 0.00 N ATOM 934 CA HIS A 59 9.510 15.664 2.247 1.00 0.00 C ATOM 935 C HIS A 59 9.560 17.087 1.687 1.00 0.00 C ATOM 936 O HIS A 59 9.908 18.013 2.394 1.00 0.00 O ATOM 937 CB HIS A 59 10.887 15.001 2.120 1.00 0.00 C ATOM 938 CG HIS A 59 10.801 13.585 2.627 1.00 0.00 C ATOM 939 ND1 HIS A 59 9.632 13.052 3.152 1.00 0.00 N ATOM 940 CD2 HIS A 59 11.734 12.582 2.704 1.00 0.00 C ATOM 941 CE1 HIS A 59 9.892 11.783 3.513 1.00 0.00 C ATOM 942 NE2 HIS A 59 11.158 11.445 3.262 1.00 0.00 N ATOM 0 H HIS A 59 8.816 14.112 0.941 1.00 0.00 H new ATOM 0 HA HIS A 59 9.240 15.727 3.301 1.00 0.00 H new ATOM 0 HB2 HIS A 59 11.214 15.009 1.080 1.00 0.00 H new ATOM 0 HB3 HIS A 59 11.628 15.561 2.691 1.00 0.00 H new ATOM 0 HD2 HIS A 59 12.761 12.663 2.380 1.00 0.00 H new ATOM 0 HE1 HIS A 59 9.164 11.118 3.953 1.00 0.00 H new ATOM 0 HE2 HIS A 59 11.607 10.547 3.441 1.00 0.00 H new ATOM 950 N GLU A 60 9.236 17.286 0.436 1.00 0.00 N ATOM 951 CA GLU A 60 9.293 18.673 -0.118 1.00 0.00 C ATOM 952 C GLU A 60 8.668 19.640 0.890 1.00 0.00 C ATOM 953 O GLU A 60 9.020 20.800 0.955 1.00 0.00 O ATOM 954 CB GLU A 60 8.536 18.752 -1.446 1.00 0.00 C ATOM 955 CG GLU A 60 7.122 18.198 -1.269 1.00 0.00 C ATOM 956 CD GLU A 60 6.105 19.236 -1.746 1.00 0.00 C ATOM 957 OE1 GLU A 60 6.416 20.414 -1.683 1.00 0.00 O ATOM 958 OE2 GLU A 60 5.031 18.835 -2.164 1.00 0.00 O ATOM 0 H GLU A 60 8.939 16.562 -0.218 1.00 0.00 H new ATOM 0 HA GLU A 60 10.334 18.943 -0.297 1.00 0.00 H new ATOM 0 HB2 GLU A 60 8.491 19.786 -1.789 1.00 0.00 H new ATOM 0 HB3 GLU A 60 9.066 18.185 -2.211 1.00 0.00 H new ATOM 0 HG2 GLU A 60 7.008 17.274 -1.836 1.00 0.00 H new ATOM 0 HG3 GLU A 60 6.944 17.953 -0.222 1.00 0.00 H new ATOM 965 N LYS A 61 7.756 19.158 1.688 1.00 0.00 N ATOM 966 CA LYS A 61 7.118 20.034 2.711 1.00 0.00 C ATOM 967 C LYS A 61 7.178 19.331 4.069 1.00 0.00 C ATOM 968 O LYS A 61 6.343 18.507 4.383 1.00 0.00 O ATOM 969 CB LYS A 61 5.658 20.289 2.330 1.00 0.00 C ATOM 970 CG LYS A 61 5.546 20.452 0.813 1.00 0.00 C ATOM 971 CD LYS A 61 4.583 21.595 0.491 1.00 0.00 C ATOM 972 CE LYS A 61 5.380 22.845 0.115 1.00 0.00 C ATOM 973 NZ LYS A 61 5.752 23.588 1.351 1.00 0.00 N ATOM 0 H LYS A 61 7.424 18.194 1.676 1.00 0.00 H new ATOM 0 HA LYS A 61 7.645 20.987 2.763 1.00 0.00 H new ATOM 0 HB2 LYS A 61 5.034 19.460 2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 61 5.292 21.185 2.831 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.527 20.658 0.386 1.00 0.00 H new ATOM 0 HG3 LYS A 61 5.190 19.525 0.363 1.00 0.00 H new ATOM 0 HD2 LYS A 61 3.925 21.310 -0.330 1.00 0.00 H new ATOM 0 HD3 LYS A 61 3.947 21.802 1.352 1.00 0.00 H new ATOM 0 HE2 LYS A 61 6.277 22.565 -0.437 1.00 0.00 H new ATOM 0 HE3 LYS A 61 4.788 23.483 -0.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 6.294 24.438 1.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.890 23.868 1.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.333 22.978 1.961 1.00 0.00 H new ATOM 987 N ASP A 62 8.157 19.646 4.877 1.00 0.00 N ATOM 988 CA ASP A 62 8.261 18.985 6.207 1.00 0.00 C ATOM 989 C ASP A 62 9.564 19.402 6.879 1.00 0.00 C ATOM 990 O ASP A 62 10.164 18.652 7.624 1.00 0.00 O ATOM 991 CB ASP A 62 8.246 17.469 6.030 1.00 0.00 C ATOM 992 CG ASP A 62 7.356 16.839 7.103 1.00 0.00 C ATOM 993 OD1 ASP A 62 7.454 17.255 8.246 1.00 0.00 O ATOM 994 OD2 ASP A 62 6.591 15.950 6.764 1.00 0.00 O ATOM 0 H ASP A 62 8.885 20.330 4.672 1.00 0.00 H new ATOM 0 HA ASP A 62 7.416 19.285 6.827 1.00 0.00 H new ATOM 0 HB2 ASP A 62 7.875 17.212 5.038 1.00 0.00 H new ATOM 0 HB3 ASP A 62 9.259 17.073 6.104 1.00 0.00 H new ATOM 999 N THR A 63 10.009 20.593 6.615 1.00 0.00 N ATOM 1000 CA THR A 63 11.280 21.068 7.229 1.00 0.00 C ATOM 1001 C THR A 63 12.340 19.982 7.060 1.00 0.00 C ATOM 1002 O THR A 63 13.202 19.801 7.898 1.00 0.00 O ATOM 1003 CB THR A 63 11.061 21.348 8.717 1.00 0.00 C ATOM 1004 OG1 THR A 63 9.800 21.979 8.898 1.00 0.00 O ATOM 1005 CG2 THR A 63 12.171 22.264 9.236 1.00 0.00 C ATOM 0 H THR A 63 9.548 21.263 5.999 1.00 0.00 H new ATOM 0 HA THR A 63 11.608 21.986 6.742 1.00 0.00 H new ATOM 0 HB THR A 63 11.081 20.409 9.270 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.657 22.158 9.851 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.013 22.462 10.296 1.00 0.00 H new ATOM 0 HG22 THR A 63 13.137 21.779 9.097 1.00 0.00 H new ATOM 0 HG23 THR A 63 12.154 23.204 8.685 1.00 0.00 H new ATOM 1013 N ARG A 64 12.279 19.265 5.976 1.00 0.00 N ATOM 1014 CA ARG A 64 13.273 18.190 5.729 1.00 0.00 C ATOM 1015 C ARG A 64 14.195 18.631 4.595 1.00 0.00 C ATOM 1016 O ARG A 64 13.878 18.476 3.433 1.00 0.00 O ATOM 1017 CB ARG A 64 12.552 16.900 5.336 1.00 0.00 C ATOM 1018 CG ARG A 64 13.149 15.725 6.113 1.00 0.00 C ATOM 1019 CD ARG A 64 12.181 15.296 7.216 1.00 0.00 C ATOM 1020 NE ARG A 64 12.845 15.437 8.542 1.00 0.00 N ATOM 1021 CZ ARG A 64 12.568 14.600 9.504 1.00 0.00 C ATOM 1022 NH1 ARG A 64 13.080 13.399 9.493 1.00 0.00 N ATOM 1023 NH2 ARG A 64 11.779 14.964 10.477 1.00 0.00 N ATOM 0 H ARG A 64 11.577 19.379 5.245 1.00 0.00 H new ATOM 0 HA ARG A 64 13.855 18.007 6.632 1.00 0.00 H new ATOM 0 HB2 ARG A 64 11.487 16.987 5.549 1.00 0.00 H new ATOM 0 HB3 ARG A 64 12.650 16.728 4.264 1.00 0.00 H new ATOM 0 HG2 ARG A 64 13.341 14.890 5.439 1.00 0.00 H new ATOM 0 HG3 ARG A 64 14.107 16.012 6.547 1.00 0.00 H new ATOM 0 HD2 ARG A 64 11.280 15.908 7.182 1.00 0.00 H new ATOM 0 HD3 ARG A 64 11.871 14.263 7.061 1.00 0.00 H new ATOM 0 HE ARG A 64 13.517 16.188 8.698 1.00 0.00 H new ATOM 0 HH11 ARG A 64 13.697 13.115 8.732 1.00 0.00 H new ATOM 0 HH12 ARG A 64 12.863 12.745 10.245 1.00 0.00 H new ATOM 0 HH21 ARG A 64 11.379 15.902 10.485 1.00 0.00 H new ATOM 0 HH22 ARG A 64 11.562 14.310 11.229 1.00 0.00 H new ATOM 1037 N CYS A 65 15.326 19.184 4.936 1.00 0.00 N ATOM 1038 CA CYS A 65 16.293 19.651 3.899 1.00 0.00 C ATOM 1039 C CYS A 65 15.929 21.069 3.442 1.00 0.00 C ATOM 1040 O CYS A 65 16.637 21.670 2.657 1.00 0.00 O ATOM 1041 CB CYS A 65 16.269 18.706 2.695 1.00 0.00 C ATOM 1042 SG CYS A 65 17.881 18.724 1.874 1.00 0.00 S ATOM 0 H CYS A 65 15.626 19.334 5.899 1.00 0.00 H new ATOM 0 HA CYS A 65 17.293 19.657 4.332 1.00 0.00 H new ATOM 0 HB2 CYS A 65 16.027 17.694 3.019 1.00 0.00 H new ATOM 0 HB3 CYS A 65 15.491 19.012 1.996 1.00 0.00 H new ATOM 1047 N LEU A 66 14.840 21.613 3.922 1.00 0.00 N ATOM 1048 CA LEU A 66 14.460 22.991 3.502 1.00 0.00 C ATOM 1049 C LEU A 66 15.697 23.889 3.536 1.00 0.00 C ATOM 1050 O LEU A 66 16.052 24.511 2.553 1.00 0.00 O ATOM 1051 CB LEU A 66 13.396 23.542 4.454 1.00 0.00 C ATOM 1052 CG LEU A 66 12.007 23.225 3.896 1.00 0.00 C ATOM 1053 CD1 LEU A 66 11.674 21.756 4.162 1.00 0.00 C ATOM 1054 CD2 LEU A 66 10.966 24.115 4.577 1.00 0.00 C ATOM 0 H LEU A 66 14.203 21.165 4.581 1.00 0.00 H new ATOM 0 HA LEU A 66 14.057 22.966 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 66 13.513 23.100 5.444 1.00 0.00 H new ATOM 0 HB3 LEU A 66 13.517 24.619 4.570 1.00 0.00 H new ATOM 0 HG LEU A 66 11.997 23.412 2.822 1.00 0.00 H new ATOM 0 HD11 LEU A 66 10.685 21.530 3.765 1.00 0.00 H new ATOM 0 HD12 LEU A 66 12.414 21.121 3.675 1.00 0.00 H new ATOM 0 HD13 LEU A 66 11.685 21.569 5.236 1.00 0.00 H new ATOM 0 HD21 LEU A 66 9.977 23.888 4.179 1.00 0.00 H new ATOM 0 HD22 LEU A 66 10.976 23.930 5.651 1.00 0.00 H new ATOM 0 HD23 LEU A 66 11.202 25.162 4.387 1.00 0.00 H new ATOM 1066 N GLY A 67 16.367 23.955 4.655 1.00 0.00 N ATOM 1067 CA GLY A 67 17.591 24.803 4.741 1.00 0.00 C ATOM 1068 C GLY A 67 17.440 25.833 5.878 1.00 0.00 C ATOM 1069 O GLY A 67 17.891 25.600 6.982 1.00 0.00 O ATOM 0 H GLY A 67 16.120 23.459 5.512 1.00 0.00 H new ATOM 0 HA2 GLY A 67 18.465 24.177 4.920 1.00 0.00 H new ATOM 0 HA3 GLY A 67 17.755 25.316 3.794 1.00 0.00 H new ATOM 1073 N ALA A 68 16.814 26.970 5.624 1.00 0.00 N ATOM 1074 CA ALA A 68 16.650 28.001 6.692 1.00 0.00 C ATOM 1075 C ALA A 68 16.444 29.359 6.021 1.00 0.00 C ATOM 1076 O ALA A 68 15.397 29.966 6.121 1.00 0.00 O ATOM 1077 CB ALA A 68 17.905 28.059 7.568 1.00 0.00 C ATOM 0 H ALA A 68 16.413 27.220 4.720 1.00 0.00 H new ATOM 0 HA ALA A 68 15.795 27.747 7.319 1.00 0.00 H new ATOM 0 HB1 ALA A 68 17.773 28.814 8.343 1.00 0.00 H new ATOM 0 HB2 ALA A 68 18.069 27.087 8.033 1.00 0.00 H new ATOM 0 HB3 ALA A 68 18.767 28.317 6.952 1.00 0.00 H new ATOM 1083 N THR A 69 17.439 29.827 5.317 1.00 0.00 N ATOM 1084 CA THR A 69 17.310 31.130 4.611 1.00 0.00 C ATOM 1085 C THR A 69 16.303 30.968 3.472 1.00 0.00 C ATOM 1086 O THR A 69 16.418 30.054 2.689 1.00 0.00 O ATOM 1087 CB THR A 69 18.671 31.522 4.027 1.00 0.00 C ATOM 1088 OG1 THR A 69 19.699 30.834 4.727 1.00 0.00 O ATOM 1089 CG2 THR A 69 18.875 33.031 4.170 1.00 0.00 C ATOM 0 H THR A 69 18.338 29.360 5.201 1.00 0.00 H new ATOM 0 HA THR A 69 16.974 31.902 5.304 1.00 0.00 H new ATOM 0 HB THR A 69 18.706 31.253 2.971 1.00 0.00 H new ATOM 0 HG1 THR A 69 20.571 31.082 4.354 1.00 0.00 H new ATOM 0 HG21 THR A 69 19.844 33.308 3.754 1.00 0.00 H new ATOM 0 HG22 THR A 69 18.086 33.557 3.633 1.00 0.00 H new ATOM 0 HG23 THR A 69 18.841 33.304 5.225 1.00 0.00 H new ATOM 1097 N ALA A 70 15.322 31.832 3.347 1.00 0.00 N ATOM 1098 CA ALA A 70 14.364 31.666 2.228 1.00 0.00 C ATOM 1099 C ALA A 70 15.167 31.450 0.948 1.00 0.00 C ATOM 1100 O ALA A 70 14.712 30.823 0.012 1.00 0.00 O ATOM 1101 CB ALA A 70 13.502 32.924 2.092 1.00 0.00 C ATOM 0 H ALA A 70 15.152 32.627 3.963 1.00 0.00 H new ATOM 0 HA ALA A 70 13.709 30.815 2.413 1.00 0.00 H new ATOM 0 HB1 ALA A 70 12.800 32.797 1.268 1.00 0.00 H new ATOM 0 HB2 ALA A 70 12.950 33.089 3.017 1.00 0.00 H new ATOM 0 HB3 ALA A 70 14.142 33.784 1.894 1.00 0.00 H new ATOM 1107 N GLN A 71 16.365 31.969 0.903 1.00 0.00 N ATOM 1108 CA GLN A 71 17.204 31.794 -0.320 1.00 0.00 C ATOM 1109 C GLN A 71 17.649 30.334 -0.440 1.00 0.00 C ATOM 1110 O GLN A 71 17.498 29.715 -1.474 1.00 0.00 O ATOM 1111 CB GLN A 71 18.434 32.698 -0.229 1.00 0.00 C ATOM 1112 CG GLN A 71 19.110 32.778 -1.599 1.00 0.00 C ATOM 1113 CD GLN A 71 18.377 33.797 -2.473 1.00 0.00 C ATOM 1114 OE1 GLN A 71 18.311 34.963 -2.140 1.00 0.00 O ATOM 1115 NE2 GLN A 71 17.818 33.403 -3.584 1.00 0.00 N ATOM 0 H GLN A 71 16.798 32.504 1.656 1.00 0.00 H new ATOM 0 HA GLN A 71 16.618 32.063 -1.199 1.00 0.00 H new ATOM 0 HB2 GLN A 71 18.143 33.694 0.103 1.00 0.00 H new ATOM 0 HB3 GLN A 71 19.132 32.307 0.511 1.00 0.00 H new ATOM 0 HG2 GLN A 71 20.155 33.067 -1.484 1.00 0.00 H new ATOM 0 HG3 GLN A 71 19.101 31.799 -2.078 1.00 0.00 H new ATOM 0 HE21 GLN A 71 17.874 32.424 -3.864 1.00 0.00 H new ATOM 0 HE22 GLN A 71 17.325 34.074 -4.173 1.00 0.00 H new ATOM 1124 N GLN A 72 18.190 29.776 0.608 1.00 0.00 N ATOM 1125 CA GLN A 72 18.636 28.355 0.544 1.00 0.00 C ATOM 1126 C GLN A 72 17.425 27.465 0.255 1.00 0.00 C ATOM 1127 O GLN A 72 17.539 26.418 -0.352 1.00 0.00 O ATOM 1128 CB GLN A 72 19.263 27.953 1.883 1.00 0.00 C ATOM 1129 CG GLN A 72 20.378 28.940 2.239 1.00 0.00 C ATOM 1130 CD GLN A 72 21.612 28.646 1.386 1.00 0.00 C ATOM 1131 OE1 GLN A 72 21.972 27.501 1.191 1.00 0.00 O ATOM 1132 NE2 GLN A 72 22.282 29.637 0.864 1.00 0.00 N ATOM 0 H GLN A 72 18.342 30.241 1.503 1.00 0.00 H new ATOM 0 HA GLN A 72 19.376 28.236 -0.247 1.00 0.00 H new ATOM 0 HB2 GLN A 72 18.504 27.947 2.665 1.00 0.00 H new ATOM 0 HB3 GLN A 72 19.664 26.941 1.820 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.041 29.963 2.069 1.00 0.00 H new ATOM 0 HG3 GLN A 72 20.626 28.858 3.297 1.00 0.00 H new ATOM 0 HE21 GLN A 72 21.981 30.598 1.027 1.00 0.00 H new ATOM 0 HE22 GLN A 72 23.107 29.451 0.293 1.00 0.00 H new ATOM 1141 N PHE A 73 16.268 27.879 0.689 1.00 0.00 N ATOM 1142 CA PHE A 73 15.040 27.075 0.450 1.00 0.00 C ATOM 1143 C PHE A 73 14.817 26.903 -1.053 1.00 0.00 C ATOM 1144 O PHE A 73 14.281 25.909 -1.496 1.00 0.00 O ATOM 1145 CB PHE A 73 13.836 27.800 1.058 1.00 0.00 C ATOM 1146 CG PHE A 73 12.572 27.044 0.728 1.00 0.00 C ATOM 1147 CD1 PHE A 73 12.342 25.783 1.291 1.00 0.00 C ATOM 1148 CD2 PHE A 73 11.628 27.604 -0.141 1.00 0.00 C ATOM 1149 CE1 PHE A 73 11.168 25.083 0.984 1.00 0.00 C ATOM 1150 CE2 PHE A 73 10.455 26.904 -0.448 1.00 0.00 C ATOM 1151 CZ PHE A 73 10.225 25.644 0.115 1.00 0.00 C ATOM 0 H PHE A 73 16.120 28.747 1.203 1.00 0.00 H new ATOM 0 HA PHE A 73 15.156 26.095 0.912 1.00 0.00 H new ATOM 0 HB2 PHE A 73 13.953 27.879 2.139 1.00 0.00 H new ATOM 0 HB3 PHE A 73 13.776 28.817 0.669 1.00 0.00 H new ATOM 0 HD1 PHE A 73 13.069 25.350 1.962 1.00 0.00 H new ATOM 0 HD2 PHE A 73 11.805 28.577 -0.575 1.00 0.00 H new ATOM 0 HE1 PHE A 73 10.990 24.110 1.418 1.00 0.00 H new ATOM 0 HE2 PHE A 73 9.728 27.337 -1.119 1.00 0.00 H new ATOM 0 HZ PHE A 73 9.320 25.104 -0.121 1.00 0.00 H new ATOM 1161 N HIS A 74 15.214 27.864 -1.844 1.00 0.00 N ATOM 1162 CA HIS A 74 15.009 27.746 -3.314 1.00 0.00 C ATOM 1163 C HIS A 74 15.701 26.502 -3.833 1.00 0.00 C ATOM 1164 O HIS A 74 15.259 25.860 -4.764 1.00 0.00 O ATOM 1165 CB HIS A 74 15.587 28.977 -4.002 1.00 0.00 C ATOM 1166 CG HIS A 74 14.573 29.543 -4.959 1.00 0.00 C ATOM 1167 ND1 HIS A 74 13.650 28.744 -5.615 1.00 0.00 N ATOM 1168 CD2 HIS A 74 14.325 30.825 -5.379 1.00 0.00 C ATOM 1169 CE1 HIS A 74 12.897 29.547 -6.389 1.00 0.00 C ATOM 1170 NE2 HIS A 74 13.266 30.826 -6.283 1.00 0.00 N ATOM 0 H HIS A 74 15.670 28.723 -1.535 1.00 0.00 H new ATOM 0 HA HIS A 74 13.942 27.674 -3.526 1.00 0.00 H new ATOM 0 HB2 HIS A 74 15.859 29.727 -3.259 1.00 0.00 H new ATOM 0 HB3 HIS A 74 16.499 28.712 -4.537 1.00 0.00 H new ATOM 0 HD1 HIS A 74 13.558 27.732 -5.527 1.00 0.00 H new ATOM 0 HD2 HIS A 74 14.869 31.701 -5.057 1.00 0.00 H new ATOM 0 HE1 HIS A 74 12.092 29.199 -7.019 1.00 0.00 H new ATOM 1178 N ARG A 75 16.777 26.170 -3.227 1.00 0.00 N ATOM 1179 CA ARG A 75 17.539 24.960 -3.648 1.00 0.00 C ATOM 1180 C ARG A 75 16.741 23.713 -3.269 1.00 0.00 C ATOM 1181 O ARG A 75 16.516 22.839 -4.081 1.00 0.00 O ATOM 1182 CB ARG A 75 18.895 24.938 -2.939 1.00 0.00 C ATOM 1183 CG ARG A 75 19.435 26.366 -2.829 1.00 0.00 C ATOM 1184 CD ARG A 75 20.956 26.352 -2.993 1.00 0.00 C ATOM 1185 NE ARG A 75 21.305 25.829 -4.345 1.00 0.00 N ATOM 1186 CZ ARG A 75 21.706 26.650 -5.278 1.00 0.00 C ATOM 1187 NH1 ARG A 75 22.699 27.462 -5.048 1.00 0.00 N ATOM 1188 NH2 ARG A 75 21.112 26.654 -6.440 1.00 0.00 N ATOM 0 H ARG A 75 17.181 26.683 -2.443 1.00 0.00 H new ATOM 0 HA ARG A 75 17.699 24.980 -4.726 1.00 0.00 H new ATOM 0 HB2 ARG A 75 18.792 24.499 -1.947 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.597 24.314 -3.492 1.00 0.00 H new ATOM 0 HG2 ARG A 75 18.982 26.997 -3.594 1.00 0.00 H new ATOM 0 HG3 ARG A 75 19.167 26.794 -1.863 1.00 0.00 H new ATOM 0 HD2 ARG A 75 21.355 27.358 -2.866 1.00 0.00 H new ATOM 0 HD3 ARG A 75 21.410 25.729 -2.222 1.00 0.00 H new ATOM 0 HE ARG A 75 21.231 24.831 -4.541 1.00 0.00 H new ATOM 0 HH11 ARG A 75 23.163 27.456 -4.140 1.00 0.00 H new ATOM 0 HH12 ARG A 75 23.013 28.103 -5.776 1.00 0.00 H new ATOM 0 HH21 ARG A 75 20.336 26.017 -6.618 1.00 0.00 H new ATOM 0 HH22 ARG A 75 21.424 27.295 -7.170 1.00 0.00 H new ATOM 1202 N HIS A 76 16.302 23.630 -2.043 1.00 0.00 N ATOM 1203 CA HIS A 76 15.508 22.445 -1.610 1.00 0.00 C ATOM 1204 C HIS A 76 14.341 22.250 -2.579 1.00 0.00 C ATOM 1205 O HIS A 76 14.026 21.147 -2.980 1.00 0.00 O ATOM 1206 CB HIS A 76 14.976 22.694 -0.196 1.00 0.00 C ATOM 1207 CG HIS A 76 13.938 21.662 0.150 1.00 0.00 C ATOM 1208 ND1 HIS A 76 14.221 20.306 0.179 1.00 0.00 N ATOM 1209 CD2 HIS A 76 12.615 21.777 0.501 1.00 0.00 C ATOM 1210 CE1 HIS A 76 13.093 19.665 0.536 1.00 0.00 C ATOM 1211 NE2 HIS A 76 12.085 20.514 0.744 1.00 0.00 N ATOM 0 H HIS A 76 16.459 24.333 -1.321 1.00 0.00 H new ATOM 0 HA HIS A 76 16.131 21.550 -1.609 1.00 0.00 H new ATOM 0 HB2 HIS A 76 15.795 22.654 0.522 1.00 0.00 H new ATOM 0 HB3 HIS A 76 14.544 23.693 -0.131 1.00 0.00 H new ATOM 0 HD1 HIS A 76 15.120 19.873 -0.032 1.00 0.00 H new ATOM 0 HD2 HIS A 76 12.070 22.706 0.577 1.00 0.00 H new ATOM 0 HE1 HIS A 76 13.013 18.593 0.641 1.00 0.00 H new ATOM 1219 N LYS A 77 13.701 23.320 -2.958 1.00 0.00 N ATOM 1220 CA LYS A 77 12.552 23.214 -3.911 1.00 0.00 C ATOM 1221 C LYS A 77 13.066 22.842 -5.306 1.00 0.00 C ATOM 1222 O LYS A 77 12.397 22.186 -6.074 1.00 0.00 O ATOM 1223 CB LYS A 77 11.803 24.565 -3.964 1.00 0.00 C ATOM 1224 CG LYS A 77 12.125 25.336 -5.253 1.00 0.00 C ATOM 1225 CD LYS A 77 11.308 24.759 -6.410 1.00 0.00 C ATOM 1226 CE LYS A 77 10.071 25.626 -6.646 1.00 0.00 C ATOM 1227 NZ LYS A 77 10.208 26.348 -7.942 1.00 0.00 N ATOM 0 H LYS A 77 13.921 24.267 -2.651 1.00 0.00 H new ATOM 0 HA LYS A 77 11.868 22.437 -3.570 1.00 0.00 H new ATOM 0 HB2 LYS A 77 10.729 24.390 -3.902 1.00 0.00 H new ATOM 0 HB3 LYS A 77 12.078 25.169 -3.099 1.00 0.00 H new ATOM 0 HG2 LYS A 77 11.895 26.394 -5.124 1.00 0.00 H new ATOM 0 HG3 LYS A 77 13.190 25.266 -5.475 1.00 0.00 H new ATOM 0 HD2 LYS A 77 11.916 24.721 -7.314 1.00 0.00 H new ATOM 0 HD3 LYS A 77 11.009 23.736 -6.183 1.00 0.00 H new ATOM 0 HE2 LYS A 77 9.175 25.005 -6.657 1.00 0.00 H new ATOM 0 HE3 LYS A 77 9.954 26.340 -5.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 9.314 26.286 -8.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 10.434 27.347 -7.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 10.971 25.916 -8.501 1.00 0.00 H new ATOM 1241 N GLN A 78 14.229 23.309 -5.644 1.00 0.00 N ATOM 1242 CA GLN A 78 14.797 23.049 -7.001 1.00 0.00 C ATOM 1243 C GLN A 78 15.087 21.558 -7.231 1.00 0.00 C ATOM 1244 O GLN A 78 14.708 21.005 -8.242 1.00 0.00 O ATOM 1245 CB GLN A 78 16.095 23.840 -7.158 1.00 0.00 C ATOM 1246 CG GLN A 78 16.762 23.470 -8.484 1.00 0.00 C ATOM 1247 CD GLN A 78 17.531 24.677 -9.024 1.00 0.00 C ATOM 1248 OE1 GLN A 78 16.962 25.729 -9.235 1.00 0.00 O ATOM 1249 NE2 GLN A 78 18.811 24.570 -9.256 1.00 0.00 N ATOM 0 H GLN A 78 14.823 23.869 -5.033 1.00 0.00 H new ATOM 0 HA GLN A 78 14.058 23.362 -7.738 1.00 0.00 H new ATOM 0 HB2 GLN A 78 15.887 24.910 -7.130 1.00 0.00 H new ATOM 0 HB3 GLN A 78 16.768 23.624 -6.328 1.00 0.00 H new ATOM 0 HG2 GLN A 78 17.440 22.629 -8.340 1.00 0.00 H new ATOM 0 HG3 GLN A 78 16.009 23.153 -9.206 1.00 0.00 H new ATOM 0 HE21 GLN A 78 19.289 23.687 -9.079 1.00 0.00 H new ATOM 0 HE22 GLN A 78 19.333 25.370 -9.614 1.00 0.00 H new ATOM 1258 N LEU A 79 15.775 20.904 -6.335 1.00 0.00 N ATOM 1259 CA LEU A 79 16.089 19.463 -6.564 1.00 0.00 C ATOM 1260 C LEU A 79 14.826 18.623 -6.429 1.00 0.00 C ATOM 1261 O LEU A 79 14.622 17.703 -7.180 1.00 0.00 O ATOM 1262 CB LEU A 79 17.179 18.976 -5.594 1.00 0.00 C ATOM 1263 CG LEU A 79 16.683 19.015 -4.147 1.00 0.00 C ATOM 1264 CD1 LEU A 79 17.391 17.923 -3.340 1.00 0.00 C ATOM 1265 CD2 LEU A 79 16.998 20.379 -3.536 1.00 0.00 C ATOM 0 H LEU A 79 16.130 21.298 -5.464 1.00 0.00 H new ATOM 0 HA LEU A 79 16.474 19.350 -7.578 1.00 0.00 H new ATOM 0 HB2 LEU A 79 17.474 17.959 -5.854 1.00 0.00 H new ATOM 0 HB3 LEU A 79 18.066 19.601 -5.695 1.00 0.00 H new ATOM 0 HG LEU A 79 15.606 18.848 -4.127 1.00 0.00 H new ATOM 0 HD11 LEU A 79 17.040 17.948 -2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.170 16.948 -3.775 1.00 0.00 H new ATOM 0 HD13 LEU A 79 18.467 18.095 -3.361 1.00 0.00 H new ATOM 0 HD21 LEU A 79 16.644 20.406 -2.505 1.00 0.00 H new ATOM 0 HD22 LEU A 79 18.075 20.546 -3.555 1.00 0.00 H new ATOM 0 HD23 LEU A 79 16.500 21.159 -4.111 1.00 0.00 H new ATOM 1277 N ILE A 80 13.975 18.924 -5.492 1.00 0.00 N ATOM 1278 CA ILE A 80 12.723 18.125 -5.354 1.00 0.00 C ATOM 1279 C ILE A 80 11.803 18.435 -6.547 1.00 0.00 C ATOM 1280 O ILE A 80 11.030 17.600 -6.973 1.00 0.00 O ATOM 1281 CB ILE A 80 12.025 18.491 -4.043 1.00 0.00 C ATOM 1282 CG1 ILE A 80 12.848 17.944 -2.874 1.00 0.00 C ATOM 1283 CG2 ILE A 80 10.622 17.879 -4.013 1.00 0.00 C ATOM 1284 CD1 ILE A 80 12.018 17.995 -1.593 1.00 0.00 C ATOM 0 H ILE A 80 14.088 19.682 -4.819 1.00 0.00 H new ATOM 0 HA ILE A 80 12.957 17.061 -5.342 1.00 0.00 H new ATOM 0 HB ILE A 80 11.941 19.575 -3.963 1.00 0.00 H new ATOM 0 HG12 ILE A 80 13.154 16.918 -3.080 1.00 0.00 H new ATOM 0 HG13 ILE A 80 13.759 18.530 -2.752 1.00 0.00 H new ATOM 0 HG21 ILE A 80 10.130 18.143 -3.077 1.00 0.00 H new ATOM 0 HG22 ILE A 80 10.039 18.263 -4.850 1.00 0.00 H new ATOM 0 HG23 ILE A 80 10.696 16.794 -4.090 1.00 0.00 H new ATOM 0 HD11 ILE A 80 12.606 17.605 -0.762 1.00 0.00 H new ATOM 0 HD12 ILE A 80 11.734 19.027 -1.384 1.00 0.00 H new ATOM 0 HD13 ILE A 80 11.120 17.390 -1.717 1.00 0.00 H new ATOM 1296 N ARG A 81 11.887 19.621 -7.101 1.00 0.00 N ATOM 1297 CA ARG A 81 11.029 19.955 -8.274 1.00 0.00 C ATOM 1298 C ARG A 81 11.516 19.117 -9.443 1.00 0.00 C ATOM 1299 O ARG A 81 10.759 18.410 -10.077 1.00 0.00 O ATOM 1300 CB ARG A 81 11.169 21.438 -8.617 1.00 0.00 C ATOM 1301 CG ARG A 81 10.033 21.855 -9.553 1.00 0.00 C ATOM 1302 CD ARG A 81 10.079 23.368 -9.771 1.00 0.00 C ATOM 1303 NE ARG A 81 10.082 23.661 -11.232 1.00 0.00 N ATOM 1304 CZ ARG A 81 10.194 24.892 -11.650 1.00 0.00 C ATOM 1305 NH1 ARG A 81 9.431 25.823 -11.146 1.00 0.00 N ATOM 1306 NH2 ARG A 81 11.068 25.190 -12.572 1.00 0.00 N ATOM 0 H ARG A 81 12.510 20.367 -6.791 1.00 0.00 H new ATOM 0 HA ARG A 81 9.982 19.749 -8.054 1.00 0.00 H new ATOM 0 HB2 ARG A 81 11.143 22.037 -7.707 1.00 0.00 H new ATOM 0 HB3 ARG A 81 12.132 21.623 -9.092 1.00 0.00 H new ATOM 0 HG2 ARG A 81 10.126 21.337 -10.507 1.00 0.00 H new ATOM 0 HG3 ARG A 81 9.072 21.568 -9.126 1.00 0.00 H new ATOM 0 HD2 ARG A 81 9.219 23.841 -9.297 1.00 0.00 H new ATOM 0 HD3 ARG A 81 10.971 23.786 -9.304 1.00 0.00 H new ATOM 0 HE ARG A 81 9.997 22.899 -11.905 1.00 0.00 H new ATOM 0 HH11 ARG A 81 8.748 25.588 -10.426 1.00 0.00 H new ATOM 0 HH12 ARG A 81 9.518 26.786 -11.472 1.00 0.00 H new ATOM 0 HH21 ARG A 81 11.663 24.461 -12.965 1.00 0.00 H new ATOM 0 HH22 ARG A 81 11.156 26.152 -12.899 1.00 0.00 H new ATOM 1320 N PHE A 82 12.793 19.152 -9.698 1.00 0.00 N ATOM 1321 CA PHE A 82 13.356 18.327 -10.769 1.00 0.00 C ATOM 1322 C PHE A 82 13.117 16.875 -10.368 1.00 0.00 C ATOM 1323 O PHE A 82 12.943 16.006 -11.198 1.00 0.00 O ATOM 1324 CB PHE A 82 14.845 18.642 -10.883 1.00 0.00 C ATOM 1325 CG PHE A 82 15.049 19.755 -11.885 1.00 0.00 C ATOM 1326 CD1 PHE A 82 14.172 20.845 -11.907 1.00 0.00 C ATOM 1327 CD2 PHE A 82 16.114 19.693 -12.791 1.00 0.00 C ATOM 1328 CE1 PHE A 82 14.361 21.876 -12.835 1.00 0.00 C ATOM 1329 CE2 PHE A 82 16.303 20.723 -13.719 1.00 0.00 C ATOM 1330 CZ PHE A 82 15.426 21.815 -13.742 1.00 0.00 C ATOM 0 H PHE A 82 13.469 19.728 -9.197 1.00 0.00 H new ATOM 0 HA PHE A 82 12.898 18.519 -11.739 1.00 0.00 H new ATOM 0 HB2 PHE A 82 15.241 18.936 -9.911 1.00 0.00 H new ATOM 0 HB3 PHE A 82 15.393 17.753 -11.195 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.350 20.891 -11.208 1.00 0.00 H new ATOM 0 HD2 PHE A 82 16.790 18.851 -12.774 1.00 0.00 H new ATOM 0 HE1 PHE A 82 13.685 22.718 -12.851 1.00 0.00 H new ATOM 0 HE2 PHE A 82 17.125 20.676 -14.418 1.00 0.00 H new ATOM 0 HZ PHE A 82 15.571 22.610 -14.459 1.00 0.00 H new ATOM 1340 N LEU A 83 13.067 16.616 -9.081 1.00 0.00 N ATOM 1341 CA LEU A 83 12.794 15.241 -8.609 1.00 0.00 C ATOM 1342 C LEU A 83 11.392 14.851 -9.063 1.00 0.00 C ATOM 1343 O LEU A 83 11.110 13.715 -9.385 1.00 0.00 O ATOM 1344 CB LEU A 83 12.897 15.239 -7.084 1.00 0.00 C ATOM 1345 CG LEU A 83 14.362 15.044 -6.694 1.00 0.00 C ATOM 1346 CD1 LEU A 83 14.574 15.391 -5.218 1.00 0.00 C ATOM 1347 CD2 LEU A 83 14.754 13.587 -6.918 1.00 0.00 C ATOM 0 H LEU A 83 13.205 17.307 -8.344 1.00 0.00 H new ATOM 0 HA LEU A 83 13.507 14.523 -9.015 1.00 0.00 H new ATOM 0 HB2 LEU A 83 12.519 16.177 -6.678 1.00 0.00 H new ATOM 0 HB3 LEU A 83 12.284 14.441 -6.665 1.00 0.00 H new ATOM 0 HG LEU A 83 14.977 15.701 -7.308 1.00 0.00 H new ATOM 0 HD11 LEU A 83 15.622 15.247 -4.957 1.00 0.00 H new ATOM 0 HD12 LEU A 83 14.297 16.431 -5.045 1.00 0.00 H new ATOM 0 HD13 LEU A 83 13.954 14.743 -4.599 1.00 0.00 H new ATOM 0 HD21 LEU A 83 15.798 13.444 -6.641 1.00 0.00 H new ATOM 0 HD22 LEU A 83 14.125 12.942 -6.305 1.00 0.00 H new ATOM 0 HD23 LEU A 83 14.619 13.331 -7.969 1.00 0.00 H new ATOM 1359 N LYS A 84 10.525 15.814 -9.106 1.00 0.00 N ATOM 1360 CA LYS A 84 9.125 15.570 -9.559 1.00 0.00 C ATOM 1361 C LYS A 84 9.116 15.314 -11.062 1.00 0.00 C ATOM 1362 O LYS A 84 8.561 14.343 -11.526 1.00 0.00 O ATOM 1363 CB LYS A 84 8.272 16.804 -9.257 1.00 0.00 C ATOM 1364 CG LYS A 84 6.895 16.644 -9.905 1.00 0.00 C ATOM 1365 CD LYS A 84 6.862 17.418 -11.226 1.00 0.00 C ATOM 1366 CE LYS A 84 5.888 16.740 -12.190 1.00 0.00 C ATOM 1367 NZ LYS A 84 4.986 17.765 -12.787 1.00 0.00 N ATOM 0 H LYS A 84 10.725 16.779 -8.843 1.00 0.00 H new ATOM 0 HA LYS A 84 8.720 14.704 -9.036 1.00 0.00 H new ATOM 0 HB2 LYS A 84 8.166 16.931 -8.180 1.00 0.00 H new ATOM 0 HB3 LYS A 84 8.763 17.700 -9.637 1.00 0.00 H new ATOM 0 HG2 LYS A 84 6.685 15.589 -10.083 1.00 0.00 H new ATOM 0 HG3 LYS A 84 6.120 17.014 -9.234 1.00 0.00 H new ATOM 0 HD2 LYS A 84 6.556 18.449 -11.048 1.00 0.00 H new ATOM 0 HD3 LYS A 84 7.859 17.453 -11.664 1.00 0.00 H new ATOM 0 HE2 LYS A 84 6.438 16.222 -12.976 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.302 15.987 -11.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 4.478 17.352 -13.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.300 18.083 -12.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 5.549 18.577 -13.111 1.00 0.00 H new ATOM 1381 N ARG A 85 9.732 16.168 -11.836 1.00 0.00 N ATOM 1382 CA ARG A 85 9.742 15.933 -13.302 1.00 0.00 C ATOM 1383 C ARG A 85 10.233 14.516 -13.532 1.00 0.00 C ATOM 1384 O ARG A 85 9.826 13.829 -14.449 1.00 0.00 O ATOM 1385 CB ARG A 85 10.681 16.929 -13.983 1.00 0.00 C ATOM 1386 CG ARG A 85 10.658 16.699 -15.497 1.00 0.00 C ATOM 1387 CD ARG A 85 12.092 16.644 -16.027 1.00 0.00 C ATOM 1388 NE ARG A 85 12.361 17.851 -16.858 1.00 0.00 N ATOM 1389 CZ ARG A 85 13.535 18.421 -16.821 1.00 0.00 C ATOM 1390 NH1 ARG A 85 14.052 18.776 -15.678 1.00 0.00 N ATOM 1391 NH2 ARG A 85 14.192 18.634 -17.929 1.00 0.00 N ATOM 0 H ARG A 85 10.221 17.005 -11.519 1.00 0.00 H new ATOM 0 HA ARG A 85 8.744 16.066 -13.720 1.00 0.00 H new ATOM 0 HB2 ARG A 85 10.374 17.950 -13.755 1.00 0.00 H new ATOM 0 HB3 ARG A 85 11.695 16.809 -13.601 1.00 0.00 H new ATOM 0 HG2 ARG A 85 10.138 15.769 -15.726 1.00 0.00 H new ATOM 0 HG3 ARG A 85 10.108 17.501 -15.989 1.00 0.00 H new ATOM 0 HD2 ARG A 85 12.796 16.597 -15.197 1.00 0.00 H new ATOM 0 HD3 ARG A 85 12.237 15.741 -16.620 1.00 0.00 H new ATOM 0 HE ARG A 85 11.628 18.232 -17.456 1.00 0.00 H new ATOM 0 HH11 ARG A 85 13.539 18.608 -14.812 1.00 0.00 H new ATOM 0 HH12 ARG A 85 14.969 19.221 -15.649 1.00 0.00 H new ATOM 0 HH21 ARG A 85 13.788 18.355 -18.823 1.00 0.00 H new ATOM 0 HH22 ARG A 85 15.109 19.079 -17.900 1.00 0.00 H new ATOM 1405 N LEU A 86 11.106 14.084 -12.684 1.00 0.00 N ATOM 1406 CA LEU A 86 11.659 12.712 -12.790 1.00 0.00 C ATOM 1407 C LEU A 86 10.592 11.675 -12.422 1.00 0.00 C ATOM 1408 O LEU A 86 10.464 10.668 -13.077 1.00 0.00 O ATOM 1409 CB LEU A 86 12.851 12.570 -11.842 1.00 0.00 C ATOM 1410 CG LEU A 86 13.295 11.107 -11.790 1.00 0.00 C ATOM 1411 CD1 LEU A 86 13.410 10.556 -13.213 1.00 0.00 C ATOM 1412 CD2 LEU A 86 14.656 11.010 -11.097 1.00 0.00 C ATOM 0 H LEU A 86 11.470 14.632 -11.904 1.00 0.00 H new ATOM 0 HA LEU A 86 11.979 12.540 -13.818 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.675 13.199 -12.181 1.00 0.00 H new ATOM 0 HB3 LEU A 86 12.578 12.913 -10.844 1.00 0.00 H new ATOM 0 HG LEU A 86 12.560 10.526 -11.233 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.726 9.514 -13.175 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.442 10.623 -13.709 1.00 0.00 H new ATOM 0 HD13 LEU A 86 14.144 11.138 -13.770 1.00 0.00 H new ATOM 0 HD21 LEU A 86 14.972 9.967 -11.060 1.00 0.00 H new ATOM 0 HD22 LEU A 86 15.390 11.592 -11.654 1.00 0.00 H new ATOM 0 HD23 LEU A 86 14.577 11.401 -10.083 1.00 0.00 H new ATOM 1424 N ASP A 87 9.841 11.893 -11.366 1.00 0.00 N ATOM 1425 CA ASP A 87 8.812 10.889 -10.950 1.00 0.00 C ATOM 1426 C ASP A 87 7.672 10.787 -11.977 1.00 0.00 C ATOM 1427 O ASP A 87 7.305 9.705 -12.391 1.00 0.00 O ATOM 1428 CB ASP A 87 8.244 11.307 -9.587 1.00 0.00 C ATOM 1429 CG ASP A 87 7.382 10.174 -9.025 1.00 0.00 C ATOM 1430 OD1 ASP A 87 7.533 9.055 -9.489 1.00 0.00 O ATOM 1431 OD2 ASP A 87 6.588 10.445 -8.139 1.00 0.00 O ATOM 0 H ASP A 87 9.898 12.723 -10.776 1.00 0.00 H new ATOM 0 HA ASP A 87 9.286 9.909 -10.886 1.00 0.00 H new ATOM 0 HB2 ASP A 87 9.056 11.537 -8.897 1.00 0.00 H new ATOM 0 HB3 ASP A 87 7.649 12.214 -9.692 1.00 0.00 H new ATOM 1436 N ARG A 88 7.096 11.887 -12.383 1.00 0.00 N ATOM 1437 CA ARG A 88 5.972 11.824 -13.364 1.00 0.00 C ATOM 1438 C ARG A 88 6.449 11.173 -14.667 1.00 0.00 C ATOM 1439 O ARG A 88 5.825 10.272 -15.190 1.00 0.00 O ATOM 1440 CB ARG A 88 5.480 13.242 -13.659 1.00 0.00 C ATOM 1441 CG ARG A 88 4.555 13.706 -12.532 1.00 0.00 C ATOM 1442 CD ARG A 88 3.583 14.760 -13.068 1.00 0.00 C ATOM 1443 NE ARG A 88 2.193 14.226 -13.014 1.00 0.00 N ATOM 1444 CZ ARG A 88 1.483 14.141 -14.106 1.00 0.00 C ATOM 1445 NH1 ARG A 88 1.328 15.192 -14.864 1.00 0.00 N ATOM 1446 NH2 ARG A 88 0.928 13.008 -14.437 1.00 0.00 N ATOM 0 H ARG A 88 7.354 12.826 -12.079 1.00 0.00 H new ATOM 0 HA ARG A 88 5.161 11.229 -12.942 1.00 0.00 H new ATOM 0 HB2 ARG A 88 6.328 13.921 -13.751 1.00 0.00 H new ATOM 0 HB3 ARG A 88 4.950 13.264 -14.611 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.002 12.858 -12.129 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.142 14.121 -11.713 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.657 15.673 -12.476 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.844 15.023 -14.093 1.00 0.00 H new ATOM 0 HE ARG A 88 1.796 13.927 -12.123 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.761 16.078 -14.603 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.774 15.128 -15.718 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.049 12.188 -13.842 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.373 12.942 -15.290 1.00 0.00 H new ATOM 1460 N ASN A 89 7.546 11.635 -15.194 1.00 0.00 N ATOM 1461 CA ASN A 89 8.079 11.070 -16.467 1.00 0.00 C ATOM 1462 C ASN A 89 8.549 9.628 -16.254 1.00 0.00 C ATOM 1463 O ASN A 89 8.548 8.828 -17.167 1.00 0.00 O ATOM 1464 CB ASN A 89 9.245 11.931 -16.956 1.00 0.00 C ATOM 1465 CG ASN A 89 8.700 13.213 -17.589 1.00 0.00 C ATOM 1466 OD1 ASN A 89 7.772 13.809 -17.079 1.00 0.00 O ATOM 1467 ND2 ASN A 89 9.241 13.665 -18.687 1.00 0.00 N ATOM 0 H ASN A 89 8.104 12.389 -14.794 1.00 0.00 H new ATOM 0 HA ASN A 89 7.287 11.070 -17.216 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.905 12.175 -16.124 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.840 11.378 -17.683 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.885 14.519 -19.117 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.020 13.165 -19.115 1.00 0.00 H new ATOM 1474 N LEU A 90 8.969 9.287 -15.066 1.00 0.00 N ATOM 1475 CA LEU A 90 9.445 7.916 -14.805 1.00 0.00 C ATOM 1476 C LEU A 90 8.392 6.895 -15.244 1.00 0.00 C ATOM 1477 O LEU A 90 8.711 5.784 -15.610 1.00 0.00 O ATOM 1478 CB LEU A 90 9.672 7.796 -13.316 1.00 0.00 C ATOM 1479 CG LEU A 90 10.806 6.823 -13.048 1.00 0.00 C ATOM 1480 CD1 LEU A 90 11.746 7.444 -12.022 1.00 0.00 C ATOM 1481 CD2 LEU A 90 10.238 5.518 -12.505 1.00 0.00 C ATOM 0 H LEU A 90 9.000 9.913 -14.262 1.00 0.00 H new ATOM 0 HA LEU A 90 10.362 7.720 -15.361 1.00 0.00 H new ATOM 0 HB2 LEU A 90 9.911 8.773 -12.895 1.00 0.00 H new ATOM 0 HB3 LEU A 90 8.761 7.452 -12.826 1.00 0.00 H new ATOM 0 HG LEU A 90 11.349 6.616 -13.970 1.00 0.00 H new ATOM 0 HD11 LEU A 90 12.567 6.757 -11.818 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.145 8.380 -12.413 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.199 7.640 -11.100 1.00 0.00 H new ATOM 0 HD21 LEU A 90 11.052 4.819 -12.312 1.00 0.00 H new ATOM 0 HD22 LEU A 90 9.700 5.713 -11.577 1.00 0.00 H new ATOM 0 HD23 LEU A 90 9.555 5.086 -13.236 1.00 0.00 H new ATOM 1493 N TRP A 91 7.140 7.255 -15.191 1.00 0.00 N ATOM 1494 CA TRP A 91 6.069 6.306 -15.585 1.00 0.00 C ATOM 1495 C TRP A 91 6.153 6.012 -17.090 1.00 0.00 C ATOM 1496 O TRP A 91 5.879 4.913 -17.526 1.00 0.00 O ATOM 1497 CB TRP A 91 4.715 6.934 -15.243 1.00 0.00 C ATOM 1498 CG TRP A 91 4.577 7.048 -13.765 1.00 0.00 C ATOM 1499 CD1 TRP A 91 4.375 8.204 -13.110 1.00 0.00 C ATOM 1500 CD2 TRP A 91 4.620 6.001 -12.756 1.00 0.00 C ATOM 1501 NE1 TRP A 91 4.292 7.943 -11.755 1.00 0.00 N ATOM 1502 CE2 TRP A 91 4.436 6.596 -11.485 1.00 0.00 C ATOM 1503 CE3 TRP A 91 4.798 4.606 -12.816 1.00 0.00 C ATOM 1504 CZ2 TRP A 91 4.431 5.835 -10.314 1.00 0.00 C ATOM 1505 CZ3 TRP A 91 4.792 3.838 -11.640 1.00 0.00 C ATOM 1506 CH2 TRP A 91 4.609 4.451 -10.392 1.00 0.00 C ATOM 0 H TRP A 91 6.813 8.173 -14.889 1.00 0.00 H new ATOM 0 HA TRP A 91 6.187 5.366 -15.047 1.00 0.00 H new ATOM 0 HB2 TRP A 91 4.633 7.919 -15.703 1.00 0.00 H new ATOM 0 HB3 TRP A 91 3.907 6.324 -15.648 1.00 0.00 H new ATOM 0 HD1 TRP A 91 4.291 9.179 -13.568 1.00 0.00 H new ATOM 0 HE1 TRP A 91 4.143 8.657 -11.042 1.00 0.00 H new ATOM 0 HE3 TRP A 91 4.940 4.123 -13.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 4.291 6.312 -9.355 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 4.929 2.768 -11.697 1.00 0.00 H new ATOM 0 HH2 TRP A 91 4.606 3.854 -9.492 1.00 0.00 H new ATOM 1517 N GLY A 92 6.531 6.976 -17.889 1.00 0.00 N ATOM 1518 CA GLY A 92 6.630 6.732 -19.357 1.00 0.00 C ATOM 1519 C GLY A 92 7.823 5.821 -19.653 1.00 0.00 C ATOM 1520 O GLY A 92 7.712 4.840 -20.364 1.00 0.00 O ATOM 0 H GLY A 92 6.775 7.920 -17.588 1.00 0.00 H new ATOM 0 HA2 GLY A 92 5.711 6.273 -19.721 1.00 0.00 H new ATOM 0 HA3 GLY A 92 6.744 7.679 -19.885 1.00 0.00 H new ATOM 1524 N LEU A 93 8.967 6.152 -19.124 1.00 0.00 N ATOM 1525 CA LEU A 93 10.188 5.335 -19.375 1.00 0.00 C ATOM 1526 C LEU A 93 9.986 3.913 -18.827 1.00 0.00 C ATOM 1527 O LEU A 93 10.390 2.943 -19.437 1.00 0.00 O ATOM 1528 CB LEU A 93 11.379 6.029 -18.679 1.00 0.00 C ATOM 1529 CG LEU A 93 12.734 5.555 -19.235 1.00 0.00 C ATOM 1530 CD1 LEU A 93 13.807 5.790 -18.176 1.00 0.00 C ATOM 1531 CD2 LEU A 93 12.680 4.065 -19.573 1.00 0.00 C ATOM 0 H LEU A 93 9.110 6.963 -18.522 1.00 0.00 H new ATOM 0 HA LEU A 93 10.385 5.255 -20.444 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.293 7.108 -18.806 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.338 5.830 -17.608 1.00 0.00 H new ATOM 0 HG LEU A 93 12.965 6.113 -20.143 1.00 0.00 H new ATOM 0 HD11 LEU A 93 14.773 5.458 -18.557 1.00 0.00 H new ATOM 0 HD12 LEU A 93 13.856 6.852 -17.938 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.559 5.227 -17.276 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.646 3.746 -19.965 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.447 3.496 -18.673 1.00 0.00 H new ATOM 0 HD23 LEU A 93 11.908 3.890 -20.323 1.00 0.00 H new ATOM 1543 N ALA A 94 9.358 3.773 -17.691 1.00 0.00 N ATOM 1544 CA ALA A 94 9.134 2.411 -17.126 1.00 0.00 C ATOM 1545 C ALA A 94 8.112 1.666 -17.990 1.00 0.00 C ATOM 1546 O ALA A 94 8.415 0.655 -18.592 1.00 0.00 O ATOM 1547 CB ALA A 94 8.601 2.532 -15.697 1.00 0.00 C ATOM 0 H ALA A 94 8.991 4.542 -17.130 1.00 0.00 H new ATOM 0 HA ALA A 94 10.075 1.861 -17.116 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.437 1.537 -15.284 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.326 3.065 -15.082 1.00 0.00 H new ATOM 0 HB3 ALA A 94 7.659 3.081 -15.705 1.00 0.00 H new ATOM 1553 N GLY A 95 6.908 2.163 -18.061 1.00 0.00 N ATOM 1554 CA GLY A 95 5.872 1.488 -18.893 1.00 0.00 C ATOM 1555 C GLY A 95 4.843 0.789 -17.995 1.00 0.00 C ATOM 1556 O GLY A 95 3.770 0.432 -18.438 1.00 0.00 O ATOM 0 H GLY A 95 6.597 3.007 -17.579 1.00 0.00 H new ATOM 0 HA2 GLY A 95 5.373 2.219 -19.529 1.00 0.00 H new ATOM 0 HA3 GLY A 95 6.343 0.760 -19.553 1.00 0.00 H new ATOM 1560 N LEU A 96 5.153 0.585 -16.741 1.00 0.00 N ATOM 1561 CA LEU A 96 4.187 -0.092 -15.841 1.00 0.00 C ATOM 1562 C LEU A 96 3.744 0.876 -14.741 1.00 0.00 C ATOM 1563 O LEU A 96 4.355 1.902 -14.517 1.00 0.00 O ATOM 1564 CB LEU A 96 4.866 -1.296 -15.199 1.00 0.00 C ATOM 1565 CG LEU A 96 3.838 -2.407 -14.971 1.00 0.00 C ATOM 1566 CD1 LEU A 96 3.665 -3.214 -16.259 1.00 0.00 C ATOM 1567 CD2 LEU A 96 4.326 -3.330 -13.851 1.00 0.00 C ATOM 0 H LEU A 96 6.034 0.860 -16.306 1.00 0.00 H new ATOM 0 HA LEU A 96 3.318 -0.414 -16.415 1.00 0.00 H new ATOM 0 HB2 LEU A 96 5.670 -1.657 -15.840 1.00 0.00 H new ATOM 0 HB3 LEU A 96 5.320 -1.007 -14.251 1.00 0.00 H new ATOM 0 HG LEU A 96 2.882 -1.966 -14.688 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.933 -4.005 -16.097 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.318 -2.557 -17.056 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.620 -3.656 -16.543 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.595 -4.122 -13.687 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.282 -3.771 -14.134 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.449 -2.755 -12.933 1.00 0.00 H new ATOM 1579 N ASN A 97 2.683 0.552 -14.054 1.00 0.00 N ATOM 1580 CA ASN A 97 2.190 1.443 -12.965 1.00 0.00 C ATOM 1581 C ASN A 97 1.590 0.584 -11.847 1.00 0.00 C ATOM 1582 O ASN A 97 0.568 0.913 -11.280 1.00 0.00 O ATOM 1583 CB ASN A 97 1.116 2.376 -13.524 1.00 0.00 C ATOM 1584 CG ASN A 97 1.293 3.773 -12.925 1.00 0.00 C ATOM 1585 OD1 ASN A 97 0.804 4.051 -11.849 1.00 0.00 O ATOM 1586 ND2 ASN A 97 1.975 4.669 -13.583 1.00 0.00 N ATOM 0 H ASN A 97 2.134 -0.295 -14.201 1.00 0.00 H new ATOM 0 HA ASN A 97 3.015 2.035 -12.569 1.00 0.00 H new ATOM 0 HB2 ASN A 97 1.189 2.422 -14.611 1.00 0.00 H new ATOM 0 HB3 ASN A 97 0.125 1.990 -13.287 1.00 0.00 H new ATOM 0 HD21 ASN A 97 2.098 5.604 -13.194 1.00 0.00 H new ATOM 0 HD22 ASN A 97 2.386 4.435 -14.487 1.00 0.00 H new ATOM 1593 N SER A 98 2.219 -0.514 -11.535 1.00 0.00 N ATOM 1594 CA SER A 98 1.693 -1.403 -10.460 1.00 0.00 C ATOM 1595 C SER A 98 2.829 -2.314 -9.966 1.00 0.00 C ATOM 1596 O SER A 98 3.107 -3.335 -10.563 1.00 0.00 O ATOM 1597 CB SER A 98 0.567 -2.269 -11.029 1.00 0.00 C ATOM 1598 OG SER A 98 -0.150 -2.875 -9.963 1.00 0.00 O ATOM 0 H SER A 98 3.079 -0.836 -11.980 1.00 0.00 H new ATOM 0 HA SER A 98 1.312 -0.802 -9.634 1.00 0.00 H new ATOM 0 HB2 SER A 98 -0.105 -1.659 -11.633 1.00 0.00 H new ATOM 0 HB3 SER A 98 0.979 -3.035 -11.686 1.00 0.00 H new ATOM 0 HG SER A 98 -0.872 -3.428 -10.327 1.00 0.00 H new ATOM 1604 N CYS A 99 3.501 -1.962 -8.896 1.00 0.00 N ATOM 1605 CA CYS A 99 4.602 -2.805 -8.407 1.00 0.00 C ATOM 1606 C CYS A 99 4.145 -3.505 -7.120 1.00 0.00 C ATOM 1607 O CYS A 99 3.032 -3.315 -6.673 1.00 0.00 O ATOM 1608 CB CYS A 99 5.842 -1.929 -8.114 1.00 0.00 C ATOM 1609 SG CYS A 99 5.548 -0.178 -8.503 1.00 0.00 S ATOM 0 H CYS A 99 3.323 -1.121 -8.348 1.00 0.00 H new ATOM 0 HA CYS A 99 4.867 -3.546 -9.161 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.114 -2.026 -7.063 1.00 0.00 H new ATOM 0 HB3 CYS A 99 6.688 -2.292 -8.697 1.00 0.00 H new ATOM 1614 N PRO A 100 5.027 -4.285 -6.564 1.00 0.00 N ATOM 1615 CA PRO A 100 4.783 -5.051 -5.302 1.00 0.00 C ATOM 1616 C PRO A 100 4.869 -4.117 -4.089 1.00 0.00 C ATOM 1617 O PRO A 100 4.709 -2.919 -4.205 1.00 0.00 O ATOM 1618 CB PRO A 100 5.916 -6.069 -5.292 1.00 0.00 C ATOM 1619 CG PRO A 100 7.035 -5.491 -6.149 1.00 0.00 C ATOM 1620 CD PRO A 100 6.392 -4.502 -7.122 1.00 0.00 C ATOM 0 HA PRO A 100 3.797 -5.514 -5.255 1.00 0.00 H new ATOM 0 HB2 PRO A 100 6.263 -6.251 -4.275 1.00 0.00 H new ATOM 0 HB3 PRO A 100 5.579 -7.026 -5.690 1.00 0.00 H new ATOM 0 HG2 PRO A 100 7.778 -4.991 -5.527 1.00 0.00 H new ATOM 0 HG3 PRO A 100 7.553 -6.282 -6.691 1.00 0.00 H new ATOM 0 HD2 PRO A 100 6.955 -3.570 -7.174 1.00 0.00 H new ATOM 0 HD3 PRO A 100 6.350 -4.906 -8.133 1.00 0.00 H new ATOM 1628 N VAL A 101 5.121 -4.656 -2.926 1.00 0.00 N ATOM 1629 CA VAL A 101 5.218 -3.796 -1.713 1.00 0.00 C ATOM 1630 C VAL A 101 5.696 -4.639 -0.531 1.00 0.00 C ATOM 1631 O VAL A 101 4.908 -5.184 0.215 1.00 0.00 O ATOM 1632 CB VAL A 101 3.845 -3.202 -1.396 1.00 0.00 C ATOM 1633 CG1 VAL A 101 2.836 -4.334 -1.190 1.00 0.00 C ATOM 1634 CG2 VAL A 101 3.935 -2.359 -0.123 1.00 0.00 C ATOM 0 H VAL A 101 5.264 -5.653 -2.765 1.00 0.00 H new ATOM 0 HA VAL A 101 5.927 -2.989 -1.895 1.00 0.00 H new ATOM 0 HB VAL A 101 3.521 -2.573 -2.225 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.857 -3.912 -0.964 1.00 0.00 H new ATOM 0 HG12 VAL A 101 2.772 -4.934 -2.098 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.160 -4.964 -0.361 1.00 0.00 H new ATOM 0 HG21 VAL A 101 2.956 -1.936 0.103 1.00 0.00 H new ATOM 0 HG22 VAL A 101 4.259 -2.987 0.707 1.00 0.00 H new ATOM 0 HG23 VAL A 101 4.654 -1.553 -0.270 1.00 0.00 H new ATOM 1644 N LYS A 102 6.984 -4.750 -0.351 1.00 0.00 N ATOM 1645 CA LYS A 102 7.512 -5.557 0.783 1.00 0.00 C ATOM 1646 C LYS A 102 8.949 -5.136 1.073 1.00 0.00 C ATOM 1647 O LYS A 102 9.891 -5.854 0.801 1.00 0.00 O ATOM 1648 CB LYS A 102 7.472 -7.043 0.422 1.00 0.00 C ATOM 1649 CG LYS A 102 7.931 -7.873 1.624 1.00 0.00 C ATOM 1650 CD LYS A 102 7.585 -9.344 1.391 1.00 0.00 C ATOM 1651 CE LYS A 102 7.194 -9.993 2.720 1.00 0.00 C ATOM 1652 NZ LYS A 102 7.734 -11.381 2.773 1.00 0.00 N ATOM 0 H LYS A 102 7.693 -4.316 -0.942 1.00 0.00 H new ATOM 0 HA LYS A 102 6.897 -5.389 1.667 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.461 -7.331 0.133 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.117 -7.237 -0.435 1.00 0.00 H new ATOM 0 HG2 LYS A 102 9.005 -7.760 1.768 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.448 -7.514 2.533 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.765 -9.427 0.678 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.438 -9.865 0.957 1.00 0.00 H new ATOM 0 HE2 LYS A 102 7.585 -9.407 3.552 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.109 -10.009 2.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 7.468 -11.823 3.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.340 -11.937 1.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.771 -11.354 2.693 1.00 0.00 H new ATOM 1666 N GLU A 103 9.119 -3.970 1.626 1.00 0.00 N ATOM 1667 CA GLU A 103 10.491 -3.484 1.943 1.00 0.00 C ATOM 1668 C GLU A 103 10.411 -2.386 3.006 1.00 0.00 C ATOM 1669 O GLU A 103 9.796 -1.357 2.804 1.00 0.00 O ATOM 1670 CB GLU A 103 11.138 -2.918 0.676 1.00 0.00 C ATOM 1671 CG GLU A 103 12.614 -2.618 0.948 1.00 0.00 C ATOM 1672 CD GLU A 103 13.276 -3.842 1.583 1.00 0.00 C ATOM 1673 OE1 GLU A 103 13.577 -4.774 0.853 1.00 0.00 O ATOM 1674 OE2 GLU A 103 13.473 -3.827 2.786 1.00 0.00 O ATOM 0 H GLU A 103 8.365 -3.329 1.874 1.00 0.00 H new ATOM 0 HA GLU A 103 11.091 -4.313 2.319 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.046 -3.632 -0.143 1.00 0.00 H new ATOM 0 HB3 GLU A 103 10.622 -2.009 0.366 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.121 -2.359 0.018 1.00 0.00 H new ATOM 0 HG3 GLU A 103 12.705 -1.758 1.611 1.00 0.00 H new ATOM 1681 N ALA A 104 11.027 -2.596 4.137 1.00 0.00 N ATOM 1682 CA ALA A 104 10.986 -1.563 5.209 1.00 0.00 C ATOM 1683 C ALA A 104 12.399 -1.030 5.463 1.00 0.00 C ATOM 1684 O ALA A 104 12.616 -0.214 6.337 1.00 0.00 O ATOM 1685 CB ALA A 104 10.439 -2.186 6.496 1.00 0.00 C ATOM 0 H ALA A 104 11.556 -3.438 4.364 1.00 0.00 H new ATOM 0 HA ALA A 104 10.340 -0.743 4.896 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.409 -1.431 7.281 1.00 0.00 H new ATOM 0 HB2 ALA A 104 9.433 -2.565 6.318 1.00 0.00 H new ATOM 0 HB3 ALA A 104 11.086 -3.007 6.807 1.00 0.00 H new ATOM 1691 N ASN A 105 13.362 -1.484 4.706 1.00 0.00 N ATOM 1692 CA ASN A 105 14.756 -0.998 4.908 1.00 0.00 C ATOM 1693 C ASN A 105 14.859 0.458 4.453 1.00 0.00 C ATOM 1694 O ASN A 105 14.160 0.889 3.558 1.00 0.00 O ATOM 1695 CB ASN A 105 15.719 -1.859 4.087 1.00 0.00 C ATOM 1696 CG ASN A 105 17.159 -1.433 4.378 1.00 0.00 C ATOM 1697 OD1 ASN A 105 17.707 -0.593 3.693 1.00 0.00 O ATOM 1698 ND2 ASN A 105 17.800 -1.981 5.375 1.00 0.00 N ATOM 0 H ASN A 105 13.243 -2.168 3.959 1.00 0.00 H new ATOM 0 HA ASN A 105 15.016 -1.067 5.964 1.00 0.00 H new ATOM 0 HB2 ASN A 105 15.583 -2.912 4.334 1.00 0.00 H new ATOM 0 HB3 ASN A 105 15.504 -1.751 3.024 1.00 0.00 H new ATOM 0 HD21 ASN A 105 18.760 -1.704 5.578 1.00 0.00 H new ATOM 0 HD22 ASN A 105 17.340 -2.686 5.951 1.00 0.00 H new ATOM 1705 N GLN A 106 15.725 1.221 5.061 1.00 0.00 N ATOM 1706 CA GLN A 106 15.871 2.648 4.662 1.00 0.00 C ATOM 1707 C GLN A 106 17.137 2.818 3.822 1.00 0.00 C ATOM 1708 O GLN A 106 18.072 2.048 3.928 1.00 0.00 O ATOM 1709 CB GLN A 106 15.968 3.521 5.915 1.00 0.00 C ATOM 1710 CG GLN A 106 17.253 3.185 6.673 1.00 0.00 C ATOM 1711 CD GLN A 106 16.954 3.097 8.171 1.00 0.00 C ATOM 1712 OE1 GLN A 106 16.521 2.071 8.656 1.00 0.00 O ATOM 1713 NE2 GLN A 106 17.169 4.136 8.929 1.00 0.00 N ATOM 0 H GLN A 106 16.338 0.917 5.817 1.00 0.00 H new ATOM 0 HA GLN A 106 15.004 2.950 4.075 1.00 0.00 H new ATOM 0 HB2 GLN A 106 15.962 4.575 5.638 1.00 0.00 H new ATOM 0 HB3 GLN A 106 15.102 3.355 6.555 1.00 0.00 H new ATOM 0 HG2 GLN A 106 17.661 2.239 6.317 1.00 0.00 H new ATOM 0 HG3 GLN A 106 18.008 3.949 6.486 1.00 0.00 H new ATOM 0 HE21 GLN A 106 17.533 4.998 8.522 1.00 0.00 H new ATOM 0 HE22 GLN A 106 16.974 4.087 9.929 1.00 0.00 H new ATOM 1722 N SER A 107 17.176 3.821 2.987 1.00 0.00 N ATOM 1723 CA SER A 107 18.382 4.040 2.141 1.00 0.00 C ATOM 1724 C SER A 107 18.789 5.513 2.206 1.00 0.00 C ATOM 1725 O SER A 107 18.215 6.289 2.942 1.00 0.00 O ATOM 1726 CB SER A 107 18.061 3.661 0.693 1.00 0.00 C ATOM 1727 OG SER A 107 19.184 3.011 0.113 1.00 0.00 O ATOM 0 H SER A 107 16.424 4.498 2.855 1.00 0.00 H new ATOM 0 HA SER A 107 19.202 3.421 2.506 1.00 0.00 H new ATOM 0 HB2 SER A 107 17.191 3.005 0.662 1.00 0.00 H new ATOM 0 HB3 SER A 107 17.808 4.553 0.120 1.00 0.00 H new ATOM 0 HG SER A 107 18.978 2.767 -0.813 1.00 0.00 H new ATOM 1733 N THR A 108 19.774 5.903 1.446 1.00 0.00 N ATOM 1734 CA THR A 108 20.216 7.328 1.470 1.00 0.00 C ATOM 1735 C THR A 108 19.936 7.976 0.109 1.00 0.00 C ATOM 1736 O THR A 108 20.037 7.345 -0.920 1.00 0.00 O ATOM 1737 CB THR A 108 21.717 7.389 1.766 1.00 0.00 C ATOM 1738 OG1 THR A 108 22.400 6.455 0.942 1.00 0.00 O ATOM 1739 CG2 THR A 108 21.962 7.050 3.237 1.00 0.00 C ATOM 0 H THR A 108 20.293 5.298 0.809 1.00 0.00 H new ATOM 0 HA THR A 108 19.669 7.865 2.245 1.00 0.00 H new ATOM 0 HB THR A 108 22.088 8.393 1.560 1.00 0.00 H new ATOM 0 HG1 THR A 108 23.361 6.495 1.130 1.00 0.00 H new ATOM 0 HG21 THR A 108 23.031 7.094 3.447 1.00 0.00 H new ATOM 0 HG22 THR A 108 21.438 7.768 3.868 1.00 0.00 H new ATOM 0 HG23 THR A 108 21.592 6.046 3.446 1.00 0.00 H new ATOM 1747 N LEU A 109 19.582 9.233 0.108 1.00 0.00 N ATOM 1748 CA LEU A 109 19.287 9.940 -1.180 1.00 0.00 C ATOM 1749 C LEU A 109 20.472 9.824 -2.130 1.00 0.00 C ATOM 1750 O LEU A 109 20.312 9.490 -3.280 1.00 0.00 O ATOM 1751 CB LEU A 109 19.028 11.424 -0.901 1.00 0.00 C ATOM 1752 CG LEU A 109 18.254 12.064 -2.061 1.00 0.00 C ATOM 1753 CD1 LEU A 109 18.882 11.704 -3.409 1.00 0.00 C ATOM 1754 CD2 LEU A 109 16.817 11.567 -2.036 1.00 0.00 C ATOM 0 H LEU A 109 19.483 9.806 0.946 1.00 0.00 H new ATOM 0 HA LEU A 109 18.409 9.482 -1.635 1.00 0.00 H new ATOM 0 HB2 LEU A 109 18.462 11.532 0.024 1.00 0.00 H new ATOM 0 HB3 LEU A 109 19.975 11.944 -0.758 1.00 0.00 H new ATOM 0 HG LEU A 109 18.287 13.147 -1.941 1.00 0.00 H new ATOM 0 HD11 LEU A 109 18.312 12.171 -4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 109 19.911 12.062 -3.438 1.00 0.00 H new ATOM 0 HD13 LEU A 109 18.870 10.622 -3.538 1.00 0.00 H new ATOM 0 HD21 LEU A 109 16.262 12.018 -2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 109 16.805 10.482 -2.142 1.00 0.00 H new ATOM 0 HD23 LEU A 109 16.353 11.844 -1.089 1.00 0.00 H new ATOM 1766 N GLU A 110 21.657 10.111 -1.680 1.00 0.00 N ATOM 1767 CA GLU A 110 22.820 10.020 -2.602 1.00 0.00 C ATOM 1768 C GLU A 110 22.766 8.676 -3.323 1.00 0.00 C ATOM 1769 O GLU A 110 22.935 8.591 -4.523 1.00 0.00 O ATOM 1770 CB GLU A 110 24.120 10.125 -1.804 1.00 0.00 C ATOM 1771 CG GLU A 110 25.309 9.839 -2.722 1.00 0.00 C ATOM 1772 CD GLU A 110 26.572 10.478 -2.141 1.00 0.00 C ATOM 1773 OE1 GLU A 110 26.482 11.046 -1.064 1.00 0.00 O ATOM 1774 OE2 GLU A 110 27.606 10.389 -2.781 1.00 0.00 O ATOM 0 H GLU A 110 21.871 10.401 -0.726 1.00 0.00 H new ATOM 0 HA GLU A 110 22.785 10.833 -3.327 1.00 0.00 H new ATOM 0 HB2 GLU A 110 24.213 11.121 -1.371 1.00 0.00 H new ATOM 0 HB3 GLU A 110 24.108 9.417 -0.976 1.00 0.00 H new ATOM 0 HG2 GLU A 110 25.449 8.763 -2.828 1.00 0.00 H new ATOM 0 HG3 GLU A 110 25.115 10.235 -3.719 1.00 0.00 H new ATOM 1781 N ASN A 111 22.531 7.623 -2.595 1.00 0.00 N ATOM 1782 CA ASN A 111 22.460 6.277 -3.222 1.00 0.00 C ATOM 1783 C ASN A 111 21.189 6.133 -4.065 1.00 0.00 C ATOM 1784 O ASN A 111 21.165 5.382 -5.000 1.00 0.00 O ATOM 1785 CB ASN A 111 22.488 5.198 -2.141 1.00 0.00 C ATOM 1786 CG ASN A 111 22.444 3.816 -2.797 1.00 0.00 C ATOM 1787 OD1 ASN A 111 23.472 3.212 -3.035 1.00 0.00 O ATOM 1788 ND2 ASN A 111 21.291 3.287 -3.103 1.00 0.00 N ATOM 0 H ASN A 111 22.384 7.637 -1.586 1.00 0.00 H new ATOM 0 HA ASN A 111 23.323 6.158 -3.877 1.00 0.00 H new ATOM 0 HB2 ASN A 111 23.390 5.297 -1.537 1.00 0.00 H new ATOM 0 HB3 ASN A 111 21.639 5.320 -1.468 1.00 0.00 H new ATOM 0 HD21 ASN A 111 21.252 2.367 -3.542 1.00 0.00 H new ATOM 0 HD22 ASN A 111 20.428 3.794 -2.903 1.00 0.00 H new ATOM 1795 N PHE A 112 20.124 6.812 -3.749 1.00 0.00 N ATOM 1796 CA PHE A 112 18.900 6.644 -4.590 1.00 0.00 C ATOM 1797 C PHE A 112 19.155 7.288 -5.949 1.00 0.00 C ATOM 1798 O PHE A 112 18.759 6.776 -6.968 1.00 0.00 O ATOM 1799 CB PHE A 112 17.704 7.315 -3.903 1.00 0.00 C ATOM 1800 CG PHE A 112 16.444 7.065 -4.705 1.00 0.00 C ATOM 1801 CD1 PHE A 112 15.751 5.854 -4.568 1.00 0.00 C ATOM 1802 CD2 PHE A 112 15.966 8.043 -5.589 1.00 0.00 C ATOM 1803 CE1 PHE A 112 14.588 5.622 -5.311 1.00 0.00 C ATOM 1804 CE2 PHE A 112 14.802 7.810 -6.331 1.00 0.00 C ATOM 1805 CZ PHE A 112 14.116 6.599 -6.193 1.00 0.00 C ATOM 0 H PHE A 112 20.043 7.461 -2.966 1.00 0.00 H new ATOM 0 HA PHE A 112 18.675 5.585 -4.720 1.00 0.00 H new ATOM 0 HB2 PHE A 112 17.587 6.923 -2.893 1.00 0.00 H new ATOM 0 HB3 PHE A 112 17.880 8.387 -3.811 1.00 0.00 H new ATOM 0 HD1 PHE A 112 16.115 5.099 -3.888 1.00 0.00 H new ATOM 0 HD2 PHE A 112 16.497 8.977 -5.698 1.00 0.00 H new ATOM 0 HE1 PHE A 112 14.055 4.689 -5.203 1.00 0.00 H new ATOM 0 HE2 PHE A 112 14.434 8.565 -7.010 1.00 0.00 H new ATOM 0 HZ PHE A 112 13.220 6.418 -6.769 1.00 0.00 H new ATOM 1815 N LEU A 113 19.821 8.402 -5.978 1.00 0.00 N ATOM 1816 CA LEU A 113 20.122 9.044 -7.276 1.00 0.00 C ATOM 1817 C LEU A 113 21.199 8.215 -8.002 1.00 0.00 C ATOM 1818 O LEU A 113 21.186 8.094 -9.211 1.00 0.00 O ATOM 1819 CB LEU A 113 20.605 10.482 -7.036 1.00 0.00 C ATOM 1820 CG LEU A 113 20.001 11.405 -8.091 1.00 0.00 C ATOM 1821 CD1 LEU A 113 20.529 11.019 -9.473 1.00 0.00 C ATOM 1822 CD2 LEU A 113 18.477 11.273 -8.070 1.00 0.00 C ATOM 0 H LEU A 113 20.170 8.895 -5.156 1.00 0.00 H new ATOM 0 HA LEU A 113 19.227 9.084 -7.898 1.00 0.00 H new ATOM 0 HB2 LEU A 113 20.314 10.813 -6.039 1.00 0.00 H new ATOM 0 HB3 LEU A 113 21.693 10.524 -7.081 1.00 0.00 H new ATOM 0 HG LEU A 113 20.280 12.436 -7.874 1.00 0.00 H new ATOM 0 HD11 LEU A 113 20.097 11.679 -10.225 1.00 0.00 H new ATOM 0 HD12 LEU A 113 21.615 11.114 -9.487 1.00 0.00 H new ATOM 0 HD13 LEU A 113 20.253 9.988 -9.693 1.00 0.00 H new ATOM 0 HD21 LEU A 113 18.044 11.932 -8.823 1.00 0.00 H new ATOM 0 HD22 LEU A 113 18.198 10.242 -8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 113 18.101 11.551 -7.085 1.00 0.00 H new ATOM 1834 N GLU A 114 22.135 7.634 -7.271 1.00 0.00 N ATOM 1835 CA GLU A 114 23.198 6.811 -7.920 1.00 0.00 C ATOM 1836 C GLU A 114 22.591 5.507 -8.437 1.00 0.00 C ATOM 1837 O GLU A 114 22.770 5.115 -9.571 1.00 0.00 O ATOM 1838 CB GLU A 114 24.259 6.483 -6.875 1.00 0.00 C ATOM 1839 CG GLU A 114 25.647 6.830 -7.408 1.00 0.00 C ATOM 1840 CD GLU A 114 25.800 6.305 -8.836 1.00 0.00 C ATOM 1841 OE1 GLU A 114 25.058 5.407 -9.200 1.00 0.00 O ATOM 1842 OE2 GLU A 114 26.657 6.809 -9.543 1.00 0.00 O ATOM 0 H GLU A 114 22.201 7.700 -6.255 1.00 0.00 H new ATOM 0 HA GLU A 114 23.638 7.361 -8.752 1.00 0.00 H new ATOM 0 HB2 GLU A 114 24.063 7.041 -5.959 1.00 0.00 H new ATOM 0 HB3 GLU A 114 24.213 5.424 -6.619 1.00 0.00 H new ATOM 0 HG2 GLU A 114 25.794 7.910 -7.390 1.00 0.00 H new ATOM 0 HG3 GLU A 114 26.412 6.394 -6.766 1.00 0.00 H new ATOM 1849 N ARG A 115 21.876 4.844 -7.579 1.00 0.00 N ATOM 1850 CA ARG A 115 21.219 3.553 -7.922 1.00 0.00 C ATOM 1851 C ARG A 115 20.173 3.789 -9.004 1.00 0.00 C ATOM 1852 O ARG A 115 20.136 3.122 -10.019 1.00 0.00 O ATOM 1853 CB ARG A 115 20.519 3.026 -6.662 1.00 0.00 C ATOM 1854 CG ARG A 115 20.643 1.503 -6.605 1.00 0.00 C ATOM 1855 CD ARG A 115 20.279 0.906 -7.964 1.00 0.00 C ATOM 1856 NE ARG A 115 20.323 -0.581 -7.884 1.00 0.00 N ATOM 1857 CZ ARG A 115 21.248 -1.242 -8.524 1.00 0.00 C ATOM 1858 NH1 ARG A 115 21.044 -1.622 -9.755 1.00 0.00 N ATOM 1859 NH2 ARG A 115 22.376 -1.524 -7.932 1.00 0.00 N ATOM 0 H ARG A 115 21.713 5.153 -6.621 1.00 0.00 H new ATOM 0 HA ARG A 115 21.958 2.837 -8.282 1.00 0.00 H new ATOM 0 HB2 ARG A 115 20.966 3.471 -5.773 1.00 0.00 H new ATOM 0 HB3 ARG A 115 19.468 3.315 -6.670 1.00 0.00 H new ATOM 0 HG2 ARG A 115 21.660 1.221 -6.334 1.00 0.00 H new ATOM 0 HG3 ARG A 115 19.985 1.103 -5.833 1.00 0.00 H new ATOM 0 HD2 ARG A 115 19.284 1.235 -8.262 1.00 0.00 H new ATOM 0 HD3 ARG A 115 20.973 1.260 -8.726 1.00 0.00 H new ATOM 0 HE ARG A 115 19.630 -1.082 -7.329 1.00 0.00 H new ATOM 0 HH11 ARG A 115 20.162 -1.402 -10.217 1.00 0.00 H new ATOM 0 HH12 ARG A 115 21.767 -2.139 -10.256 1.00 0.00 H new ATOM 0 HH21 ARG A 115 22.535 -1.228 -6.969 1.00 0.00 H new ATOM 0 HH22 ARG A 115 23.099 -2.041 -8.432 1.00 0.00 H new ATOM 1873 N LEU A 116 19.323 4.743 -8.783 1.00 0.00 N ATOM 1874 CA LEU A 116 18.263 5.060 -9.771 1.00 0.00 C ATOM 1875 C LEU A 116 18.917 5.343 -11.133 1.00 0.00 C ATOM 1876 O LEU A 116 18.463 4.864 -12.153 1.00 0.00 O ATOM 1877 CB LEU A 116 17.500 6.304 -9.301 1.00 0.00 C ATOM 1878 CG LEU A 116 16.261 6.499 -10.175 1.00 0.00 C ATOM 1879 CD1 LEU A 116 15.003 6.296 -9.328 1.00 0.00 C ATOM 1880 CD2 LEU A 116 16.263 7.916 -10.754 1.00 0.00 C ATOM 0 H LEU A 116 19.317 5.327 -7.946 1.00 0.00 H new ATOM 0 HA LEU A 116 17.574 4.221 -9.864 1.00 0.00 H new ATOM 0 HB2 LEU A 116 17.208 6.192 -8.257 1.00 0.00 H new ATOM 0 HB3 LEU A 116 18.143 7.182 -9.360 1.00 0.00 H new ATOM 0 HG LEU A 116 16.272 5.774 -10.989 1.00 0.00 H new ATOM 0 HD11 LEU A 116 14.119 6.435 -9.950 1.00 0.00 H new ATOM 0 HD12 LEU A 116 15.001 5.287 -8.915 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.991 7.021 -8.514 1.00 0.00 H new ATOM 0 HD21 LEU A 116 15.380 8.056 -11.377 1.00 0.00 H new ATOM 0 HD22 LEU A 116 16.251 8.641 -9.941 1.00 0.00 H new ATOM 0 HD23 LEU A 116 17.159 8.061 -11.357 1.00 0.00 H new ATOM 1892 N LYS A 117 19.983 6.126 -11.169 1.00 0.00 N ATOM 1893 CA LYS A 117 20.635 6.421 -12.479 1.00 0.00 C ATOM 1894 C LYS A 117 21.327 5.167 -13.027 1.00 0.00 C ATOM 1895 O LYS A 117 21.452 4.992 -14.222 1.00 0.00 O ATOM 1896 CB LYS A 117 21.670 7.531 -12.292 1.00 0.00 C ATOM 1897 CG LYS A 117 22.274 7.900 -13.648 1.00 0.00 C ATOM 1898 CD LYS A 117 23.094 9.183 -13.510 1.00 0.00 C ATOM 1899 CE LYS A 117 22.990 9.997 -14.802 1.00 0.00 C ATOM 1900 NZ LYS A 117 24.037 9.543 -15.761 1.00 0.00 N ATOM 0 H LYS A 117 20.417 6.563 -10.356 1.00 0.00 H new ATOM 0 HA LYS A 117 19.872 6.741 -13.188 1.00 0.00 H new ATOM 0 HB2 LYS A 117 21.203 8.406 -11.840 1.00 0.00 H new ATOM 0 HB3 LYS A 117 22.454 7.201 -11.611 1.00 0.00 H new ATOM 0 HG2 LYS A 117 22.906 7.089 -14.009 1.00 0.00 H new ATOM 0 HG3 LYS A 117 21.483 8.039 -14.385 1.00 0.00 H new ATOM 0 HD2 LYS A 117 22.730 9.771 -12.667 1.00 0.00 H new ATOM 0 HD3 LYS A 117 24.136 8.941 -13.303 1.00 0.00 H new ATOM 0 HE2 LYS A 117 22.001 9.875 -15.243 1.00 0.00 H new ATOM 0 HE3 LYS A 117 23.114 11.058 -14.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 24.693 10.326 -15.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 24.562 8.745 -15.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 23.587 9.241 -16.649 1.00 0.00 H new ATOM 1914 N THR A 118 21.787 4.298 -12.167 1.00 0.00 N ATOM 1915 CA THR A 118 22.479 3.068 -12.650 1.00 0.00 C ATOM 1916 C THR A 118 21.526 2.238 -13.511 1.00 0.00 C ATOM 1917 O THR A 118 21.858 1.836 -14.608 1.00 0.00 O ATOM 1918 CB THR A 118 22.935 2.234 -11.450 1.00 0.00 C ATOM 1919 OG1 THR A 118 23.501 3.089 -10.467 1.00 0.00 O ATOM 1920 CG2 THR A 118 23.980 1.213 -11.903 1.00 0.00 C ATOM 0 H THR A 118 21.714 4.386 -11.153 1.00 0.00 H new ATOM 0 HA THR A 118 23.344 3.356 -13.247 1.00 0.00 H new ATOM 0 HB THR A 118 22.078 1.710 -11.026 1.00 0.00 H new ATOM 0 HG1 THR A 118 22.802 3.664 -10.092 1.00 0.00 H new ATOM 0 HG21 THR A 118 24.304 0.620 -11.048 1.00 0.00 H new ATOM 0 HG22 THR A 118 23.544 0.556 -12.656 1.00 0.00 H new ATOM 0 HG23 THR A 118 24.837 1.734 -12.329 1.00 0.00 H new ATOM 1928 N ILE A 119 20.345 1.976 -13.024 1.00 0.00 N ATOM 1929 CA ILE A 119 19.380 1.168 -13.819 1.00 0.00 C ATOM 1930 C ILE A 119 19.133 1.839 -15.170 1.00 0.00 C ATOM 1931 O ILE A 119 19.190 1.207 -16.203 1.00 0.00 O ATOM 1932 CB ILE A 119 18.073 1.048 -13.061 1.00 0.00 C ATOM 1933 CG1 ILE A 119 18.313 0.293 -11.752 1.00 0.00 C ATOM 1934 CG2 ILE A 119 17.051 0.291 -13.910 1.00 0.00 C ATOM 1935 CD1 ILE A 119 18.410 1.290 -10.598 1.00 0.00 C ATOM 0 H ILE A 119 20.007 2.286 -12.113 1.00 0.00 H new ATOM 0 HA ILE A 119 19.794 0.173 -13.985 1.00 0.00 H new ATOM 0 HB ILE A 119 17.689 2.044 -12.842 1.00 0.00 H new ATOM 0 HG12 ILE A 119 17.500 -0.410 -11.571 1.00 0.00 H new ATOM 0 HG13 ILE A 119 19.231 -0.291 -11.820 1.00 0.00 H new ATOM 0 HG21 ILE A 119 16.113 0.207 -13.361 1.00 0.00 H new ATOM 0 HG22 ILE A 119 16.880 0.831 -14.841 1.00 0.00 H new ATOM 0 HG23 ILE A 119 17.431 -0.706 -14.134 1.00 0.00 H new ATOM 0 HD11 ILE A 119 18.581 0.752 -9.666 1.00 0.00 H new ATOM 0 HD12 ILE A 119 19.238 1.976 -10.778 1.00 0.00 H new ATOM 0 HD13 ILE A 119 17.480 1.855 -10.526 1.00 0.00 H new ATOM 1947 N MET A 120 18.857 3.114 -15.172 1.00 0.00 N ATOM 1948 CA MET A 120 18.607 3.822 -16.461 1.00 0.00 C ATOM 1949 C MET A 120 19.800 3.635 -17.387 1.00 0.00 C ATOM 1950 O MET A 120 19.648 3.518 -18.579 1.00 0.00 O ATOM 1951 CB MET A 120 18.406 5.311 -16.193 1.00 0.00 C ATOM 1952 CG MET A 120 16.997 5.543 -15.650 1.00 0.00 C ATOM 1953 SD MET A 120 17.077 6.468 -14.099 1.00 0.00 S ATOM 1954 CE MET A 120 15.394 6.093 -13.550 1.00 0.00 C ATOM 0 H MET A 120 18.794 3.697 -14.337 1.00 0.00 H new ATOM 0 HA MET A 120 17.714 3.410 -16.931 1.00 0.00 H new ATOM 0 HB2 MET A 120 19.147 5.666 -15.477 1.00 0.00 H new ATOM 0 HB3 MET A 120 18.552 5.880 -17.111 1.00 0.00 H new ATOM 0 HG2 MET A 120 16.403 6.092 -16.380 1.00 0.00 H new ATOM 0 HG3 MET A 120 16.499 4.587 -15.488 1.00 0.00 H new ATOM 0 HE1 MET A 120 14.891 7.016 -13.262 1.00 0.00 H new ATOM 0 HE2 MET A 120 14.844 5.618 -14.362 1.00 0.00 H new ATOM 0 HE3 MET A 120 15.432 5.418 -12.695 1.00 0.00 H new ATOM 1964 N ARG A 121 20.980 3.601 -16.858 1.00 0.00 N ATOM 1965 CA ARG A 121 22.165 3.402 -17.733 1.00 0.00 C ATOM 1966 C ARG A 121 22.034 2.038 -18.404 1.00 0.00 C ATOM 1967 O ARG A 121 22.418 1.840 -19.539 1.00 0.00 O ATOM 1968 CB ARG A 121 23.429 3.419 -16.878 1.00 0.00 C ATOM 1969 CG ARG A 121 24.333 4.572 -17.320 1.00 0.00 C ATOM 1970 CD ARG A 121 25.226 4.109 -18.474 1.00 0.00 C ATOM 1971 NE ARG A 121 25.805 2.775 -18.149 1.00 0.00 N ATOM 1972 CZ ARG A 121 26.979 2.692 -17.585 1.00 0.00 C ATOM 1973 NH1 ARG A 121 28.004 3.298 -18.121 1.00 0.00 N ATOM 1974 NH2 ARG A 121 27.129 2.005 -16.486 1.00 0.00 N ATOM 0 H ARG A 121 21.180 3.701 -15.863 1.00 0.00 H new ATOM 0 HA ARG A 121 22.223 4.192 -18.481 1.00 0.00 H new ATOM 0 HB2 ARG A 121 23.167 3.532 -15.826 1.00 0.00 H new ATOM 0 HB3 ARG A 121 23.958 2.471 -16.975 1.00 0.00 H new ATOM 0 HG2 ARG A 121 23.728 5.423 -17.633 1.00 0.00 H new ATOM 0 HG3 ARG A 121 24.946 4.908 -16.484 1.00 0.00 H new ATOM 0 HD2 ARG A 121 24.647 4.051 -19.396 1.00 0.00 H new ATOM 0 HD3 ARG A 121 26.024 4.832 -18.644 1.00 0.00 H new ATOM 0 HE ARG A 121 25.283 1.926 -18.367 1.00 0.00 H new ATOM 0 HH11 ARG A 121 27.887 3.836 -18.980 1.00 0.00 H new ATOM 0 HH12 ARG A 121 28.922 3.234 -17.681 1.00 0.00 H new ATOM 0 HH21 ARG A 121 26.328 1.532 -16.067 1.00 0.00 H new ATOM 0 HH22 ARG A 121 28.047 1.941 -16.046 1.00 0.00 H new ATOM 1988 N GLU A 122 21.496 1.094 -17.686 1.00 0.00 N ATOM 1989 CA GLU A 122 21.325 -0.283 -18.233 1.00 0.00 C ATOM 1990 C GLU A 122 20.246 -0.308 -19.323 1.00 0.00 C ATOM 1991 O GLU A 122 20.458 -0.831 -20.399 1.00 0.00 O ATOM 1992 CB GLU A 122 20.881 -1.218 -17.098 1.00 0.00 C ATOM 1993 CG GLU A 122 21.999 -1.409 -16.058 1.00 0.00 C ATOM 1994 CD GLU A 122 21.380 -1.843 -14.728 1.00 0.00 C ATOM 1995 OE1 GLU A 122 20.679 -2.841 -14.723 1.00 0.00 O ATOM 1996 OE2 GLU A 122 21.615 -1.169 -13.739 1.00 0.00 O ATOM 0 H GLU A 122 21.162 1.218 -16.730 1.00 0.00 H new ATOM 0 HA GLU A 122 22.274 -0.606 -18.660 1.00 0.00 H new ATOM 0 HB2 GLU A 122 19.996 -0.808 -16.612 1.00 0.00 H new ATOM 0 HB3 GLU A 122 20.598 -2.186 -17.512 1.00 0.00 H new ATOM 0 HG2 GLU A 122 22.710 -2.159 -16.404 1.00 0.00 H new ATOM 0 HG3 GLU A 122 22.554 -0.480 -15.928 1.00 0.00 H new ATOM 2003 N LYS A 123 19.086 0.228 -19.054 1.00 0.00 N ATOM 2004 CA LYS A 123 18.006 0.201 -20.087 1.00 0.00 C ATOM 2005 C LYS A 123 18.408 1.070 -21.276 1.00 0.00 C ATOM 2006 O LYS A 123 18.076 0.792 -22.412 1.00 0.00 O ATOM 2007 CB LYS A 123 16.708 0.738 -19.479 1.00 0.00 C ATOM 2008 CG LYS A 123 15.512 0.129 -20.214 1.00 0.00 C ATOM 2009 CD LYS A 123 14.226 0.440 -19.444 1.00 0.00 C ATOM 2010 CE LYS A 123 13.058 -0.326 -20.069 1.00 0.00 C ATOM 2011 NZ LYS A 123 12.860 -1.610 -19.340 1.00 0.00 N ATOM 0 H LYS A 123 18.839 0.680 -18.173 1.00 0.00 H new ATOM 0 HA LYS A 123 17.855 -0.824 -20.425 1.00 0.00 H new ATOM 0 HB2 LYS A 123 16.661 0.491 -18.418 1.00 0.00 H new ATOM 0 HB3 LYS A 123 16.680 1.825 -19.555 1.00 0.00 H new ATOM 0 HG2 LYS A 123 15.449 0.532 -21.225 1.00 0.00 H new ATOM 0 HG3 LYS A 123 15.640 -0.949 -20.308 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.340 0.159 -18.397 1.00 0.00 H new ATOM 0 HD3 LYS A 123 14.026 1.511 -19.467 1.00 0.00 H new ATOM 0 HE2 LYS A 123 12.149 0.274 -20.023 1.00 0.00 H new ATOM 0 HE3 LYS A 123 13.259 -0.521 -21.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 12.015 -2.092 -19.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 13.692 -2.218 -19.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 12.734 -1.418 -18.326 1.00 0.00 H new ATOM 2025 N TYR A 124 19.119 2.125 -21.016 1.00 0.00 N ATOM 2026 CA TYR A 124 19.557 3.035 -22.106 1.00 0.00 C ATOM 2027 C TYR A 124 20.628 2.346 -22.955 1.00 0.00 C ATOM 2028 O TYR A 124 20.671 2.498 -24.160 1.00 0.00 O ATOM 2029 CB TYR A 124 20.126 4.318 -21.492 1.00 0.00 C ATOM 2030 CG TYR A 124 20.280 5.364 -22.569 1.00 0.00 C ATOM 2031 CD1 TYR A 124 21.244 5.198 -23.569 1.00 0.00 C ATOM 2032 CD2 TYR A 124 19.458 6.497 -22.567 1.00 0.00 C ATOM 2033 CE1 TYR A 124 21.387 6.167 -24.569 1.00 0.00 C ATOM 2034 CE2 TYR A 124 19.601 7.465 -23.567 1.00 0.00 C ATOM 2035 CZ TYR A 124 20.566 7.300 -24.568 1.00 0.00 C ATOM 2036 OH TYR A 124 20.707 8.255 -25.555 1.00 0.00 O ATOM 0 H TYR A 124 19.420 2.401 -20.081 1.00 0.00 H new ATOM 0 HA TYR A 124 18.706 3.282 -22.741 1.00 0.00 H new ATOM 0 HB2 TYR A 124 19.464 4.683 -20.707 1.00 0.00 H new ATOM 0 HB3 TYR A 124 21.090 4.115 -21.027 1.00 0.00 H new ATOM 0 HD1 TYR A 124 21.877 4.323 -23.570 1.00 0.00 H new ATOM 0 HD2 TYR A 124 18.714 6.624 -21.794 1.00 0.00 H new ATOM 0 HE1 TYR A 124 22.131 6.040 -25.341 1.00 0.00 H new ATOM 0 HE2 TYR A 124 18.967 8.339 -23.567 1.00 0.00 H new ATOM 0 HH TYR A 124 19.977 8.166 -26.203 1.00 0.00 H new ATOM 2046 N SER A 125 21.497 1.594 -22.336 1.00 0.00 N ATOM 2047 CA SER A 125 22.569 0.902 -23.105 1.00 0.00 C ATOM 2048 C SER A 125 22.063 -0.458 -23.596 1.00 0.00 C ATOM 2049 O SER A 125 22.835 -1.316 -23.977 1.00 0.00 O ATOM 2050 CB SER A 125 23.788 0.694 -22.204 1.00 0.00 C ATOM 2051 OG SER A 125 24.634 -0.295 -22.772 1.00 0.00 O ATOM 0 H SER A 125 21.510 1.429 -21.330 1.00 0.00 H new ATOM 0 HA SER A 125 22.846 1.514 -23.963 1.00 0.00 H new ATOM 0 HB2 SER A 125 24.333 1.631 -22.089 1.00 0.00 H new ATOM 0 HB3 SER A 125 23.469 0.387 -21.208 1.00 0.00 H new ATOM 0 HG SER A 125 24.371 -0.455 -23.702 1.00 0.00 H new ATOM 2057 N LYS A 126 20.775 -0.667 -23.591 1.00 0.00 N ATOM 2058 CA LYS A 126 20.231 -1.973 -24.061 1.00 0.00 C ATOM 2059 C LYS A 126 19.168 -1.723 -25.132 1.00 0.00 C ATOM 2060 O LYS A 126 18.125 -2.348 -25.142 1.00 0.00 O ATOM 2061 CB LYS A 126 19.606 -2.720 -22.882 1.00 0.00 C ATOM 2062 CG LYS A 126 19.355 -4.176 -23.279 1.00 0.00 C ATOM 2063 CD LYS A 126 19.594 -5.085 -22.071 1.00 0.00 C ATOM 2064 CE LYS A 126 20.397 -6.311 -22.506 1.00 0.00 C ATOM 2065 NZ LYS A 126 21.835 -5.940 -22.643 1.00 0.00 N ATOM 0 H LYS A 126 20.076 0.009 -23.282 1.00 0.00 H new ATOM 0 HA LYS A 126 21.037 -2.574 -24.482 1.00 0.00 H new ATOM 0 HB2 LYS A 126 20.268 -2.676 -22.017 1.00 0.00 H new ATOM 0 HB3 LYS A 126 18.670 -2.244 -22.591 1.00 0.00 H new ATOM 0 HG2 LYS A 126 18.333 -4.294 -23.640 1.00 0.00 H new ATOM 0 HG3 LYS A 126 20.017 -4.460 -24.097 1.00 0.00 H new ATOM 0 HD2 LYS A 126 20.132 -4.542 -21.294 1.00 0.00 H new ATOM 0 HD3 LYS A 126 18.641 -5.395 -21.641 1.00 0.00 H new ATOM 0 HE2 LYS A 126 20.285 -7.111 -21.774 1.00 0.00 H new ATOM 0 HE3 LYS A 126 20.016 -6.691 -23.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 22.382 -6.774 -22.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 21.934 -5.190 -23.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 22.194 -5.597 -21.729 1.00 0.00 H new ATOM 2079 N CYS A 127 19.422 -0.813 -26.031 1.00 0.00 N ATOM 2080 CA CYS A 127 18.428 -0.519 -27.097 1.00 0.00 C ATOM 2081 C CYS A 127 18.797 -1.288 -28.367 1.00 0.00 C ATOM 2082 O CYS A 127 18.367 -0.955 -29.453 1.00 0.00 O ATOM 2083 CB CYS A 127 18.441 0.981 -27.387 1.00 0.00 C ATOM 2084 SG CYS A 127 17.848 1.880 -25.932 1.00 0.00 S ATOM 0 H CYS A 127 20.278 -0.260 -26.072 1.00 0.00 H new ATOM 0 HA CYS A 127 17.434 -0.824 -26.769 1.00 0.00 H new ATOM 0 HB2 CYS A 127 19.450 1.305 -27.642 1.00 0.00 H new ATOM 0 HB3 CYS A 127 17.809 1.202 -28.247 1.00 0.00 H new ATOM 2089 N SER A 128 19.590 -2.317 -28.240 1.00 0.00 N ATOM 2090 CA SER A 128 19.985 -3.105 -29.441 1.00 0.00 C ATOM 2091 C SER A 128 20.315 -4.540 -29.024 1.00 0.00 C ATOM 2092 O SER A 128 20.878 -4.777 -27.974 1.00 0.00 O ATOM 2093 CB SER A 128 21.216 -2.467 -30.087 1.00 0.00 C ATOM 2094 OG SER A 128 21.736 -3.338 -31.082 1.00 0.00 O ATOM 0 H SER A 128 19.981 -2.645 -27.357 1.00 0.00 H new ATOM 0 HA SER A 128 19.162 -3.114 -30.156 1.00 0.00 H new ATOM 0 HB2 SER A 128 20.950 -1.508 -30.531 1.00 0.00 H new ATOM 0 HB3 SER A 128 21.975 -2.268 -29.330 1.00 0.00 H new ATOM 0 HG SER A 128 22.524 -2.928 -31.496 1.00 0.00 H new ATOM 2100 N SER A 129 19.968 -5.499 -29.837 1.00 0.00 N ATOM 2101 CA SER A 129 20.261 -6.917 -29.487 1.00 0.00 C ATOM 2102 C SER A 129 21.588 -7.336 -30.124 1.00 0.00 C ATOM 2103 O SER A 129 22.290 -6.464 -30.610 1.00 0.00 O ATOM 2104 CB SER A 129 19.139 -7.815 -30.009 1.00 0.00 C ATOM 2105 OG SER A 129 19.114 -9.024 -29.265 1.00 0.00 O ATOM 2106 OXT SER A 129 21.878 -8.521 -30.116 1.00 0.00 O ATOM 0 H SER A 129 19.494 -5.362 -30.730 1.00 0.00 H new ATOM 0 HA SER A 129 20.330 -7.016 -28.404 1.00 0.00 H new ATOM 0 HB2 SER A 129 18.180 -7.303 -29.924 1.00 0.00 H new ATOM 0 HB3 SER A 129 19.293 -8.030 -31.067 1.00 0.00 H new ATOM 0 HG SER A 129 20.021 -9.389 -29.203 1.00 0.00 H new TER 2112 SER A 129