USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 890 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 GLN : amide:sc= -1.18! X(o=-0.35!,f=0.13) USER MOD Set 1.2: A 102 TYR OH : rot 149:sc= 0.835 USER MOD Set 2.1: A 30 SER OG : rot 146:sc= 0.0278 USER MOD Set 2.2: A 33 THR OG1 : rot 180:sc= -0.28 USER MOD Single : A 1 GLY N :NH3+ -135:sc= 0.0449 (180deg=0) USER MOD Single : A 2 SER OG : rot 51:sc= 1.13 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -0.0721 K(o=-0.072,f=-2!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc=-0.00211 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 153:sc= 0 (180deg=-0.647) USER MOD Single : A 31 GLN : amide:sc= -1.91! C(o=-1.9!,f=-1.5!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -116:sc= -0.221 (180deg=-2.95!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= -0.0161 USER MOD Single : A 44 HIS : no HD1:sc= -3.44 K(o=-3.4,f=-6.2!) USER MOD Single : A 50 HIS : no HD1:sc= -0.22 X(o=-0.22,f=-0.045) USER MOD Single : A 51 HIS : no HD1:sc= -0.297 K(o=-0.3,f=-1.6) USER MOD Single : A 52 TYR OH : rot 150:sc= -0.971 USER MOD Single : A 53 GLN : amide:sc=-0.00124 X(o=-0.0012,f=-0.15) USER MOD Single : A 57 LYS NZ :NH3+ 156:sc= 0.208 (180deg=-0.443) USER MOD Single : A 61 SER OG : rot 180:sc= -0.172 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= -0.114 X(o=-0.11,f=0) USER MOD Single : A 73 GLN : amide:sc= -0.629 X(o=-0.63,f=-0.6) USER MOD Single : A 74 THR OG1 : rot 125:sc= 1.13 USER MOD Single : A 75 MET CE :methyl -153:sc= -1.29 (180deg=-3.78!) USER MOD Single : A 79 ASN : amide:sc= -1.24 K(o=-1.2,f=-0.013) USER MOD Single : A 80 ASN : amide:sc= -0.0374 X(o=-0.037,f=0) USER MOD Single : A 84 ASN : amide:sc= -0.0608 K(o=-0.061,f=-1.7) USER MOD Single : A 85 THR OG1 : rot 64:sc= 0.247 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 28:sc= -0.289 USER MOD Single : A 95 ASN : amide:sc= -9.3! C(o=-9.3!,f=-16!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0.326 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 110 THR OG1 : rot -162:sc= 0.779 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -33.837 -2.212 -5.801 1.00 0.00 N ATOM 2 CA GLY A 1 -32.792 -1.204 -5.812 1.00 0.00 C ATOM 3 C GLY A 1 -32.219 -0.979 -7.197 1.00 0.00 C ATOM 4 O GLY A 1 -32.905 -1.174 -8.199 1.00 0.00 O ATOM 0 H1 GLY A 1 -34.639 -1.874 -5.232 1.00 0.00 H new ATOM 0 H2 GLY A 1 -34.155 -2.393 -6.775 1.00 0.00 H new ATOM 0 H3 GLY A 1 -33.466 -3.092 -5.389 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -33.193 -0.265 -5.431 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -31.992 -1.507 -5.136 1.00 0.00 H new ATOM 8 N SER A 2 -30.957 -0.563 -7.252 1.00 0.00 N ATOM 9 CA SER A 2 -30.293 -0.306 -8.525 1.00 0.00 C ATOM 10 C SER A 2 -29.933 -1.613 -9.224 1.00 0.00 C ATOM 11 O SER A 2 -28.887 -2.204 -8.959 1.00 0.00 O ATOM 12 CB SER A 2 -29.031 0.532 -8.305 1.00 0.00 C ATOM 13 OG SER A 2 -28.072 -0.180 -7.541 1.00 0.00 O ATOM 0 H SER A 2 -30.375 -0.397 -6.431 1.00 0.00 H new ATOM 0 HA SER A 2 -30.983 0.248 -9.162 1.00 0.00 H new ATOM 0 HB2 SER A 2 -28.601 0.808 -9.268 1.00 0.00 H new ATOM 0 HB3 SER A 2 -29.291 1.459 -7.795 1.00 0.00 H new ATOM 0 HG SER A 2 -27.932 -1.066 -7.935 1.00 0.00 H new ATOM 19 N SER A 3 -30.809 -2.057 -10.120 1.00 0.00 N ATOM 20 CA SER A 3 -30.586 -3.295 -10.857 1.00 0.00 C ATOM 21 C SER A 3 -30.171 -4.421 -9.915 1.00 0.00 C ATOM 22 O SER A 3 -29.141 -5.065 -10.113 1.00 0.00 O ATOM 23 CB SER A 3 -29.514 -3.091 -11.929 1.00 0.00 C ATOM 24 OG SER A 3 -29.920 -2.118 -12.876 1.00 0.00 O ATOM 0 H SER A 3 -31.679 -1.578 -10.353 1.00 0.00 H new ATOM 0 HA SER A 3 -31.523 -3.574 -11.339 1.00 0.00 H new ATOM 0 HB2 SER A 3 -28.581 -2.780 -11.460 1.00 0.00 H new ATOM 0 HB3 SER A 3 -29.317 -4.036 -12.435 1.00 0.00 H new ATOM 0 HG SER A 3 -29.218 -2.004 -13.550 1.00 0.00 H new ATOM 30 N GLY A 4 -30.982 -4.653 -8.886 1.00 0.00 N ATOM 31 CA GLY A 4 -30.682 -5.701 -7.927 1.00 0.00 C ATOM 32 C GLY A 4 -31.887 -6.566 -7.619 1.00 0.00 C ATOM 33 O GLY A 4 -33.013 -6.072 -7.544 1.00 0.00 O ATOM 0 H GLY A 4 -31.840 -4.134 -8.700 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -29.879 -6.327 -8.317 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -30.316 -5.251 -7.004 1.00 0.00 H new ATOM 37 N SER A 5 -31.654 -7.862 -7.441 1.00 0.00 N ATOM 38 CA SER A 5 -32.731 -8.799 -7.145 1.00 0.00 C ATOM 39 C SER A 5 -32.512 -9.468 -5.791 1.00 0.00 C ATOM 40 O SER A 5 -31.486 -9.263 -5.144 1.00 0.00 O ATOM 41 CB SER A 5 -32.827 -9.862 -8.242 1.00 0.00 C ATOM 42 OG SER A 5 -33.171 -9.280 -9.487 1.00 0.00 O ATOM 0 H SER A 5 -30.729 -8.287 -7.497 1.00 0.00 H new ATOM 0 HA SER A 5 -33.666 -8.240 -7.108 1.00 0.00 H new ATOM 0 HB2 SER A 5 -31.874 -10.384 -8.332 1.00 0.00 H new ATOM 0 HB3 SER A 5 -33.573 -10.607 -7.967 1.00 0.00 H new ATOM 0 HG SER A 5 -33.224 -9.979 -10.171 1.00 0.00 H new ATOM 48 N SER A 6 -33.485 -10.270 -5.369 1.00 0.00 N ATOM 49 CA SER A 6 -33.402 -10.967 -4.092 1.00 0.00 C ATOM 50 C SER A 6 -32.866 -12.383 -4.279 1.00 0.00 C ATOM 51 O SER A 6 -33.202 -13.063 -5.247 1.00 0.00 O ATOM 52 CB SER A 6 -34.776 -11.014 -3.422 1.00 0.00 C ATOM 53 OG SER A 6 -34.696 -11.597 -2.132 1.00 0.00 O ATOM 0 H SER A 6 -34.340 -10.453 -5.894 1.00 0.00 H new ATOM 0 HA SER A 6 -32.712 -10.418 -3.451 1.00 0.00 H new ATOM 0 HB2 SER A 6 -35.180 -10.005 -3.344 1.00 0.00 H new ATOM 0 HB3 SER A 6 -35.466 -11.587 -4.041 1.00 0.00 H new ATOM 0 HG SER A 6 -35.587 -11.614 -1.725 1.00 0.00 H new ATOM 59 N GLY A 7 -32.029 -12.821 -3.343 1.00 0.00 N ATOM 60 CA GLY A 7 -31.460 -14.154 -3.422 1.00 0.00 C ATOM 61 C GLY A 7 -29.952 -14.132 -3.570 1.00 0.00 C ATOM 62 O GLY A 7 -29.229 -13.938 -2.594 1.00 0.00 O ATOM 0 H GLY A 7 -31.735 -12.277 -2.532 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -31.726 -14.713 -2.525 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -31.898 -14.683 -4.269 1.00 0.00 H new ATOM 66 N GLN A 8 -29.476 -14.333 -4.795 1.00 0.00 N ATOM 67 CA GLN A 8 -28.045 -14.337 -5.068 1.00 0.00 C ATOM 68 C GLN A 8 -27.267 -14.899 -3.882 1.00 0.00 C ATOM 69 O GLN A 8 -26.195 -14.402 -3.539 1.00 0.00 O ATOM 70 CB GLN A 8 -27.559 -12.923 -5.387 1.00 0.00 C ATOM 71 CG GLN A 8 -27.761 -11.939 -4.245 1.00 0.00 C ATOM 72 CD GLN A 8 -27.775 -10.497 -4.713 1.00 0.00 C ATOM 73 OE1 GLN A 8 -27.802 -10.221 -5.913 1.00 0.00 O ATOM 74 NE2 GLN A 8 -27.758 -9.567 -3.766 1.00 0.00 N ATOM 0 H GLN A 8 -30.062 -14.495 -5.614 1.00 0.00 H new ATOM 0 HA GLN A 8 -27.868 -14.977 -5.933 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -26.500 -12.960 -5.641 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -28.085 -12.557 -6.269 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -28.701 -12.162 -3.740 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -26.966 -12.071 -3.511 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -27.736 -9.840 -2.783 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -27.767 -8.579 -4.021 1.00 0.00 H new ATOM 83 N GLU A 9 -27.815 -15.937 -3.259 1.00 0.00 N ATOM 84 CA GLU A 9 -27.172 -16.565 -2.110 1.00 0.00 C ATOM 85 C GLU A 9 -26.561 -17.909 -2.496 1.00 0.00 C ATOM 86 O GLU A 9 -26.858 -18.936 -1.884 1.00 0.00 O ATOM 87 CB GLU A 9 -28.181 -16.757 -0.975 1.00 0.00 C ATOM 88 CG GLU A 9 -29.324 -17.695 -1.329 1.00 0.00 C ATOM 89 CD GLU A 9 -30.528 -17.513 -0.427 1.00 0.00 C ATOM 90 OE1 GLU A 9 -30.348 -17.508 0.809 1.00 0.00 O ATOM 91 OE2 GLU A 9 -31.651 -17.375 -0.955 1.00 0.00 O ATOM 0 H GLU A 9 -28.702 -16.361 -3.530 1.00 0.00 H new ATOM 0 HA GLU A 9 -26.373 -15.907 -1.768 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -27.661 -17.146 -0.100 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -28.591 -15.786 -0.697 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -29.621 -17.525 -2.364 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -28.977 -18.726 -1.262 1.00 0.00 H new ATOM 98 N TYR A 10 -25.708 -17.894 -3.513 1.00 0.00 N ATOM 99 CA TYR A 10 -25.057 -19.111 -3.982 1.00 0.00 C ATOM 100 C TYR A 10 -23.557 -19.068 -3.706 1.00 0.00 C ATOM 101 O TYR A 10 -22.962 -20.065 -3.296 1.00 0.00 O ATOM 102 CB TYR A 10 -25.306 -19.302 -5.479 1.00 0.00 C ATOM 103 CG TYR A 10 -24.321 -18.562 -6.357 1.00 0.00 C ATOM 104 CD1 TYR A 10 -24.267 -17.174 -6.353 1.00 0.00 C ATOM 105 CD2 TYR A 10 -23.447 -19.250 -7.188 1.00 0.00 C ATOM 106 CE1 TYR A 10 -23.370 -16.492 -7.154 1.00 0.00 C ATOM 107 CE2 TYR A 10 -22.546 -18.578 -7.991 1.00 0.00 C ATOM 108 CZ TYR A 10 -22.512 -17.199 -7.970 1.00 0.00 C ATOM 109 OH TYR A 10 -21.615 -16.524 -8.768 1.00 0.00 O ATOM 0 H TYR A 10 -25.451 -17.052 -4.029 1.00 0.00 H new ATOM 0 HA TYR A 10 -25.484 -19.954 -3.438 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -25.261 -20.366 -5.713 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -26.315 -18.966 -5.717 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -24.937 -16.618 -5.714 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -23.472 -20.330 -7.207 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -23.341 -15.412 -7.141 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -21.873 -19.129 -8.631 1.00 0.00 H new ATOM 0 HH TYR A 10 -21.083 -17.169 -9.280 1.00 0.00 H new ATOM 119 N ILE A 11 -22.953 -17.907 -3.934 1.00 0.00 N ATOM 120 CA ILE A 11 -21.524 -17.732 -3.708 1.00 0.00 C ATOM 121 C ILE A 11 -21.253 -16.532 -2.807 1.00 0.00 C ATOM 122 O ILE A 11 -20.446 -16.609 -1.878 1.00 0.00 O ATOM 123 CB ILE A 11 -20.763 -17.546 -5.034 1.00 0.00 C ATOM 124 CG1 ILE A 11 -20.576 -18.895 -5.733 1.00 0.00 C ATOM 125 CG2 ILE A 11 -19.417 -16.882 -4.784 1.00 0.00 C ATOM 126 CD1 ILE A 11 -19.667 -19.843 -4.983 1.00 0.00 C ATOM 0 H ILE A 11 -23.431 -17.073 -4.275 1.00 0.00 H new ATOM 0 HA ILE A 11 -21.169 -18.639 -3.219 1.00 0.00 H new ATOM 0 HB ILE A 11 -21.350 -16.898 -5.685 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -21.550 -19.366 -5.863 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -20.168 -18.725 -6.729 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -18.891 -16.757 -5.731 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -19.573 -15.906 -4.324 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -18.822 -17.506 -4.118 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -19.580 -20.778 -5.536 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -18.680 -19.392 -4.875 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -20.084 -20.043 -3.996 1.00 0.00 H new ATOM 138 N LEU A 12 -21.930 -15.425 -3.085 1.00 0.00 N ATOM 139 CA LEU A 12 -21.764 -14.207 -2.299 1.00 0.00 C ATOM 140 C LEU A 12 -21.734 -14.523 -0.807 1.00 0.00 C ATOM 141 O LEU A 12 -21.190 -13.757 -0.011 1.00 0.00 O ATOM 142 CB LEU A 12 -22.896 -13.224 -2.600 1.00 0.00 C ATOM 143 CG LEU A 12 -22.671 -12.284 -3.785 1.00 0.00 C ATOM 144 CD1 LEU A 12 -23.976 -11.621 -4.198 1.00 0.00 C ATOM 145 CD2 LEU A 12 -21.623 -11.235 -3.443 1.00 0.00 C ATOM 0 H LEU A 12 -22.600 -15.345 -3.850 1.00 0.00 H new ATOM 0 HA LEU A 12 -20.813 -13.752 -2.576 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -23.807 -13.794 -2.782 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -23.071 -12.619 -1.710 1.00 0.00 H new ATOM 0 HG LEU A 12 -22.306 -12.874 -4.626 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -23.795 -10.956 -5.043 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -24.697 -12.386 -4.486 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -24.372 -11.045 -3.362 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -21.476 -10.575 -4.298 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -21.959 -10.650 -2.587 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -20.682 -11.727 -3.199 1.00 0.00 H new ATOM 157 N ALA A 13 -22.318 -15.657 -0.435 1.00 0.00 N ATOM 158 CA ALA A 13 -22.355 -16.077 0.961 1.00 0.00 C ATOM 159 C ALA A 13 -21.098 -16.856 1.332 1.00 0.00 C ATOM 160 O ALA A 13 -20.570 -16.713 2.436 1.00 0.00 O ATOM 161 CB ALA A 13 -23.596 -16.915 1.227 1.00 0.00 C ATOM 0 H ALA A 13 -22.772 -16.302 -1.081 1.00 0.00 H new ATOM 0 HA ALA A 13 -22.394 -15.183 1.584 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -23.611 -17.222 2.273 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -24.487 -16.326 1.009 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -23.581 -17.799 0.590 1.00 0.00 H new ATOM 167 N LEU A 14 -20.623 -17.680 0.405 1.00 0.00 N ATOM 168 CA LEU A 14 -19.427 -18.483 0.635 1.00 0.00 C ATOM 169 C LEU A 14 -18.177 -17.746 0.166 1.00 0.00 C ATOM 170 O LEU A 14 -17.121 -18.350 -0.018 1.00 0.00 O ATOM 171 CB LEU A 14 -19.543 -19.825 -0.089 1.00 0.00 C ATOM 172 CG LEU A 14 -20.821 -20.623 0.175 1.00 0.00 C ATOM 173 CD1 LEU A 14 -20.950 -21.768 -0.817 1.00 0.00 C ATOM 174 CD2 LEU A 14 -20.838 -21.147 1.603 1.00 0.00 C ATOM 0 H LEU A 14 -21.048 -17.810 -0.513 1.00 0.00 H new ATOM 0 HA LEU A 14 -19.340 -18.661 1.707 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -19.467 -19.644 -1.161 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -18.689 -20.442 0.192 1.00 0.00 H new ATOM 0 HG LEU A 14 -21.675 -19.958 0.044 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -21.865 -22.324 -0.614 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -20.986 -21.369 -1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -20.092 -22.433 -0.719 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -21.755 -21.712 1.772 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -19.977 -21.796 1.763 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -20.795 -20.309 2.299 1.00 0.00 H new ATOM 186 N ALA A 15 -18.304 -16.437 -0.022 1.00 0.00 N ATOM 187 CA ALA A 15 -17.184 -15.616 -0.465 1.00 0.00 C ATOM 188 C ALA A 15 -16.258 -15.277 0.698 1.00 0.00 C ATOM 189 O ALA A 15 -16.480 -15.712 1.828 1.00 0.00 O ATOM 190 CB ALA A 15 -17.691 -14.343 -1.127 1.00 0.00 C ATOM 0 H ALA A 15 -19.172 -15.922 0.126 1.00 0.00 H new ATOM 0 HA ALA A 15 -16.613 -16.189 -1.195 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.843 -13.740 -1.453 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -18.305 -14.601 -1.990 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -18.288 -13.775 -0.414 1.00 0.00 H new ATOM 196 N ASP A 16 -15.220 -14.499 0.414 1.00 0.00 N ATOM 197 CA ASP A 16 -14.259 -14.101 1.437 1.00 0.00 C ATOM 198 C ASP A 16 -13.552 -12.807 1.046 1.00 0.00 C ATOM 199 O ASP A 16 -13.856 -12.210 0.012 1.00 0.00 O ATOM 200 CB ASP A 16 -13.232 -15.211 1.661 1.00 0.00 C ATOM 201 CG ASP A 16 -13.853 -16.594 1.615 1.00 0.00 C ATOM 202 OD1 ASP A 16 -14.042 -17.120 0.499 1.00 0.00 O ATOM 203 OD2 ASP A 16 -14.151 -17.147 2.694 1.00 0.00 O ATOM 0 H ASP A 16 -15.022 -14.131 -0.516 1.00 0.00 H new ATOM 0 HA ASP A 16 -14.804 -13.929 2.365 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.454 -15.140 0.901 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -12.749 -15.065 2.627 1.00 0.00 H new ATOM 208 N VAL A 17 -12.608 -12.379 1.878 1.00 0.00 N ATOM 209 CA VAL A 17 -11.859 -11.156 1.619 1.00 0.00 C ATOM 210 C VAL A 17 -10.375 -11.453 1.426 1.00 0.00 C ATOM 211 O VAL A 17 -9.838 -12.428 1.952 1.00 0.00 O ATOM 212 CB VAL A 17 -12.023 -10.142 2.766 1.00 0.00 C ATOM 213 CG1 VAL A 17 -13.371 -9.445 2.672 1.00 0.00 C ATOM 214 CG2 VAL A 17 -11.862 -10.832 4.113 1.00 0.00 C ATOM 0 H VAL A 17 -12.344 -12.861 2.737 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.264 -10.724 0.704 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.243 -9.386 2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -13.470 -8.732 3.490 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -13.442 -8.918 1.721 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -14.169 -10.185 2.737 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.981 -10.101 4.913 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -12.619 -11.609 4.216 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.871 -11.281 4.176 1.00 0.00 H new ATOM 224 N PRO A 18 -9.695 -10.591 0.654 1.00 0.00 N ATOM 225 CA PRO A 18 -8.263 -10.739 0.375 1.00 0.00 C ATOM 226 C PRO A 18 -7.402 -10.469 1.604 1.00 0.00 C ATOM 227 O PRO A 18 -7.812 -9.749 2.515 1.00 0.00 O ATOM 228 CB PRO A 18 -8.001 -9.684 -0.702 1.00 0.00 C ATOM 229 CG PRO A 18 -9.062 -8.659 -0.495 1.00 0.00 C ATOM 230 CD PRO A 18 -10.271 -9.408 -0.005 1.00 0.00 C ATOM 0 HA PRO A 18 -8.011 -11.754 0.068 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.006 -9.251 -0.598 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.057 -10.116 -1.701 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.745 -7.911 0.232 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.280 -8.130 -1.423 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -10.861 -8.809 0.689 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -10.931 -9.687 -0.826 1.00 0.00 H new ATOM 238 N SER A 19 -6.208 -11.052 1.624 1.00 0.00 N ATOM 239 CA SER A 19 -5.291 -10.878 2.743 1.00 0.00 C ATOM 240 C SER A 19 -4.495 -9.584 2.597 1.00 0.00 C ATOM 241 O SER A 19 -4.437 -8.997 1.516 1.00 0.00 O ATOM 242 CB SER A 19 -4.335 -12.069 2.839 1.00 0.00 C ATOM 243 OG SER A 19 -3.612 -12.046 4.058 1.00 0.00 O ATOM 0 H SER A 19 -5.853 -11.649 0.877 1.00 0.00 H new ATOM 0 HA SER A 19 -5.881 -10.821 3.658 1.00 0.00 H new ATOM 0 HB2 SER A 19 -4.899 -12.999 2.765 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.640 -12.050 2.000 1.00 0.00 H new ATOM 0 HG SER A 19 -3.010 -12.818 4.096 1.00 0.00 H new ATOM 249 N SER A 20 -3.883 -9.146 3.692 1.00 0.00 N ATOM 250 CA SER A 20 -3.092 -7.920 3.688 1.00 0.00 C ATOM 251 C SER A 20 -1.993 -7.986 2.634 1.00 0.00 C ATOM 252 O SER A 20 -1.283 -8.984 2.501 1.00 0.00 O ATOM 253 CB SER A 20 -2.478 -7.679 5.068 1.00 0.00 C ATOM 254 OG SER A 20 -1.433 -8.600 5.329 1.00 0.00 O ATOM 0 H SER A 20 -3.919 -9.621 4.594 1.00 0.00 H new ATOM 0 HA SER A 20 -3.755 -7.090 3.444 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.093 -6.661 5.125 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.248 -7.772 5.834 1.00 0.00 H new ATOM 0 HG SER A 20 -1.056 -8.424 6.216 1.00 0.00 H new ATOM 260 N PRO A 21 -1.845 -6.897 1.864 1.00 0.00 N ATOM 261 CA PRO A 21 -0.833 -6.806 0.807 1.00 0.00 C ATOM 262 C PRO A 21 0.583 -6.722 1.366 1.00 0.00 C ATOM 263 O PRO A 21 0.778 -6.466 2.556 1.00 0.00 O ATOM 264 CB PRO A 21 -1.198 -5.511 0.078 1.00 0.00 C ATOM 265 CG PRO A 21 -1.918 -4.693 1.095 1.00 0.00 C ATOM 266 CD PRO A 21 -2.655 -5.672 1.966 1.00 0.00 C ATOM 0 HA PRO A 21 -0.833 -7.687 0.165 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -0.308 -4.997 -0.285 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.828 -5.709 -0.789 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -1.220 -4.097 1.682 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.609 -3.997 0.619 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.724 -5.321 2.996 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.674 -5.834 1.615 1.00 0.00 H new ATOM 274 N TYR A 22 1.569 -6.939 0.503 1.00 0.00 N ATOM 275 CA TYR A 22 2.968 -6.889 0.912 1.00 0.00 C ATOM 276 C TYR A 22 3.817 -6.179 -0.138 1.00 0.00 C ATOM 277 O TYR A 22 3.308 -5.721 -1.160 1.00 0.00 O ATOM 278 CB TYR A 22 3.503 -8.303 1.147 1.00 0.00 C ATOM 279 CG TYR A 22 3.305 -9.229 -0.033 1.00 0.00 C ATOM 280 CD1 TYR A 22 4.123 -9.144 -1.153 1.00 0.00 C ATOM 281 CD2 TYR A 22 2.300 -10.189 -0.027 1.00 0.00 C ATOM 282 CE1 TYR A 22 3.946 -9.986 -2.233 1.00 0.00 C ATOM 283 CE2 TYR A 22 2.118 -11.037 -1.102 1.00 0.00 C ATOM 284 CZ TYR A 22 2.942 -10.932 -2.202 1.00 0.00 C ATOM 285 OH TYR A 22 2.763 -11.774 -3.275 1.00 0.00 O ATOM 0 H TYR A 22 1.426 -7.151 -0.484 1.00 0.00 H new ATOM 0 HA TYR A 22 3.029 -6.326 1.843 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.566 -8.246 1.379 1.00 0.00 H new ATOM 0 HB3 TYR A 22 3.008 -8.729 2.020 1.00 0.00 H new ATOM 0 HD1 TYR A 22 4.911 -8.406 -1.179 1.00 0.00 H new ATOM 0 HD2 TYR A 22 1.651 -10.273 0.832 1.00 0.00 H new ATOM 0 HE1 TYR A 22 4.589 -9.905 -3.097 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.334 -11.779 -1.081 1.00 0.00 H new ATOM 0 HH TYR A 22 2.015 -12.381 -3.093 1.00 0.00 H new ATOM 295 N GLY A 23 5.118 -6.094 0.123 1.00 0.00 N ATOM 296 CA GLY A 23 6.019 -5.440 -0.808 1.00 0.00 C ATOM 297 C GLY A 23 5.977 -3.929 -0.692 1.00 0.00 C ATOM 298 O GLY A 23 6.824 -3.232 -1.250 1.00 0.00 O ATOM 0 H GLY A 23 5.564 -6.466 0.962 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.037 -5.787 -0.628 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.758 -5.730 -1.826 1.00 0.00 H new ATOM 302 N VAL A 24 4.986 -3.421 0.034 1.00 0.00 N ATOM 303 CA VAL A 24 4.836 -1.983 0.222 1.00 0.00 C ATOM 304 C VAL A 24 6.191 -1.307 0.401 1.00 0.00 C ATOM 305 O VAL A 24 7.002 -1.728 1.227 1.00 0.00 O ATOM 306 CB VAL A 24 3.951 -1.665 1.441 1.00 0.00 C ATOM 307 CG1 VAL A 24 3.856 -0.162 1.655 1.00 0.00 C ATOM 308 CG2 VAL A 24 2.568 -2.276 1.268 1.00 0.00 C ATOM 0 H VAL A 24 4.275 -3.984 0.501 1.00 0.00 H new ATOM 0 HA VAL A 24 4.356 -1.596 -0.677 1.00 0.00 H new ATOM 0 HB VAL A 24 4.410 -2.105 2.326 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.226 0.043 2.521 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.853 0.245 1.826 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.421 0.305 0.771 1.00 0.00 H new ATOM 0 HG21 VAL A 24 1.955 -2.042 2.138 1.00 0.00 H new ATOM 0 HG22 VAL A 24 2.099 -1.867 0.373 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.658 -3.358 1.168 1.00 0.00 H new ATOM 318 N LYS A 25 6.430 -0.257 -0.376 1.00 0.00 N ATOM 319 CA LYS A 25 7.686 0.480 -0.304 1.00 0.00 C ATOM 320 C LYS A 25 7.547 1.857 -0.944 1.00 0.00 C ATOM 321 O LYS A 25 6.710 2.062 -1.824 1.00 0.00 O ATOM 322 CB LYS A 25 8.803 -0.305 -0.995 1.00 0.00 C ATOM 323 CG LYS A 25 8.957 0.028 -2.469 1.00 0.00 C ATOM 324 CD LYS A 25 9.600 -1.117 -3.234 1.00 0.00 C ATOM 325 CE LYS A 25 11.118 -1.048 -3.168 1.00 0.00 C ATOM 326 NZ LYS A 25 11.643 -1.607 -1.891 1.00 0.00 N ATOM 0 H LYS A 25 5.769 0.104 -1.064 1.00 0.00 H new ATOM 0 HA LYS A 25 7.940 0.612 0.748 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.745 -0.105 -0.485 1.00 0.00 H new ATOM 0 HB3 LYS A 25 8.604 -1.372 -0.891 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.979 0.250 -2.897 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.564 0.927 -2.579 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.260 -2.067 -2.823 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.278 -1.087 -4.275 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.544 -1.598 -4.007 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.439 -0.011 -3.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.608 -1.966 -2.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.659 -0.861 -1.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.029 -2.384 -1.574 1.00 0.00 H new ATOM 340 N ILE A 26 8.372 2.798 -0.497 1.00 0.00 N ATOM 341 CA ILE A 26 8.341 4.155 -1.028 1.00 0.00 C ATOM 342 C ILE A 26 9.525 4.409 -1.956 1.00 0.00 C ATOM 343 O ILE A 26 10.569 4.899 -1.527 1.00 0.00 O ATOM 344 CB ILE A 26 8.355 5.203 0.100 1.00 0.00 C ATOM 345 CG1 ILE A 26 7.375 4.807 1.206 1.00 0.00 C ATOM 346 CG2 ILE A 26 8.014 6.580 -0.450 1.00 0.00 C ATOM 347 CD1 ILE A 26 6.017 4.388 0.687 1.00 0.00 C ATOM 0 H ILE A 26 9.070 2.646 0.231 1.00 0.00 H new ATOM 0 HA ILE A 26 7.412 4.252 -1.591 1.00 0.00 H new ATOM 0 HB ILE A 26 9.358 5.243 0.526 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.803 3.988 1.784 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.251 5.648 1.889 1.00 0.00 H new ATOM 0 HG21 ILE A 26 8.028 7.309 0.360 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.748 6.862 -1.205 1.00 0.00 H new ATOM 0 HG23 ILE A 26 7.021 6.557 -0.900 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.374 4.121 1.525 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.568 5.213 0.134 1.00 0.00 H new ATOM 0 HD13 ILE A 26 6.129 3.528 0.027 1.00 0.00 H new ATOM 359 N ILE A 27 9.353 4.072 -3.231 1.00 0.00 N ATOM 360 CA ILE A 27 10.405 4.267 -4.221 1.00 0.00 C ATOM 361 C ILE A 27 10.616 5.748 -4.516 1.00 0.00 C ATOM 362 O ILE A 27 11.750 6.213 -4.624 1.00 0.00 O ATOM 363 CB ILE A 27 10.083 3.534 -5.535 1.00 0.00 C ATOM 364 CG1 ILE A 27 8.757 4.034 -6.112 1.00 0.00 C ATOM 365 CG2 ILE A 27 10.033 2.031 -5.306 1.00 0.00 C ATOM 366 CD1 ILE A 27 8.385 3.381 -7.425 1.00 0.00 C ATOM 0 H ILE A 27 8.495 3.663 -3.602 1.00 0.00 H new ATOM 0 HA ILE A 27 11.319 3.851 -3.796 1.00 0.00 H new ATOM 0 HB ILE A 27 10.874 3.746 -6.254 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.963 3.852 -5.387 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.816 5.113 -6.256 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.804 1.527 -6.245 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.999 1.687 -4.936 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.260 1.800 -4.573 1.00 0.00 H new ATOM 0 HD11 ILE A 27 7.434 3.783 -7.775 1.00 0.00 H new ATOM 0 HD12 ILE A 27 9.159 3.584 -8.165 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.293 2.304 -7.283 1.00 0.00 H new ATOM 378 N GLU A 28 9.515 6.483 -4.643 1.00 0.00 N ATOM 379 CA GLU A 28 9.581 7.912 -4.924 1.00 0.00 C ATOM 380 C GLU A 28 9.087 8.725 -3.731 1.00 0.00 C ATOM 381 O GLU A 28 7.882 8.878 -3.525 1.00 0.00 O ATOM 382 CB GLU A 28 8.750 8.249 -6.163 1.00 0.00 C ATOM 383 CG GLU A 28 9.265 7.599 -7.437 1.00 0.00 C ATOM 384 CD GLU A 28 8.979 8.431 -8.672 1.00 0.00 C ATOM 385 OE1 GLU A 28 8.881 9.670 -8.544 1.00 0.00 O ATOM 386 OE2 GLU A 28 8.854 7.845 -9.768 1.00 0.00 O ATOM 0 H GLU A 28 8.569 6.113 -4.556 1.00 0.00 H new ATOM 0 HA GLU A 28 10.623 8.171 -5.112 1.00 0.00 H new ATOM 0 HB2 GLU A 28 7.720 7.935 -5.996 1.00 0.00 H new ATOM 0 HB3 GLU A 28 8.735 9.331 -6.297 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.340 7.441 -7.351 1.00 0.00 H new ATOM 0 HG3 GLU A 28 8.806 6.617 -7.551 1.00 0.00 H new ATOM 393 N LEU A 29 10.026 9.244 -2.947 1.00 0.00 N ATOM 394 CA LEU A 29 9.687 10.041 -1.773 1.00 0.00 C ATOM 395 C LEU A 29 10.029 11.510 -1.996 1.00 0.00 C ATOM 396 O LEU A 29 11.171 11.853 -2.302 1.00 0.00 O ATOM 397 CB LEU A 29 10.430 9.514 -0.543 1.00 0.00 C ATOM 398 CG LEU A 29 10.011 10.112 0.801 1.00 0.00 C ATOM 399 CD1 LEU A 29 8.585 9.707 1.143 1.00 0.00 C ATOM 400 CD2 LEU A 29 10.969 9.675 1.900 1.00 0.00 C ATOM 0 H LEU A 29 11.027 9.127 -3.103 1.00 0.00 H new ATOM 0 HA LEU A 29 8.613 9.958 -1.605 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.293 8.434 -0.496 1.00 0.00 H new ATOM 0 HB3 LEU A 29 11.496 9.695 -0.682 1.00 0.00 H new ATOM 0 HG LEU A 29 10.050 11.198 0.723 1.00 0.00 H new ATOM 0 HD11 LEU A 29 8.304 10.141 2.102 1.00 0.00 H new ATOM 0 HD12 LEU A 29 7.908 10.068 0.369 1.00 0.00 H new ATOM 0 HD13 LEU A 29 8.520 8.621 1.203 1.00 0.00 H new ATOM 0 HD21 LEU A 29 10.656 10.110 2.849 1.00 0.00 H new ATOM 0 HD22 LEU A 29 10.961 8.588 1.978 1.00 0.00 H new ATOM 0 HD23 LEU A 29 11.977 10.014 1.660 1.00 0.00 H new ATOM 412 N SER A 30 9.031 12.375 -1.838 1.00 0.00 N ATOM 413 CA SER A 30 9.226 13.809 -2.024 1.00 0.00 C ATOM 414 C SER A 30 8.947 14.566 -0.730 1.00 0.00 C ATOM 415 O SER A 30 8.656 13.964 0.304 1.00 0.00 O ATOM 416 CB SER A 30 8.315 14.327 -3.138 1.00 0.00 C ATOM 417 OG SER A 30 8.507 13.596 -4.337 1.00 0.00 O ATOM 0 H SER A 30 8.080 12.108 -1.582 1.00 0.00 H new ATOM 0 HA SER A 30 10.265 13.977 -2.306 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.274 14.251 -2.825 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.518 15.383 -3.316 1.00 0.00 H new ATOM 0 HG SER A 30 7.657 13.529 -4.819 1.00 0.00 H new ATOM 423 N GLN A 31 9.040 15.890 -0.795 1.00 0.00 N ATOM 424 CA GLN A 31 8.799 16.731 0.372 1.00 0.00 C ATOM 425 C GLN A 31 7.309 17.003 0.549 1.00 0.00 C ATOM 426 O GLN A 31 6.847 17.292 1.653 1.00 0.00 O ATOM 427 CB GLN A 31 9.558 18.053 0.240 1.00 0.00 C ATOM 428 CG GLN A 31 9.483 18.662 -1.152 1.00 0.00 C ATOM 429 CD GLN A 31 10.575 18.153 -2.072 1.00 0.00 C ATOM 430 OE1 GLN A 31 10.307 17.724 -3.194 1.00 0.00 O ATOM 431 NE2 GLN A 31 11.815 18.200 -1.601 1.00 0.00 N ATOM 0 H GLN A 31 9.280 16.404 -1.643 1.00 0.00 H new ATOM 0 HA GLN A 31 9.160 16.199 1.252 1.00 0.00 H new ATOM 0 HB2 GLN A 31 9.158 18.766 0.961 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.604 17.889 0.500 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.510 18.438 -1.590 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.555 19.747 -1.074 1.00 0.00 H new ATOM 0 HE21 GLN A 31 11.991 18.564 -0.665 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.592 17.872 -2.176 1.00 0.00 H new ATOM 440 N THR A 32 6.561 16.907 -0.546 1.00 0.00 N ATOM 441 CA THR A 32 5.123 17.145 -0.512 1.00 0.00 C ATOM 442 C THR A 32 4.351 15.893 -0.913 1.00 0.00 C ATOM 443 O THR A 32 3.257 15.636 -0.406 1.00 0.00 O ATOM 444 CB THR A 32 4.723 18.302 -1.446 1.00 0.00 C ATOM 445 OG1 THR A 32 5.280 18.096 -2.748 1.00 0.00 O ATOM 446 CG2 THR A 32 5.199 19.635 -0.889 1.00 0.00 C ATOM 0 H THR A 32 6.927 16.666 -1.467 1.00 0.00 H new ATOM 0 HA THR A 32 4.870 17.413 0.514 1.00 0.00 H new ATOM 0 HB THR A 32 3.636 18.323 -1.517 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.019 18.835 -3.336 1.00 0.00 H new ATOM 0 HG21 THR A 32 4.905 20.438 -1.565 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.749 19.802 0.090 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.285 19.622 -0.791 1.00 0.00 H new ATOM 454 N THR A 33 4.925 15.115 -1.825 1.00 0.00 N ATOM 455 CA THR A 33 4.290 13.890 -2.294 1.00 0.00 C ATOM 456 C THR A 33 5.043 12.658 -1.805 1.00 0.00 C ATOM 457 O THR A 33 6.138 12.767 -1.254 1.00 0.00 O ATOM 458 CB THR A 33 4.209 13.852 -3.832 1.00 0.00 C ATOM 459 OG1 THR A 33 5.481 14.187 -4.397 1.00 0.00 O ATOM 460 CG2 THR A 33 3.151 14.817 -4.342 1.00 0.00 C ATOM 0 H THR A 33 5.829 15.312 -2.254 1.00 0.00 H new ATOM 0 HA THR A 33 3.280 13.881 -1.884 1.00 0.00 H new ATOM 0 HB THR A 33 3.932 12.842 -4.135 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.422 14.159 -5.375 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.112 14.772 -5.430 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.179 14.541 -3.933 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.402 15.831 -4.029 1.00 0.00 H new ATOM 468 N ALA A 34 4.449 11.487 -2.010 1.00 0.00 N ATOM 469 CA ALA A 34 5.066 10.234 -1.592 1.00 0.00 C ATOM 470 C ALA A 34 4.416 9.043 -2.288 1.00 0.00 C ATOM 471 O ALA A 34 3.233 8.764 -2.088 1.00 0.00 O ATOM 472 CB ALA A 34 4.975 10.079 -0.082 1.00 0.00 C ATOM 0 H ALA A 34 3.541 11.380 -2.463 1.00 0.00 H new ATOM 0 HA ALA A 34 6.117 10.261 -1.881 1.00 0.00 H new ATOM 0 HB1 ALA A 34 5.440 9.139 0.216 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.492 10.908 0.401 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.928 10.078 0.221 1.00 0.00 H new ATOM 478 N LYS A 35 5.195 8.344 -3.106 1.00 0.00 N ATOM 479 CA LYS A 35 4.696 7.182 -3.833 1.00 0.00 C ATOM 480 C LYS A 35 4.902 5.906 -3.024 1.00 0.00 C ATOM 481 O LYS A 35 5.848 5.799 -2.244 1.00 0.00 O ATOM 482 CB LYS A 35 5.398 7.060 -5.186 1.00 0.00 C ATOM 483 CG LYS A 35 4.720 6.090 -6.138 1.00 0.00 C ATOM 484 CD LYS A 35 5.445 6.019 -7.472 1.00 0.00 C ATOM 485 CE LYS A 35 4.969 7.103 -8.425 1.00 0.00 C ATOM 486 NZ LYS A 35 5.763 8.354 -8.286 1.00 0.00 N ATOM 0 H LYS A 35 6.176 8.562 -3.283 1.00 0.00 H new ATOM 0 HA LYS A 35 3.627 7.319 -3.998 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.442 8.044 -5.653 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.427 6.738 -5.024 1.00 0.00 H new ATOM 0 HG2 LYS A 35 4.688 5.098 -5.687 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.688 6.400 -6.300 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.518 6.122 -7.310 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.283 5.040 -7.923 1.00 0.00 H new ATOM 0 HE2 LYS A 35 5.039 6.741 -9.451 1.00 0.00 H new ATOM 0 HE3 LYS A 35 3.918 7.318 -8.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.147 9.121 -7.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.533 8.203 -7.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 6.165 8.614 -9.209 1.00 0.00 H new ATOM 500 N VAL A 36 4.011 4.938 -3.215 1.00 0.00 N ATOM 501 CA VAL A 36 4.097 3.667 -2.506 1.00 0.00 C ATOM 502 C VAL A 36 3.811 2.495 -3.439 1.00 0.00 C ATOM 503 O VAL A 36 2.671 2.281 -3.852 1.00 0.00 O ATOM 504 CB VAL A 36 3.112 3.618 -1.322 1.00 0.00 C ATOM 505 CG1 VAL A 36 1.702 3.948 -1.786 1.00 0.00 C ATOM 506 CG2 VAL A 36 3.156 2.253 -0.650 1.00 0.00 C ATOM 0 H VAL A 36 3.221 5.010 -3.856 1.00 0.00 H new ATOM 0 HA VAL A 36 5.116 3.585 -2.127 1.00 0.00 H new ATOM 0 HB VAL A 36 3.412 4.368 -0.590 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.021 3.908 -0.936 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.686 4.949 -2.218 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.387 3.224 -2.537 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.455 2.235 0.184 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.882 1.483 -1.371 1.00 0.00 H new ATOM 0 HG23 VAL A 36 4.164 2.062 -0.281 1.00 0.00 H new ATOM 516 N SER A 37 4.854 1.740 -3.768 1.00 0.00 N ATOM 517 CA SER A 37 4.716 0.592 -4.656 1.00 0.00 C ATOM 518 C SER A 37 4.615 -0.703 -3.856 1.00 0.00 C ATOM 519 O SER A 37 5.520 -1.049 -3.095 1.00 0.00 O ATOM 520 CB SER A 37 5.902 0.520 -5.619 1.00 0.00 C ATOM 521 OG SER A 37 5.901 -0.701 -6.339 1.00 0.00 O ATOM 0 H SER A 37 5.804 1.903 -3.433 1.00 0.00 H new ATOM 0 HA SER A 37 3.798 0.716 -5.231 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.860 1.357 -6.316 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.834 0.616 -5.061 1.00 0.00 H new ATOM 0 HG SER A 37 6.668 -0.722 -6.949 1.00 0.00 H new ATOM 527 N PHE A 38 3.510 -1.418 -4.036 1.00 0.00 N ATOM 528 CA PHE A 38 3.288 -2.675 -3.332 1.00 0.00 C ATOM 529 C PHE A 38 2.943 -3.794 -4.310 1.00 0.00 C ATOM 530 O PHE A 38 2.909 -3.584 -5.521 1.00 0.00 O ATOM 531 CB PHE A 38 2.167 -2.518 -2.303 1.00 0.00 C ATOM 532 CG PHE A 38 1.029 -1.662 -2.782 1.00 0.00 C ATOM 533 CD1 PHE A 38 1.215 -0.311 -3.023 1.00 0.00 C ATOM 534 CD2 PHE A 38 -0.226 -2.210 -2.991 1.00 0.00 C ATOM 535 CE1 PHE A 38 0.171 0.479 -3.465 1.00 0.00 C ATOM 536 CE2 PHE A 38 -1.275 -1.425 -3.433 1.00 0.00 C ATOM 537 CZ PHE A 38 -1.076 -0.078 -3.669 1.00 0.00 C ATOM 0 H PHE A 38 2.753 -1.148 -4.664 1.00 0.00 H new ATOM 0 HA PHE A 38 4.211 -2.940 -2.816 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.784 -3.504 -2.041 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.579 -2.084 -1.392 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.188 0.130 -2.864 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.387 -3.262 -2.807 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.330 1.531 -3.651 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.249 -1.864 -3.594 1.00 0.00 H new ATOM 0 HZ PHE A 38 -1.894 0.538 -4.012 1.00 0.00 H new ATOM 547 N ASN A 39 2.687 -4.983 -3.774 1.00 0.00 N ATOM 548 CA ASN A 39 2.346 -6.136 -4.599 1.00 0.00 C ATOM 549 C ASN A 39 1.006 -6.730 -4.175 1.00 0.00 C ATOM 550 O ASN A 39 0.667 -6.745 -2.991 1.00 0.00 O ATOM 551 CB ASN A 39 3.441 -7.199 -4.505 1.00 0.00 C ATOM 552 CG ASN A 39 4.765 -6.717 -5.066 1.00 0.00 C ATOM 553 OD1 ASN A 39 4.808 -6.049 -6.100 1.00 0.00 O ATOM 554 ND2 ASN A 39 5.853 -7.051 -4.382 1.00 0.00 N ATOM 0 H ASN A 39 2.709 -5.173 -2.772 1.00 0.00 H new ATOM 0 HA ASN A 39 2.264 -5.800 -5.633 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.575 -7.488 -3.462 1.00 0.00 H new ATOM 0 HB3 ASN A 39 3.124 -8.092 -5.045 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.772 -6.753 -4.708 1.00 0.00 H new ATOM 0 HD22 ASN A 39 5.770 -7.606 -3.530 1.00 0.00 H new ATOM 561 N LYS A 40 0.247 -7.222 -5.149 1.00 0.00 N ATOM 562 CA LYS A 40 -1.054 -7.821 -4.878 1.00 0.00 C ATOM 563 C LYS A 40 -0.918 -9.022 -3.948 1.00 0.00 C ATOM 564 O LYS A 40 0.109 -9.701 -3.919 1.00 0.00 O ATOM 565 CB LYS A 40 -1.724 -8.247 -6.185 1.00 0.00 C ATOM 566 CG LYS A 40 -1.595 -7.222 -7.298 1.00 0.00 C ATOM 567 CD LYS A 40 -2.785 -7.267 -8.242 1.00 0.00 C ATOM 568 CE LYS A 40 -2.566 -8.266 -9.368 1.00 0.00 C ATOM 569 NZ LYS A 40 -1.934 -7.629 -10.557 1.00 0.00 N ATOM 0 H LYS A 40 0.511 -7.217 -6.134 1.00 0.00 H new ATOM 0 HA LYS A 40 -1.675 -7.073 -4.386 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -1.287 -9.188 -6.517 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -2.781 -8.435 -5.997 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -1.510 -6.225 -6.867 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.678 -7.406 -7.858 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -3.683 -7.536 -7.685 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.955 -6.276 -8.662 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -1.935 -9.081 -9.013 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.521 -8.705 -9.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -1.801 -8.341 -11.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -2.548 -6.868 -10.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -1.011 -7.232 -10.289 1.00 0.00 H new ATOM 583 N PRO A 41 -1.977 -9.294 -3.172 1.00 0.00 N ATOM 584 CA PRO A 41 -2.000 -10.417 -2.230 1.00 0.00 C ATOM 585 C PRO A 41 -2.047 -11.767 -2.936 1.00 0.00 C ATOM 586 O PRO A 41 -2.713 -11.919 -3.961 1.00 0.00 O ATOM 587 CB PRO A 41 -3.286 -10.185 -1.433 1.00 0.00 C ATOM 588 CG PRO A 41 -4.159 -9.394 -2.345 1.00 0.00 C ATOM 589 CD PRO A 41 -3.235 -8.528 -3.156 1.00 0.00 C ATOM 0 HA PRO A 41 -1.101 -10.451 -1.615 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.755 -11.129 -1.155 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.086 -9.644 -0.508 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.745 -10.049 -2.989 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.866 -8.787 -1.779 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.619 -8.364 -4.163 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.102 -7.546 -2.702 1.00 0.00 H new ATOM 597 N ASP A 42 -1.337 -12.744 -2.384 1.00 0.00 N ATOM 598 CA ASP A 42 -1.300 -14.083 -2.961 1.00 0.00 C ATOM 599 C ASP A 42 -2.710 -14.622 -3.177 1.00 0.00 C ATOM 600 O ASP A 42 -2.957 -15.390 -4.107 1.00 0.00 O ATOM 601 CB ASP A 42 -0.511 -15.031 -2.055 1.00 0.00 C ATOM 602 CG ASP A 42 -0.401 -16.427 -2.634 1.00 0.00 C ATOM 603 OD1 ASP A 42 0.178 -16.569 -3.732 1.00 0.00 O ATOM 604 OD2 ASP A 42 -0.892 -17.378 -1.991 1.00 0.00 O ATOM 0 H ASP A 42 -0.779 -12.634 -1.537 1.00 0.00 H new ATOM 0 HA ASP A 42 -0.803 -14.020 -3.929 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.489 -14.628 -1.895 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.994 -15.083 -1.079 1.00 0.00 H new ATOM 609 N SER A 43 -3.632 -14.214 -2.311 1.00 0.00 N ATOM 610 CA SER A 43 -5.019 -14.659 -2.404 1.00 0.00 C ATOM 611 C SER A 43 -5.961 -13.472 -2.569 1.00 0.00 C ATOM 612 O SER A 43 -5.549 -12.316 -2.456 1.00 0.00 O ATOM 613 CB SER A 43 -5.403 -15.461 -1.158 1.00 0.00 C ATOM 614 OG SER A 43 -6.598 -16.192 -1.372 1.00 0.00 O ATOM 0 H SER A 43 -3.445 -13.576 -1.537 1.00 0.00 H new ATOM 0 HA SER A 43 -5.112 -15.298 -3.282 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.595 -16.146 -0.899 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.532 -14.786 -0.312 1.00 0.00 H new ATOM 0 HG SER A 43 -6.822 -16.697 -0.563 1.00 0.00 H new ATOM 620 N HIS A 44 -7.230 -13.763 -2.837 1.00 0.00 N ATOM 621 CA HIS A 44 -8.233 -12.720 -3.018 1.00 0.00 C ATOM 622 C HIS A 44 -9.413 -12.932 -2.075 1.00 0.00 C ATOM 623 O HIS A 44 -9.892 -11.992 -1.443 1.00 0.00 O ATOM 624 CB HIS A 44 -8.720 -12.697 -4.467 1.00 0.00 C ATOM 625 CG HIS A 44 -9.103 -14.047 -4.991 1.00 0.00 C ATOM 626 ND1 HIS A 44 -10.318 -14.641 -4.724 1.00 0.00 N ATOM 627 CD2 HIS A 44 -8.423 -14.918 -5.774 1.00 0.00 C ATOM 628 CE1 HIS A 44 -10.369 -15.819 -5.318 1.00 0.00 C ATOM 629 NE2 HIS A 44 -9.232 -16.012 -5.962 1.00 0.00 N ATOM 0 H HIS A 44 -7.588 -14.713 -2.934 1.00 0.00 H new ATOM 0 HA HIS A 44 -7.771 -11.761 -2.783 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -9.579 -12.030 -4.543 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -7.936 -12.280 -5.099 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -7.430 -14.778 -6.176 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -11.200 -16.508 -5.283 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -8.994 -16.839 -6.510 1.00 0.00 H new ATOM 638 N GLY A 45 -9.877 -14.175 -1.986 1.00 0.00 N ATOM 639 CA GLY A 45 -10.999 -14.488 -1.119 1.00 0.00 C ATOM 640 C GLY A 45 -12.255 -14.827 -1.896 1.00 0.00 C ATOM 641 O GLY A 45 -13.336 -14.319 -1.596 1.00 0.00 O ATOM 0 H GLY A 45 -9.496 -14.971 -2.498 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.735 -15.328 -0.477 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.198 -13.638 -0.466 1.00 0.00 H new ATOM 645 N GLY A 46 -12.115 -15.687 -2.899 1.00 0.00 N ATOM 646 CA GLY A 46 -13.256 -16.077 -3.707 1.00 0.00 C ATOM 647 C GLY A 46 -13.604 -15.042 -4.757 1.00 0.00 C ATOM 648 O GLY A 46 -13.528 -15.312 -5.956 1.00 0.00 O ATOM 0 H GLY A 46 -11.232 -16.121 -3.167 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -13.043 -17.028 -4.195 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -14.118 -16.237 -3.059 1.00 0.00 H new ATOM 652 N VAL A 47 -13.989 -13.851 -4.307 1.00 0.00 N ATOM 653 CA VAL A 47 -14.351 -12.771 -5.216 1.00 0.00 C ATOM 654 C VAL A 47 -13.116 -12.012 -5.687 1.00 0.00 C ATOM 655 O VAL A 47 -12.141 -11.845 -4.954 1.00 0.00 O ATOM 656 CB VAL A 47 -15.326 -11.780 -4.552 1.00 0.00 C ATOM 657 CG1 VAL A 47 -16.714 -12.393 -4.438 1.00 0.00 C ATOM 658 CG2 VAL A 47 -14.807 -11.358 -3.186 1.00 0.00 C ATOM 0 H VAL A 47 -14.058 -13.611 -3.318 1.00 0.00 H new ATOM 0 HA VAL A 47 -14.841 -13.231 -6.074 1.00 0.00 H new ATOM 0 HB VAL A 47 -15.398 -10.891 -5.179 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -17.389 -11.679 -3.967 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -17.085 -12.641 -5.432 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -16.663 -13.298 -3.833 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.508 -10.658 -2.731 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.705 -12.236 -2.548 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.835 -10.877 -3.299 1.00 0.00 H new ATOM 668 N PRO A 48 -13.155 -11.538 -6.942 1.00 0.00 N ATOM 669 CA PRO A 48 -12.046 -10.787 -7.540 1.00 0.00 C ATOM 670 C PRO A 48 -11.882 -9.404 -6.919 1.00 0.00 C ATOM 671 O PRO A 48 -12.864 -8.759 -6.551 1.00 0.00 O ATOM 672 CB PRO A 48 -12.451 -10.668 -9.012 1.00 0.00 C ATOM 673 CG PRO A 48 -13.938 -10.770 -9.004 1.00 0.00 C ATOM 674 CD PRO A 48 -14.284 -11.700 -7.874 1.00 0.00 C ATOM 0 HA PRO A 48 -11.088 -11.283 -7.386 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -12.121 -9.721 -9.438 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -12.003 -11.460 -9.611 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -14.395 -9.791 -8.858 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -14.308 -11.156 -9.954 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -15.232 -11.431 -7.408 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -14.378 -12.731 -8.216 1.00 0.00 H new ATOM 682 N ILE A 49 -10.636 -8.956 -6.806 1.00 0.00 N ATOM 683 CA ILE A 49 -10.345 -7.649 -6.231 1.00 0.00 C ATOM 684 C ILE A 49 -10.815 -6.527 -7.151 1.00 0.00 C ATOM 685 O ILE A 49 -10.728 -6.634 -8.374 1.00 0.00 O ATOM 686 CB ILE A 49 -8.839 -7.477 -5.959 1.00 0.00 C ATOM 687 CG1 ILE A 49 -8.358 -8.522 -4.951 1.00 0.00 C ATOM 688 CG2 ILE A 49 -8.549 -6.071 -5.454 1.00 0.00 C ATOM 689 CD1 ILE A 49 -6.852 -8.574 -4.806 1.00 0.00 C ATOM 0 H ILE A 49 -9.813 -9.479 -7.105 1.00 0.00 H new ATOM 0 HA ILE A 49 -10.886 -7.592 -5.286 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.297 -7.625 -6.893 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.801 -8.308 -3.979 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -8.720 -9.504 -5.257 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.481 -5.965 -5.266 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.860 -5.344 -6.204 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -9.099 -5.896 -4.529 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.583 -9.337 -4.075 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.402 -8.818 -5.768 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.485 -7.604 -4.470 1.00 0.00 H new ATOM 701 N HIS A 50 -11.313 -5.449 -6.552 1.00 0.00 N ATOM 702 CA HIS A 50 -11.796 -4.304 -7.317 1.00 0.00 C ATOM 703 C HIS A 50 -10.749 -3.196 -7.355 1.00 0.00 C ATOM 704 O HIS A 50 -10.360 -2.731 -8.428 1.00 0.00 O ATOM 705 CB HIS A 50 -13.096 -3.773 -6.714 1.00 0.00 C ATOM 706 CG HIS A 50 -14.325 -4.413 -7.283 1.00 0.00 C ATOM 707 ND1 HIS A 50 -15.452 -4.675 -6.533 1.00 0.00 N ATOM 708 CD2 HIS A 50 -14.601 -4.840 -8.536 1.00 0.00 C ATOM 709 CE1 HIS A 50 -16.368 -5.238 -7.301 1.00 0.00 C ATOM 710 NE2 HIS A 50 -15.877 -5.350 -8.522 1.00 0.00 N ATOM 0 H HIS A 50 -11.393 -5.345 -5.540 1.00 0.00 H new ATOM 0 HA HIS A 50 -11.987 -4.635 -8.338 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -13.079 -3.933 -5.636 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -13.149 -2.696 -6.876 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -13.941 -4.790 -9.389 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -17.351 -5.553 -6.984 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -16.365 -5.750 -9.324 1.00 0.00 H new ATOM 719 N HIS A 51 -10.295 -2.776 -6.178 1.00 0.00 N ATOM 720 CA HIS A 51 -9.292 -1.721 -6.078 1.00 0.00 C ATOM 721 C HIS A 51 -8.565 -1.790 -4.739 1.00 0.00 C ATOM 722 O HIS A 51 -8.835 -2.667 -3.919 1.00 0.00 O ATOM 723 CB HIS A 51 -9.946 -0.349 -6.247 1.00 0.00 C ATOM 724 CG HIS A 51 -10.948 -0.027 -5.182 1.00 0.00 C ATOM 725 ND1 HIS A 51 -12.108 -0.749 -4.996 1.00 0.00 N ATOM 726 CD2 HIS A 51 -10.957 0.945 -4.240 1.00 0.00 C ATOM 727 CE1 HIS A 51 -12.788 -0.234 -3.988 1.00 0.00 C ATOM 728 NE2 HIS A 51 -12.111 0.796 -3.512 1.00 0.00 N ATOM 0 H HIS A 51 -10.605 -3.150 -5.281 1.00 0.00 H new ATOM 0 HA HIS A 51 -8.564 -1.868 -6.875 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.170 0.416 -6.247 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -10.436 -0.307 -7.220 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -10.197 1.698 -4.089 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.736 -0.593 -3.616 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.399 1.385 -2.731 1.00 0.00 H new ATOM 737 N TYR A 52 -7.642 -0.858 -4.524 1.00 0.00 N ATOM 738 CA TYR A 52 -6.874 -0.815 -3.285 1.00 0.00 C ATOM 739 C TYR A 52 -7.136 0.483 -2.527 1.00 0.00 C ATOM 740 O TYR A 52 -7.098 1.569 -3.104 1.00 0.00 O ATOM 741 CB TYR A 52 -5.379 -0.952 -3.583 1.00 0.00 C ATOM 742 CG TYR A 52 -4.963 -2.356 -3.958 1.00 0.00 C ATOM 743 CD1 TYR A 52 -4.735 -3.319 -2.981 1.00 0.00 C ATOM 744 CD2 TYR A 52 -4.797 -2.721 -5.287 1.00 0.00 C ATOM 745 CE1 TYR A 52 -4.354 -4.603 -3.319 1.00 0.00 C ATOM 746 CE2 TYR A 52 -4.418 -4.003 -5.635 1.00 0.00 C ATOM 747 CZ TYR A 52 -4.198 -4.940 -4.647 1.00 0.00 C ATOM 748 OH TYR A 52 -3.818 -6.218 -4.988 1.00 0.00 O ATOM 0 H TYR A 52 -7.408 -0.123 -5.191 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.192 -1.650 -2.660 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.115 -0.275 -4.395 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -4.812 -0.636 -2.707 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.858 -3.059 -1.940 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.967 -1.989 -6.063 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -4.179 -5.339 -2.548 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -4.295 -4.270 -6.674 1.00 0.00 H new ATOM 0 HH TYR A 52 -4.193 -6.448 -5.864 1.00 0.00 H new ATOM 758 N GLN A 53 -7.400 0.360 -1.230 1.00 0.00 N ATOM 759 CA GLN A 53 -7.668 1.523 -0.392 1.00 0.00 C ATOM 760 C GLN A 53 -6.424 1.928 0.391 1.00 0.00 C ATOM 761 O GLN A 53 -5.847 1.121 1.120 1.00 0.00 O ATOM 762 CB GLN A 53 -8.819 1.228 0.571 1.00 0.00 C ATOM 763 CG GLN A 53 -9.379 2.469 1.248 1.00 0.00 C ATOM 764 CD GLN A 53 -10.837 2.316 1.634 1.00 0.00 C ATOM 765 OE1 GLN A 53 -11.676 1.954 0.806 1.00 0.00 O ATOM 766 NE2 GLN A 53 -11.148 2.590 2.895 1.00 0.00 N ATOM 0 H GLN A 53 -7.434 -0.532 -0.737 1.00 0.00 H new ATOM 0 HA GLN A 53 -7.950 2.351 -1.042 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.620 0.729 0.025 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.473 0.532 1.335 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -8.792 2.688 2.140 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -9.272 3.323 0.579 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -10.421 2.886 3.547 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -12.114 2.504 3.212 1.00 0.00 H new ATOM 775 N VAL A 54 -6.015 3.183 0.235 1.00 0.00 N ATOM 776 CA VAL A 54 -4.840 3.696 0.928 1.00 0.00 C ATOM 777 C VAL A 54 -5.213 4.823 1.883 1.00 0.00 C ATOM 778 O VAL A 54 -5.860 5.794 1.490 1.00 0.00 O ATOM 779 CB VAL A 54 -3.782 4.210 -0.066 1.00 0.00 C ATOM 780 CG1 VAL A 54 -2.587 4.788 0.677 1.00 0.00 C ATOM 781 CG2 VAL A 54 -3.347 3.094 -1.005 1.00 0.00 C ATOM 0 H VAL A 54 -6.481 3.863 -0.366 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.421 2.866 1.497 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.227 5.005 -0.664 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.850 5.146 -0.042 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.915 5.617 1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.139 4.016 1.302 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.599 3.475 -1.701 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.920 2.276 -0.425 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.210 2.731 -1.563 1.00 0.00 H new ATOM 791 N ASP A 55 -4.801 4.689 3.138 1.00 0.00 N ATOM 792 CA ASP A 55 -5.091 5.698 4.151 1.00 0.00 C ATOM 793 C ASP A 55 -3.802 6.271 4.731 1.00 0.00 C ATOM 794 O ASP A 55 -2.931 5.532 5.188 1.00 0.00 O ATOM 795 CB ASP A 55 -5.945 5.098 5.269 1.00 0.00 C ATOM 796 CG ASP A 55 -7.118 4.298 4.737 1.00 0.00 C ATOM 797 OD1 ASP A 55 -7.079 3.907 3.551 1.00 0.00 O ATOM 798 OD2 ASP A 55 -8.073 4.062 5.505 1.00 0.00 O ATOM 0 H ASP A 55 -4.265 3.891 3.479 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.645 6.507 3.675 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -5.323 4.455 5.892 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -6.316 5.899 5.909 1.00 0.00 H new ATOM 803 N VAL A 56 -3.687 7.596 4.707 1.00 0.00 N ATOM 804 CA VAL A 56 -2.505 8.270 5.231 1.00 0.00 C ATOM 805 C VAL A 56 -2.888 9.501 6.043 1.00 0.00 C ATOM 806 O VAL A 56 -3.926 10.119 5.803 1.00 0.00 O ATOM 807 CB VAL A 56 -1.551 8.692 4.097 1.00 0.00 C ATOM 808 CG1 VAL A 56 -2.148 9.839 3.297 1.00 0.00 C ATOM 809 CG2 VAL A 56 -0.191 9.075 4.661 1.00 0.00 C ATOM 0 H VAL A 56 -4.398 8.223 4.330 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.995 7.557 5.879 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.415 7.845 3.425 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.460 10.124 2.501 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.097 9.524 2.862 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.315 10.692 3.954 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.471 9.370 3.847 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.306 9.908 5.355 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.239 8.222 5.186 1.00 0.00 H new ATOM 819 N LYS A 57 -2.044 9.856 7.005 1.00 0.00 N ATOM 820 CA LYS A 57 -2.292 11.016 7.853 1.00 0.00 C ATOM 821 C LYS A 57 -1.075 11.325 8.721 1.00 0.00 C ATOM 822 O LYS A 57 -0.136 10.534 8.792 1.00 0.00 O ATOM 823 CB LYS A 57 -3.515 10.773 8.740 1.00 0.00 C ATOM 824 CG LYS A 57 -3.180 10.147 10.083 1.00 0.00 C ATOM 825 CD LYS A 57 -4.396 10.095 10.992 1.00 0.00 C ATOM 826 CE LYS A 57 -4.094 9.346 12.282 1.00 0.00 C ATOM 827 NZ LYS A 57 -4.943 9.821 13.409 1.00 0.00 N ATOM 0 H LYS A 57 -1.181 9.356 7.217 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.484 11.873 7.207 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.025 11.721 8.908 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.214 10.125 8.211 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -2.796 9.139 9.930 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -2.388 10.720 10.565 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -4.721 11.109 11.226 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.221 9.608 10.471 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -4.256 8.279 12.129 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.043 9.475 12.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -5.021 9.071 14.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -4.511 10.665 13.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -5.890 10.060 13.053 1.00 0.00 H new ATOM 841 N GLU A 58 -1.103 12.480 9.379 1.00 0.00 N ATOM 842 CA GLU A 58 -0.003 12.892 10.243 1.00 0.00 C ATOM 843 C GLU A 58 -0.059 12.162 11.582 1.00 0.00 C ATOM 844 O GLU A 58 -1.132 11.971 12.154 1.00 0.00 O ATOM 845 CB GLU A 58 -0.044 14.404 10.473 1.00 0.00 C ATOM 846 CG GLU A 58 0.729 15.198 9.434 1.00 0.00 C ATOM 847 CD GLU A 58 0.319 16.658 9.392 1.00 0.00 C ATOM 848 OE1 GLU A 58 -0.672 16.977 8.703 1.00 0.00 O ATOM 849 OE2 GLU A 58 0.990 17.480 10.049 1.00 0.00 O ATOM 0 H GLU A 58 -1.874 13.146 9.330 1.00 0.00 H new ATOM 0 HA GLU A 58 0.932 12.632 9.746 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.082 14.735 10.473 1.00 0.00 H new ATOM 0 HB3 GLU A 58 0.360 14.624 11.461 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.795 15.130 9.649 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.573 14.752 8.452 1.00 0.00 H new ATOM 856 N VAL A 59 1.106 11.753 12.076 1.00 0.00 N ATOM 857 CA VAL A 59 1.191 11.044 13.347 1.00 0.00 C ATOM 858 C VAL A 59 0.529 11.840 14.466 1.00 0.00 C ATOM 859 O VAL A 59 0.267 11.312 15.546 1.00 0.00 O ATOM 860 CB VAL A 59 2.654 10.758 13.733 1.00 0.00 C ATOM 861 CG1 VAL A 59 3.485 12.030 13.657 1.00 0.00 C ATOM 862 CG2 VAL A 59 2.728 10.144 15.124 1.00 0.00 C ATOM 0 H VAL A 59 2.004 11.901 11.615 1.00 0.00 H new ATOM 0 HA VAL A 59 0.665 10.098 13.217 1.00 0.00 H new ATOM 0 HB VAL A 59 3.066 10.041 13.022 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.516 11.808 13.933 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.458 12.422 12.640 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.077 12.772 14.343 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.769 9.948 15.380 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.299 10.835 15.850 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.169 9.209 15.139 1.00 0.00 H new ATOM 872 N ALA A 60 0.259 13.114 14.198 1.00 0.00 N ATOM 873 CA ALA A 60 -0.376 13.982 15.181 1.00 0.00 C ATOM 874 C ALA A 60 -1.847 14.207 14.847 1.00 0.00 C ATOM 875 O ALA A 60 -2.692 14.283 15.739 1.00 0.00 O ATOM 876 CB ALA A 60 0.358 15.313 15.263 1.00 0.00 C ATOM 0 H ALA A 60 0.470 13.567 13.309 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.322 13.489 16.152 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.127 15.951 16.001 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.393 15.140 15.557 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.335 15.802 14.289 1.00 0.00 H new ATOM 882 N SER A 61 -2.146 14.314 13.557 1.00 0.00 N ATOM 883 CA SER A 61 -3.515 14.535 13.105 1.00 0.00 C ATOM 884 C SER A 61 -4.416 13.372 13.510 1.00 0.00 C ATOM 885 O SER A 61 -3.935 12.289 13.841 1.00 0.00 O ATOM 886 CB SER A 61 -3.549 14.716 11.586 1.00 0.00 C ATOM 887 OG SER A 61 -4.883 14.763 11.108 1.00 0.00 O ATOM 0 H SER A 61 -1.459 14.251 12.806 1.00 0.00 H new ATOM 0 HA SER A 61 -3.887 15.442 13.581 1.00 0.00 H new ATOM 0 HB2 SER A 61 -3.029 15.635 11.314 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.016 13.895 11.107 1.00 0.00 H new ATOM 0 HG SER A 61 -4.878 14.881 10.135 1.00 0.00 H new ATOM 893 N GLU A 62 -5.723 13.606 13.481 1.00 0.00 N ATOM 894 CA GLU A 62 -6.691 12.579 13.846 1.00 0.00 C ATOM 895 C GLU A 62 -7.496 12.133 12.628 1.00 0.00 C ATOM 896 O GLU A 62 -8.091 11.055 12.626 1.00 0.00 O ATOM 897 CB GLU A 62 -7.635 13.099 14.932 1.00 0.00 C ATOM 898 CG GLU A 62 -8.329 11.996 15.714 1.00 0.00 C ATOM 899 CD GLU A 62 -9.653 12.442 16.303 1.00 0.00 C ATOM 900 OE1 GLU A 62 -10.660 12.445 15.564 1.00 0.00 O ATOM 901 OE2 GLU A 62 -9.681 12.790 17.502 1.00 0.00 O ATOM 0 H GLU A 62 -6.136 14.498 13.209 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.143 11.720 14.232 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.070 13.723 15.624 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.390 13.736 14.471 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.497 11.142 15.058 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -7.674 11.658 16.517 1.00 0.00 H new ATOM 908 N ILE A 63 -7.511 12.970 11.596 1.00 0.00 N ATOM 909 CA ILE A 63 -8.242 12.662 10.374 1.00 0.00 C ATOM 910 C ILE A 63 -7.395 11.824 9.422 1.00 0.00 C ATOM 911 O ILE A 63 -6.188 12.036 9.300 1.00 0.00 O ATOM 912 CB ILE A 63 -8.692 13.944 9.649 1.00 0.00 C ATOM 913 CG1 ILE A 63 -9.541 14.812 10.580 1.00 0.00 C ATOM 914 CG2 ILE A 63 -9.468 13.595 8.387 1.00 0.00 C ATOM 915 CD1 ILE A 63 -10.976 14.348 10.698 1.00 0.00 C ATOM 0 H ILE A 63 -7.025 13.867 11.582 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.123 12.092 10.669 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.806 14.511 9.362 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -9.087 14.819 11.571 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -9.529 15.840 10.217 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.779 14.512 7.886 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.833 13.014 7.719 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.348 13.009 8.652 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -11.518 15.010 11.374 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -11.447 14.368 9.715 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -10.999 13.331 11.090 1.00 0.00 H new ATOM 927 N TRP A 64 -8.035 10.873 8.752 1.00 0.00 N ATOM 928 CA TRP A 64 -7.339 10.004 7.808 1.00 0.00 C ATOM 929 C TRP A 64 -7.708 10.355 6.371 1.00 0.00 C ATOM 930 O TRP A 64 -8.858 10.681 6.076 1.00 0.00 O ATOM 931 CB TRP A 64 -7.675 8.539 8.091 1.00 0.00 C ATOM 932 CG TRP A 64 -6.923 7.972 9.258 1.00 0.00 C ATOM 933 CD1 TRP A 64 -7.240 8.103 10.580 1.00 0.00 C ATOM 934 CD2 TRP A 64 -5.729 7.185 9.206 1.00 0.00 C ATOM 935 NE1 TRP A 64 -6.313 7.446 11.352 1.00 0.00 N ATOM 936 CE2 TRP A 64 -5.376 6.873 10.534 1.00 0.00 C ATOM 937 CE3 TRP A 64 -4.923 6.711 8.167 1.00 0.00 C ATOM 938 CZ2 TRP A 64 -4.253 6.112 10.847 1.00 0.00 C ATOM 939 CZ3 TRP A 64 -3.809 5.956 8.480 1.00 0.00 C ATOM 940 CH2 TRP A 64 -3.483 5.661 9.811 1.00 0.00 C ATOM 0 H TRP A 64 -9.033 10.683 8.844 1.00 0.00 H new ATOM 0 HA TRP A 64 -6.267 10.155 7.935 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -8.745 8.449 8.279 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.456 7.945 7.204 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.093 8.643 10.962 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.321 7.393 12.371 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -5.167 6.931 7.138 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -3.999 5.886 11.872 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.178 5.587 7.685 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.607 5.066 10.022 1.00 0.00 H new ATOM 951 N LYS A 65 -6.725 10.285 5.479 1.00 0.00 N ATOM 952 CA LYS A 65 -6.945 10.593 4.072 1.00 0.00 C ATOM 953 C LYS A 65 -6.971 9.320 3.233 1.00 0.00 C ATOM 954 O LYS A 65 -5.974 8.601 3.149 1.00 0.00 O ATOM 955 CB LYS A 65 -5.854 11.534 3.557 1.00 0.00 C ATOM 956 CG LYS A 65 -5.783 12.852 4.308 1.00 0.00 C ATOM 957 CD LYS A 65 -5.040 13.910 3.510 1.00 0.00 C ATOM 958 CE LYS A 65 -5.948 14.575 2.486 1.00 0.00 C ATOM 959 NZ LYS A 65 -6.640 15.767 3.049 1.00 0.00 N ATOM 0 H LYS A 65 -5.768 10.017 5.707 1.00 0.00 H new ATOM 0 HA LYS A 65 -7.913 11.086 3.982 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.889 11.032 3.629 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.030 11.737 2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -6.792 13.202 4.527 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -5.284 12.700 5.265 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -4.640 14.664 4.188 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.190 13.454 3.003 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -5.360 14.873 1.618 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.689 13.856 2.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.249 16.191 2.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.222 15.479 3.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.933 16.464 3.359 1.00 0.00 H new ATOM 973 N ILE A 66 -8.114 9.046 2.614 1.00 0.00 N ATOM 974 CA ILE A 66 -8.267 7.859 1.781 1.00 0.00 C ATOM 975 C ILE A 66 -7.924 8.163 0.327 1.00 0.00 C ATOM 976 O ILE A 66 -8.271 9.221 -0.197 1.00 0.00 O ATOM 977 CB ILE A 66 -9.700 7.301 1.853 1.00 0.00 C ATOM 978 CG1 ILE A 66 -10.068 6.968 3.301 1.00 0.00 C ATOM 979 CG2 ILE A 66 -9.834 6.069 0.971 1.00 0.00 C ATOM 980 CD1 ILE A 66 -9.348 5.755 3.843 1.00 0.00 C ATOM 0 H ILE A 66 -8.948 9.630 2.673 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.576 7.110 2.167 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.389 8.062 1.487 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.841 7.827 3.932 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.143 6.801 3.365 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.853 5.686 1.033 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.608 6.335 -0.062 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.137 5.302 1.309 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.657 5.578 4.873 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.595 4.884 3.236 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -8.272 5.926 3.812 1.00 0.00 H new ATOM 992 N VAL A 67 -7.242 7.225 -0.323 1.00 0.00 N ATOM 993 CA VAL A 67 -6.854 7.390 -1.719 1.00 0.00 C ATOM 994 C VAL A 67 -6.885 6.057 -2.459 1.00 0.00 C ATOM 995 O VAL A 67 -6.009 5.212 -2.274 1.00 0.00 O ATOM 996 CB VAL A 67 -5.446 8.000 -1.842 1.00 0.00 C ATOM 997 CG1 VAL A 67 -5.006 8.038 -3.297 1.00 0.00 C ATOM 998 CG2 VAL A 67 -5.413 9.393 -1.230 1.00 0.00 C ATOM 0 H VAL A 67 -6.947 6.343 0.095 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.577 8.070 -2.170 1.00 0.00 H new ATOM 0 HB VAL A 67 -4.747 7.370 -1.292 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -4.009 8.472 -3.364 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.988 7.025 -3.698 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.705 8.644 -3.873 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.410 9.809 -1.326 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -6.124 10.036 -1.750 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.682 9.334 -0.175 1.00 0.00 H new ATOM 1008 N ARG A 68 -7.901 5.875 -3.297 1.00 0.00 N ATOM 1009 CA ARG A 68 -8.047 4.645 -4.065 1.00 0.00 C ATOM 1010 C ARG A 68 -7.329 4.753 -5.408 1.00 0.00 C ATOM 1011 O ARG A 68 -6.847 5.823 -5.780 1.00 0.00 O ATOM 1012 CB ARG A 68 -9.526 4.330 -4.289 1.00 0.00 C ATOM 1013 CG ARG A 68 -10.309 5.483 -4.897 1.00 0.00 C ATOM 1014 CD ARG A 68 -11.766 5.112 -5.120 1.00 0.00 C ATOM 1015 NE ARG A 68 -11.906 3.932 -5.970 1.00 0.00 N ATOM 1016 CZ ARG A 68 -13.045 3.578 -6.554 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -14.138 4.310 -6.381 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -13.093 2.491 -7.313 1.00 0.00 N ATOM 0 H ARG A 68 -8.635 6.564 -3.461 1.00 0.00 H new ATOM 0 HA ARG A 68 -7.593 3.835 -3.494 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -9.609 3.461 -4.942 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -9.979 4.057 -3.336 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.250 6.351 -4.240 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -9.857 5.771 -5.846 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -12.244 4.925 -4.158 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -12.288 5.952 -5.577 1.00 0.00 H new ATOM 0 HE ARG A 68 -11.084 3.348 -6.123 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -14.105 5.147 -5.798 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -15.012 4.036 -6.831 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -12.255 1.926 -7.448 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -13.968 2.220 -7.761 1.00 0.00 H new ATOM 1032 N SER A 69 -7.264 3.639 -6.129 1.00 0.00 N ATOM 1033 CA SER A 69 -6.602 3.608 -7.428 1.00 0.00 C ATOM 1034 C SER A 69 -7.601 3.300 -8.540 1.00 0.00 C ATOM 1035 O SER A 69 -8.374 2.346 -8.449 1.00 0.00 O ATOM 1036 CB SER A 69 -5.484 2.564 -7.430 1.00 0.00 C ATOM 1037 OG SER A 69 -4.893 2.448 -6.147 1.00 0.00 O ATOM 0 H SER A 69 -7.661 2.746 -5.836 1.00 0.00 H new ATOM 0 HA SER A 69 -6.171 4.592 -7.611 1.00 0.00 H new ATOM 0 HB2 SER A 69 -5.884 1.598 -7.738 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.724 2.842 -8.160 1.00 0.00 H new ATOM 0 HG SER A 69 -4.183 1.773 -6.174 1.00 0.00 H new ATOM 1043 N HIS A 70 -7.580 4.117 -9.589 1.00 0.00 N ATOM 1044 CA HIS A 70 -8.483 3.933 -10.720 1.00 0.00 C ATOM 1045 C HIS A 70 -8.674 2.451 -11.026 1.00 0.00 C ATOM 1046 O HIS A 70 -9.800 1.956 -11.075 1.00 0.00 O ATOM 1047 CB HIS A 70 -7.944 4.656 -11.953 1.00 0.00 C ATOM 1048 CG HIS A 70 -8.663 4.301 -13.218 1.00 0.00 C ATOM 1049 ND1 HIS A 70 -9.774 4.983 -13.668 1.00 0.00 N ATOM 1050 CD2 HIS A 70 -8.423 3.331 -14.130 1.00 0.00 C ATOM 1051 CE1 HIS A 70 -10.187 4.445 -14.803 1.00 0.00 C ATOM 1052 NE2 HIS A 70 -9.385 3.441 -15.105 1.00 0.00 N ATOM 0 H HIS A 70 -6.948 4.912 -9.679 1.00 0.00 H new ATOM 0 HA HIS A 70 -9.451 4.358 -10.454 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -8.016 5.732 -11.794 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -6.886 4.421 -12.068 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.624 2.605 -14.098 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -11.037 4.772 -15.384 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -9.466 2.844 -15.928 1.00 0.00 H new ATOM 1061 N GLY A 71 -7.565 1.747 -11.235 1.00 0.00 N ATOM 1062 CA GLY A 71 -7.632 0.328 -11.537 1.00 0.00 C ATOM 1063 C GLY A 71 -7.132 -0.531 -10.393 1.00 0.00 C ATOM 1064 O GLY A 71 -7.234 -0.148 -9.228 1.00 0.00 O ATOM 0 H GLY A 71 -6.622 2.134 -11.201 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.662 0.057 -11.768 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.040 0.121 -12.429 1.00 0.00 H new ATOM 1068 N VAL A 72 -6.591 -1.700 -10.725 1.00 0.00 N ATOM 1069 CA VAL A 72 -6.074 -2.616 -9.717 1.00 0.00 C ATOM 1070 C VAL A 72 -4.558 -2.509 -9.602 1.00 0.00 C ATOM 1071 O VAL A 72 -3.881 -3.481 -9.267 1.00 0.00 O ATOM 1072 CB VAL A 72 -6.451 -4.075 -10.038 1.00 0.00 C ATOM 1073 CG1 VAL A 72 -7.962 -4.248 -10.040 1.00 0.00 C ATOM 1074 CG2 VAL A 72 -5.858 -4.496 -11.374 1.00 0.00 C ATOM 0 H VAL A 72 -6.500 -2.034 -11.685 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.528 -2.331 -8.768 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.036 -4.718 -9.262 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.209 -5.285 -10.269 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.359 -3.988 -9.059 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.402 -3.595 -10.794 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.134 -5.529 -11.585 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.242 -3.849 -12.163 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -4.772 -4.412 -11.333 1.00 0.00 H new ATOM 1084 N GLN A 73 -4.031 -1.321 -9.881 1.00 0.00 N ATOM 1085 CA GLN A 73 -2.594 -1.087 -9.810 1.00 0.00 C ATOM 1086 C GLN A 73 -2.127 -1.004 -8.359 1.00 0.00 C ATOM 1087 O GLN A 73 -2.918 -0.729 -7.456 1.00 0.00 O ATOM 1088 CB GLN A 73 -2.228 0.201 -10.549 1.00 0.00 C ATOM 1089 CG GLN A 73 -2.802 1.455 -9.910 1.00 0.00 C ATOM 1090 CD GLN A 73 -2.622 2.686 -10.775 1.00 0.00 C ATOM 1091 OE1 GLN A 73 -1.830 2.686 -11.719 1.00 0.00 O ATOM 1092 NE2 GLN A 73 -3.356 3.747 -10.457 1.00 0.00 N ATOM 0 H GLN A 73 -4.578 -0.506 -10.158 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.091 -1.927 -10.288 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.142 0.289 -10.591 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -2.583 0.133 -11.577 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -3.864 1.305 -9.715 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.321 1.620 -8.946 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -4.000 3.704 -9.667 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -3.276 4.605 -11.003 1.00 0.00 H new ATOM 1101 N THR A 74 -0.838 -1.244 -8.142 1.00 0.00 N ATOM 1102 CA THR A 74 -0.267 -1.198 -6.802 1.00 0.00 C ATOM 1103 C THR A 74 0.709 -0.036 -6.661 1.00 0.00 C ATOM 1104 O THR A 74 1.507 0.006 -5.724 1.00 0.00 O ATOM 1105 CB THR A 74 0.462 -2.510 -6.457 1.00 0.00 C ATOM 1106 OG1 THR A 74 1.545 -2.724 -7.369 1.00 0.00 O ATOM 1107 CG2 THR A 74 -0.496 -3.692 -6.514 1.00 0.00 C ATOM 0 H THR A 74 -0.169 -1.472 -8.878 1.00 0.00 H new ATOM 0 HA THR A 74 -1.097 -1.059 -6.109 1.00 0.00 H new ATOM 0 HB THR A 74 0.853 -2.427 -5.443 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.377 -2.848 -6.866 1.00 0.00 H new ATOM 0 HG21 THR A 74 0.041 -4.608 -6.267 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.304 -3.540 -5.798 1.00 0.00 H new ATOM 0 HG23 THR A 74 -0.912 -3.775 -7.518 1.00 0.00 H new ATOM 1115 N MET A 75 0.640 0.906 -7.596 1.00 0.00 N ATOM 1116 CA MET A 75 1.518 2.071 -7.573 1.00 0.00 C ATOM 1117 C MET A 75 0.706 3.363 -7.569 1.00 0.00 C ATOM 1118 O MET A 75 -0.022 3.652 -8.519 1.00 0.00 O ATOM 1119 CB MET A 75 2.461 2.050 -8.777 1.00 0.00 C ATOM 1120 CG MET A 75 3.759 2.805 -8.546 1.00 0.00 C ATOM 1121 SD MET A 75 5.010 2.434 -9.790 1.00 0.00 S ATOM 1122 CE MET A 75 5.469 4.084 -10.312 1.00 0.00 C ATOM 0 H MET A 75 -0.014 0.886 -8.378 1.00 0.00 H new ATOM 0 HA MET A 75 2.109 2.032 -6.658 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.692 1.015 -9.029 1.00 0.00 H new ATOM 0 HB3 MET A 75 1.948 2.480 -9.637 1.00 0.00 H new ATOM 0 HG2 MET A 75 3.557 3.876 -8.548 1.00 0.00 H new ATOM 0 HG3 MET A 75 4.149 2.556 -7.559 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.833 4.053 -11.339 1.00 0.00 H new ATOM 0 HE2 MET A 75 4.599 4.739 -10.255 1.00 0.00 H new ATOM 0 HE3 MET A 75 6.254 4.467 -9.660 1.00 0.00 H new ATOM 1132 N VAL A 76 0.838 4.136 -6.497 1.00 0.00 N ATOM 1133 CA VAL A 76 0.118 5.398 -6.371 1.00 0.00 C ATOM 1134 C VAL A 76 0.996 6.471 -5.740 1.00 0.00 C ATOM 1135 O VAL A 76 1.917 6.169 -4.980 1.00 0.00 O ATOM 1136 CB VAL A 76 -1.159 5.233 -5.526 1.00 0.00 C ATOM 1137 CG1 VAL A 76 -2.043 6.465 -5.648 1.00 0.00 C ATOM 1138 CG2 VAL A 76 -1.916 3.980 -5.943 1.00 0.00 C ATOM 0 H VAL A 76 1.437 3.911 -5.703 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.159 5.706 -7.379 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.870 5.124 -4.481 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.940 6.330 -5.044 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.497 7.341 -5.296 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.326 6.608 -6.691 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -2.815 3.879 -5.336 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.195 4.056 -6.994 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.281 3.106 -5.798 1.00 0.00 H new ATOM 1148 N VAL A 77 0.705 7.729 -6.058 1.00 0.00 N ATOM 1149 CA VAL A 77 1.469 8.849 -5.520 1.00 0.00 C ATOM 1150 C VAL A 77 0.594 9.740 -4.645 1.00 0.00 C ATOM 1151 O VAL A 77 -0.458 10.214 -5.078 1.00 0.00 O ATOM 1152 CB VAL A 77 2.084 9.701 -6.647 1.00 0.00 C ATOM 1153 CG1 VAL A 77 1.020 10.570 -7.301 1.00 0.00 C ATOM 1154 CG2 VAL A 77 3.223 10.553 -6.108 1.00 0.00 C ATOM 0 H VAL A 77 -0.053 7.998 -6.685 1.00 0.00 H new ATOM 0 HA VAL A 77 2.271 8.425 -4.916 1.00 0.00 H new ATOM 0 HB VAL A 77 2.489 9.032 -7.406 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.473 11.165 -8.094 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.241 9.935 -7.723 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.583 11.234 -6.555 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.646 11.149 -6.917 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.845 11.215 -5.329 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.995 9.906 -5.691 1.00 0.00 H new ATOM 1164 N LEU A 78 1.035 9.965 -3.413 1.00 0.00 N ATOM 1165 CA LEU A 78 0.292 10.801 -2.475 1.00 0.00 C ATOM 1166 C LEU A 78 0.700 12.264 -2.609 1.00 0.00 C ATOM 1167 O LEU A 78 1.831 12.573 -2.982 1.00 0.00 O ATOM 1168 CB LEU A 78 0.527 10.325 -1.040 1.00 0.00 C ATOM 1169 CG LEU A 78 0.000 8.928 -0.703 1.00 0.00 C ATOM 1170 CD1 LEU A 78 0.435 8.519 0.696 1.00 0.00 C ATOM 1171 CD2 LEU A 78 -1.515 8.885 -0.827 1.00 0.00 C ATOM 0 H LEU A 78 1.903 9.581 -3.039 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.769 10.715 -2.711 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.599 10.345 -0.842 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.064 11.040 -0.360 1.00 0.00 H new ATOM 0 HG LEU A 78 0.422 8.219 -1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.052 7.523 0.920 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.524 8.510 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.042 9.231 1.422 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -1.872 7.884 -0.584 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.957 9.605 -0.138 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.804 9.135 -1.848 1.00 0.00 H new ATOM 1183 N ASN A 79 -0.230 13.163 -2.300 1.00 0.00 N ATOM 1184 CA ASN A 79 0.034 14.595 -2.385 1.00 0.00 C ATOM 1185 C ASN A 79 -0.584 15.332 -1.200 1.00 0.00 C ATOM 1186 O ASN A 79 -1.160 14.716 -0.305 1.00 0.00 O ATOM 1187 CB ASN A 79 -0.519 15.160 -3.695 1.00 0.00 C ATOM 1188 CG ASN A 79 -1.736 14.399 -4.185 1.00 0.00 C ATOM 1189 OD1 ASN A 79 -1.827 14.041 -5.360 1.00 0.00 O ATOM 1190 ND2 ASN A 79 -2.679 14.148 -3.284 1.00 0.00 N ATOM 0 H ASN A 79 -1.172 12.925 -1.989 1.00 0.00 H new ATOM 0 HA ASN A 79 1.114 14.743 -2.361 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.782 16.208 -3.553 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.258 15.127 -4.458 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -3.521 13.640 -3.555 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -2.561 14.464 -2.321 1.00 0.00 H new ATOM 1197 N ASN A 80 -0.459 16.656 -1.204 1.00 0.00 N ATOM 1198 CA ASN A 80 -1.005 17.478 -0.130 1.00 0.00 C ATOM 1199 C ASN A 80 -0.385 17.100 1.212 1.00 0.00 C ATOM 1200 O ASN A 80 -1.094 16.828 2.182 1.00 0.00 O ATOM 1201 CB ASN A 80 -2.525 17.323 -0.063 1.00 0.00 C ATOM 1202 CG ASN A 80 -3.240 18.191 -1.081 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -3.936 19.142 -0.723 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -3.071 17.866 -2.358 1.00 0.00 N ATOM 0 H ASN A 80 0.015 17.182 -1.938 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.762 18.519 -0.343 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.789 16.279 -0.231 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.870 17.582 0.938 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -3.527 18.413 -3.088 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -2.485 17.069 -2.608 1.00 0.00 H new ATOM 1211 N LEU A 81 0.943 17.087 1.261 1.00 0.00 N ATOM 1212 CA LEU A 81 1.660 16.744 2.484 1.00 0.00 C ATOM 1213 C LEU A 81 2.694 17.811 2.826 1.00 0.00 C ATOM 1214 O LEU A 81 3.289 18.420 1.938 1.00 0.00 O ATOM 1215 CB LEU A 81 2.343 15.384 2.334 1.00 0.00 C ATOM 1216 CG LEU A 81 1.541 14.305 1.605 1.00 0.00 C ATOM 1217 CD1 LEU A 81 2.457 13.190 1.126 1.00 0.00 C ATOM 1218 CD2 LEU A 81 0.450 13.751 2.509 1.00 0.00 C ATOM 0 H LEU A 81 1.545 17.310 0.468 1.00 0.00 H new ATOM 0 HA LEU A 81 0.937 16.692 3.298 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.284 15.529 1.803 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.592 15.013 3.328 1.00 0.00 H new ATOM 0 HG LEU A 81 1.068 14.757 0.733 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.868 12.432 0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.201 13.599 0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 81 2.959 12.739 1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -0.111 12.984 1.974 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.902 13.315 3.400 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -0.224 14.556 2.801 1.00 0.00 H new ATOM 1230 N GLU A 82 2.906 18.031 4.121 1.00 0.00 N ATOM 1231 CA GLU A 82 3.870 19.024 4.579 1.00 0.00 C ATOM 1232 C GLU A 82 5.270 18.424 4.662 1.00 0.00 C ATOM 1233 O GLU A 82 5.457 17.266 5.037 1.00 0.00 O ATOM 1234 CB GLU A 82 3.457 19.575 5.946 1.00 0.00 C ATOM 1235 CG GLU A 82 2.123 20.301 5.931 1.00 0.00 C ATOM 1236 CD GLU A 82 1.860 21.061 7.217 1.00 0.00 C ATOM 1237 OE1 GLU A 82 2.801 21.698 7.735 1.00 0.00 O ATOM 1238 OE2 GLU A 82 0.710 21.019 7.705 1.00 0.00 O ATOM 0 H GLU A 82 2.423 17.535 4.870 1.00 0.00 H new ATOM 0 HA GLU A 82 3.885 19.840 3.856 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.406 18.753 6.659 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.229 20.258 6.302 1.00 0.00 H new ATOM 0 HG2 GLU A 82 2.101 20.996 5.091 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.322 19.579 5.769 1.00 0.00 H new ATOM 1245 N PRO A 83 6.281 19.231 4.303 1.00 0.00 N ATOM 1246 CA PRO A 83 7.683 18.801 4.328 1.00 0.00 C ATOM 1247 C PRO A 83 8.207 18.614 5.748 1.00 0.00 C ATOM 1248 O PRO A 83 7.654 19.162 6.700 1.00 0.00 O ATOM 1249 CB PRO A 83 8.417 19.951 3.633 1.00 0.00 C ATOM 1250 CG PRO A 83 7.545 21.140 3.843 1.00 0.00 C ATOM 1251 CD PRO A 83 6.133 20.622 3.845 1.00 0.00 C ATOM 0 HA PRO A 83 7.822 17.834 3.845 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.407 20.105 4.062 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.558 19.746 2.572 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.780 21.635 4.785 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.690 21.875 3.051 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.494 21.199 4.513 1.00 0.00 H new ATOM 0 HD3 PRO A 83 5.685 20.673 2.853 1.00 0.00 H new ATOM 1259 N ASN A 84 9.276 17.838 5.880 1.00 0.00 N ATOM 1260 CA ASN A 84 9.876 17.578 7.185 1.00 0.00 C ATOM 1261 C ASN A 84 8.826 17.087 8.177 1.00 0.00 C ATOM 1262 O ASN A 84 8.868 17.423 9.361 1.00 0.00 O ATOM 1263 CB ASN A 84 10.547 18.844 7.721 1.00 0.00 C ATOM 1264 CG ASN A 84 11.603 18.540 8.767 1.00 0.00 C ATOM 1265 OD1 ASN A 84 11.720 17.407 9.235 1.00 0.00 O ATOM 1266 ND2 ASN A 84 12.377 19.553 9.138 1.00 0.00 N ATOM 0 H ASN A 84 9.746 17.378 5.100 1.00 0.00 H new ATOM 0 HA ASN A 84 10.629 16.799 7.064 1.00 0.00 H new ATOM 0 HB2 ASN A 84 11.004 19.387 6.894 1.00 0.00 H new ATOM 0 HB3 ASN A 84 9.790 19.498 8.153 1.00 0.00 H new ATOM 0 HD21 ASN A 84 13.105 19.409 9.838 1.00 0.00 H new ATOM 0 HD22 ASN A 84 12.244 20.475 8.723 1.00 0.00 H new ATOM 1273 N THR A 85 7.884 16.287 7.685 1.00 0.00 N ATOM 1274 CA THR A 85 6.823 15.749 8.528 1.00 0.00 C ATOM 1275 C THR A 85 6.664 14.247 8.319 1.00 0.00 C ATOM 1276 O THR A 85 7.044 13.711 7.278 1.00 0.00 O ATOM 1277 CB THR A 85 5.476 16.440 8.245 1.00 0.00 C ATOM 1278 OG1 THR A 85 5.561 17.832 8.577 1.00 0.00 O ATOM 1279 CG2 THR A 85 4.356 15.791 9.044 1.00 0.00 C ATOM 0 H THR A 85 7.835 15.998 6.708 1.00 0.00 H new ATOM 0 HA THR A 85 7.112 15.941 9.561 1.00 0.00 H new ATOM 0 HB THR A 85 5.253 16.332 7.184 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.219 18.267 7.995 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.415 16.296 8.827 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.275 14.739 8.769 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.575 15.872 10.109 1.00 0.00 H new ATOM 1287 N THR A 86 6.098 13.573 9.316 1.00 0.00 N ATOM 1288 CA THR A 86 5.890 12.133 9.242 1.00 0.00 C ATOM 1289 C THR A 86 4.419 11.801 9.015 1.00 0.00 C ATOM 1290 O THR A 86 3.532 12.518 9.480 1.00 0.00 O ATOM 1291 CB THR A 86 6.371 11.427 10.524 1.00 0.00 C ATOM 1292 OG1 THR A 86 7.732 11.779 10.794 1.00 0.00 O ATOM 1293 CG2 THR A 86 6.249 9.917 10.389 1.00 0.00 C ATOM 0 H THR A 86 5.776 14.002 10.184 1.00 0.00 H new ATOM 0 HA THR A 86 6.477 11.773 8.397 1.00 0.00 H new ATOM 0 HB THR A 86 5.740 11.753 11.351 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.031 11.328 11.611 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.595 9.441 11.306 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.207 9.651 10.212 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.858 9.576 9.552 1.00 0.00 H new ATOM 1301 N TYR A 87 4.166 10.712 8.298 1.00 0.00 N ATOM 1302 CA TYR A 87 2.802 10.287 8.008 1.00 0.00 C ATOM 1303 C TYR A 87 2.700 8.765 7.978 1.00 0.00 C ATOM 1304 O TYR A 87 3.556 8.087 7.411 1.00 0.00 O ATOM 1305 CB TYR A 87 2.338 10.867 6.671 1.00 0.00 C ATOM 1306 CG TYR A 87 2.577 12.354 6.541 1.00 0.00 C ATOM 1307 CD1 TYR A 87 3.863 12.862 6.401 1.00 0.00 C ATOM 1308 CD2 TYR A 87 1.516 13.252 6.557 1.00 0.00 C ATOM 1309 CE1 TYR A 87 4.085 14.220 6.282 1.00 0.00 C ATOM 1310 CE2 TYR A 87 1.730 14.612 6.438 1.00 0.00 C ATOM 1311 CZ TYR A 87 3.016 15.091 6.301 1.00 0.00 C ATOM 1312 OH TYR A 87 3.233 16.445 6.182 1.00 0.00 O ATOM 0 H TYR A 87 4.888 10.107 7.907 1.00 0.00 H new ATOM 0 HA TYR A 87 2.156 10.661 8.802 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.856 10.352 5.862 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.274 10.666 6.547 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.703 12.183 6.385 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.508 12.881 6.664 1.00 0.00 H new ATOM 0 HE1 TYR A 87 5.091 14.598 6.175 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.895 15.296 6.452 1.00 0.00 H new ATOM 0 HH TYR A 87 4.054 16.601 5.670 1.00 0.00 H new ATOM 1322 N GLU A 88 1.646 8.237 8.591 1.00 0.00 N ATOM 1323 CA GLU A 88 1.432 6.795 8.635 1.00 0.00 C ATOM 1324 C GLU A 88 0.493 6.351 7.516 1.00 0.00 C ATOM 1325 O GLU A 88 -0.649 6.803 7.433 1.00 0.00 O ATOM 1326 CB GLU A 88 0.856 6.384 9.991 1.00 0.00 C ATOM 1327 CG GLU A 88 1.604 6.974 11.174 1.00 0.00 C ATOM 1328 CD GLU A 88 1.289 6.265 12.477 1.00 0.00 C ATOM 1329 OE1 GLU A 88 1.827 5.160 12.697 1.00 0.00 O ATOM 1330 OE2 GLU A 88 0.504 6.817 13.277 1.00 0.00 O ATOM 0 H GLU A 88 0.927 8.785 9.064 1.00 0.00 H new ATOM 0 HA GLU A 88 2.396 6.305 8.494 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.188 6.693 10.041 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.871 5.297 10.068 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.676 6.919 10.985 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.351 8.030 11.269 1.00 0.00 H new ATOM 1337 N ILE A 89 0.984 5.462 6.659 1.00 0.00 N ATOM 1338 CA ILE A 89 0.190 4.956 5.545 1.00 0.00 C ATOM 1339 C ILE A 89 -0.041 3.454 5.674 1.00 0.00 C ATOM 1340 O ILE A 89 0.805 2.728 6.196 1.00 0.00 O ATOM 1341 CB ILE A 89 0.867 5.246 4.193 1.00 0.00 C ATOM 1342 CG1 ILE A 89 0.398 4.243 3.137 1.00 0.00 C ATOM 1343 CG2 ILE A 89 2.381 5.201 4.339 1.00 0.00 C ATOM 1344 CD1 ILE A 89 0.782 4.627 1.727 1.00 0.00 C ATOM 0 H ILE A 89 1.927 5.077 6.714 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.769 5.474 5.579 1.00 0.00 H new ATOM 0 HB ILE A 89 0.582 6.247 3.868 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.819 3.264 3.366 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.686 4.146 3.196 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.846 5.408 3.375 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.699 5.951 5.064 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.684 4.212 4.683 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.417 3.871 1.032 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.339 5.592 1.479 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.867 4.696 1.651 1.00 0.00 H new ATOM 1356 N ARG A 90 -1.191 2.995 5.193 1.00 0.00 N ATOM 1357 CA ARG A 90 -1.534 1.579 5.253 1.00 0.00 C ATOM 1358 C ARG A 90 -2.310 1.154 4.009 1.00 0.00 C ATOM 1359 O ARG A 90 -3.290 1.793 3.627 1.00 0.00 O ATOM 1360 CB ARG A 90 -2.360 1.285 6.507 1.00 0.00 C ATOM 1361 CG ARG A 90 -3.677 2.042 6.561 1.00 0.00 C ATOM 1362 CD ARG A 90 -4.379 1.846 7.896 1.00 0.00 C ATOM 1363 NE ARG A 90 -5.514 2.751 8.056 1.00 0.00 N ATOM 1364 CZ ARG A 90 -6.132 2.956 9.213 1.00 0.00 C ATOM 1365 NH1 ARG A 90 -5.727 2.325 10.307 1.00 0.00 N ATOM 1366 NH2 ARG A 90 -7.157 3.796 9.280 1.00 0.00 N ATOM 0 H ARG A 90 -1.902 3.583 4.757 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.606 1.008 5.295 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.563 0.215 6.555 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.770 1.537 7.388 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.494 3.104 6.397 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.326 1.702 5.754 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.723 0.815 7.976 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -3.669 2.009 8.706 1.00 0.00 H new ATOM 0 HE ARG A 90 -5.850 3.253 7.234 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -4.938 1.680 10.261 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.204 2.485 11.194 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.471 4.285 8.442 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.631 3.952 10.170 1.00 0.00 H new ATOM 1380 N VAL A 91 -1.863 0.071 3.381 1.00 0.00 N ATOM 1381 CA VAL A 91 -2.515 -0.439 2.181 1.00 0.00 C ATOM 1382 C VAL A 91 -3.429 -1.615 2.510 1.00 0.00 C ATOM 1383 O VAL A 91 -3.120 -2.430 3.379 1.00 0.00 O ATOM 1384 CB VAL A 91 -1.482 -0.886 1.129 1.00 0.00 C ATOM 1385 CG1 VAL A 91 -2.177 -1.297 -0.161 1.00 0.00 C ATOM 1386 CG2 VAL A 91 -0.473 0.223 0.870 1.00 0.00 C ATOM 0 H VAL A 91 -1.053 -0.470 3.683 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.110 0.378 1.772 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.945 -1.752 1.516 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.432 -1.610 -0.892 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.857 -2.124 0.040 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.740 -0.452 -0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.249 -0.109 0.125 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.992 1.109 0.503 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.047 0.465 1.797 1.00 0.00 H new ATOM 1396 N ALA A 92 -4.555 -1.695 1.809 1.00 0.00 N ATOM 1397 CA ALA A 92 -5.514 -2.772 2.025 1.00 0.00 C ATOM 1398 C ALA A 92 -6.183 -3.181 0.717 1.00 0.00 C ATOM 1399 O ALA A 92 -6.245 -2.398 -0.231 1.00 0.00 O ATOM 1400 CB ALA A 92 -6.560 -2.351 3.046 1.00 0.00 C ATOM 0 H ALA A 92 -4.826 -1.027 1.087 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.972 -3.635 2.412 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.269 -3.165 3.197 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.071 -2.115 3.991 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.090 -1.471 2.682 1.00 0.00 H new ATOM 1406 N ALA A 93 -6.682 -4.412 0.673 1.00 0.00 N ATOM 1407 CA ALA A 93 -7.348 -4.924 -0.518 1.00 0.00 C ATOM 1408 C ALA A 93 -8.864 -4.896 -0.354 1.00 0.00 C ATOM 1409 O ALA A 93 -9.405 -5.453 0.599 1.00 0.00 O ATOM 1410 CB ALA A 93 -6.874 -6.338 -0.822 1.00 0.00 C ATOM 0 H ALA A 93 -6.638 -5.073 1.449 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.087 -4.277 -1.356 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -7.380 -6.707 -1.714 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -5.797 -6.332 -0.992 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.105 -6.988 0.022 1.00 0.00 H new ATOM 1416 N VAL A 94 -9.543 -4.243 -1.292 1.00 0.00 N ATOM 1417 CA VAL A 94 -10.997 -4.142 -1.252 1.00 0.00 C ATOM 1418 C VAL A 94 -11.629 -4.817 -2.465 1.00 0.00 C ATOM 1419 O VAL A 94 -11.388 -4.420 -3.604 1.00 0.00 O ATOM 1420 CB VAL A 94 -11.457 -2.673 -1.198 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -12.968 -2.581 -1.347 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -10.999 -2.019 0.096 1.00 0.00 C ATOM 0 H VAL A 94 -9.109 -3.776 -2.089 1.00 0.00 H new ATOM 0 HA VAL A 94 -11.324 -4.651 -0.345 1.00 0.00 H new ATOM 0 HB VAL A 94 -11.001 -2.136 -2.030 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -13.275 -1.536 -1.306 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.266 -3.010 -2.304 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.448 -3.131 -0.538 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.333 -0.982 0.117 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -11.424 -2.554 0.945 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -9.911 -2.052 0.155 1.00 0.00 H new ATOM 1432 N ASN A 95 -12.437 -5.840 -2.211 1.00 0.00 N ATOM 1433 CA ASN A 95 -13.105 -6.571 -3.282 1.00 0.00 C ATOM 1434 C ASN A 95 -14.618 -6.559 -3.089 1.00 0.00 C ATOM 1435 O ASN A 95 -15.121 -6.071 -2.078 1.00 0.00 O ATOM 1436 CB ASN A 95 -12.598 -8.014 -3.335 1.00 0.00 C ATOM 1437 CG ASN A 95 -12.940 -8.794 -2.081 1.00 0.00 C ATOM 1438 OD1 ASN A 95 -13.412 -8.229 -1.095 1.00 0.00 O ATOM 1439 ND2 ASN A 95 -12.703 -10.100 -2.113 1.00 0.00 N ATOM 0 H ASN A 95 -12.646 -6.182 -1.273 1.00 0.00 H new ATOM 0 HA ASN A 95 -12.874 -6.076 -4.225 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -13.030 -8.516 -4.201 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.517 -8.011 -3.474 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -12.913 -10.677 -1.298 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -12.311 -10.527 -2.952 1.00 0.00 H new ATOM 1446 N GLY A 96 -15.338 -7.101 -4.066 1.00 0.00 N ATOM 1447 CA GLY A 96 -16.787 -7.143 -3.985 1.00 0.00 C ATOM 1448 C GLY A 96 -17.280 -7.470 -2.590 1.00 0.00 C ATOM 1449 O GLY A 96 -18.339 -7.002 -2.171 1.00 0.00 O ATOM 0 H GLY A 96 -14.944 -7.512 -4.912 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -17.193 -6.180 -4.294 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -17.166 -7.888 -4.685 1.00 0.00 H new ATOM 1453 N LYS A 97 -16.512 -8.278 -1.867 1.00 0.00 N ATOM 1454 CA LYS A 97 -16.876 -8.670 -0.510 1.00 0.00 C ATOM 1455 C LYS A 97 -16.755 -7.488 0.447 1.00 0.00 C ATOM 1456 O LYS A 97 -17.718 -7.118 1.117 1.00 0.00 O ATOM 1457 CB LYS A 97 -15.985 -9.819 -0.033 1.00 0.00 C ATOM 1458 CG LYS A 97 -16.475 -10.476 1.246 1.00 0.00 C ATOM 1459 CD LYS A 97 -17.374 -11.667 0.952 1.00 0.00 C ATOM 1460 CE LYS A 97 -18.843 -11.273 0.972 1.00 0.00 C ATOM 1461 NZ LYS A 97 -19.361 -11.136 2.362 1.00 0.00 N ATOM 0 H LYS A 97 -15.633 -8.675 -2.198 1.00 0.00 H new ATOM 0 HA LYS A 97 -17.914 -9.003 -0.520 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -15.925 -10.572 -0.819 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -14.974 -9.443 0.126 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -15.621 -10.802 1.839 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -17.020 -9.747 1.845 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -17.121 -12.084 -0.023 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -17.196 -12.450 1.689 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -18.973 -10.330 0.441 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -19.428 -12.023 0.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -20.365 -10.867 2.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -19.260 -12.043 2.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -18.820 -10.403 2.863 1.00 0.00 H new ATOM 1475 N GLY A 98 -15.564 -6.899 0.506 1.00 0.00 N ATOM 1476 CA GLY A 98 -15.341 -5.764 1.383 1.00 0.00 C ATOM 1477 C GLY A 98 -13.868 -5.471 1.588 1.00 0.00 C ATOM 1478 O GLY A 98 -13.051 -5.717 0.702 1.00 0.00 O ATOM 0 H GLY A 98 -14.750 -7.187 -0.037 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -15.829 -4.884 0.964 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -15.808 -5.958 2.349 1.00 0.00 H new ATOM 1482 N GLN A 99 -13.529 -4.943 2.760 1.00 0.00 N ATOM 1483 CA GLN A 99 -12.144 -4.614 3.077 1.00 0.00 C ATOM 1484 C GLN A 99 -11.535 -5.659 4.006 1.00 0.00 C ATOM 1485 O GLN A 99 -11.801 -5.668 5.206 1.00 0.00 O ATOM 1486 CB GLN A 99 -12.061 -3.230 3.723 1.00 0.00 C ATOM 1487 CG GLN A 99 -10.642 -2.790 4.040 1.00 0.00 C ATOM 1488 CD GLN A 99 -10.565 -1.344 4.487 1.00 0.00 C ATOM 1489 OE1 GLN A 99 -11.156 -0.962 5.497 1.00 0.00 O ATOM 1490 NE2 GLN A 99 -9.832 -0.530 3.736 1.00 0.00 N ATOM 0 H GLN A 99 -14.194 -4.734 3.505 1.00 0.00 H new ATOM 0 HA GLN A 99 -11.577 -4.607 2.146 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -12.519 -2.499 3.056 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -12.646 -3.232 4.643 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.233 -3.430 4.822 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.018 -2.927 3.157 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -9.359 -0.889 2.907 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.742 0.454 3.989 1.00 0.00 H new ATOM 1499 N GLY A 100 -10.715 -6.540 3.440 1.00 0.00 N ATOM 1500 CA GLY A 100 -10.082 -7.579 4.232 1.00 0.00 C ATOM 1501 C GLY A 100 -9.384 -7.027 5.459 1.00 0.00 C ATOM 1502 O GLY A 100 -10.031 -6.701 6.455 1.00 0.00 O ATOM 0 H GLY A 100 -10.478 -6.553 2.448 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.834 -8.305 4.541 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.359 -8.112 3.615 1.00 0.00 H new ATOM 1506 N ASP A 101 -8.062 -6.922 5.389 1.00 0.00 N ATOM 1507 CA ASP A 101 -7.275 -6.406 6.504 1.00 0.00 C ATOM 1508 C ASP A 101 -6.201 -5.443 6.011 1.00 0.00 C ATOM 1509 O ASP A 101 -5.645 -5.619 4.927 1.00 0.00 O ATOM 1510 CB ASP A 101 -6.630 -7.558 7.277 1.00 0.00 C ATOM 1511 CG ASP A 101 -7.551 -8.134 8.334 1.00 0.00 C ATOM 1512 OD1 ASP A 101 -8.405 -8.976 7.983 1.00 0.00 O ATOM 1513 OD2 ASP A 101 -7.417 -7.744 9.512 1.00 0.00 O ATOM 0 H ASP A 101 -7.512 -7.187 4.572 1.00 0.00 H new ATOM 0 HA ASP A 101 -7.946 -5.863 7.170 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.346 -8.345 6.579 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.714 -7.206 7.751 1.00 0.00 H new ATOM 1518 N TYR A 102 -5.914 -4.424 6.813 1.00 0.00 N ATOM 1519 CA TYR A 102 -4.908 -3.430 6.457 1.00 0.00 C ATOM 1520 C TYR A 102 -3.501 -3.992 6.633 1.00 0.00 C ATOM 1521 O TYR A 102 -3.256 -4.820 7.510 1.00 0.00 O ATOM 1522 CB TYR A 102 -5.078 -2.173 7.312 1.00 0.00 C ATOM 1523 CG TYR A 102 -6.228 -1.294 6.875 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -6.085 -0.405 5.816 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -7.457 -1.352 7.520 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -7.132 0.400 5.413 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -8.510 -0.551 7.123 1.00 0.00 C ATOM 1528 CZ TYR A 102 -8.343 0.324 6.069 1.00 0.00 C ATOM 1529 OH TYR A 102 -9.389 1.123 5.670 1.00 0.00 O ATOM 0 H TYR A 102 -6.364 -4.264 7.714 1.00 0.00 H new ATOM 0 HA TYR A 102 -5.047 -3.169 5.408 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -5.231 -2.468 8.350 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.156 -1.593 7.278 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -5.139 -0.343 5.299 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.591 -2.035 8.346 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -7.003 1.086 4.588 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.459 -0.609 7.635 1.00 0.00 H new ATOM 0 HH TYR A 102 -10.236 0.660 5.837 1.00 0.00 H new ATOM 1539 N SER A 103 -2.579 -3.534 5.792 1.00 0.00 N ATOM 1540 CA SER A 103 -1.196 -3.992 5.851 1.00 0.00 C ATOM 1541 C SER A 103 -0.450 -3.323 7.001 1.00 0.00 C ATOM 1542 O SER A 103 -0.887 -2.299 7.528 1.00 0.00 O ATOM 1543 CB SER A 103 -0.483 -3.702 4.528 1.00 0.00 C ATOM 1544 OG SER A 103 -0.327 -2.307 4.329 1.00 0.00 O ATOM 0 H SER A 103 -2.765 -2.846 5.062 1.00 0.00 H new ATOM 0 HA SER A 103 -1.203 -5.068 6.023 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.494 -4.185 4.524 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.053 -4.129 3.703 1.00 0.00 H new ATOM 0 HG SER A 103 0.132 -2.147 3.478 1.00 0.00 H new ATOM 1550 N LYS A 104 0.678 -3.908 7.387 1.00 0.00 N ATOM 1551 CA LYS A 104 1.488 -3.370 8.474 1.00 0.00 C ATOM 1552 C LYS A 104 1.630 -1.856 8.348 1.00 0.00 C ATOM 1553 O LYS A 104 2.202 -1.356 7.379 1.00 0.00 O ATOM 1554 CB LYS A 104 2.871 -4.024 8.480 1.00 0.00 C ATOM 1555 CG LYS A 104 3.741 -3.598 9.650 1.00 0.00 C ATOM 1556 CD LYS A 104 5.075 -4.325 9.647 1.00 0.00 C ATOM 1557 CE LYS A 104 4.938 -5.744 10.181 1.00 0.00 C ATOM 1558 NZ LYS A 104 6.053 -6.618 9.724 1.00 0.00 N ATOM 0 H LYS A 104 1.053 -4.756 6.963 1.00 0.00 H new ATOM 0 HA LYS A 104 0.984 -3.594 9.414 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.751 -5.107 8.503 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.383 -3.779 7.549 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.912 -2.522 9.605 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.218 -3.799 10.585 1.00 0.00 H new ATOM 0 HD2 LYS A 104 5.473 -4.354 8.633 1.00 0.00 H new ATOM 0 HD3 LYS A 104 5.792 -3.774 10.255 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.917 -5.722 11.271 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.988 -6.166 9.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 5.924 -7.576 10.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 6.058 -6.660 8.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 6.958 -6.230 10.059 1.00 0.00 H new ATOM 1572 N ILE A 105 1.107 -1.134 9.334 1.00 0.00 N ATOM 1573 CA ILE A 105 1.179 0.322 9.333 1.00 0.00 C ATOM 1574 C ILE A 105 2.567 0.804 8.927 1.00 0.00 C ATOM 1575 O ILE A 105 3.564 0.468 9.566 1.00 0.00 O ATOM 1576 CB ILE A 105 0.831 0.903 10.717 1.00 0.00 C ATOM 1577 CG1 ILE A 105 -0.627 0.602 11.068 1.00 0.00 C ATOM 1578 CG2 ILE A 105 1.090 2.402 10.742 1.00 0.00 C ATOM 1579 CD1 ILE A 105 -1.621 1.251 10.131 1.00 0.00 C ATOM 0 H ILE A 105 0.630 -1.533 10.142 1.00 0.00 H new ATOM 0 HA ILE A 105 0.448 0.674 8.605 1.00 0.00 H new ATOM 0 HB ILE A 105 1.469 0.432 11.464 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.780 -0.477 11.056 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.825 0.940 12.085 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.840 2.798 11.726 1.00 0.00 H new ATOM 0 HG22 ILE A 105 2.142 2.593 10.531 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.474 2.890 9.987 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.634 0.994 10.441 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.496 2.333 10.161 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.450 0.894 9.115 1.00 0.00 H new ATOM 1591 N GLU A 106 2.624 1.595 7.859 1.00 0.00 N ATOM 1592 CA GLU A 106 3.891 2.124 7.368 1.00 0.00 C ATOM 1593 C GLU A 106 4.075 3.579 7.795 1.00 0.00 C ATOM 1594 O GLU A 106 3.115 4.346 7.848 1.00 0.00 O ATOM 1595 CB GLU A 106 3.958 2.015 5.844 1.00 0.00 C ATOM 1596 CG GLU A 106 4.263 0.613 5.346 1.00 0.00 C ATOM 1597 CD GLU A 106 5.353 -0.068 6.150 1.00 0.00 C ATOM 1598 OE1 GLU A 106 6.541 0.125 5.819 1.00 0.00 O ATOM 1599 OE2 GLU A 106 5.019 -0.792 7.111 1.00 0.00 O ATOM 0 H GLU A 106 1.808 1.883 7.318 1.00 0.00 H new ATOM 0 HA GLU A 106 4.696 1.532 7.802 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.007 2.342 5.423 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.723 2.697 5.473 1.00 0.00 H new ATOM 0 HG2 GLU A 106 3.355 0.011 5.389 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.565 0.661 4.300 1.00 0.00 H new ATOM 1606 N ILE A 107 5.315 3.948 8.097 1.00 0.00 N ATOM 1607 CA ILE A 107 5.626 5.308 8.517 1.00 0.00 C ATOM 1608 C ILE A 107 6.736 5.908 7.661 1.00 0.00 C ATOM 1609 O ILE A 107 7.882 5.460 7.707 1.00 0.00 O ATOM 1610 CB ILE A 107 6.050 5.357 9.996 1.00 0.00 C ATOM 1611 CG1 ILE A 107 4.957 4.759 10.884 1.00 0.00 C ATOM 1612 CG2 ILE A 107 6.354 6.789 10.413 1.00 0.00 C ATOM 1613 CD1 ILE A 107 5.474 4.213 12.196 1.00 0.00 C ATOM 0 H ILE A 107 6.121 3.324 8.059 1.00 0.00 H new ATOM 0 HA ILE A 107 4.716 5.894 8.389 1.00 0.00 H new ATOM 0 HB ILE A 107 6.956 4.763 10.118 1.00 0.00 H new ATOM 0 HG12 ILE A 107 4.208 5.524 11.088 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.455 3.959 10.340 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.652 6.807 11.461 1.00 0.00 H new ATOM 0 HG22 ILE A 107 7.164 7.183 9.798 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.464 7.404 10.278 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.644 3.806 12.773 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.202 3.425 12.001 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.950 5.014 12.761 1.00 0.00 H new ATOM 1625 N PHE A 108 6.389 6.926 6.880 1.00 0.00 N ATOM 1626 CA PHE A 108 7.356 7.590 6.014 1.00 0.00 C ATOM 1627 C PHE A 108 7.355 9.097 6.250 1.00 0.00 C ATOM 1628 O PHE A 108 6.297 9.721 6.332 1.00 0.00 O ATOM 1629 CB PHE A 108 7.046 7.293 4.546 1.00 0.00 C ATOM 1630 CG PHE A 108 5.828 8.007 4.033 1.00 0.00 C ATOM 1631 CD1 PHE A 108 5.853 9.375 3.814 1.00 0.00 C ATOM 1632 CD2 PHE A 108 4.659 7.311 3.774 1.00 0.00 C ATOM 1633 CE1 PHE A 108 4.734 10.036 3.343 1.00 0.00 C ATOM 1634 CE2 PHE A 108 3.537 7.968 3.302 1.00 0.00 C ATOM 1635 CZ PHE A 108 3.575 9.331 3.087 1.00 0.00 C ATOM 0 H PHE A 108 5.445 7.309 6.829 1.00 0.00 H new ATOM 0 HA PHE A 108 8.346 7.203 6.255 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.905 7.575 3.938 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.906 6.219 4.423 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.757 9.931 4.014 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.623 6.245 3.942 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.766 11.102 3.176 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.631 7.415 3.102 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.699 9.845 2.719 1.00 0.00 H new ATOM 1645 N GLN A 109 8.547 9.674 6.361 1.00 0.00 N ATOM 1646 CA GLN A 109 8.683 11.108 6.589 1.00 0.00 C ATOM 1647 C GLN A 109 9.157 11.818 5.325 1.00 0.00 C ATOM 1648 O GLN A 109 10.210 11.494 4.776 1.00 0.00 O ATOM 1649 CB GLN A 109 9.663 11.372 7.735 1.00 0.00 C ATOM 1650 CG GLN A 109 10.012 12.841 7.909 1.00 0.00 C ATOM 1651 CD GLN A 109 11.114 13.061 8.927 1.00 0.00 C ATOM 1652 OE1 GLN A 109 11.178 12.377 9.948 1.00 0.00 O ATOM 1653 NE2 GLN A 109 11.990 14.021 8.651 1.00 0.00 N ATOM 0 H GLN A 109 9.432 9.171 6.297 1.00 0.00 H new ATOM 0 HA GLN A 109 7.703 11.502 6.859 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.233 10.997 8.664 1.00 0.00 H new ATOM 0 HB3 GLN A 109 10.579 10.808 7.557 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.322 13.253 6.949 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.122 13.388 8.219 1.00 0.00 H new ATOM 0 HE21 GLN A 109 11.898 14.564 7.792 1.00 0.00 H new ATOM 0 HE22 GLN A 109 12.754 14.215 9.298 1.00 0.00 H new ATOM 1662 N THR A 110 8.372 12.789 4.868 1.00 0.00 N ATOM 1663 CA THR A 110 8.711 13.544 3.669 1.00 0.00 C ATOM 1664 C THR A 110 10.085 14.190 3.795 1.00 0.00 C ATOM 1665 O THR A 110 10.643 14.279 4.890 1.00 0.00 O ATOM 1666 CB THR A 110 7.665 14.639 3.381 1.00 0.00 C ATOM 1667 OG1 THR A 110 7.559 15.522 4.505 1.00 0.00 O ATOM 1668 CG2 THR A 110 6.306 14.025 3.083 1.00 0.00 C ATOM 0 H THR A 110 7.497 13.071 5.311 1.00 0.00 H new ATOM 0 HA THR A 110 8.722 12.835 2.841 1.00 0.00 H new ATOM 0 HB THR A 110 7.991 15.201 2.506 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.720 16.025 4.448 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.585 14.817 2.883 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.383 13.376 2.211 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.975 13.441 3.941 1.00 0.00 H new ATOM 1676 N LEU A 111 10.627 14.640 2.670 1.00 0.00 N ATOM 1677 CA LEU A 111 11.939 15.280 2.654 1.00 0.00 C ATOM 1678 C LEU A 111 11.830 16.754 3.027 1.00 0.00 C ATOM 1679 O LEU A 111 10.883 17.447 2.651 1.00 0.00 O ATOM 1680 CB LEU A 111 12.581 15.137 1.273 1.00 0.00 C ATOM 1681 CG LEU A 111 12.977 13.719 0.861 1.00 0.00 C ATOM 1682 CD1 LEU A 111 13.091 13.616 -0.653 1.00 0.00 C ATOM 1683 CD2 LEU A 111 14.285 13.315 1.524 1.00 0.00 C ATOM 0 H LEU A 111 10.179 14.574 1.756 1.00 0.00 H new ATOM 0 HA LEU A 111 12.568 14.783 3.393 1.00 0.00 H new ATOM 0 HB2 LEU A 111 11.887 15.530 0.529 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.471 15.765 1.241 1.00 0.00 H new ATOM 0 HG LEU A 111 12.198 13.034 1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.374 12.600 -0.928 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.131 13.862 -1.108 1.00 0.00 H new ATOM 0 HD13 LEU A 111 13.850 14.313 -1.009 1.00 0.00 H new ATOM 0 HD21 LEU A 111 14.550 12.303 1.219 1.00 0.00 H new ATOM 0 HD22 LEU A 111 15.074 14.004 1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 111 14.169 13.349 2.607 1.00 0.00 H new ATOM 1695 N PRO A 112 12.822 17.249 3.783 1.00 0.00 N ATOM 1696 CA PRO A 112 12.861 18.647 4.221 1.00 0.00 C ATOM 1697 C PRO A 112 13.128 19.608 3.067 1.00 0.00 C ATOM 1698 O PRO A 112 14.177 19.548 2.425 1.00 0.00 O ATOM 1699 CB PRO A 112 14.022 18.674 5.218 1.00 0.00 C ATOM 1700 CG PRO A 112 14.900 17.542 4.809 1.00 0.00 C ATOM 1701 CD PRO A 112 13.982 16.481 4.267 1.00 0.00 C ATOM 0 HA PRO A 112 11.910 18.968 4.645 1.00 0.00 H new ATOM 0 HB2 PRO A 112 14.556 19.623 5.178 1.00 0.00 H new ATOM 0 HB3 PRO A 112 13.668 18.550 6.241 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.619 17.859 4.054 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.473 17.166 5.657 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.453 15.915 3.463 1.00 0.00 H new ATOM 0 HD3 PRO A 112 13.697 15.765 5.037 1.00 0.00 H new ATOM 1709 N VAL A 113 12.173 20.497 2.810 1.00 0.00 N ATOM 1710 CA VAL A 113 12.306 21.472 1.734 1.00 0.00 C ATOM 1711 C VAL A 113 13.750 21.938 1.591 1.00 0.00 C ATOM 1712 O VAL A 113 14.410 22.261 2.579 1.00 0.00 O ATOM 1713 CB VAL A 113 11.404 22.697 1.974 1.00 0.00 C ATOM 1714 CG1 VAL A 113 11.561 23.705 0.846 1.00 0.00 C ATOM 1715 CG2 VAL A 113 9.952 22.269 2.119 1.00 0.00 C ATOM 0 H VAL A 113 11.299 20.562 3.332 1.00 0.00 H new ATOM 0 HA VAL A 113 11.995 20.975 0.815 1.00 0.00 H new ATOM 0 HB VAL A 113 11.712 23.177 2.903 1.00 0.00 H new ATOM 0 HG11 VAL A 113 10.916 24.564 1.033 1.00 0.00 H new ATOM 0 HG12 VAL A 113 12.599 24.035 0.795 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.281 23.240 -0.099 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.329 23.147 2.288 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.629 21.765 1.208 1.00 0.00 H new ATOM 0 HG23 VAL A 113 9.856 21.588 2.965 1.00 0.00 H new ATOM 1725 N SER A 114 14.236 21.972 0.353 1.00 0.00 N ATOM 1726 CA SER A 114 15.603 22.396 0.080 1.00 0.00 C ATOM 1727 C SER A 114 15.621 23.649 -0.790 1.00 0.00 C ATOM 1728 O SER A 114 14.686 23.904 -1.548 1.00 0.00 O ATOM 1729 CB SER A 114 16.380 21.271 -0.609 1.00 0.00 C ATOM 1730 OG SER A 114 17.777 21.503 -0.545 1.00 0.00 O ATOM 0 H SER A 114 13.702 21.711 -0.476 1.00 0.00 H new ATOM 0 HA SER A 114 16.081 22.629 1.031 1.00 0.00 H new ATOM 0 HB2 SER A 114 16.144 20.318 -0.135 1.00 0.00 H new ATOM 0 HB3 SER A 114 16.068 21.194 -1.651 1.00 0.00 H new ATOM 0 HG SER A 114 18.251 20.770 -0.990 1.00 0.00 H new ATOM 1736 N GLY A 115 16.691 24.428 -0.673 1.00 0.00 N ATOM 1737 CA GLY A 115 16.811 25.645 -1.454 1.00 0.00 C ATOM 1738 C GLY A 115 18.101 26.391 -1.172 1.00 0.00 C ATOM 1739 O GLY A 115 18.655 26.321 -0.075 1.00 0.00 O ATOM 0 H GLY A 115 17.477 24.238 -0.051 1.00 0.00 H new ATOM 0 HA2 GLY A 115 16.762 25.399 -2.515 1.00 0.00 H new ATOM 0 HA3 GLY A 115 15.964 26.296 -1.239 1.00 0.00 H new ATOM 1743 N PRO A 116 18.599 27.123 -2.179 1.00 0.00 N ATOM 1744 CA PRO A 116 19.838 27.898 -2.058 1.00 0.00 C ATOM 1745 C PRO A 116 19.681 29.099 -1.132 1.00 0.00 C ATOM 1746 O PRO A 116 18.822 29.952 -1.347 1.00 0.00 O ATOM 1747 CB PRO A 116 20.109 28.359 -3.492 1.00 0.00 C ATOM 1748 CG PRO A 116 18.770 28.372 -4.146 1.00 0.00 C ATOM 1749 CD PRO A 116 17.991 27.251 -3.514 1.00 0.00 C ATOM 0 HA PRO A 116 20.647 27.310 -1.625 1.00 0.00 H new ATOM 0 HB2 PRO A 116 20.568 29.348 -3.510 1.00 0.00 H new ATOM 0 HB3 PRO A 116 20.793 27.681 -4.003 1.00 0.00 H new ATOM 0 HG2 PRO A 116 18.270 29.329 -3.994 1.00 0.00 H new ATOM 0 HG3 PRO A 116 18.860 28.227 -5.223 1.00 0.00 H new ATOM 0 HD2 PRO A 116 16.928 27.486 -3.451 1.00 0.00 H new ATOM 0 HD3 PRO A 116 18.080 26.328 -4.086 1.00 0.00 H new ATOM 1757 N SER A 117 20.520 29.159 -0.103 1.00 0.00 N ATOM 1758 CA SER A 117 20.472 30.255 0.858 1.00 0.00 C ATOM 1759 C SER A 117 21.809 30.406 1.577 1.00 0.00 C ATOM 1760 O SER A 117 22.534 29.431 1.775 1.00 0.00 O ATOM 1761 CB SER A 117 19.356 30.020 1.878 1.00 0.00 C ATOM 1762 OG SER A 117 19.240 31.116 2.768 1.00 0.00 O ATOM 0 H SER A 117 21.241 28.462 0.087 1.00 0.00 H new ATOM 0 HA SER A 117 20.267 31.175 0.311 1.00 0.00 H new ATOM 0 HB2 SER A 117 18.410 29.868 1.358 1.00 0.00 H new ATOM 0 HB3 SER A 117 19.560 29.110 2.442 1.00 0.00 H new ATOM 0 HG SER A 117 18.519 30.942 3.409 1.00 0.00 H new ATOM 1768 N SER A 118 22.131 31.636 1.965 1.00 0.00 N ATOM 1769 CA SER A 118 23.383 31.917 2.658 1.00 0.00 C ATOM 1770 C SER A 118 23.695 30.827 3.678 1.00 0.00 C ATOM 1771 O SER A 118 23.008 30.692 4.690 1.00 0.00 O ATOM 1772 CB SER A 118 23.311 33.277 3.354 1.00 0.00 C ATOM 1773 OG SER A 118 22.928 34.295 2.445 1.00 0.00 O ATOM 0 H SER A 118 21.542 32.454 1.811 1.00 0.00 H new ATOM 0 HA SER A 118 24.183 31.938 1.918 1.00 0.00 H new ATOM 0 HB2 SER A 118 22.596 33.231 4.176 1.00 0.00 H new ATOM 0 HB3 SER A 118 24.281 33.519 3.788 1.00 0.00 H new ATOM 0 HG SER A 118 22.887 35.154 2.914 1.00 0.00 H new ATOM 1779 N GLY A 119 24.738 30.049 3.405 1.00 0.00 N ATOM 1780 CA GLY A 119 25.124 28.980 4.307 1.00 0.00 C ATOM 1781 C GLY A 119 23.930 28.221 4.850 1.00 0.00 C ATOM 1782 O GLY A 119 23.739 28.137 6.064 1.00 0.00 O ATOM 0 H GLY A 119 25.323 30.140 2.574 1.00 0.00 H new ATOM 0 HA2 GLY A 119 25.784 28.288 3.784 1.00 0.00 H new ATOM 0 HA3 GLY A 119 25.694 29.397 5.137 1.00 0.00 H new TER 1786 GLY A 119