USER MOD reduce.3.24.130724 H: found=0, std=0, add=1158, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1152 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 22 GLN : amide:sc= 1.61 K(o=3.2,f=-0.21) USER MOD Set 1.2: A 150 GLN : amide:sc= 1.63 K(o=3.2,f=0.82) USER MOD Set 2.1: A 85 ASN : amide:sc= -0.57 K(o=0.41,f=-3.5!) USER MOD Set 2.2: A 117 LYS NZ :NH3+ -170:sc= 0.978 (180deg=0.894) USER MOD Set 3.1: A 94 HIS : no HD1:sc= 0.734 K(o=1.1,f=-6.3!) USER MOD Set 3.2: A 137 TYR OH : rot -23:sc= 0.405 USER MOD Set 4.1: A 87 THR OG1 : rot -54:sc= 0.988 USER MOD Set 4.2: A 124 THR OG1 : rot 110:sc= 0.777 USER MOD Single : A 1 MET CE :methyl -167:sc=-0.00506 (180deg=-0.21) USER MOD Single : A 1 MET N :NH3+ 175:sc= -0.413 (180deg=-0.419) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 176:sc= 0.865 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 176:sc= 0.923 (180deg=0.903) USER MOD Single : A 17 SER OG : rot -35:sc= 0.695 USER MOD Single : A 20 THR OG1 : rot 151:sc= 0.62 USER MOD Single : A 25 GLN : amide:sc= -0.146 X(o=-0.15,f=-0.14) USER MOD Single : A 26 ASN : amide:sc= -0.0107 X(o=-0.011,f=0) USER MOD Single : A 27 HIS : no HD1:sc= -0.0857 X(o=-0.086,f=-0.42) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot -60:sc= 0.91 USER MOD Single : A 42 LYS NZ :NH3+ 179:sc= 0.899 (180deg=0.899) USER MOD Single : A 43 GLN : amide:sc= -0.0123 K(o=-0.012,f=-0.96) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0101 USER MOD Single : A 51 CYS SG : rot -32:sc= -0.0931 USER MOD Single : A 58 THR OG1 : rot 122:sc= 0.00419 USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 71 TYR OH : rot 180:sc= -0.0768 USER MOD Single : A 72 MET CE :methyl 138:sc= -0.579 (180deg=-1.53) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.035 K(o=-0.035,f=-1.3!) USER MOD Single : A 88 LYS NZ :NH3+ -176:sc= 0.81 (180deg=0.8) USER MOD Single : A 89 SER OG : rot -80:sc= 0.955 USER MOD Single : A 95 GLN :FLIP amide:sc= -0.0414 F(o=-2.1!,f=-0.041) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 178:sc= 0.821 (180deg=0.817) USER MOD Single : A 104 LYS NZ :NH3+ -163:sc= -0.108 (180deg=-0.432) USER MOD Single : A 106 SER OG : rot 70:sc= 0.884 USER MOD Single : A 111 MET CE :methyl -119:sc= -0.145 (180deg=-0.199) USER MOD Single : A 116 ASN : amide:sc= 0.353 K(o=0.35,f=-9.9!) USER MOD Single : A 118 CYS SG : rot 94:sc= 0.301 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN :FLIP amide:sc= -0.0974 F(o=-2.2!,f=-0.097) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot -37:sc= 1.18 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 THR OG1 : rot -158:sc= 0.539 USER MOD Single : A 145 SER OG : rot 161:sc= 0.903 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 116:sc= 0.965 USER MOD Single : A 158 THR OG1 : rot 83:sc= 0.611 USER MOD Single : A 165 GLN : amide:sc= -0.152 X(o=-0.15,f=-0.15) USER MOD Single : A 166 HIS : no HE2:sc= 0.824 K(o=0.82,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -23.415 -6.484 -0.341 1.00 0.00 N ATOM 2 CA MET A 1 -22.876 -5.753 0.800 1.00 0.00 C ATOM 3 C MET A 1 -21.461 -6.223 1.128 1.00 0.00 C ATOM 4 O MET A 1 -21.035 -6.184 2.282 1.00 0.00 O ATOM 5 CB MET A 1 -23.786 -5.922 2.015 1.00 0.00 C ATOM 6 CG MET A 1 -25.179 -5.333 1.844 1.00 0.00 C ATOM 7 SD MET A 1 -25.155 -3.544 1.616 1.00 0.00 S ATOM 8 CE MET A 1 -24.709 -2.999 3.262 1.00 0.00 C ATOM 0 H1 MET A 1 -24.406 -6.209 -0.493 1.00 0.00 H new ATOM 0 H2 MET A 1 -22.859 -6.260 -1.191 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.364 -7.506 -0.154 1.00 0.00 H new ATOM 0 HA MET A 1 -22.832 -4.696 0.538 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.879 -6.985 2.239 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.311 -5.455 2.878 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.663 -5.798 0.985 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.782 -5.576 2.719 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.877 -1.925 3.348 1.00 0.00 H new ATOM 0 HE2 MET A 1 -25.321 -3.522 3.997 1.00 0.00 H new ATOM 0 HE3 MET A 1 -23.657 -3.218 3.445 1.00 0.00 H new ATOM 18 N THR A 2 -20.738 -6.667 0.104 1.00 0.00 N ATOM 19 CA THR A 2 -19.374 -7.149 0.284 1.00 0.00 C ATOM 20 C THR A 2 -18.439 -6.015 0.686 1.00 0.00 C ATOM 21 O THR A 2 -18.396 -4.972 0.035 1.00 0.00 O ATOM 22 CB THR A 2 -18.837 -7.815 -0.997 1.00 0.00 C ATOM 23 OG1 THR A 2 -19.687 -8.909 -1.362 1.00 0.00 O ATOM 24 CG2 THR A 2 -17.422 -8.329 -0.778 1.00 0.00 C ATOM 0 H THR A 2 -21.074 -6.703 -0.858 1.00 0.00 H new ATOM 0 HA THR A 2 -19.405 -7.891 1.082 1.00 0.00 H new ATOM 0 HB THR A 2 -18.824 -7.073 -1.796 1.00 0.00 H new ATOM 0 HG1 THR A 2 -19.345 -9.331 -2.178 1.00 0.00 H new ATOM 0 HG21 THR A 2 -17.059 -8.796 -1.693 1.00 0.00 H new ATOM 0 HG22 THR A 2 -16.770 -7.497 -0.512 1.00 0.00 H new ATOM 0 HG23 THR A 2 -17.422 -9.062 0.028 1.00 0.00 H new ATOM 32 N GLU A 3 -17.691 -6.227 1.765 1.00 0.00 N ATOM 33 CA GLU A 3 -16.755 -5.220 2.254 1.00 0.00 C ATOM 34 C GLU A 3 -15.324 -5.748 2.226 1.00 0.00 C ATOM 35 O GLU A 3 -15.062 -6.886 2.619 1.00 0.00 O ATOM 36 CB GLU A 3 -17.130 -4.781 3.671 1.00 0.00 C ATOM 37 CG GLU A 3 -16.199 -3.736 4.272 1.00 0.00 C ATOM 38 CD GLU A 3 -16.636 -3.349 5.657 1.00 0.00 C ATOM 39 OE1 GLU A 3 -17.577 -3.925 6.146 1.00 0.00 O ATOM 40 OE2 GLU A 3 -15.961 -2.556 6.271 1.00 0.00 O ATOM 0 H GLU A 3 -17.715 -7.085 2.316 1.00 0.00 H new ATOM 0 HA GLU A 3 -16.814 -4.355 1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -18.144 -4.382 3.658 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -17.140 -5.657 4.319 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -15.182 -4.127 4.305 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -16.180 -2.852 3.634 1.00 0.00 H new ATOM 47 N TYR A 4 -14.402 -4.916 1.756 1.00 0.00 N ATOM 48 CA TYR A 4 -12.991 -5.285 1.711 1.00 0.00 C ATOM 49 C TYR A 4 -12.168 -4.399 2.642 1.00 0.00 C ATOM 50 O TYR A 4 -12.304 -3.175 2.637 1.00 0.00 O ATOM 51 CB TYR A 4 -12.456 -5.189 0.280 1.00 0.00 C ATOM 52 CG TYR A 4 -13.007 -6.245 -0.652 1.00 0.00 C ATOM 53 CD1 TYR A 4 -12.450 -7.514 -0.698 1.00 0.00 C ATOM 54 CD2 TYR A 4 -14.081 -5.968 -1.486 1.00 0.00 C ATOM 55 CE1 TYR A 4 -12.948 -8.481 -1.548 1.00 0.00 C ATOM 56 CE2 TYR A 4 -14.589 -6.929 -2.339 1.00 0.00 C ATOM 57 CZ TYR A 4 -14.018 -8.185 -2.368 1.00 0.00 C ATOM 58 OH TYR A 4 -14.518 -9.146 -3.217 1.00 0.00 O ATOM 0 H TYR A 4 -14.605 -3.982 1.401 1.00 0.00 H new ATOM 0 HA TYR A 4 -12.901 -6.317 2.050 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -12.694 -4.204 -0.121 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -11.369 -5.270 0.303 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -11.613 -7.750 -0.058 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -14.527 -4.985 -1.468 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -12.502 -9.465 -1.571 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -15.428 -6.699 -2.979 1.00 0.00 H new ATOM 0 HH TYR A 4 -15.310 -8.796 -3.677 1.00 0.00 H new ATOM 68 N LYS A 5 -11.310 -5.028 3.440 1.00 0.00 N ATOM 69 CA LYS A 5 -10.543 -4.312 4.454 1.00 0.00 C ATOM 70 C LYS A 5 -9.088 -4.157 4.025 1.00 0.00 C ATOM 71 O LYS A 5 -8.340 -5.134 3.963 1.00 0.00 O ATOM 72 CB LYS A 5 -10.624 -5.038 5.798 1.00 0.00 C ATOM 73 CG LYS A 5 -12.029 -5.134 6.378 1.00 0.00 C ATOM 74 CD LYS A 5 -12.036 -5.909 7.686 1.00 0.00 C ATOM 75 CE LYS A 5 -13.431 -5.965 8.290 1.00 0.00 C ATOM 76 NZ LYS A 5 -13.441 -6.662 9.606 1.00 0.00 N ATOM 0 H LYS A 5 -11.129 -6.031 3.404 1.00 0.00 H new ATOM 0 HA LYS A 5 -10.975 -3.318 4.566 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -10.224 -6.045 5.678 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -9.983 -4.524 6.514 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.425 -4.132 6.544 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -12.688 -5.622 5.660 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -11.672 -6.922 7.513 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -11.351 -5.440 8.392 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -13.814 -4.952 8.413 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -14.103 -6.478 7.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -14.410 -6.678 9.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -13.100 -7.637 9.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -12.820 -6.158 10.270 1.00 0.00 H new ATOM 90 N LEU A 6 -8.691 -2.924 3.732 1.00 0.00 N ATOM 91 CA LEU A 6 -7.386 -2.662 3.136 1.00 0.00 C ATOM 92 C LEU A 6 -6.496 -1.878 4.095 1.00 0.00 C ATOM 93 O LEU A 6 -6.883 -0.824 4.598 1.00 0.00 O ATOM 94 CB LEU A 6 -7.550 -1.899 1.814 1.00 0.00 C ATOM 95 CG LEU A 6 -6.303 -1.868 0.920 1.00 0.00 C ATOM 96 CD1 LEU A 6 -6.712 -1.778 -0.543 1.00 0.00 C ATOM 97 CD2 LEU A 6 -5.427 -0.686 1.310 1.00 0.00 C ATOM 0 H LEU A 6 -9.254 -2.090 3.897 1.00 0.00 H new ATOM 0 HA LEU A 6 -6.905 -3.619 2.933 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.369 -2.348 1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -7.842 -0.873 2.039 1.00 0.00 H new ATOM 0 HG LEU A 6 -5.733 -2.787 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -5.820 -1.757 -1.169 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -7.319 -2.645 -0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -7.290 -0.868 -0.704 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -4.541 -0.664 0.675 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -5.988 0.240 1.183 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -5.124 -0.786 2.352 1.00 0.00 H new ATOM 109 N VAL A 7 -5.299 -2.400 4.344 1.00 0.00 N ATOM 110 CA VAL A 7 -4.352 -1.749 5.242 1.00 0.00 C ATOM 111 C VAL A 7 -3.189 -1.142 4.467 1.00 0.00 C ATOM 112 O VAL A 7 -2.537 -1.818 3.672 1.00 0.00 O ATOM 113 CB VAL A 7 -3.800 -2.733 6.292 1.00 0.00 C ATOM 114 CG1 VAL A 7 -2.773 -2.044 7.178 1.00 0.00 C ATOM 115 CG2 VAL A 7 -4.931 -3.302 7.134 1.00 0.00 C ATOM 0 H VAL A 7 -4.962 -3.272 3.936 1.00 0.00 H new ATOM 0 HA VAL A 7 -4.897 -0.956 5.754 1.00 0.00 H new ATOM 0 HB VAL A 7 -3.310 -3.555 5.770 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.393 -2.753 7.914 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -1.948 -1.681 6.565 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -3.241 -1.204 7.691 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.523 -3.995 7.870 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -5.447 -2.490 7.646 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.634 -3.830 6.490 1.00 0.00 H new ATOM 125 N VAL A 8 -2.933 0.141 4.704 1.00 0.00 N ATOM 126 CA VAL A 8 -1.840 0.839 4.038 1.00 0.00 C ATOM 127 C VAL A 8 -0.726 1.181 5.022 1.00 0.00 C ATOM 128 O VAL A 8 -0.973 1.762 6.079 1.00 0.00 O ATOM 129 CB VAL A 8 -2.326 2.132 3.357 1.00 0.00 C ATOM 130 CG1 VAL A 8 -1.179 2.812 2.625 1.00 0.00 C ATOM 131 CG2 VAL A 8 -3.466 1.833 2.396 1.00 0.00 C ATOM 0 H VAL A 8 -3.468 0.718 5.353 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.453 0.163 3.276 1.00 0.00 H new ATOM 0 HB VAL A 8 -2.694 2.809 4.128 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -1.540 3.724 2.150 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -0.391 3.061 3.335 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.783 2.139 1.865 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -3.796 2.758 1.924 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -3.123 1.137 1.630 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -4.297 1.388 2.944 1.00 0.00 H new ATOM 141 N VAL A 9 0.502 0.814 4.668 1.00 0.00 N ATOM 142 CA VAL A 9 1.648 1.035 5.541 1.00 0.00 C ATOM 143 C VAL A 9 2.798 1.690 4.783 1.00 0.00 C ATOM 144 O VAL A 9 2.853 1.639 3.555 1.00 0.00 O ATOM 145 CB VAL A 9 2.142 -0.281 6.170 1.00 0.00 C ATOM 146 CG1 VAL A 9 1.056 -0.896 7.040 1.00 0.00 C ATOM 147 CG2 VAL A 9 2.574 -1.259 5.088 1.00 0.00 C ATOM 0 H VAL A 9 0.728 0.362 3.782 1.00 0.00 H new ATOM 0 HA VAL A 9 1.314 1.702 6.336 1.00 0.00 H new ATOM 0 HB VAL A 9 3.004 -0.060 6.799 1.00 0.00 H new ATOM 0 HG11 VAL A 9 1.422 -1.825 7.476 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.791 -0.201 7.836 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.176 -1.103 6.431 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.920 -2.183 5.550 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.729 -1.475 4.434 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.383 -0.821 4.503 1.00 0.00 H new ATOM 157 N GLY A 10 3.717 2.302 5.524 1.00 0.00 N ATOM 158 CA GLY A 10 4.869 2.931 4.906 1.00 0.00 C ATOM 159 C GLY A 10 5.631 3.818 5.871 1.00 0.00 C ATOM 160 O GLY A 10 5.112 4.194 6.921 1.00 0.00 O ATOM 0 H GLY A 10 3.684 2.373 6.541 1.00 0.00 H new ATOM 0 HA2 GLY A 10 5.537 2.161 4.520 1.00 0.00 H new ATOM 0 HA3 GLY A 10 4.541 3.525 4.053 1.00 0.00 H new ATOM 164 N ALA A 11 6.868 4.150 5.515 1.00 0.00 N ATOM 165 CA ALA A 11 7.709 4.987 6.363 1.00 0.00 C ATOM 166 C ALA A 11 7.317 6.456 6.246 1.00 0.00 C ATOM 167 O ALA A 11 6.663 6.860 5.284 1.00 0.00 O ATOM 168 CB ALA A 11 9.174 4.798 6.003 1.00 0.00 C ATOM 0 H ALA A 11 7.310 3.852 4.645 1.00 0.00 H new ATOM 0 HA ALA A 11 7.559 4.680 7.398 1.00 0.00 H new ATOM 0 HB1 ALA A 11 9.790 5.429 6.644 1.00 0.00 H new ATOM 0 HB2 ALA A 11 9.452 3.754 6.146 1.00 0.00 H new ATOM 0 HB3 ALA A 11 9.331 5.076 4.961 1.00 0.00 H new ATOM 174 N GLY A 12 7.720 7.252 7.231 1.00 0.00 N ATOM 175 CA GLY A 12 7.387 8.665 7.228 1.00 0.00 C ATOM 176 C GLY A 12 8.043 9.412 6.084 1.00 0.00 C ATOM 177 O GLY A 12 9.202 9.162 5.753 1.00 0.00 O ATOM 0 H GLY A 12 8.272 6.944 8.032 1.00 0.00 H new ATOM 0 HA2 GLY A 12 6.305 8.780 7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 12 7.696 9.110 8.174 1.00 0.00 H new ATOM 181 N GLY A 13 7.300 10.331 5.475 1.00 0.00 N ATOM 182 CA GLY A 13 7.844 11.125 4.388 1.00 0.00 C ATOM 183 C GLY A 13 7.011 11.024 3.126 1.00 0.00 C ATOM 184 O GLY A 13 7.239 11.757 2.163 1.00 0.00 O ATOM 0 H GLY A 13 6.331 10.540 5.715 1.00 0.00 H new ATOM 0 HA2 GLY A 13 7.904 12.168 4.698 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.862 10.797 4.176 1.00 0.00 H new ATOM 188 N VAL A 14 6.045 10.113 3.127 1.00 0.00 N ATOM 189 CA VAL A 14 5.121 9.974 2.007 1.00 0.00 C ATOM 190 C VAL A 14 3.701 10.352 2.417 1.00 0.00 C ATOM 191 O VAL A 14 3.406 10.507 3.601 1.00 0.00 O ATOM 192 CB VAL A 14 5.120 8.540 1.448 1.00 0.00 C ATOM 193 CG1 VAL A 14 6.509 8.159 0.956 1.00 0.00 C ATOM 194 CG2 VAL A 14 4.644 7.556 2.506 1.00 0.00 C ATOM 0 H VAL A 14 5.881 9.459 3.892 1.00 0.00 H new ATOM 0 HA VAL A 14 5.466 10.655 1.228 1.00 0.00 H new ATOM 0 HB VAL A 14 4.431 8.500 0.604 1.00 0.00 H new ATOM 0 HG11 VAL A 14 6.490 7.142 0.564 1.00 0.00 H new ATOM 0 HG12 VAL A 14 6.817 8.846 0.168 1.00 0.00 H new ATOM 0 HG13 VAL A 14 7.216 8.216 1.783 1.00 0.00 H new ATOM 0 HG21 VAL A 14 4.650 6.547 2.093 1.00 0.00 H new ATOM 0 HG22 VAL A 14 5.309 7.599 3.368 1.00 0.00 H new ATOM 0 HG23 VAL A 14 3.632 7.816 2.815 1.00 0.00 H new ATOM 204 N GLY A 15 2.825 10.497 1.429 1.00 0.00 N ATOM 205 CA GLY A 15 1.463 10.922 1.700 1.00 0.00 C ATOM 206 C GLY A 15 0.447 9.836 1.403 1.00 0.00 C ATOM 207 O GLY A 15 -0.494 10.049 0.638 1.00 0.00 O ATOM 0 H GLY A 15 3.033 10.328 0.445 1.00 0.00 H new ATOM 0 HA2 GLY A 15 1.379 11.218 2.746 1.00 0.00 H new ATOM 0 HA3 GLY A 15 1.234 11.803 1.100 1.00 0.00 H new ATOM 211 N LYS A 16 0.637 8.668 2.008 1.00 0.00 N ATOM 212 CA LYS A 16 -0.222 7.521 1.744 1.00 0.00 C ATOM 213 C LYS A 16 -1.663 7.818 2.145 1.00 0.00 C ATOM 214 O LYS A 16 -2.605 7.330 1.519 1.00 0.00 O ATOM 215 CB LYS A 16 0.290 6.285 2.485 1.00 0.00 C ATOM 216 CG LYS A 16 0.184 6.372 4.001 1.00 0.00 C ATOM 217 CD LYS A 16 0.967 5.256 4.676 1.00 0.00 C ATOM 218 CE LYS A 16 0.518 5.054 6.116 1.00 0.00 C ATOM 219 NZ LYS A 16 0.828 6.236 6.966 1.00 0.00 N ATOM 0 H LYS A 16 1.379 8.492 2.685 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.198 7.321 0.673 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -0.269 5.414 2.143 1.00 0.00 H new ATOM 0 HB3 LYS A 16 1.333 6.120 2.215 1.00 0.00 H new ATOM 0 HG2 LYS A 16 0.559 7.338 4.339 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.863 6.315 4.298 1.00 0.00 H new ATOM 0 HD2 LYS A 16 0.835 4.329 4.119 1.00 0.00 H new ATOM 0 HD3 LYS A 16 2.031 5.492 4.655 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -0.555 4.863 6.138 1.00 0.00 H new ATOM 0 HE3 LYS A 16 1.008 4.172 6.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 0.446 6.086 7.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 1.859 6.363 7.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 0.396 7.086 6.550 1.00 0.00 H new ATOM 233 N SER A 17 -1.828 8.621 3.192 1.00 0.00 N ATOM 234 CA SER A 17 -3.151 9.070 3.609 1.00 0.00 C ATOM 235 C SER A 17 -3.686 10.140 2.663 1.00 0.00 C ATOM 236 O SER A 17 -4.888 10.220 2.415 1.00 0.00 O ATOM 237 CB SER A 17 -3.101 9.596 5.030 1.00 0.00 C ATOM 238 OG SER A 17 -2.999 8.562 5.971 1.00 0.00 O ATOM 0 H SER A 17 -1.062 8.974 3.766 1.00 0.00 H new ATOM 0 HA SER A 17 -3.830 8.218 3.573 1.00 0.00 H new ATOM 0 HB2 SER A 17 -2.250 10.269 5.137 1.00 0.00 H new ATOM 0 HB3 SER A 17 -3.998 10.182 5.231 1.00 0.00 H new ATOM 0 HG SER A 17 -3.510 7.786 5.661 1.00 0.00 H new ATOM 244 N ALA A 18 -2.783 10.960 2.136 1.00 0.00 N ATOM 245 CA ALA A 18 -3.141 11.932 1.111 1.00 0.00 C ATOM 246 C ALA A 18 -3.650 11.239 -0.150 1.00 0.00 C ATOM 247 O ALA A 18 -4.570 11.725 -0.809 1.00 0.00 O ATOM 248 CB ALA A 18 -1.946 12.816 0.781 1.00 0.00 C ATOM 0 H ALA A 18 -1.798 10.970 2.402 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.945 12.555 1.503 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -2.228 13.537 0.014 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.627 13.346 1.678 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -1.126 12.198 0.414 1.00 0.00 H new ATOM 254 N LEU A 19 -3.047 10.101 -0.478 1.00 0.00 N ATOM 255 CA LEU A 19 -3.491 9.302 -1.614 1.00 0.00 C ATOM 256 C LEU A 19 -4.871 8.706 -1.355 1.00 0.00 C ATOM 257 O LEU A 19 -5.718 8.665 -2.249 1.00 0.00 O ATOM 258 CB LEU A 19 -2.475 8.191 -1.910 1.00 0.00 C ATOM 259 CG LEU A 19 -1.137 8.667 -2.489 1.00 0.00 C ATOM 260 CD1 LEU A 19 -0.144 7.514 -2.525 1.00 0.00 C ATOM 261 CD2 LEU A 19 -1.359 9.231 -3.884 1.00 0.00 C ATOM 0 H LEU A 19 -2.250 9.712 0.026 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.562 9.954 -2.484 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.279 7.644 -0.988 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.925 7.486 -2.609 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.725 9.452 -1.855 1.00 0.00 H new ATOM 0 HD11 LEU A 19 0.803 7.862 -2.938 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.016 7.140 -1.514 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -0.539 6.713 -3.149 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -0.408 9.569 -4.295 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -1.778 8.457 -4.527 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.051 10.072 -3.831 1.00 0.00 H new ATOM 273 N THR A 20 -5.092 8.249 -0.127 1.00 0.00 N ATOM 274 CA THR A 20 -6.401 7.751 0.278 1.00 0.00 C ATOM 275 C THR A 20 -7.473 8.822 0.112 1.00 0.00 C ATOM 276 O THR A 20 -8.560 8.552 -0.398 1.00 0.00 O ATOM 277 CB THR A 20 -6.393 7.269 1.741 1.00 0.00 C ATOM 278 OG1 THR A 20 -5.377 6.272 1.913 1.00 0.00 O ATOM 279 CG2 THR A 20 -7.745 6.680 2.116 1.00 0.00 C ATOM 0 H THR A 20 -4.382 8.213 0.604 1.00 0.00 H new ATOM 0 HA THR A 20 -6.632 6.907 -0.372 1.00 0.00 H new ATOM 0 HB THR A 20 -6.188 8.122 2.388 1.00 0.00 H new ATOM 0 HG1 THR A 20 -5.050 6.294 2.837 1.00 0.00 H new ATOM 0 HG21 THR A 20 -7.721 6.345 3.153 1.00 0.00 H new ATOM 0 HG22 THR A 20 -8.518 7.439 1.998 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.966 5.833 1.466 1.00 0.00 H new ATOM 287 N ILE A 21 -7.159 10.039 0.544 1.00 0.00 N ATOM 288 CA ILE A 21 -8.133 11.124 0.542 1.00 0.00 C ATOM 289 C ILE A 21 -8.495 11.535 -0.882 1.00 0.00 C ATOM 290 O ILE A 21 -9.662 11.766 -1.192 1.00 0.00 O ATOM 291 CB ILE A 21 -7.608 12.354 1.305 1.00 0.00 C ATOM 292 CG1 ILE A 21 -7.495 12.046 2.800 1.00 0.00 C ATOM 293 CG2 ILE A 21 -8.517 13.552 1.071 1.00 0.00 C ATOM 294 CD1 ILE A 21 -6.699 13.071 3.576 1.00 0.00 C ATOM 0 H ILE A 21 -6.239 10.298 0.899 1.00 0.00 H new ATOM 0 HA ILE A 21 -9.024 10.750 1.046 1.00 0.00 H new ATOM 0 HB ILE A 21 -6.615 12.599 0.929 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -8.497 11.980 3.225 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -7.031 11.068 2.926 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -8.132 14.413 1.617 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -8.549 13.782 0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -9.523 13.320 1.422 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -6.663 12.784 4.627 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -5.685 13.121 3.179 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -7.174 14.048 3.482 1.00 0.00 H new ATOM 306 N GLN A 22 -7.485 11.620 -1.741 1.00 0.00 N ATOM 307 CA GLN A 22 -7.681 12.103 -3.104 1.00 0.00 C ATOM 308 C GLN A 22 -8.741 11.279 -3.826 1.00 0.00 C ATOM 309 O GLN A 22 -9.652 11.826 -4.450 1.00 0.00 O ATOM 310 CB GLN A 22 -6.365 12.057 -3.886 1.00 0.00 C ATOM 311 CG GLN A 22 -5.432 13.222 -3.601 1.00 0.00 C ATOM 312 CD GLN A 22 -4.176 13.177 -4.451 1.00 0.00 C ATOM 313 OE1 GLN A 22 -4.242 13.192 -5.683 1.00 0.00 O ATOM 314 NE2 GLN A 22 -3.022 13.117 -3.796 1.00 0.00 N ATOM 0 H GLN A 22 -6.524 11.361 -1.519 1.00 0.00 H new ATOM 0 HA GLN A 22 -8.023 13.136 -3.046 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.848 11.126 -3.652 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.589 12.038 -4.953 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -5.958 14.159 -3.784 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.155 13.213 -2.547 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -3.014 13.107 -2.776 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -2.143 13.081 -4.313 1.00 0.00 H new ATOM 323 N LEU A 23 -8.618 9.959 -3.739 1.00 0.00 N ATOM 324 CA LEU A 23 -9.486 9.057 -4.487 1.00 0.00 C ATOM 325 C LEU A 23 -10.920 9.128 -3.969 1.00 0.00 C ATOM 326 O LEU A 23 -11.869 9.196 -4.750 1.00 0.00 O ATOM 327 CB LEU A 23 -8.959 7.619 -4.404 1.00 0.00 C ATOM 328 CG LEU A 23 -9.740 6.588 -5.228 1.00 0.00 C ATOM 329 CD1 LEU A 23 -9.696 6.956 -6.705 1.00 0.00 C ATOM 330 CD2 LEU A 23 -9.152 5.203 -5.000 1.00 0.00 C ATOM 0 H LEU A 23 -7.924 9.489 -3.157 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.485 9.371 -5.531 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.920 7.611 -4.732 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.966 7.306 -3.360 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.782 6.584 -4.909 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.254 6.217 -7.281 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.142 7.940 -6.848 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -8.660 6.974 -7.045 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.708 4.471 -5.586 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.106 5.196 -5.308 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -9.220 4.948 -3.942 1.00 0.00 H new ATOM 342 N ILE A 24 -11.068 9.115 -2.649 1.00 0.00 N ATOM 343 CA ILE A 24 -12.382 9.005 -2.029 1.00 0.00 C ATOM 344 C ILE A 24 -13.131 10.333 -2.087 1.00 0.00 C ATOM 345 O ILE A 24 -14.356 10.369 -1.980 1.00 0.00 O ATOM 346 CB ILE A 24 -12.278 8.546 -0.563 1.00 0.00 C ATOM 347 CG1 ILE A 24 -11.564 9.607 0.279 1.00 0.00 C ATOM 348 CG2 ILE A 24 -11.552 7.213 -0.472 1.00 0.00 C ATOM 349 CD1 ILE A 24 -11.508 9.280 1.753 1.00 0.00 C ATOM 0 H ILE A 24 -10.294 9.179 -1.988 1.00 0.00 H new ATOM 0 HA ILE A 24 -12.936 8.255 -2.594 1.00 0.00 H new ATOM 0 HB ILE A 24 -13.286 8.414 -0.169 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -10.548 9.731 -0.095 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -12.071 10.563 0.148 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -11.488 6.904 0.571 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -12.100 6.461 -1.040 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.547 7.317 -0.882 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -10.988 10.078 2.283 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -12.521 9.186 2.144 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -10.975 8.340 1.897 1.00 0.00 H new ATOM 361 N GLN A 25 -12.386 11.420 -2.258 1.00 0.00 N ATOM 362 CA GLN A 25 -12.979 12.748 -2.335 1.00 0.00 C ATOM 363 C GLN A 25 -13.018 13.244 -3.777 1.00 0.00 C ATOM 364 O GLN A 25 -13.526 14.330 -4.056 1.00 0.00 O ATOM 365 CB GLN A 25 -12.197 13.738 -1.466 1.00 0.00 C ATOM 366 CG GLN A 25 -12.203 13.403 0.016 1.00 0.00 C ATOM 367 CD GLN A 25 -13.601 13.403 0.604 1.00 0.00 C ATOM 368 OE1 GLN A 25 -14.380 14.335 0.390 1.00 0.00 O ATOM 369 NE2 GLN A 25 -13.926 12.355 1.354 1.00 0.00 N ATOM 0 H GLN A 25 -11.370 11.406 -2.346 1.00 0.00 H new ATOM 0 HA GLN A 25 -14.001 12.680 -1.962 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -11.165 13.775 -1.815 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -12.616 14.735 -1.604 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -11.749 12.424 0.166 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -11.587 14.125 0.551 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -13.250 11.606 1.505 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -14.852 12.299 1.779 1.00 0.00 H new ATOM 378 N ASN A 26 -12.476 12.444 -4.688 1.00 0.00 N ATOM 379 CA ASN A 26 -12.379 12.836 -6.089 1.00 0.00 C ATOM 380 C ASN A 26 -11.629 14.157 -6.234 1.00 0.00 C ATOM 381 O ASN A 26 -12.028 15.028 -7.008 1.00 0.00 O ATOM 382 CB ASN A 26 -13.749 12.933 -6.735 1.00 0.00 C ATOM 383 CG ASN A 26 -14.509 11.636 -6.741 1.00 0.00 C ATOM 384 OD1 ASN A 26 -14.045 10.623 -7.275 1.00 0.00 O ATOM 385 ND2 ASN A 26 -15.710 11.683 -6.221 1.00 0.00 N ATOM 0 H ASN A 26 -12.097 11.520 -4.481 1.00 0.00 H new ATOM 0 HA ASN A 26 -11.817 12.059 -6.607 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.336 13.685 -6.209 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -13.633 13.280 -7.762 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -16.309 10.858 -6.246 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -16.046 12.545 -5.791 1.00 0.00 H new ATOM 392 N HIS A 27 -10.540 14.298 -5.485 1.00 0.00 N ATOM 393 CA HIS A 27 -9.784 15.546 -5.462 1.00 0.00 C ATOM 394 C HIS A 27 -8.345 15.317 -5.913 1.00 0.00 C ATOM 395 O HIS A 27 -7.892 14.178 -6.026 1.00 0.00 O ATOM 396 CB HIS A 27 -9.804 16.168 -4.062 1.00 0.00 C ATOM 397 CG HIS A 27 -11.129 16.757 -3.685 1.00 0.00 C ATOM 398 ND1 HIS A 27 -11.480 17.018 -2.377 1.00 0.00 N ATOM 399 CD2 HIS A 27 -12.184 17.136 -4.442 1.00 0.00 C ATOM 400 CE1 HIS A 27 -12.697 17.533 -2.347 1.00 0.00 C ATOM 401 NE2 HIS A 27 -13.146 17.614 -3.586 1.00 0.00 N ATOM 0 H HIS A 27 -10.161 13.564 -4.886 1.00 0.00 H new ATOM 0 HA HIS A 27 -10.260 16.238 -6.157 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -9.534 15.406 -3.331 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -9.042 16.945 -4.008 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -12.256 17.074 -5.518 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -13.233 17.836 -1.460 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -14.060 17.973 -3.863 1.00 0.00 H new ATOM 548 N GLU A 37 -3.438 5.926 12.745 1.00 0.00 N ATOM 549 CA GLU A 37 -4.624 5.171 13.134 1.00 0.00 C ATOM 550 C GLU A 37 -5.884 5.791 12.537 1.00 0.00 C ATOM 551 O GLU A 37 -6.794 6.191 13.262 1.00 0.00 O ATOM 552 CB GLU A 37 -4.741 5.100 14.658 1.00 0.00 C ATOM 553 CG GLU A 37 -3.602 4.359 15.343 1.00 0.00 C ATOM 554 CD GLU A 37 -3.717 4.443 16.840 1.00 0.00 C ATOM 555 OE1 GLU A 37 -4.700 4.961 17.312 1.00 0.00 O ATOM 556 OE2 GLU A 37 -2.878 3.891 17.512 1.00 0.00 O ATOM 0 HA GLU A 37 -4.521 4.158 12.744 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -4.788 6.114 15.054 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.682 4.613 14.916 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.608 3.314 15.034 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.648 4.780 15.025 1.00 0.00 H new ATOM 563 N ASP A 38 -5.928 5.867 11.212 1.00 0.00 N ATOM 564 CA ASP A 38 -6.907 6.701 10.526 1.00 0.00 C ATOM 565 C ASP A 38 -7.623 5.913 9.434 1.00 0.00 C ATOM 566 O ASP A 38 -7.003 5.465 8.471 1.00 0.00 O ATOM 567 CB ASP A 38 -6.236 7.940 9.929 1.00 0.00 C ATOM 568 CG ASP A 38 -7.200 8.944 9.313 1.00 0.00 C ATOM 569 OD1 ASP A 38 -8.370 8.649 9.246 1.00 0.00 O ATOM 570 OD2 ASP A 38 -6.792 10.053 9.061 1.00 0.00 O ATOM 0 H ASP A 38 -5.297 5.361 10.591 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.646 7.023 11.259 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -5.662 8.439 10.710 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.526 7.621 9.166 1.00 0.00 H new ATOM 575 N SER A 39 -8.933 5.747 9.592 1.00 0.00 N ATOM 576 CA SER A 39 -9.706 4.876 8.713 1.00 0.00 C ATOM 577 C SER A 39 -10.568 5.696 7.759 1.00 0.00 C ATOM 578 O SER A 39 -11.121 6.730 8.135 1.00 0.00 O ATOM 579 CB SER A 39 -10.568 3.936 9.533 1.00 0.00 C ATOM 580 OG SER A 39 -11.437 3.185 8.731 1.00 0.00 O ATOM 0 H SER A 39 -9.481 6.204 10.321 1.00 0.00 H new ATOM 0 HA SER A 39 -9.011 4.284 8.117 1.00 0.00 H new ATOM 0 HB2 SER A 39 -9.928 3.263 10.103 1.00 0.00 H new ATOM 0 HB3 SER A 39 -11.148 4.512 10.254 1.00 0.00 H new ATOM 0 HG SER A 39 -11.973 2.591 9.297 1.00 0.00 H new ATOM 586 N TYR A 40 -10.677 5.228 6.520 1.00 0.00 N ATOM 587 CA TYR A 40 -11.608 5.811 5.562 1.00 0.00 C ATOM 588 C TYR A 40 -12.492 4.736 4.938 1.00 0.00 C ATOM 589 O TYR A 40 -12.084 3.583 4.799 1.00 0.00 O ATOM 590 CB TYR A 40 -10.850 6.570 4.471 1.00 0.00 C ATOM 591 CG TYR A 40 -9.986 7.695 4.995 1.00 0.00 C ATOM 592 CD1 TYR A 40 -8.677 7.463 5.391 1.00 0.00 C ATOM 593 CD2 TYR A 40 -10.481 8.988 5.090 1.00 0.00 C ATOM 594 CE1 TYR A 40 -7.882 8.488 5.871 1.00 0.00 C ATOM 595 CE2 TYR A 40 -9.696 10.019 5.567 1.00 0.00 C ATOM 596 CZ TYR A 40 -8.397 9.765 5.957 1.00 0.00 C ATOM 597 OH TYR A 40 -7.610 10.789 6.432 1.00 0.00 O ATOM 0 H TYR A 40 -10.132 4.446 6.156 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.247 6.513 6.098 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -10.222 5.868 3.923 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -11.568 6.978 3.760 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -8.271 6.464 5.323 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -11.497 9.191 4.786 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -6.865 8.290 6.176 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -10.097 11.020 5.635 1.00 0.00 H new ATOM 0 HH TYR A 40 -7.320 10.582 7.345 1.00 0.00 H new ATOM 607 N ARG A 41 -13.706 5.123 4.560 1.00 0.00 N ATOM 608 CA ARG A 41 -14.609 4.224 3.852 1.00 0.00 C ATOM 609 C ARG A 41 -15.093 4.853 2.549 1.00 0.00 C ATOM 610 O ARG A 41 -15.415 6.041 2.502 1.00 0.00 O ATOM 611 CB ARG A 41 -15.775 3.774 4.722 1.00 0.00 C ATOM 612 CG ARG A 41 -15.413 2.772 5.807 1.00 0.00 C ATOM 613 CD ARG A 41 -16.567 2.303 6.616 1.00 0.00 C ATOM 614 NE ARG A 41 -16.239 1.281 7.596 1.00 0.00 N ATOM 615 CZ ARG A 41 -17.092 0.815 8.530 1.00 0.00 C ATOM 616 NH1 ARG A 41 -18.308 1.302 8.641 1.00 0.00 N ATOM 617 NH2 ARG A 41 -16.663 -0.129 9.352 1.00 0.00 N ATOM 0 H ARG A 41 -14.087 6.053 4.732 1.00 0.00 H new ATOM 0 HA ARG A 41 -14.042 3.327 3.604 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -16.219 4.652 5.191 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -16.539 3.334 4.081 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -14.935 1.909 5.343 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -14.678 3.225 6.472 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -17.004 3.158 7.133 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -17.331 1.912 5.944 1.00 0.00 H new ATOM 0 HE ARG A 41 -15.298 0.889 7.576 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -18.619 2.044 8.015 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -18.940 0.937 9.354 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -15.710 -0.484 9.268 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -17.285 -0.502 10.069 1.00 0.00 H new ATOM 631 N LYS A 42 -15.141 4.050 1.492 1.00 0.00 N ATOM 632 CA LYS A 42 -15.651 4.508 0.206 1.00 0.00 C ATOM 633 C LYS A 42 -16.254 3.349 -0.584 1.00 0.00 C ATOM 634 O LYS A 42 -15.627 2.301 -0.741 1.00 0.00 O ATOM 635 CB LYS A 42 -14.540 5.179 -0.605 1.00 0.00 C ATOM 636 CG LYS A 42 -14.980 5.699 -1.966 1.00 0.00 C ATOM 637 CD LYS A 42 -15.861 6.932 -1.829 1.00 0.00 C ATOM 638 CE LYS A 42 -16.442 7.350 -3.172 1.00 0.00 C ATOM 639 NZ LYS A 42 -17.560 6.465 -3.594 1.00 0.00 N ATOM 0 H LYS A 42 -14.833 3.078 1.501 1.00 0.00 H new ATOM 0 HA LYS A 42 -16.436 5.240 0.396 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -14.135 6.009 -0.026 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -13.729 4.465 -0.748 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -14.103 5.941 -2.566 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -15.524 4.918 -2.497 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -16.670 6.727 -1.128 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -15.278 7.753 -1.411 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -16.797 8.378 -3.109 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -15.658 7.330 -3.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -17.938 6.794 -4.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -17.212 5.490 -3.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -18.313 6.491 -2.877 1.00 0.00 H new ATOM 653 N GLN A 43 -17.471 3.548 -1.079 1.00 0.00 N ATOM 654 CA GLN A 43 -18.107 2.569 -1.953 1.00 0.00 C ATOM 655 C GLN A 43 -17.499 2.609 -3.352 1.00 0.00 C ATOM 656 O GLN A 43 -17.479 3.656 -4.001 1.00 0.00 O ATOM 657 CB GLN A 43 -19.615 2.823 -2.037 1.00 0.00 C ATOM 658 CG GLN A 43 -20.375 1.801 -2.865 1.00 0.00 C ATOM 659 CD GLN A 43 -21.875 2.020 -2.821 1.00 0.00 C ATOM 660 OE1 GLN A 43 -22.363 2.943 -2.164 1.00 0.00 O ATOM 661 NE2 GLN A 43 -22.616 1.166 -3.518 1.00 0.00 N ATOM 0 H GLN A 43 -18.036 4.376 -0.890 1.00 0.00 H new ATOM 0 HA GLN A 43 -17.935 1.581 -1.527 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -20.027 2.834 -1.028 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -19.782 3.813 -2.461 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -20.034 1.849 -3.899 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -20.146 0.800 -2.500 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -22.169 0.417 -4.047 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -23.632 1.259 -3.524 1.00 0.00 H new ATOM 670 N VAL A 44 -17.003 1.464 -3.810 1.00 0.00 N ATOM 671 CA VAL A 44 -16.275 1.397 -5.070 1.00 0.00 C ATOM 672 C VAL A 44 -16.729 0.205 -5.904 1.00 0.00 C ATOM 673 O VAL A 44 -17.321 -0.742 -5.384 1.00 0.00 O ATOM 674 CB VAL A 44 -14.754 1.301 -4.840 1.00 0.00 C ATOM 675 CG1 VAL A 44 -14.244 2.546 -4.129 1.00 0.00 C ATOM 676 CG2 VAL A 44 -14.414 0.054 -4.039 1.00 0.00 C ATOM 0 H VAL A 44 -17.092 0.570 -3.327 1.00 0.00 H new ATOM 0 HA VAL A 44 -16.493 2.319 -5.609 1.00 0.00 H new ATOM 0 HB VAL A 44 -14.262 1.232 -5.810 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -13.168 2.462 -3.974 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -14.455 3.425 -4.738 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -14.743 2.644 -3.165 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -13.336 0.002 -3.886 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -14.916 0.094 -3.072 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -14.746 -0.830 -4.584 1.00 0.00 H new ATOM 686 N VAL A 45 -16.448 0.256 -7.202 1.00 0.00 N ATOM 687 CA VAL A 45 -16.667 -0.890 -8.077 1.00 0.00 C ATOM 688 C VAL A 45 -15.345 -1.442 -8.600 1.00 0.00 C ATOM 689 O VAL A 45 -14.634 -0.774 -9.350 1.00 0.00 O ATOM 690 CB VAL A 45 -17.569 -0.524 -9.271 1.00 0.00 C ATOM 691 CG1 VAL A 45 -17.753 -1.726 -10.186 1.00 0.00 C ATOM 692 CG2 VAL A 45 -18.916 -0.014 -8.785 1.00 0.00 C ATOM 0 H VAL A 45 -16.068 1.078 -7.671 1.00 0.00 H new ATOM 0 HA VAL A 45 -17.165 -1.653 -7.479 1.00 0.00 H new ATOM 0 HB VAL A 45 -17.085 0.271 -9.838 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -18.393 -1.450 -11.024 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -16.782 -2.050 -10.561 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -18.216 -2.540 -9.629 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -19.540 0.240 -9.642 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -19.407 -0.788 -8.195 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -18.768 0.873 -8.169 1.00 0.00 H new ATOM 702 N ILE A 46 -15.022 -2.667 -8.197 1.00 0.00 N ATOM 703 CA ILE A 46 -13.756 -3.285 -8.571 1.00 0.00 C ATOM 704 C ILE A 46 -13.983 -4.602 -9.304 1.00 0.00 C ATOM 705 O ILE A 46 -14.622 -5.514 -8.782 1.00 0.00 O ATOM 706 CB ILE A 46 -12.866 -3.538 -7.341 1.00 0.00 C ATOM 707 CG1 ILE A 46 -12.569 -2.223 -6.616 1.00 0.00 C ATOM 708 CG2 ILE A 46 -11.575 -4.228 -7.751 1.00 0.00 C ATOM 709 CD1 ILE A 46 -11.830 -2.399 -5.309 1.00 0.00 C ATOM 0 H ILE A 46 -15.620 -3.251 -7.612 1.00 0.00 H new ATOM 0 HA ILE A 46 -13.248 -2.586 -9.236 1.00 0.00 H new ATOM 0 HB ILE A 46 -13.402 -4.194 -6.655 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -11.980 -1.582 -7.272 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -13.508 -1.705 -6.424 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -10.958 -4.399 -6.869 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -11.807 -5.183 -8.223 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -11.033 -3.597 -8.456 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -11.656 -1.423 -4.855 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -12.426 -3.012 -4.634 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -10.874 -2.888 -5.495 1.00 0.00 H new ATOM 721 N ASP A 47 -13.451 -4.695 -10.519 1.00 0.00 N ATOM 722 CA ASP A 47 -13.627 -5.885 -11.341 1.00 0.00 C ATOM 723 C ASP A 47 -15.099 -6.103 -11.677 1.00 0.00 C ATOM 724 O ASP A 47 -15.556 -7.237 -11.802 1.00 0.00 O ATOM 725 CB ASP A 47 -13.059 -7.117 -10.633 1.00 0.00 C ATOM 726 CG ASP A 47 -12.693 -8.266 -11.563 1.00 0.00 C ATOM 727 OD1 ASP A 47 -12.540 -8.028 -12.738 1.00 0.00 O ATOM 728 OD2 ASP A 47 -12.418 -9.336 -11.074 1.00 0.00 O ATOM 0 H ASP A 47 -12.895 -3.960 -10.955 1.00 0.00 H new ATOM 0 HA ASP A 47 -13.081 -5.734 -12.272 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -12.171 -6.822 -10.073 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -13.790 -7.473 -9.907 1.00 0.00 H new ATOM 733 N GLY A 48 -15.837 -5.006 -11.817 1.00 0.00 N ATOM 734 CA GLY A 48 -17.252 -5.098 -12.123 1.00 0.00 C ATOM 735 C GLY A 48 -18.094 -5.384 -10.895 1.00 0.00 C ATOM 736 O GLY A 48 -19.322 -5.367 -10.959 1.00 0.00 O ATOM 0 H GLY A 48 -15.480 -4.055 -11.724 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -17.584 -4.164 -12.578 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -17.411 -5.885 -12.860 1.00 0.00 H new ATOM 740 N GLU A 49 -17.430 -5.652 -9.775 1.00 0.00 N ATOM 741 CA GLU A 49 -18.126 -5.972 -8.533 1.00 0.00 C ATOM 742 C GLU A 49 -18.276 -4.731 -7.658 1.00 0.00 C ATOM 743 O GLU A 49 -17.306 -4.023 -7.392 1.00 0.00 O ATOM 744 CB GLU A 49 -17.385 -7.072 -7.771 1.00 0.00 C ATOM 745 CG GLU A 49 -18.068 -7.514 -6.484 1.00 0.00 C ATOM 746 CD GLU A 49 -17.276 -8.584 -5.785 1.00 0.00 C ATOM 747 OE1 GLU A 49 -17.014 -9.594 -6.393 1.00 0.00 O ATOM 748 OE2 GLU A 49 -16.839 -8.348 -4.684 1.00 0.00 O ATOM 0 H GLU A 49 -16.413 -5.654 -9.702 1.00 0.00 H new ATOM 0 HA GLU A 49 -19.122 -6.334 -8.787 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -17.273 -7.937 -8.424 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -16.381 -6.720 -7.533 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -18.190 -6.657 -5.821 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -19.067 -7.887 -6.709 1.00 0.00 H new ATOM 755 N THR A 50 -19.503 -4.473 -7.212 1.00 0.00 N ATOM 756 CA THR A 50 -19.773 -3.348 -6.327 1.00 0.00 C ATOM 757 C THR A 50 -19.583 -3.741 -4.866 1.00 0.00 C ATOM 758 O THR A 50 -20.156 -4.726 -4.399 1.00 0.00 O ATOM 759 CB THR A 50 -21.199 -2.805 -6.523 1.00 0.00 C ATOM 760 OG1 THR A 50 -21.365 -2.365 -7.877 1.00 0.00 O ATOM 761 CG2 THR A 50 -21.462 -1.640 -5.580 1.00 0.00 C ATOM 0 H THR A 50 -20.324 -5.029 -7.450 1.00 0.00 H new ATOM 0 HA THR A 50 -19.060 -2.565 -6.585 1.00 0.00 H new ATOM 0 HB THR A 50 -21.908 -3.604 -6.304 1.00 0.00 H new ATOM 0 HG1 THR A 50 -22.274 -2.021 -8.000 1.00 0.00 H new ATOM 0 HG21 THR A 50 -22.476 -1.269 -5.733 1.00 0.00 H new ATOM 0 HG22 THR A 50 -21.350 -1.974 -4.549 1.00 0.00 H new ATOM 0 HG23 THR A 50 -20.749 -0.841 -5.782 1.00 0.00 H new ATOM 769 N CYS A 51 -18.779 -2.965 -4.148 1.00 0.00 N ATOM 770 CA CYS A 51 -18.396 -3.313 -2.784 1.00 0.00 C ATOM 771 C CYS A 51 -18.046 -2.064 -1.983 1.00 0.00 C ATOM 772 O CYS A 51 -17.936 -0.968 -2.536 1.00 0.00 O ATOM 773 CB CYS A 51 -17.159 -4.187 -2.991 1.00 0.00 C ATOM 774 SG CYS A 51 -15.743 -3.323 -3.713 1.00 0.00 S ATOM 0 H CYS A 51 -18.379 -2.090 -4.488 1.00 0.00 H new ATOM 0 HA CYS A 51 -19.190 -3.810 -2.227 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -16.861 -4.607 -2.030 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -17.425 -5.024 -3.636 1.00 0.00 H new ATOM 0 HG CYS A 51 -16.166 -2.391 -4.514 1.00 0.00 H new ATOM 780 N LEU A 52 -17.873 -2.235 -0.678 1.00 0.00 N ATOM 781 CA LEU A 52 -17.422 -1.146 0.184 1.00 0.00 C ATOM 782 C LEU A 52 -15.959 -1.331 0.575 1.00 0.00 C ATOM 783 O LEU A 52 -15.589 -2.343 1.173 1.00 0.00 O ATOM 784 CB LEU A 52 -18.304 -1.056 1.434 1.00 0.00 C ATOM 785 CG LEU A 52 -17.871 -0.005 2.465 1.00 0.00 C ATOM 786 CD1 LEU A 52 -18.031 1.393 1.885 1.00 0.00 C ATOM 787 CD2 LEU A 52 -18.701 -0.161 3.731 1.00 0.00 C ATOM 0 H LEU A 52 -18.038 -3.117 -0.192 1.00 0.00 H new ATOM 0 HA LEU A 52 -17.508 -0.213 -0.372 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -19.326 -0.837 1.123 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -18.320 -2.032 1.919 1.00 0.00 H new ATOM 0 HG LEU A 52 -16.820 -0.153 2.714 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -17.721 2.131 2.625 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -17.411 1.490 0.993 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -19.075 1.560 1.621 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -18.393 0.586 4.463 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -19.756 -0.023 3.494 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -18.550 -1.158 4.145 1.00 0.00 H new ATOM 799 N LEU A 53 -15.133 -0.349 0.238 1.00 0.00 N ATOM 800 CA LEU A 53 -13.704 -0.419 0.523 1.00 0.00 C ATOM 801 C LEU A 53 -13.365 0.344 1.801 1.00 0.00 C ATOM 802 O LEU A 53 -13.481 1.569 1.853 1.00 0.00 O ATOM 803 CB LEU A 53 -12.899 0.133 -0.660 1.00 0.00 C ATOM 804 CG LEU A 53 -11.375 0.072 -0.498 1.00 0.00 C ATOM 805 CD1 LEU A 53 -10.923 -1.373 -0.334 1.00 0.00 C ATOM 806 CD2 LEU A 53 -10.708 0.712 -1.707 1.00 0.00 C ATOM 0 H LEU A 53 -15.427 0.506 -0.233 1.00 0.00 H new ATOM 0 HA LEU A 53 -13.436 -1.465 0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -13.175 -0.421 -1.557 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -13.190 1.171 -0.824 1.00 0.00 H new ATOM 0 HG LEU A 53 -11.083 0.623 0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -9.839 -1.405 -0.220 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -11.394 -1.803 0.550 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.212 -1.947 -1.215 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.625 0.668 -1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -10.998 0.174 -2.610 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -11.022 1.753 -1.788 1.00 0.00 H new ATOM 818 N ASP A 54 -12.943 -0.388 2.825 1.00 0.00 N ATOM 819 CA ASP A 54 -12.580 0.220 4.100 1.00 0.00 C ATOM 820 C ASP A 54 -11.067 0.231 4.288 1.00 0.00 C ATOM 821 O ASP A 54 -10.444 -0.820 4.449 1.00 0.00 O ATOM 822 CB ASP A 54 -13.250 -0.523 5.260 1.00 0.00 C ATOM 823 CG ASP A 54 -13.009 0.100 6.628 1.00 0.00 C ATOM 824 OD1 ASP A 54 -12.198 0.990 6.720 1.00 0.00 O ATOM 825 OD2 ASP A 54 -13.744 -0.207 7.536 1.00 0.00 O ATOM 0 H ASP A 54 -12.844 -1.403 2.798 1.00 0.00 H new ATOM 0 HA ASP A 54 -12.933 1.251 4.093 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -14.324 -0.565 5.077 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -12.889 -1.551 5.274 1.00 0.00 H new ATOM 830 N ILE A 55 -10.482 1.424 4.262 1.00 0.00 N ATOM 831 CA ILE A 55 -9.032 1.561 4.234 1.00 0.00 C ATOM 832 C ILE A 55 -8.502 2.079 5.567 1.00 0.00 C ATOM 833 O ILE A 55 -8.891 3.154 6.026 1.00 0.00 O ATOM 834 CB ILE A 55 -8.576 2.507 3.108 1.00 0.00 C ATOM 835 CG1 ILE A 55 -9.058 1.991 1.749 1.00 0.00 C ATOM 836 CG2 ILE A 55 -7.062 2.654 3.117 1.00 0.00 C ATOM 837 CD1 ILE A 55 -9.000 3.025 0.649 1.00 0.00 C ATOM 0 H ILE A 55 -10.990 2.309 4.260 1.00 0.00 H new ATOM 0 HA ILE A 55 -8.626 0.567 4.047 1.00 0.00 H new ATOM 0 HB ILE A 55 -9.017 3.489 3.280 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -8.451 1.133 1.461 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -10.084 1.637 1.848 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -6.757 3.326 2.315 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.742 3.064 4.075 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.601 1.678 2.968 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.357 2.586 -0.283 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.630 3.874 0.914 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -7.971 3.362 0.521 1.00 0.00 H new ATOM 849 N LEU A 56 -7.612 1.309 6.183 1.00 0.00 N ATOM 850 CA LEU A 56 -6.966 1.728 7.423 1.00 0.00 C ATOM 851 C LEU A 56 -5.529 2.166 7.166 1.00 0.00 C ATOM 852 O LEU A 56 -4.699 1.375 6.715 1.00 0.00 O ATOM 853 CB LEU A 56 -7.005 0.592 8.453 1.00 0.00 C ATOM 854 CG LEU A 56 -6.280 0.883 9.772 1.00 0.00 C ATOM 855 CD1 LEU A 56 -6.948 2.047 10.490 1.00 0.00 C ATOM 856 CD2 LEU A 56 -6.290 -0.364 10.644 1.00 0.00 C ATOM 0 H LEU A 56 -7.321 0.392 5.845 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.514 2.582 7.823 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.047 0.358 8.673 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -6.566 -0.299 8.004 1.00 0.00 H new ATOM 0 HG LEU A 56 -5.246 1.158 9.564 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.425 2.246 11.426 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.910 2.934 9.858 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.987 1.796 10.701 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.774 -0.156 11.582 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.320 -0.654 10.853 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.783 -1.176 10.123 1.00 0.00 H new ATOM 868 N ASP A 57 -5.238 3.429 7.459 1.00 0.00 N ATOM 869 CA ASP A 57 -3.882 3.951 7.333 1.00 0.00 C ATOM 870 C ASP A 57 -3.186 3.988 8.691 1.00 0.00 C ATOM 871 O ASP A 57 -3.742 4.484 9.672 1.00 0.00 O ATOM 872 CB ASP A 57 -3.898 5.348 6.709 1.00 0.00 C ATOM 873 CG ASP A 57 -4.285 5.376 5.237 1.00 0.00 C ATOM 874 OD1 ASP A 57 -4.461 4.323 4.669 1.00 0.00 O ATOM 875 OD2 ASP A 57 -4.555 6.440 4.734 1.00 0.00 O ATOM 0 H ASP A 57 -5.923 4.110 7.785 1.00 0.00 H new ATOM 0 HA ASP A 57 -3.323 3.283 6.678 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -4.595 5.974 7.267 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.910 5.794 6.821 1.00 0.00 H new ATOM 880 N THR A 58 -1.968 3.459 8.741 1.00 0.00 N ATOM 881 CA THR A 58 -1.230 3.357 9.993 1.00 0.00 C ATOM 882 C THR A 58 -0.416 4.618 10.256 1.00 0.00 C ATOM 883 O THR A 58 -0.450 5.565 9.470 1.00 0.00 O ATOM 884 CB THR A 58 -0.287 2.139 9.995 1.00 0.00 C ATOM 885 OG1 THR A 58 0.200 1.912 11.324 1.00 0.00 O ATOM 886 CG2 THR A 58 0.890 2.373 9.060 1.00 0.00 C ATOM 0 H THR A 58 -1.472 3.094 7.928 1.00 0.00 H new ATOM 0 HA THR A 58 -1.969 3.234 10.785 1.00 0.00 H new ATOM 0 HB THR A 58 -0.843 1.267 9.650 1.00 0.00 H new ATOM 0 HG1 THR A 58 -0.036 1.004 11.608 1.00 0.00 H new ATOM 0 HG21 THR A 58 1.545 1.502 9.075 1.00 0.00 H new ATOM 0 HG22 THR A 58 0.523 2.534 8.046 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.446 3.251 9.388 1.00 0.00 H new ATOM 1053 N GLN A 70 -2.120 -3.712 15.982 1.00 0.00 N ATOM 1054 CA GLN A 70 -3.539 -4.044 15.981 1.00 0.00 C ATOM 1055 C GLN A 70 -4.069 -4.161 14.555 1.00 0.00 C ATOM 1056 O GLN A 70 -4.931 -4.993 14.268 1.00 0.00 O ATOM 1057 CB GLN A 70 -4.340 -2.989 16.747 1.00 0.00 C ATOM 1058 CG GLN A 70 -4.328 -1.611 16.106 1.00 0.00 C ATOM 1059 CD GLN A 70 -5.047 -0.575 16.950 1.00 0.00 C ATOM 1060 OE1 GLN A 70 -5.681 -0.903 17.955 1.00 0.00 O ATOM 1061 NE2 GLN A 70 -4.956 0.685 16.540 1.00 0.00 N ATOM 0 HA GLN A 70 -3.657 -5.007 16.477 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -5.372 -3.327 16.836 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -3.942 -2.910 17.759 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -3.297 -1.295 15.949 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -4.798 -1.666 15.124 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -4.420 0.911 15.702 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -5.422 1.426 17.063 1.00 0.00 H new ATOM 1070 N TYR A 71 -3.550 -3.322 13.667 1.00 0.00 N ATOM 1071 CA TYR A 71 -4.034 -3.269 12.292 1.00 0.00 C ATOM 1072 C TYR A 71 -3.814 -4.602 11.585 1.00 0.00 C ATOM 1073 O TYR A 71 -4.404 -4.866 10.537 1.00 0.00 O ATOM 1074 CB TYR A 71 -3.340 -2.143 11.521 1.00 0.00 C ATOM 1075 CG TYR A 71 -1.874 -2.399 11.250 1.00 0.00 C ATOM 1076 CD1 TYR A 71 -1.471 -3.469 10.465 1.00 0.00 C ATOM 1077 CD2 TYR A 71 -0.898 -1.567 11.778 1.00 0.00 C ATOM 1078 CE1 TYR A 71 -0.133 -3.708 10.213 1.00 0.00 C ATOM 1079 CE2 TYR A 71 0.442 -1.796 11.534 1.00 0.00 C ATOM 1080 CZ TYR A 71 0.821 -2.867 10.751 1.00 0.00 C ATOM 1081 OH TYR A 71 2.155 -3.098 10.503 1.00 0.00 O ATOM 0 H TYR A 71 -2.794 -2.669 13.874 1.00 0.00 H new ATOM 0 HA TYR A 71 -5.105 -3.067 12.320 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.855 -1.995 10.572 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -3.439 -1.215 12.085 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -2.216 -4.127 10.043 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.191 -0.726 12.390 1.00 0.00 H new ATOM 0 HE1 TYR A 71 0.164 -4.546 9.600 1.00 0.00 H new ATOM 0 HE2 TYR A 71 1.190 -1.140 11.954 1.00 0.00 H new ATOM 0 HH TYR A 71 2.695 -2.415 10.953 1.00 0.00 H new ATOM 1091 N MET A 72 -2.961 -5.439 12.166 1.00 0.00 N ATOM 1092 CA MET A 72 -2.764 -6.797 11.669 1.00 0.00 C ATOM 1093 C MET A 72 -4.091 -7.544 11.587 1.00 0.00 C ATOM 1094 O MET A 72 -4.309 -8.345 10.678 1.00 0.00 O ATOM 1095 CB MET A 72 -1.785 -7.552 12.565 1.00 0.00 C ATOM 1096 CG MET A 72 -1.506 -8.983 12.127 1.00 0.00 C ATOM 1097 SD MET A 72 -2.813 -10.126 12.613 1.00 0.00 S ATOM 1098 CE MET A 72 -2.562 -10.196 14.384 1.00 0.00 C ATOM 0 H MET A 72 -2.395 -5.202 12.981 1.00 0.00 H new ATOM 0 HA MET A 72 -2.345 -6.735 10.664 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.843 -7.004 12.596 1.00 0.00 H new ATOM 0 HB3 MET A 72 -2.179 -7.566 13.581 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.389 -9.011 11.044 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.561 -9.313 12.558 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.527 -10.169 14.890 1.00 0.00 H new ATOM 0 HE2 MET A 72 -2.043 -11.119 14.642 1.00 0.00 H new ATOM 0 HE3 MET A 72 -1.962 -9.342 14.701 1.00 0.00 H new ATOM 1108 N ARG A 73 -4.976 -7.275 12.543 1.00 0.00 N ATOM 1109 CA ARG A 73 -6.208 -8.043 12.680 1.00 0.00 C ATOM 1110 C ARG A 73 -6.965 -8.098 11.355 1.00 0.00 C ATOM 1111 O ARG A 73 -7.651 -9.076 11.060 1.00 0.00 O ATOM 1112 CB ARG A 73 -7.088 -7.521 13.806 1.00 0.00 C ATOM 1113 CG ARG A 73 -8.374 -8.301 14.028 1.00 0.00 C ATOM 1114 CD ARG A 73 -9.171 -7.848 15.196 1.00 0.00 C ATOM 1115 NE ARG A 73 -10.488 -8.457 15.299 1.00 0.00 N ATOM 1116 CZ ARG A 73 -11.415 -8.125 16.219 1.00 0.00 C ATOM 1117 NH1 ARG A 73 -11.162 -7.220 17.139 1.00 0.00 N ATOM 1118 NH2 ARG A 73 -12.578 -8.751 16.187 1.00 0.00 N ATOM 0 H ARG A 73 -4.863 -6.532 13.233 1.00 0.00 H new ATOM 0 HA ARG A 73 -5.928 -9.061 12.951 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -6.512 -7.528 14.731 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -7.342 -6.482 13.597 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.990 -8.226 13.132 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -8.128 -9.355 14.158 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -8.612 -8.064 16.107 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -9.288 -6.766 15.142 1.00 0.00 H new ATOM 0 HE ARG A 73 -10.727 -9.187 14.628 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -10.253 -6.758 17.163 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -11.875 -6.980 17.828 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -12.754 -9.464 15.479 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -13.300 -8.522 16.870 1.00 0.00 H new ATOM 1132 N THR A 74 -6.834 -7.040 10.561 1.00 0.00 N ATOM 1133 CA THR A 74 -7.415 -7.011 9.225 1.00 0.00 C ATOM 1134 C THR A 74 -6.898 -8.167 8.375 1.00 0.00 C ATOM 1135 O THR A 74 -7.676 -8.981 7.878 1.00 0.00 O ATOM 1136 CB THR A 74 -7.114 -5.683 8.507 1.00 0.00 C ATOM 1137 OG1 THR A 74 -7.788 -4.610 9.177 1.00 0.00 O ATOM 1138 CG2 THR A 74 -7.576 -5.742 7.059 1.00 0.00 C ATOM 0 H THR A 74 -6.330 -6.192 10.820 1.00 0.00 H new ATOM 0 HA THR A 74 -8.494 -7.109 9.349 1.00 0.00 H new ATOM 0 HB THR A 74 -6.037 -5.513 8.527 1.00 0.00 H new ATOM 0 HG1 THR A 74 -7.594 -3.765 8.720 1.00 0.00 H new ATOM 0 HG21 THR A 74 -7.355 -4.794 6.568 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.055 -6.548 6.543 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.650 -5.925 7.027 1.00 0.00 H new ATOM 1146 N GLY A 75 -5.581 -8.232 8.211 1.00 0.00 N ATOM 1147 CA GLY A 75 -4.938 -9.486 7.863 1.00 0.00 C ATOM 1148 C GLY A 75 -5.162 -9.870 6.414 1.00 0.00 C ATOM 1149 O GLY A 75 -4.607 -10.858 5.934 1.00 0.00 O ATOM 0 H GLY A 75 -4.947 -7.439 8.313 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -3.868 -9.407 8.053 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -5.319 -10.277 8.508 1.00 0.00 H new ATOM 1153 N GLU A 76 -5.979 -9.087 5.715 1.00 0.00 N ATOM 1154 CA GLU A 76 -6.355 -9.407 4.344 1.00 0.00 C ATOM 1155 C GLU A 76 -5.218 -9.081 3.380 1.00 0.00 C ATOM 1156 O GLU A 76 -4.671 -9.968 2.724 1.00 0.00 O ATOM 1157 CB GLU A 76 -7.622 -8.649 3.943 1.00 0.00 C ATOM 1158 CG GLU A 76 -8.888 -9.127 4.640 1.00 0.00 C ATOM 1159 CD GLU A 76 -10.091 -8.353 4.181 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -9.945 -7.524 3.314 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -11.175 -8.665 4.613 1.00 0.00 O ATOM 0 H GLU A 76 -6.392 -8.227 6.076 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.557 -10.477 4.290 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -7.481 -7.590 4.159 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -7.759 -8.739 2.865 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -9.037 -10.188 4.439 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -8.774 -9.020 5.719 1.00 0.00 H new ATOM 1168 N GLY A 77 -4.868 -7.801 3.297 1.00 0.00 N ATOM 1169 CA GLY A 77 -3.805 -7.379 2.403 1.00 0.00 C ATOM 1170 C GLY A 77 -3.174 -6.070 2.832 1.00 0.00 C ATOM 1171 O GLY A 77 -3.768 -5.306 3.595 1.00 0.00 O ATOM 0 H GLY A 77 -5.301 -7.049 3.833 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -3.038 -8.153 2.364 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -4.203 -7.274 1.394 1.00 0.00 H new ATOM 1175 N PHE A 78 -1.966 -5.807 2.342 1.00 0.00 N ATOM 1176 CA PHE A 78 -1.200 -4.645 2.778 1.00 0.00 C ATOM 1177 C PHE A 78 -0.589 -3.919 1.583 1.00 0.00 C ATOM 1178 O PHE A 78 -0.064 -4.548 0.662 1.00 0.00 O ATOM 1179 CB PHE A 78 -0.105 -5.064 3.761 1.00 0.00 C ATOM 1180 CG PHE A 78 -0.628 -5.706 5.014 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -0.944 -4.939 6.125 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -0.808 -7.080 5.085 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -1.424 -5.527 7.279 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -1.289 -7.672 6.236 1.00 0.00 C ATOM 1185 CZ PHE A 78 -1.597 -6.895 7.333 1.00 0.00 C ATOM 0 H PHE A 78 -1.497 -6.383 1.643 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.880 -3.960 3.284 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.571 -5.759 3.263 1.00 0.00 H new ATOM 0 HB3 PHE A 78 0.483 -4.187 4.031 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.813 -3.868 6.088 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -0.569 -7.694 4.229 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.664 -4.917 8.138 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -1.424 -8.743 6.277 1.00 0.00 H new ATOM 0 HZ PHE A 78 -1.973 -7.357 8.234 1.00 0.00 H new ATOM 1195 N LEU A 79 -0.659 -2.593 1.606 1.00 0.00 N ATOM 1196 CA LEU A 79 0.050 -1.772 0.631 1.00 0.00 C ATOM 1197 C LEU A 79 1.323 -1.186 1.234 1.00 0.00 C ATOM 1198 O LEU A 79 1.301 -0.627 2.332 1.00 0.00 O ATOM 1199 CB LEU A 79 -0.861 -0.653 0.113 1.00 0.00 C ATOM 1200 CG LEU A 79 -2.080 -1.123 -0.690 1.00 0.00 C ATOM 1201 CD1 LEU A 79 -2.847 0.078 -1.226 1.00 0.00 C ATOM 1202 CD2 LEU A 79 -1.623 -2.022 -1.830 1.00 0.00 C ATOM 0 H LEU A 79 -1.200 -2.063 2.289 1.00 0.00 H new ATOM 0 HA LEU A 79 0.334 -2.408 -0.207 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.210 -0.067 0.964 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.269 0.015 -0.513 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.746 -1.691 -0.040 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.711 -0.266 -1.795 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.184 0.696 -0.393 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.197 0.665 -1.874 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.490 -2.356 -2.400 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.950 -1.467 -2.484 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.101 -2.888 -1.423 1.00 0.00 H new ATOM 1214 N CYS A 80 2.430 -1.317 0.511 1.00 0.00 N ATOM 1215 CA CYS A 80 3.696 -0.734 0.939 1.00 0.00 C ATOM 1216 C CYS A 80 4.042 0.491 0.099 1.00 0.00 C ATOM 1217 O CYS A 80 4.327 0.380 -1.093 1.00 0.00 O ATOM 1218 CB CYS A 80 4.693 -1.864 0.683 1.00 0.00 C ATOM 1219 SG CYS A 80 4.437 -3.336 1.702 1.00 0.00 S ATOM 0 H CYS A 80 2.476 -1.822 -0.374 1.00 0.00 H new ATOM 0 HA CYS A 80 3.685 -0.391 1.973 1.00 0.00 H new ATOM 0 HB2 CYS A 80 4.636 -2.150 -0.367 1.00 0.00 H new ATOM 0 HB3 CYS A 80 5.701 -1.488 0.857 1.00 0.00 H new ATOM 0 HG CYS A 80 5.332 -4.231 1.404 1.00 0.00 H new ATOM 1225 N VAL A 81 4.011 1.662 0.729 1.00 0.00 N ATOM 1226 CA VAL A 81 4.256 2.915 0.026 1.00 0.00 C ATOM 1227 C VAL A 81 5.593 3.523 0.433 1.00 0.00 C ATOM 1228 O VAL A 81 5.859 3.726 1.619 1.00 0.00 O ATOM 1229 CB VAL A 81 3.135 3.938 0.288 1.00 0.00 C ATOM 1230 CG1 VAL A 81 3.425 5.245 -0.435 1.00 0.00 C ATOM 1231 CG2 VAL A 81 1.789 3.378 -0.147 1.00 0.00 C ATOM 0 H VAL A 81 3.819 1.768 1.725 1.00 0.00 H new ATOM 0 HA VAL A 81 4.278 2.680 -1.038 1.00 0.00 H new ATOM 0 HB VAL A 81 3.096 4.137 1.359 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.622 5.956 -0.238 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.369 5.656 -0.078 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.492 5.061 -1.507 1.00 0.00 H new ATOM 0 HG21 VAL A 81 1.009 4.115 0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.817 3.150 -1.212 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.575 2.468 0.414 1.00 0.00 H new ATOM 1241 N PHE A 82 6.431 3.814 -0.557 1.00 0.00 N ATOM 1242 CA PHE A 82 7.740 4.404 -0.302 1.00 0.00 C ATOM 1243 C PHE A 82 8.011 5.558 -1.262 1.00 0.00 C ATOM 1244 O PHE A 82 7.284 5.756 -2.235 1.00 0.00 O ATOM 1245 CB PHE A 82 8.836 3.345 -0.438 1.00 0.00 C ATOM 1246 CG PHE A 82 9.093 2.928 -1.858 1.00 0.00 C ATOM 1247 CD1 PHE A 82 8.344 1.921 -2.445 1.00 0.00 C ATOM 1248 CD2 PHE A 82 10.084 3.543 -2.605 1.00 0.00 C ATOM 1249 CE1 PHE A 82 8.580 1.535 -3.750 1.00 0.00 C ATOM 1250 CE2 PHE A 82 10.324 3.161 -3.912 1.00 0.00 C ATOM 1251 CZ PHE A 82 9.570 2.157 -4.485 1.00 0.00 C ATOM 0 H PHE A 82 6.227 3.651 -1.543 1.00 0.00 H new ATOM 0 HA PHE A 82 7.744 4.792 0.717 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.760 3.732 -0.009 1.00 0.00 H new ATOM 0 HB3 PHE A 82 8.557 2.467 0.145 1.00 0.00 H new ATOM 0 HD1 PHE A 82 7.567 1.432 -1.876 1.00 0.00 H new ATOM 0 HD2 PHE A 82 10.676 4.330 -2.162 1.00 0.00 H new ATOM 0 HE1 PHE A 82 7.991 0.747 -4.195 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.100 3.648 -4.484 1.00 0.00 H new ATOM 0 HZ PHE A 82 9.754 1.858 -5.506 1.00 0.00 H new ATOM 1261 N ALA A 83 9.064 6.320 -0.979 1.00 0.00 N ATOM 1262 CA ALA A 83 9.489 7.395 -1.866 1.00 0.00 C ATOM 1263 C ALA A 83 10.802 7.047 -2.559 1.00 0.00 C ATOM 1264 O ALA A 83 11.694 6.450 -1.957 1.00 0.00 O ATOM 1265 CB ALA A 83 9.629 8.697 -1.091 1.00 0.00 C ATOM 0 H ALA A 83 9.637 6.212 -0.142 1.00 0.00 H new ATOM 0 HA ALA A 83 8.725 7.523 -2.633 1.00 0.00 H new ATOM 0 HB1 ALA A 83 9.947 9.491 -1.767 1.00 0.00 H new ATOM 0 HB2 ALA A 83 8.669 8.961 -0.647 1.00 0.00 H new ATOM 0 HB3 ALA A 83 10.371 8.573 -0.302 1.00 0.00 H new ATOM 1271 N ILE A 84 10.913 7.423 -3.829 1.00 0.00 N ATOM 1272 CA ILE A 84 12.048 7.019 -4.649 1.00 0.00 C ATOM 1273 C ILE A 84 13.335 7.687 -4.174 1.00 0.00 C ATOM 1274 O ILE A 84 14.428 7.332 -4.610 1.00 0.00 O ATOM 1275 CB ILE A 84 11.821 7.357 -6.133 1.00 0.00 C ATOM 1276 CG1 ILE A 84 11.716 8.872 -6.326 1.00 0.00 C ATOM 1277 CG2 ILE A 84 10.572 6.663 -6.653 1.00 0.00 C ATOM 1278 CD1 ILE A 84 11.690 9.303 -7.775 1.00 0.00 C ATOM 0 H ILE A 84 10.230 8.007 -4.312 1.00 0.00 H new ATOM 0 HA ILE A 84 12.144 5.938 -4.544 1.00 0.00 H new ATOM 0 HB ILE A 84 12.676 6.996 -6.705 1.00 0.00 H new ATOM 0 HG12 ILE A 84 10.811 9.230 -5.834 1.00 0.00 H new ATOM 0 HG13 ILE A 84 12.560 9.351 -5.829 1.00 0.00 H new ATOM 0 HG21 ILE A 84 10.427 6.914 -7.704 1.00 0.00 H new ATOM 0 HG22 ILE A 84 10.686 5.584 -6.550 1.00 0.00 H new ATOM 0 HG23 ILE A 84 9.706 6.993 -6.079 1.00 0.00 H new ATOM 0 HD11 ILE A 84 11.614 10.389 -7.830 1.00 0.00 H new ATOM 0 HD12 ILE A 84 12.606 8.977 -8.268 1.00 0.00 H new ATOM 0 HD13 ILE A 84 10.831 8.854 -8.273 1.00 0.00 H new ATOM 1290 N ASN A 85 13.194 8.655 -3.273 1.00 0.00 N ATOM 1291 CA ASN A 85 14.349 9.296 -2.654 1.00 0.00 C ATOM 1292 C ASN A 85 14.699 8.622 -1.331 1.00 0.00 C ATOM 1293 O ASN A 85 15.598 9.064 -0.617 1.00 0.00 O ATOM 1294 CB ASN A 85 14.117 10.780 -2.444 1.00 0.00 C ATOM 1295 CG ASN A 85 13.053 11.089 -1.427 1.00 0.00 C ATOM 1296 OD1 ASN A 85 11.892 10.692 -1.573 1.00 0.00 O ATOM 1297 ND2 ASN A 85 13.424 11.862 -0.438 1.00 0.00 N ATOM 0 H ASN A 85 12.293 9.012 -2.956 1.00 0.00 H new ATOM 0 HA ASN A 85 15.190 9.182 -3.338 1.00 0.00 H new ATOM 0 HB2 ASN A 85 15.052 11.244 -2.130 1.00 0.00 H new ATOM 0 HB3 ASN A 85 13.840 11.233 -3.396 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.741 12.164 0.257 1.00 0.00 H new ATOM 0 HD22 ASN A 85 14.396 12.162 -0.362 1.00 0.00 H new ATOM 1304 N ASN A 86 13.983 7.548 -1.012 1.00 0.00 N ATOM 1305 CA ASN A 86 14.247 6.789 0.205 1.00 0.00 C ATOM 1306 C ASN A 86 14.791 5.403 -0.126 1.00 0.00 C ATOM 1307 O ASN A 86 14.031 4.466 -0.377 1.00 0.00 O ATOM 1308 CB ASN A 86 13.005 6.674 1.070 1.00 0.00 C ATOM 1309 CG ASN A 86 12.620 7.958 1.750 1.00 0.00 C ATOM 1310 OD1 ASN A 86 13.442 8.867 1.914 1.00 0.00 O ATOM 1311 ND2 ASN A 86 11.399 8.006 2.218 1.00 0.00 N ATOM 0 H ASN A 86 13.217 7.184 -1.579 1.00 0.00 H new ATOM 0 HA ASN A 86 15.002 7.334 0.771 1.00 0.00 H new ATOM 0 HB2 ASN A 86 12.173 6.337 0.452 1.00 0.00 H new ATOM 0 HB3 ASN A 86 13.170 5.908 1.827 1.00 0.00 H new ATOM 0 HD21 ASN A 86 11.087 8.821 2.746 1.00 0.00 H new ATOM 0 HD22 ASN A 86 10.759 7.229 2.055 1.00 0.00 H new ATOM 1318 N THR A 87 16.115 5.278 -0.125 1.00 0.00 N ATOM 1319 CA THR A 87 16.759 3.972 -0.198 1.00 0.00 C ATOM 1320 C THR A 87 16.463 3.144 1.047 1.00 0.00 C ATOM 1321 O THR A 87 16.108 1.968 0.953 1.00 0.00 O ATOM 1322 CB THR A 87 18.285 4.103 -0.365 1.00 0.00 C ATOM 1323 OG1 THR A 87 18.575 4.806 -1.581 1.00 0.00 O ATOM 1324 CG2 THR A 87 18.936 2.730 -0.409 1.00 0.00 C ATOM 0 H THR A 87 16.762 6.065 -0.074 1.00 0.00 H new ATOM 0 HA THR A 87 16.350 3.467 -1.073 1.00 0.00 H new ATOM 0 HB THR A 87 18.684 4.655 0.486 1.00 0.00 H new ATOM 0 HG1 THR A 87 18.121 4.366 -2.330 1.00 0.00 H new ATOM 0 HG21 THR A 87 20.014 2.842 -0.527 1.00 0.00 H new ATOM 0 HG22 THR A 87 18.726 2.198 0.519 1.00 0.00 H new ATOM 0 HG23 THR A 87 18.535 2.164 -1.250 1.00 0.00 H new ATOM 1332 N LYS A 88 16.612 3.762 2.214 1.00 0.00 N ATOM 1333 CA LYS A 88 16.458 3.056 3.480 1.00 0.00 C ATOM 1334 C LYS A 88 15.094 2.378 3.563 1.00 0.00 C ATOM 1335 O LYS A 88 14.959 1.304 4.151 1.00 0.00 O ATOM 1336 CB LYS A 88 16.644 4.016 4.656 1.00 0.00 C ATOM 1337 CG LYS A 88 16.560 3.356 6.026 1.00 0.00 C ATOM 1338 CD LYS A 88 16.834 4.356 7.140 1.00 0.00 C ATOM 1339 CE LYS A 88 16.958 3.663 8.489 1.00 0.00 C ATOM 1340 NZ LYS A 88 15.640 3.185 8.991 1.00 0.00 N ATOM 0 H LYS A 88 16.840 4.752 2.309 1.00 0.00 H new ATOM 0 HA LYS A 88 17.227 2.286 3.532 1.00 0.00 H new ATOM 0 HB2 LYS A 88 17.614 4.505 4.560 1.00 0.00 H new ATOM 0 HB3 LYS A 88 15.886 4.797 4.595 1.00 0.00 H new ATOM 0 HG2 LYS A 88 15.570 2.920 6.162 1.00 0.00 H new ATOM 0 HG3 LYS A 88 17.279 2.539 6.083 1.00 0.00 H new ATOM 0 HD2 LYS A 88 17.752 4.902 6.924 1.00 0.00 H new ATOM 0 HD3 LYS A 88 16.029 5.090 7.179 1.00 0.00 H new ATOM 0 HE2 LYS A 88 17.641 2.818 8.402 1.00 0.00 H new ATOM 0 HE3 LYS A 88 17.394 4.352 9.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 15.757 2.780 9.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 14.975 3.983 9.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 15.267 2.458 8.348 1.00 0.00 H new ATOM 1354 N SER A 89 14.087 3.010 2.969 1.00 0.00 N ATOM 1355 CA SER A 89 12.710 2.550 3.105 1.00 0.00 C ATOM 1356 C SER A 89 12.580 1.090 2.678 1.00 0.00 C ATOM 1357 O SER A 89 11.693 0.374 3.140 1.00 0.00 O ATOM 1358 CB SER A 89 11.783 3.428 2.288 1.00 0.00 C ATOM 1359 OG SER A 89 11.933 3.214 0.911 1.00 0.00 O ATOM 0 H SER A 89 14.199 3.842 2.389 1.00 0.00 H new ATOM 0 HA SER A 89 12.425 2.621 4.155 1.00 0.00 H new ATOM 0 HB2 SER A 89 10.750 3.230 2.575 1.00 0.00 H new ATOM 0 HB3 SER A 89 11.982 4.475 2.516 1.00 0.00 H new ATOM 0 HG SER A 89 12.719 3.702 0.588 1.00 0.00 H new ATOM 1365 N PHE A 90 13.471 0.658 1.794 1.00 0.00 N ATOM 1366 CA PHE A 90 13.465 -0.719 1.314 1.00 0.00 C ATOM 1367 C PHE A 90 13.815 -1.689 2.439 1.00 0.00 C ATOM 1368 O PHE A 90 13.184 -2.734 2.589 1.00 0.00 O ATOM 1369 CB PHE A 90 14.443 -0.886 0.149 1.00 0.00 C ATOM 1370 CG PHE A 90 13.885 -0.455 -1.177 1.00 0.00 C ATOM 1371 CD1 PHE A 90 12.552 -0.094 -1.300 1.00 0.00 C ATOM 1372 CD2 PHE A 90 14.692 -0.412 -2.305 1.00 0.00 C ATOM 1373 CE1 PHE A 90 12.038 0.302 -2.520 1.00 0.00 C ATOM 1374 CE2 PHE A 90 14.181 -0.015 -3.525 1.00 0.00 C ATOM 1375 CZ PHE A 90 12.851 0.341 -3.632 1.00 0.00 C ATOM 0 H PHE A 90 14.207 1.241 1.395 1.00 0.00 H new ATOM 0 HA PHE A 90 12.459 -0.949 0.962 1.00 0.00 H new ATOM 0 HB2 PHE A 90 15.344 -0.310 0.358 1.00 0.00 H new ATOM 0 HB3 PHE A 90 14.741 -1.932 0.084 1.00 0.00 H new ATOM 0 HD1 PHE A 90 11.909 -0.123 -0.433 1.00 0.00 H new ATOM 0 HD2 PHE A 90 15.732 -0.692 -2.228 1.00 0.00 H new ATOM 0 HE1 PHE A 90 10.998 0.581 -2.602 1.00 0.00 H new ATOM 0 HE2 PHE A 90 14.821 0.017 -4.394 1.00 0.00 H new ATOM 0 HZ PHE A 90 12.449 0.649 -4.586 1.00 0.00 H new ATOM 1385 N GLU A 91 14.828 -1.333 3.224 1.00 0.00 N ATOM 1386 CA GLU A 91 15.216 -2.136 4.378 1.00 0.00 C ATOM 1387 C GLU A 91 14.139 -2.096 5.457 1.00 0.00 C ATOM 1388 O GLU A 91 13.882 -3.093 6.131 1.00 0.00 O ATOM 1389 CB GLU A 91 16.552 -1.651 4.946 1.00 0.00 C ATOM 1390 CG GLU A 91 17.752 -1.922 4.050 1.00 0.00 C ATOM 1391 CD GLU A 91 19.003 -1.305 4.611 1.00 0.00 C ATOM 1392 OE1 GLU A 91 18.917 -0.641 5.616 1.00 0.00 O ATOM 1393 OE2 GLU A 91 20.062 -1.590 4.102 1.00 0.00 O ATOM 0 H GLU A 91 15.393 -0.496 3.082 1.00 0.00 H new ATOM 0 HA GLU A 91 15.331 -3.168 4.046 1.00 0.00 H new ATOM 0 HB2 GLU A 91 16.487 -0.579 5.130 1.00 0.00 H new ATOM 0 HB3 GLU A 91 16.718 -2.131 5.910 1.00 0.00 H new ATOM 0 HG2 GLU A 91 17.892 -2.998 3.941 1.00 0.00 H new ATOM 0 HG3 GLU A 91 17.562 -1.523 3.054 1.00 0.00 H new ATOM 1400 N ASP A 92 13.513 -0.934 5.617 1.00 0.00 N ATOM 1401 CA ASP A 92 12.437 -0.773 6.587 1.00 0.00 C ATOM 1402 C ASP A 92 11.261 -1.684 6.253 1.00 0.00 C ATOM 1403 O ASP A 92 10.720 -2.360 7.129 1.00 0.00 O ATOM 1404 CB ASP A 92 11.975 0.686 6.640 1.00 0.00 C ATOM 1405 CG ASP A 92 12.992 1.647 7.241 1.00 0.00 C ATOM 1406 OD1 ASP A 92 13.962 1.185 7.795 1.00 0.00 O ATOM 1407 OD2 ASP A 92 12.876 2.826 7.006 1.00 0.00 O ATOM 0 H ASP A 92 13.733 -0.091 5.087 1.00 0.00 H new ATOM 0 HA ASP A 92 12.823 -1.055 7.567 1.00 0.00 H new ATOM 0 HB2 ASP A 92 11.736 1.015 5.629 1.00 0.00 H new ATOM 0 HB3 ASP A 92 11.054 0.742 7.220 1.00 0.00 H new ATOM 1412 N ILE A 93 10.872 -1.699 4.982 1.00 0.00 N ATOM 1413 CA ILE A 93 9.766 -2.534 4.533 1.00 0.00 C ATOM 1414 C ILE A 93 10.059 -4.011 4.776 1.00 0.00 C ATOM 1415 O ILE A 93 9.181 -4.769 5.192 1.00 0.00 O ATOM 1416 CB ILE A 93 9.466 -2.318 3.038 1.00 0.00 C ATOM 1417 CG1 ILE A 93 8.873 -0.924 2.810 1.00 0.00 C ATOM 1418 CG2 ILE A 93 8.521 -3.392 2.525 1.00 0.00 C ATOM 1419 CD1 ILE A 93 8.823 -0.514 1.356 1.00 0.00 C ATOM 0 H ILE A 93 11.307 -1.142 4.246 1.00 0.00 H new ATOM 0 HA ILE A 93 8.892 -2.240 5.114 1.00 0.00 H new ATOM 0 HB ILE A 93 10.401 -2.390 2.482 1.00 0.00 H new ATOM 0 HG12 ILE A 93 7.864 -0.897 3.221 1.00 0.00 H new ATOM 0 HG13 ILE A 93 9.462 -0.193 3.364 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.320 -3.224 1.467 1.00 0.00 H new ATOM 0 HG22 ILE A 93 8.979 -4.372 2.656 1.00 0.00 H new ATOM 0 HG23 ILE A 93 7.586 -3.351 3.083 1.00 0.00 H new ATOM 0 HD11 ILE A 93 8.391 0.484 1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 93 9.832 -0.508 0.945 1.00 0.00 H new ATOM 0 HD13 ILE A 93 8.209 -1.222 0.799 1.00 0.00 H new ATOM 1431 N HIS A 94 11.299 -4.414 4.516 1.00 0.00 N ATOM 1432 CA HIS A 94 11.693 -5.811 4.659 1.00 0.00 C ATOM 1433 C HIS A 94 11.594 -6.258 6.114 1.00 0.00 C ATOM 1434 O HIS A 94 11.004 -7.295 6.416 1.00 0.00 O ATOM 1435 CB HIS A 94 13.118 -6.029 4.137 1.00 0.00 C ATOM 1436 CG HIS A 94 13.622 -7.426 4.331 1.00 0.00 C ATOM 1437 ND1 HIS A 94 13.201 -8.483 3.552 1.00 0.00 N ATOM 1438 CD2 HIS A 94 14.511 -7.938 5.214 1.00 0.00 C ATOM 1439 CE1 HIS A 94 13.811 -9.587 3.949 1.00 0.00 C ATOM 1440 NE2 HIS A 94 14.610 -9.283 4.955 1.00 0.00 N ATOM 0 H HIS A 94 12.047 -3.794 4.206 1.00 0.00 H new ATOM 0 HA HIS A 94 11.007 -6.414 4.064 1.00 0.00 H new ATOM 0 HB2 HIS A 94 13.148 -5.785 3.075 1.00 0.00 H new ATOM 0 HB3 HIS A 94 13.791 -5.336 4.642 1.00 0.00 H new ATOM 0 HD2 HIS A 94 15.043 -7.391 5.979 1.00 0.00 H new ATOM 0 HE1 HIS A 94 13.678 -10.570 3.523 1.00 0.00 H new ATOM 0 HE2 HIS A 94 15.205 -9.941 5.459 1.00 0.00 H new ATOM 1447 N GLN A 95 12.178 -5.470 7.011 1.00 0.00 N ATOM 1448 CA GLN A 95 12.206 -5.814 8.427 1.00 0.00 C ATOM 1449 C GLN A 95 10.799 -5.807 9.018 1.00 0.00 C ATOM 1450 O GLN A 95 10.390 -6.759 9.683 1.00 0.00 O ATOM 1451 CB GLN A 95 13.098 -4.840 9.200 1.00 0.00 C ATOM 1452 CG GLN A 95 14.583 -5.003 8.924 1.00 0.00 C ATOM 1453 CD GLN A 95 15.409 -3.875 9.516 1.00 0.00 C ATOM 1454 OE1 GLN A 95 14.732 -2.868 10.055 1.00 0.00 O flip ATOM 1455 NE2 GLN A 95 16.642 -3.911 9.491 1.00 0.00 N flip ATOM 0 H GLN A 95 12.638 -4.589 6.782 1.00 0.00 H new ATOM 0 HA GLN A 95 12.617 -6.820 8.518 1.00 0.00 H new ATOM 0 HB2 GLN A 95 12.804 -3.820 8.952 1.00 0.00 H new ATOM 0 HB3 GLN A 95 12.922 -4.972 10.267 1.00 0.00 H new ATOM 0 HG2 GLN A 95 14.924 -5.953 9.335 1.00 0.00 H new ATOM 0 HG3 GLN A 95 14.747 -5.044 7.847 1.00 0.00 H new ATOM 0 HE21 GLN A 95 17.121 -4.705 9.066 1.00 0.00 H new ATOM 0 HE22 GLN A 95 17.183 -3.146 9.895 1.00 0.00 H new ATOM 1464 N TYR A 96 10.064 -4.730 8.769 1.00 0.00 N ATOM 1465 CA TYR A 96 8.706 -4.596 9.281 1.00 0.00 C ATOM 1466 C TYR A 96 7.794 -5.668 8.692 1.00 0.00 C ATOM 1467 O TYR A 96 6.846 -6.116 9.337 1.00 0.00 O ATOM 1468 CB TYR A 96 8.150 -3.203 8.972 1.00 0.00 C ATOM 1469 CG TYR A 96 8.697 -2.113 9.867 1.00 0.00 C ATOM 1470 CD1 TYR A 96 8.594 -2.207 11.247 1.00 0.00 C ATOM 1471 CD2 TYR A 96 9.313 -0.992 9.330 1.00 0.00 C ATOM 1472 CE1 TYR A 96 9.091 -1.216 12.069 1.00 0.00 C ATOM 1473 CE2 TYR A 96 9.814 0.006 10.142 1.00 0.00 C ATOM 1474 CZ TYR A 96 9.701 -0.109 11.513 1.00 0.00 C ATOM 1475 OH TYR A 96 10.197 0.882 12.328 1.00 0.00 O ATOM 0 H TYR A 96 10.386 -3.936 8.215 1.00 0.00 H new ATOM 0 HA TYR A 96 8.739 -4.729 10.362 1.00 0.00 H new ATOM 0 HB2 TYR A 96 8.374 -2.955 7.935 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.064 -3.227 9.066 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.117 -3.071 11.686 1.00 0.00 H new ATOM 0 HD2 TYR A 96 9.402 -0.898 8.258 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.003 -1.306 13.142 1.00 0.00 H new ATOM 0 HE2 TYR A 96 10.292 0.872 9.707 1.00 0.00 H new ATOM 0 HH TYR A 96 10.595 1.589 11.778 1.00 0.00 H new ATOM 1485 N ARG A 97 8.089 -6.074 7.462 1.00 0.00 N ATOM 1486 CA ARG A 97 7.357 -7.162 6.820 1.00 0.00 C ATOM 1487 C ARG A 97 7.500 -8.454 7.617 1.00 0.00 C ATOM 1488 O ARG A 97 6.518 -9.159 7.853 1.00 0.00 O ATOM 1489 CB ARG A 97 7.764 -7.351 5.367 1.00 0.00 C ATOM 1490 CG ARG A 97 7.075 -8.504 4.655 1.00 0.00 C ATOM 1491 CD ARG A 97 7.563 -8.751 3.274 1.00 0.00 C ATOM 1492 NE ARG A 97 8.980 -9.062 3.182 1.00 0.00 N ATOM 1493 CZ ARG A 97 9.519 -10.266 3.455 1.00 0.00 C ATOM 1494 NH1 ARG A 97 8.771 -11.263 3.874 1.00 0.00 N ATOM 1495 NH2 ARG A 97 10.825 -10.412 3.316 1.00 0.00 N ATOM 0 H ARG A 97 8.829 -5.667 6.889 1.00 0.00 H new ATOM 0 HA ARG A 97 6.303 -6.885 6.812 1.00 0.00 H new ATOM 0 HB2 ARG A 97 7.554 -6.430 4.823 1.00 0.00 H new ATOM 0 HB3 ARG A 97 8.842 -7.508 5.324 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.211 -9.412 5.243 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.004 -8.305 4.619 1.00 0.00 H new ATOM 0 HD2 ARG A 97 6.994 -9.575 2.843 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.357 -7.870 2.666 1.00 0.00 H new ATOM 0 HE ARG A 97 9.611 -8.316 2.890 1.00 0.00 H new ATOM 0 HH11 ARG A 97 7.767 -11.131 3.997 1.00 0.00 H new ATOM 0 HH12 ARG A 97 9.195 -12.168 4.076 1.00 0.00 H new ATOM 0 HH21 ARG A 97 11.396 -9.625 3.009 1.00 0.00 H new ATOM 0 HH22 ARG A 97 11.262 -11.312 3.515 1.00 0.00 H new ATOM 1509 N GLU A 98 8.726 -8.761 8.026 1.00 0.00 N ATOM 1510 CA GLU A 98 8.998 -9.981 8.777 1.00 0.00 C ATOM 1511 C GLU A 98 8.380 -9.911 10.170 1.00 0.00 C ATOM 1512 O GLU A 98 7.907 -10.916 10.701 1.00 0.00 O ATOM 1513 CB GLU A 98 10.506 -10.224 8.880 1.00 0.00 C ATOM 1514 CG GLU A 98 11.167 -10.633 7.571 1.00 0.00 C ATOM 1515 CD GLU A 98 12.653 -10.790 7.736 1.00 0.00 C ATOM 1516 OE1 GLU A 98 13.146 -10.511 8.802 1.00 0.00 O ATOM 1517 OE2 GLU A 98 13.281 -11.294 6.834 1.00 0.00 O ATOM 0 H GLU A 98 9.547 -8.182 7.850 1.00 0.00 H new ATOM 0 HA GLU A 98 8.545 -10.815 8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.984 -9.315 9.246 1.00 0.00 H new ATOM 0 HB3 GLU A 98 10.687 -11.001 9.623 1.00 0.00 H new ATOM 0 HG2 GLU A 98 10.737 -11.571 7.221 1.00 0.00 H new ATOM 0 HG3 GLU A 98 10.961 -9.883 6.807 1.00 0.00 H new ATOM 1524 N GLN A 99 8.388 -8.719 10.756 1.00 0.00 N ATOM 1525 CA GLN A 99 7.783 -8.507 12.065 1.00 0.00 C ATOM 1526 C GLN A 99 6.273 -8.706 12.008 1.00 0.00 C ATOM 1527 O GLN A 99 5.688 -9.348 12.880 1.00 0.00 O ATOM 1528 CB GLN A 99 8.101 -7.101 12.583 1.00 0.00 C ATOM 1529 CG GLN A 99 7.517 -6.794 13.951 1.00 0.00 C ATOM 1530 CD GLN A 99 7.859 -5.394 14.426 1.00 0.00 C ATOM 1531 OE1 GLN A 99 8.917 -5.166 15.017 1.00 0.00 O ATOM 1532 NE2 GLN A 99 6.960 -4.450 14.173 1.00 0.00 N ATOM 0 H GLN A 99 8.807 -7.885 10.345 1.00 0.00 H new ATOM 0 HA GLN A 99 8.205 -9.243 12.750 1.00 0.00 H new ATOM 0 HB2 GLN A 99 9.183 -6.978 12.627 1.00 0.00 H new ATOM 0 HB3 GLN A 99 7.726 -6.369 11.868 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.434 -6.907 13.914 1.00 0.00 H new ATOM 0 HG3 GLN A 99 7.889 -7.521 14.673 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.098 -4.685 13.681 1.00 0.00 H new ATOM 0 HE22 GLN A 99 7.131 -3.490 14.471 1.00 0.00 H new ATOM 1541 N ILE A 100 5.648 -8.152 10.975 1.00 0.00 N ATOM 1542 CA ILE A 100 4.225 -8.368 10.737 1.00 0.00 C ATOM 1543 C ILE A 100 3.918 -9.851 10.552 1.00 0.00 C ATOM 1544 O ILE A 100 2.893 -10.347 11.021 1.00 0.00 O ATOM 1545 CB ILE A 100 3.735 -7.592 9.502 1.00 0.00 C ATOM 1546 CG1 ILE A 100 3.758 -6.086 9.775 1.00 0.00 C ATOM 1547 CG2 ILE A 100 2.337 -8.044 9.110 1.00 0.00 C ATOM 1548 CD1 ILE A 100 3.580 -5.238 8.535 1.00 0.00 C ATOM 0 H ILE A 100 6.104 -7.550 10.289 1.00 0.00 H new ATOM 0 HA ILE A 100 3.698 -7.998 11.617 1.00 0.00 H new ATOM 0 HB ILE A 100 4.408 -7.801 8.671 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.969 -5.843 10.486 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.705 -5.826 10.249 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.006 -7.485 8.235 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.351 -9.109 8.877 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.651 -7.863 9.937 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.607 -4.183 8.809 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.384 -5.451 7.830 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.621 -5.468 8.072 1.00 0.00 H new ATOM 1560 N LYS A 101 4.814 -10.554 9.868 1.00 0.00 N ATOM 1561 CA LYS A 101 4.628 -11.975 9.599 1.00 0.00 C ATOM 1562 C LYS A 101 4.606 -12.776 10.898 1.00 0.00 C ATOM 1563 O LYS A 101 3.833 -13.723 11.040 1.00 0.00 O ATOM 1564 CB LYS A 101 5.732 -12.496 8.677 1.00 0.00 C ATOM 1565 CG LYS A 101 5.544 -12.138 7.208 1.00 0.00 C ATOM 1566 CD LYS A 101 6.669 -12.701 6.354 1.00 0.00 C ATOM 1567 CE LYS A 101 6.610 -14.220 6.288 1.00 0.00 C ATOM 1568 NZ LYS A 101 7.522 -14.769 5.249 1.00 0.00 N ATOM 0 H LYS A 101 5.677 -10.163 9.490 1.00 0.00 H new ATOM 0 HA LYS A 101 3.667 -12.101 9.101 1.00 0.00 H new ATOM 0 HB2 LYS A 101 6.689 -12.099 9.016 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.785 -13.581 8.770 1.00 0.00 H new ATOM 0 HG2 LYS A 101 4.588 -12.526 6.856 1.00 0.00 H new ATOM 0 HG3 LYS A 101 5.508 -11.054 7.097 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.604 -12.289 5.347 1.00 0.00 H new ATOM 0 HD3 LYS A 101 7.630 -12.390 6.765 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.876 -14.636 7.260 1.00 0.00 H new ATOM 0 HE3 LYS A 101 5.588 -14.534 6.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.476 -15.808 5.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.232 -14.420 4.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.496 -14.463 5.446 1.00 0.00 H new ATOM 1582 N ARG A 102 5.458 -12.388 11.840 1.00 0.00 N ATOM 1583 CA ARG A 102 5.513 -13.047 13.141 1.00 0.00 C ATOM 1584 C ARG A 102 4.255 -12.751 13.952 1.00 0.00 C ATOM 1585 O ARG A 102 3.723 -13.628 14.635 1.00 0.00 O ATOM 1586 CB ARG A 102 6.775 -12.694 13.913 1.00 0.00 C ATOM 1587 CG ARG A 102 8.048 -13.335 13.384 1.00 0.00 C ATOM 1588 CD ARG A 102 9.270 -13.001 14.161 1.00 0.00 C ATOM 1589 NE ARG A 102 10.472 -13.691 13.720 1.00 0.00 N ATOM 1590 CZ ARG A 102 11.685 -13.552 14.288 1.00 0.00 C ATOM 1591 NH1 ARG A 102 11.873 -12.723 15.291 1.00 0.00 N ATOM 1592 NH2 ARG A 102 12.691 -14.253 13.793 1.00 0.00 N ATOM 0 H ARG A 102 6.120 -11.621 11.728 1.00 0.00 H new ATOM 0 HA ARG A 102 5.553 -14.121 12.960 1.00 0.00 H new ATOM 0 HB2 ARG A 102 6.899 -11.611 13.903 1.00 0.00 H new ATOM 0 HB3 ARG A 102 6.642 -12.990 14.954 1.00 0.00 H new ATOM 0 HG2 ARG A 102 7.920 -14.417 13.378 1.00 0.00 H new ATOM 0 HG3 ARG A 102 8.194 -13.025 12.349 1.00 0.00 H new ATOM 0 HD2 ARG A 102 9.441 -11.926 14.101 1.00 0.00 H new ATOM 0 HD3 ARG A 102 9.094 -13.238 15.210 1.00 0.00 H new ATOM 0 HE ARG A 102 10.390 -14.325 12.925 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.093 -12.173 15.651 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.799 -12.630 15.709 1.00 0.00 H new ATOM 0 HH21 ARG A 102 12.537 -14.878 13.002 1.00 0.00 H new ATOM 0 HH22 ARG A 102 13.621 -14.169 14.202 1.00 0.00 H new ATOM 1606 N VAL A 103 3.785 -11.511 13.874 1.00 0.00 N ATOM 1607 CA VAL A 103 2.592 -11.098 14.605 1.00 0.00 C ATOM 1608 C VAL A 103 1.352 -11.814 14.080 1.00 0.00 C ATOM 1609 O VAL A 103 0.468 -12.193 14.850 1.00 0.00 O ATOM 1610 CB VAL A 103 2.372 -9.575 14.515 1.00 0.00 C ATOM 1611 CG1 VAL A 103 1.020 -9.198 15.101 1.00 0.00 C ATOM 1612 CG2 VAL A 103 3.489 -8.833 15.233 1.00 0.00 C ATOM 0 H VAL A 103 4.212 -10.774 13.312 1.00 0.00 H new ATOM 0 HA VAL A 103 2.751 -11.370 15.648 1.00 0.00 H new ATOM 0 HB VAL A 103 2.386 -9.285 13.464 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.881 -8.119 15.030 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.229 -9.704 14.547 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.980 -9.501 16.147 1.00 0.00 H new ATOM 0 HG21 VAL A 103 3.318 -7.759 15.160 1.00 0.00 H new ATOM 0 HG22 VAL A 103 3.505 -9.127 16.282 1.00 0.00 H new ATOM 0 HG23 VAL A 103 4.445 -9.081 14.772 1.00 0.00 H new ATOM 1622 N LYS A 104 1.293 -11.997 12.766 1.00 0.00 N ATOM 1623 CA LYS A 104 0.135 -12.615 12.130 1.00 0.00 C ATOM 1624 C LYS A 104 0.279 -14.134 12.095 1.00 0.00 C ATOM 1625 O LYS A 104 -0.648 -14.846 11.710 1.00 0.00 O ATOM 1626 CB LYS A 104 -0.055 -12.069 10.714 1.00 0.00 C ATOM 1627 CG LYS A 104 0.997 -12.532 9.715 1.00 0.00 C ATOM 1628 CD LYS A 104 0.912 -11.742 8.418 1.00 0.00 C ATOM 1629 CE LYS A 104 1.733 -12.397 7.316 1.00 0.00 C ATOM 1630 NZ LYS A 104 2.121 -11.425 6.258 1.00 0.00 N ATOM 0 H LYS A 104 2.034 -11.726 12.120 1.00 0.00 H new ATOM 0 HA LYS A 104 -0.746 -12.367 12.721 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -1.039 -12.367 10.352 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -0.047 -10.980 10.753 1.00 0.00 H new ATOM 0 HG2 LYS A 104 1.990 -12.417 10.149 1.00 0.00 H new ATOM 0 HG3 LYS A 104 0.862 -13.593 9.507 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.129 -11.667 8.103 1.00 0.00 H new ATOM 0 HD3 LYS A 104 1.269 -10.726 8.585 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.630 -12.841 7.747 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.159 -13.209 6.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.417 -11.941 5.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.309 -10.817 6.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.909 -10.837 6.598 1.00 0.00 H new ATOM 1644 N ASP A 105 1.445 -14.622 12.502 1.00 0.00 N ATOM 1645 CA ASP A 105 1.741 -16.049 12.440 1.00 0.00 C ATOM 1646 C ASP A 105 1.306 -16.635 11.100 1.00 0.00 C ATOM 1647 O ASP A 105 0.647 -17.674 11.050 1.00 0.00 O ATOM 1648 CB ASP A 105 1.055 -16.791 13.589 1.00 0.00 C ATOM 1649 CG ASP A 105 1.528 -16.379 14.975 1.00 0.00 C ATOM 1650 OD1 ASP A 105 2.716 -16.351 15.193 1.00 0.00 O ATOM 1651 OD2 ASP A 105 0.713 -15.945 15.755 1.00 0.00 O ATOM 0 H ASP A 105 2.201 -14.051 12.879 1.00 0.00 H new ATOM 0 HA ASP A 105 2.819 -16.175 12.538 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -0.020 -16.626 13.521 1.00 0.00 H new ATOM 0 HB3 ASP A 105 1.221 -17.861 13.465 1.00 0.00 H new ATOM 1656 N SER A 106 1.679 -15.962 10.015 1.00 0.00 N ATOM 1657 CA SER A 106 1.318 -16.410 8.676 1.00 0.00 C ATOM 1658 C SER A 106 2.432 -16.102 7.681 1.00 0.00 C ATOM 1659 O SER A 106 3.225 -15.180 7.884 1.00 0.00 O ATOM 1660 CB SER A 106 0.019 -15.758 8.240 1.00 0.00 C ATOM 1661 OG SER A 106 -1.026 -16.017 9.135 1.00 0.00 O ATOM 0 H SER A 106 2.231 -15.105 10.038 1.00 0.00 H new ATOM 0 HA SER A 106 1.177 -17.491 8.700 1.00 0.00 H new ATOM 0 HB2 SER A 106 0.165 -14.681 8.155 1.00 0.00 H new ATOM 0 HB3 SER A 106 -0.254 -16.122 7.249 1.00 0.00 H new ATOM 0 HG SER A 106 -0.864 -15.538 9.974 1.00 0.00 H new ATOM 1667 N ASP A 107 2.488 -16.877 6.605 1.00 0.00 N ATOM 1668 CA ASP A 107 3.419 -16.610 5.516 1.00 0.00 C ATOM 1669 C ASP A 107 2.979 -15.392 4.710 1.00 0.00 C ATOM 1670 O ASP A 107 2.034 -14.697 5.083 1.00 0.00 O ATOM 1671 CB ASP A 107 3.543 -17.832 4.602 1.00 0.00 C ATOM 1672 CG ASP A 107 2.280 -18.161 3.818 1.00 0.00 C ATOM 1673 OD1 ASP A 107 1.387 -17.347 3.797 1.00 0.00 O ATOM 1674 OD2 ASP A 107 2.279 -19.148 3.121 1.00 0.00 O ATOM 0 H ASP A 107 1.898 -17.697 6.463 1.00 0.00 H new ATOM 0 HA ASP A 107 4.395 -16.399 5.952 1.00 0.00 H new ATOM 0 HB2 ASP A 107 4.359 -17.664 3.899 1.00 0.00 H new ATOM 0 HB3 ASP A 107 3.816 -18.697 5.207 1.00 0.00 H new ATOM 1679 N ASP A 108 3.669 -15.140 3.604 1.00 0.00 N ATOM 1680 CA ASP A 108 3.482 -13.905 2.850 1.00 0.00 C ATOM 1681 C ASP A 108 2.021 -13.730 2.449 1.00 0.00 C ATOM 1682 O ASP A 108 1.270 -14.700 2.358 1.00 0.00 O ATOM 1683 CB ASP A 108 4.377 -13.891 1.608 1.00 0.00 C ATOM 1684 CG ASP A 108 5.864 -13.750 1.905 1.00 0.00 C ATOM 1685 OD1 ASP A 108 6.201 -13.477 3.033 1.00 0.00 O ATOM 1686 OD2 ASP A 108 6.652 -14.070 1.048 1.00 0.00 O ATOM 0 H ASP A 108 4.363 -15.774 3.209 1.00 0.00 H new ATOM 0 HA ASP A 108 3.765 -13.072 3.493 1.00 0.00 H new ATOM 0 HB2 ASP A 108 4.216 -14.813 1.049 1.00 0.00 H new ATOM 0 HB3 ASP A 108 4.068 -13.069 0.962 1.00 0.00 H new ATOM 1691 N VAL A 109 1.623 -12.483 2.213 1.00 0.00 N ATOM 1692 CA VAL A 109 0.220 -12.159 1.985 1.00 0.00 C ATOM 1693 C VAL A 109 0.060 -11.214 0.799 1.00 0.00 C ATOM 1694 O VAL A 109 1.017 -10.592 0.336 1.00 0.00 O ATOM 1695 CB VAL A 109 -0.422 -11.518 3.230 1.00 0.00 C ATOM 1696 CG1 VAL A 109 -0.428 -12.501 4.390 1.00 0.00 C ATOM 1697 CG2 VAL A 109 0.316 -10.245 3.615 1.00 0.00 C ATOM 0 H VAL A 109 2.253 -11.681 2.175 1.00 0.00 H new ATOM 0 HA VAL A 109 -0.289 -13.098 1.769 1.00 0.00 H new ATOM 0 HB VAL A 109 -1.453 -11.259 2.991 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.885 -12.032 5.262 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.999 -13.387 4.113 1.00 0.00 H new ATOM 0 HG13 VAL A 109 0.596 -12.789 4.628 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -0.151 -9.806 4.496 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.357 -10.481 3.836 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.272 -9.535 2.789 1.00 0.00 H new ATOM 1707 N PRO A 110 -1.178 -11.103 0.294 1.00 0.00 N ATOM 1708 CA PRO A 110 -1.514 -10.163 -0.779 1.00 0.00 C ATOM 1709 C PRO A 110 -0.987 -8.758 -0.504 1.00 0.00 C ATOM 1710 O PRO A 110 -1.310 -8.152 0.518 1.00 0.00 O ATOM 1711 CB PRO A 110 -3.044 -10.196 -0.834 1.00 0.00 C ATOM 1712 CG PRO A 110 -3.402 -11.564 -0.364 1.00 0.00 C ATOM 1713 CD PRO A 110 -2.406 -11.890 0.717 1.00 0.00 C ATOM 0 HA PRO A 110 -1.055 -10.442 -1.727 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -3.481 -9.429 -0.195 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -3.409 -10.015 -1.845 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -4.422 -11.593 0.020 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -3.348 -12.286 -1.179 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -2.763 -11.585 1.701 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.202 -12.959 0.770 1.00 0.00 H new ATOM 1721 N MET A 111 -0.177 -8.243 -1.425 1.00 0.00 N ATOM 1722 CA MET A 111 0.456 -6.943 -1.243 1.00 0.00 C ATOM 1723 C MET A 111 0.719 -6.273 -2.588 1.00 0.00 C ATOM 1724 O MET A 111 0.816 -6.941 -3.617 1.00 0.00 O ATOM 1725 CB MET A 111 1.760 -7.094 -0.462 1.00 0.00 C ATOM 1726 CG MET A 111 1.576 -7.442 1.009 1.00 0.00 C ATOM 1727 SD MET A 111 3.138 -7.506 1.908 1.00 0.00 S ATOM 1728 CE MET A 111 3.868 -8.987 1.215 1.00 0.00 C ATOM 0 H MET A 111 0.055 -8.706 -2.303 1.00 0.00 H new ATOM 0 HA MET A 111 -0.224 -6.309 -0.674 1.00 0.00 H new ATOM 0 HB2 MET A 111 2.364 -7.869 -0.933 1.00 0.00 H new ATOM 0 HB3 MET A 111 2.323 -6.163 -0.535 1.00 0.00 H new ATOM 0 HG2 MET A 111 0.923 -6.703 1.474 1.00 0.00 H new ATOM 0 HG3 MET A 111 1.075 -8.406 1.090 1.00 0.00 H new ATOM 0 HE1 MET A 111 4.027 -9.719 2.007 1.00 0.00 H new ATOM 0 HE2 MET A 111 3.199 -9.405 0.463 1.00 0.00 H new ATOM 0 HE3 MET A 111 4.824 -8.740 0.753 1.00 0.00 H new ATOM 1738 N VAL A 112 0.832 -4.949 -2.573 1.00 0.00 N ATOM 1739 CA VAL A 112 1.319 -4.209 -3.730 1.00 0.00 C ATOM 1740 C VAL A 112 2.346 -3.159 -3.320 1.00 0.00 C ATOM 1741 O VAL A 112 2.181 -2.476 -2.308 1.00 0.00 O ATOM 1742 CB VAL A 112 0.168 -3.519 -4.486 1.00 0.00 C ATOM 1743 CG1 VAL A 112 0.702 -2.753 -5.687 1.00 0.00 C ATOM 1744 CG2 VAL A 112 -0.869 -4.542 -4.927 1.00 0.00 C ATOM 0 H VAL A 112 0.592 -4.366 -1.771 1.00 0.00 H new ATOM 0 HA VAL A 112 1.791 -4.936 -4.391 1.00 0.00 H new ATOM 0 HB VAL A 112 -0.311 -2.811 -3.810 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -0.125 -2.272 -6.209 1.00 0.00 H new ATOM 0 HG12 VAL A 112 1.408 -1.994 -5.350 1.00 0.00 H new ATOM 0 HG13 VAL A 112 1.206 -3.443 -6.364 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -1.675 -4.037 -5.459 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -0.401 -5.273 -5.586 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -1.275 -5.049 -4.052 1.00 0.00 H new ATOM 1754 N LEU A 113 3.407 -3.037 -4.110 1.00 0.00 N ATOM 1755 CA LEU A 113 4.474 -2.086 -3.816 1.00 0.00 C ATOM 1756 C LEU A 113 4.306 -0.810 -4.633 1.00 0.00 C ATOM 1757 O LEU A 113 4.234 -0.852 -5.862 1.00 0.00 O ATOM 1758 CB LEU A 113 5.843 -2.722 -4.090 1.00 0.00 C ATOM 1759 CG LEU A 113 7.051 -1.835 -3.764 1.00 0.00 C ATOM 1760 CD1 LEU A 113 7.137 -1.601 -2.261 1.00 0.00 C ATOM 1761 CD2 LEU A 113 8.321 -2.496 -4.280 1.00 0.00 C ATOM 0 H LEU A 113 3.552 -3.584 -4.959 1.00 0.00 H new ATOM 0 HA LEU A 113 4.415 -1.822 -2.760 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.921 -3.642 -3.511 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.892 -3.003 -5.142 1.00 0.00 H new ATOM 0 HG LEU A 113 6.935 -0.868 -4.254 1.00 0.00 H new ATOM 0 HD11 LEU A 113 7.998 -0.970 -2.040 1.00 0.00 H new ATOM 0 HD12 LEU A 113 6.228 -1.108 -1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 113 7.247 -2.557 -1.750 1.00 0.00 H new ATOM 0 HD21 LEU A 113 9.179 -1.865 -4.048 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.445 -3.468 -3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.249 -2.629 -5.360 1.00 0.00 H new ATOM 1773 N VAL A 114 4.244 0.326 -3.944 1.00 0.00 N ATOM 1774 CA VAL A 114 3.940 1.597 -4.590 1.00 0.00 C ATOM 1775 C VAL A 114 5.044 2.618 -4.340 1.00 0.00 C ATOM 1776 O VAL A 114 5.460 2.833 -3.202 1.00 0.00 O ATOM 1777 CB VAL A 114 2.598 2.173 -4.099 1.00 0.00 C ATOM 1778 CG1 VAL A 114 2.321 3.515 -4.759 1.00 0.00 C ATOM 1779 CG2 VAL A 114 1.465 1.199 -4.380 1.00 0.00 C ATOM 0 H VAL A 114 4.400 0.391 -2.938 1.00 0.00 H new ATOM 0 HA VAL A 114 3.869 1.399 -5.659 1.00 0.00 H new ATOM 0 HB VAL A 114 2.663 2.325 -3.022 1.00 0.00 H new ATOM 0 HG11 VAL A 114 1.369 3.907 -4.401 1.00 0.00 H new ATOM 0 HG12 VAL A 114 3.119 4.215 -4.510 1.00 0.00 H new ATOM 0 HG13 VAL A 114 2.276 3.386 -5.840 1.00 0.00 H new ATOM 0 HG21 VAL A 114 0.525 1.623 -4.026 1.00 0.00 H new ATOM 0 HG22 VAL A 114 1.400 1.016 -5.453 1.00 0.00 H new ATOM 0 HG23 VAL A 114 1.657 0.259 -3.863 1.00 0.00 H new ATOM 1789 N GLY A 115 5.515 3.247 -5.413 1.00 0.00 N ATOM 1790 CA GLY A 115 6.536 4.269 -5.285 1.00 0.00 C ATOM 1791 C GLY A 115 6.029 5.646 -5.668 1.00 0.00 C ATOM 1792 O GLY A 115 5.549 5.849 -6.783 1.00 0.00 O ATOM 0 H GLY A 115 5.207 3.066 -6.368 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.897 4.291 -4.257 1.00 0.00 H new ATOM 0 HA3 GLY A 115 7.386 4.010 -5.916 1.00 0.00 H new ATOM 1796 N ASN A 116 6.137 6.594 -4.743 1.00 0.00 N ATOM 1797 CA ASN A 116 5.641 7.946 -4.973 1.00 0.00 C ATOM 1798 C ASN A 116 6.781 8.885 -5.355 1.00 0.00 C ATOM 1799 O ASN A 116 7.955 8.539 -5.227 1.00 0.00 O ATOM 1800 CB ASN A 116 4.900 8.482 -3.762 1.00 0.00 C ATOM 1801 CG ASN A 116 4.120 9.738 -4.035 1.00 0.00 C ATOM 1802 OD1 ASN A 116 3.776 10.041 -5.183 1.00 0.00 O ATOM 1803 ND2 ASN A 116 3.912 10.509 -2.998 1.00 0.00 N ATOM 0 H ASN A 116 6.563 6.451 -3.827 1.00 0.00 H new ATOM 0 HA ASN A 116 4.936 7.897 -5.803 1.00 0.00 H new ATOM 0 HB2 ASN A 116 4.218 7.714 -3.396 1.00 0.00 H new ATOM 0 HB3 ASN A 116 5.618 8.677 -2.965 1.00 0.00 H new ATOM 0 HD21 ASN A 116 3.445 11.408 -3.116 1.00 0.00 H new ATOM 0 HD22 ASN A 116 4.216 10.211 -2.071 1.00 0.00 H new ATOM 1810 N LYS A 117 6.426 10.076 -5.825 1.00 0.00 N ATOM 1811 CA LYS A 117 7.413 11.110 -6.116 1.00 0.00 C ATOM 1812 C LYS A 117 8.225 10.754 -7.356 1.00 0.00 C ATOM 1813 O LYS A 117 9.416 11.055 -7.437 1.00 0.00 O ATOM 1814 CB LYS A 117 8.342 11.318 -4.918 1.00 0.00 C ATOM 1815 CG LYS A 117 7.623 11.602 -3.606 1.00 0.00 C ATOM 1816 CD LYS A 117 8.600 12.025 -2.520 1.00 0.00 C ATOM 1817 CE LYS A 117 7.936 12.039 -1.151 1.00 0.00 C ATOM 1818 NZ LYS A 117 8.892 12.409 -0.072 1.00 0.00 N ATOM 0 H LYS A 117 5.461 10.350 -6.013 1.00 0.00 H new ATOM 0 HA LYS A 117 6.879 12.040 -6.311 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.960 10.429 -4.794 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.016 12.147 -5.136 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.882 12.387 -3.757 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.083 10.712 -3.285 1.00 0.00 H new ATOM 0 HD2 LYS A 117 9.450 11.342 -2.507 1.00 0.00 H new ATOM 0 HD3 LYS A 117 8.991 13.017 -2.747 1.00 0.00 H new ATOM 0 HE2 LYS A 117 7.106 12.745 -1.158 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.516 11.055 -0.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 8.450 12.244 0.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 9.751 11.828 -0.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 9.144 13.414 -0.161 1.00 0.00 H new ATOM 1832 N CYS A 118 7.574 10.113 -8.320 1.00 0.00 N ATOM 1833 CA CYS A 118 8.253 9.653 -9.527 1.00 0.00 C ATOM 1834 C CYS A 118 8.618 10.829 -10.425 1.00 0.00 C ATOM 1835 O CYS A 118 9.327 10.667 -11.420 1.00 0.00 O ATOM 1836 CB CYS A 118 7.197 8.771 -10.195 1.00 0.00 C ATOM 1837 SG CYS A 118 6.806 7.255 -9.290 1.00 0.00 S ATOM 0 H CYS A 118 6.577 9.900 -8.290 1.00 0.00 H new ATOM 0 HA CYS A 118 9.189 9.132 -9.324 1.00 0.00 H new ATOM 0 HB2 CYS A 118 6.283 9.351 -10.319 1.00 0.00 H new ATOM 0 HB3 CYS A 118 7.543 8.504 -11.194 1.00 0.00 H new ATOM 0 HG CYS A 118 5.776 7.460 -8.524 1.00 0.00 H new ATOM 1843 N ASP A 119 8.131 12.013 -10.070 1.00 0.00 N ATOM 1844 CA ASP A 119 8.489 13.233 -10.784 1.00 0.00 C ATOM 1845 C ASP A 119 9.675 13.923 -10.118 1.00 0.00 C ATOM 1846 O ASP A 119 10.157 14.952 -10.596 1.00 0.00 O ATOM 1847 CB ASP A 119 7.295 14.187 -10.854 1.00 0.00 C ATOM 1848 CG ASP A 119 6.120 13.665 -11.671 1.00 0.00 C ATOM 1849 OD1 ASP A 119 6.351 13.124 -12.727 1.00 0.00 O ATOM 1850 OD2 ASP A 119 5.023 13.670 -11.167 1.00 0.00 O ATOM 0 H ASP A 119 7.487 12.154 -9.292 1.00 0.00 H new ATOM 0 HA ASP A 119 8.775 12.957 -11.799 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.953 14.396 -9.841 1.00 0.00 H new ATOM 0 HB3 ASP A 119 7.626 15.134 -11.280 1.00 0.00 H new ATOM 1855 N LEU A 120 10.141 13.352 -9.013 1.00 0.00 N ATOM 1856 CA LEU A 120 11.306 13.881 -8.311 1.00 0.00 C ATOM 1857 C LEU A 120 12.595 13.507 -9.038 1.00 0.00 C ATOM 1858 O LEU A 120 12.816 12.343 -9.371 1.00 0.00 O ATOM 1859 CB LEU A 120 11.336 13.367 -6.866 1.00 0.00 C ATOM 1860 CG LEU A 120 12.531 13.840 -6.029 1.00 0.00 C ATOM 1861 CD1 LEU A 120 12.479 15.351 -5.852 1.00 0.00 C ATOM 1862 CD2 LEU A 120 12.518 13.138 -4.680 1.00 0.00 C ATOM 0 H LEU A 120 9.730 12.523 -8.584 1.00 0.00 H new ATOM 0 HA LEU A 120 11.230 14.968 -8.293 1.00 0.00 H new ATOM 0 HB2 LEU A 120 10.418 13.678 -6.368 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.335 12.277 -6.885 1.00 0.00 H new ATOM 0 HG LEU A 120 13.458 13.589 -6.545 1.00 0.00 H new ATOM 0 HD11 LEU A 120 13.332 15.677 -5.256 1.00 0.00 H new ATOM 0 HD12 LEU A 120 12.513 15.833 -6.829 1.00 0.00 H new ATOM 0 HD13 LEU A 120 11.555 15.626 -5.344 1.00 0.00 H new ATOM 0 HD21 LEU A 120 13.368 13.475 -4.086 1.00 0.00 H new ATOM 0 HD22 LEU A 120 11.592 13.375 -4.156 1.00 0.00 H new ATOM 0 HD23 LEU A 120 12.585 12.060 -4.830 1.00 0.00 H new ATOM 1874 N ALA A 121 13.444 14.502 -9.276 1.00 0.00 N ATOM 1875 CA ALA A 121 14.684 14.287 -10.011 1.00 0.00 C ATOM 1876 C ALA A 121 15.748 13.657 -9.119 1.00 0.00 C ATOM 1877 O ALA A 121 16.438 12.723 -9.527 1.00 0.00 O ATOM 1878 CB ALA A 121 15.189 15.602 -10.590 1.00 0.00 C ATOM 0 H ALA A 121 13.295 15.464 -8.971 1.00 0.00 H new ATOM 0 HA ALA A 121 14.478 13.597 -10.829 1.00 0.00 H new ATOM 0 HB1 ALA A 121 16.116 15.427 -11.136 1.00 0.00 H new ATOM 0 HB2 ALA A 121 14.440 16.013 -11.267 1.00 0.00 H new ATOM 0 HB3 ALA A 121 15.373 16.309 -9.781 1.00 0.00 H new ATOM 1884 N ALA A 122 15.875 14.173 -7.901 1.00 0.00 N ATOM 1885 CA ALA A 122 16.868 13.672 -6.960 1.00 0.00 C ATOM 1886 C ALA A 122 16.382 12.400 -6.273 1.00 0.00 C ATOM 1887 O ALA A 122 15.819 12.450 -5.181 1.00 0.00 O ATOM 1888 CB ALA A 122 17.200 14.738 -5.927 1.00 0.00 C ATOM 0 H ALA A 122 15.303 14.938 -7.543 1.00 0.00 H new ATOM 0 HA ALA A 122 17.772 13.429 -7.519 1.00 0.00 H new ATOM 0 HB1 ALA A 122 17.943 14.350 -5.230 1.00 0.00 H new ATOM 0 HB2 ALA A 122 17.598 15.620 -6.429 1.00 0.00 H new ATOM 0 HB3 ALA A 122 16.297 15.009 -5.380 1.00 0.00 H new ATOM 1894 N ARG A 123 16.604 11.262 -6.923 1.00 0.00 N ATOM 1895 CA ARG A 123 16.132 9.982 -6.404 1.00 0.00 C ATOM 1896 C ARG A 123 17.305 9.074 -6.048 1.00 0.00 C ATOM 1897 O ARG A 123 18.397 9.205 -6.601 1.00 0.00 O ATOM 1898 CB ARG A 123 15.162 9.297 -7.357 1.00 0.00 C ATOM 1899 CG ARG A 123 15.748 8.934 -8.713 1.00 0.00 C ATOM 1900 CD ARG A 123 14.803 8.232 -9.618 1.00 0.00 C ATOM 1901 NE ARG A 123 15.361 7.878 -10.914 1.00 0.00 N ATOM 1902 CZ ARG A 123 16.070 6.759 -11.162 1.00 0.00 C ATOM 1903 NH1 ARG A 123 16.341 5.903 -10.201 1.00 0.00 N ATOM 1904 NH2 ARG A 123 16.506 6.556 -12.392 1.00 0.00 N ATOM 0 H ARG A 123 17.107 11.199 -7.808 1.00 0.00 H new ATOM 0 HA ARG A 123 15.576 10.188 -5.490 1.00 0.00 H new ATOM 0 HB2 ARG A 123 14.790 8.389 -6.883 1.00 0.00 H new ATOM 0 HB3 ARG A 123 14.304 9.951 -7.511 1.00 0.00 H new ATOM 0 HG2 ARG A 123 16.093 9.845 -9.202 1.00 0.00 H new ATOM 0 HG3 ARG A 123 16.624 8.303 -8.560 1.00 0.00 H new ATOM 0 HD2 ARG A 123 14.455 7.324 -9.126 1.00 0.00 H new ATOM 0 HD3 ARG A 123 13.930 8.865 -9.773 1.00 0.00 H new ATOM 0 HE ARG A 123 15.205 8.522 -11.689 1.00 0.00 H new ATOM 0 HH11 ARG A 123 16.013 6.081 -9.252 1.00 0.00 H new ATOM 0 HH12 ARG A 123 16.879 5.061 -10.405 1.00 0.00 H new ATOM 0 HH21 ARG A 123 16.303 7.237 -13.124 1.00 0.00 H new ATOM 0 HH22 ARG A 123 17.045 5.718 -12.610 1.00 0.00 H new ATOM 1918 N THR A 124 17.071 8.152 -5.119 1.00 0.00 N ATOM 1919 CA THR A 124 18.062 7.137 -4.785 1.00 0.00 C ATOM 1920 C THR A 124 17.471 5.735 -4.895 1.00 0.00 C ATOM 1921 O THR A 124 18.013 4.777 -4.346 1.00 0.00 O ATOM 1922 CB THR A 124 18.620 7.338 -3.364 1.00 0.00 C ATOM 1923 OG1 THR A 124 17.550 7.268 -2.413 1.00 0.00 O ATOM 1924 CG2 THR A 124 19.309 8.689 -3.248 1.00 0.00 C ATOM 0 H THR A 124 16.204 8.088 -4.585 1.00 0.00 H new ATOM 0 HA THR A 124 18.876 7.243 -5.502 1.00 0.00 H new ATOM 0 HB THR A 124 19.347 6.552 -3.161 1.00 0.00 H new ATOM 0 HG1 THR A 124 17.630 6.443 -1.890 1.00 0.00 H new ATOM 0 HG21 THR A 124 19.697 8.814 -2.237 1.00 0.00 H new ATOM 0 HG22 THR A 124 20.131 8.740 -3.961 1.00 0.00 H new ATOM 0 HG23 THR A 124 18.593 9.482 -3.462 1.00 0.00 H new ATOM 1932 N VAL A 125 16.355 5.624 -5.608 1.00 0.00 N ATOM 1933 CA VAL A 125 15.784 4.322 -5.937 1.00 0.00 C ATOM 1934 C VAL A 125 15.616 4.160 -7.442 1.00 0.00 C ATOM 1935 O VAL A 125 14.901 4.930 -8.083 1.00 0.00 O ATOM 1936 CB VAL A 125 14.422 4.112 -5.251 1.00 0.00 C ATOM 1937 CG1 VAL A 125 13.791 2.806 -5.707 1.00 0.00 C ATOM 1938 CG2 VAL A 125 14.578 4.126 -3.738 1.00 0.00 C ATOM 0 H VAL A 125 15.828 6.419 -5.969 1.00 0.00 H new ATOM 0 HA VAL A 125 16.483 3.570 -5.570 1.00 0.00 H new ATOM 0 HB VAL A 125 13.764 4.932 -5.537 1.00 0.00 H new ATOM 0 HG11 VAL A 125 12.829 2.674 -5.212 1.00 0.00 H new ATOM 0 HG12 VAL A 125 13.643 2.831 -6.787 1.00 0.00 H new ATOM 0 HG13 VAL A 125 14.448 1.975 -5.450 1.00 0.00 H new ATOM 0 HG21 VAL A 125 13.605 3.976 -3.270 1.00 0.00 H new ATOM 0 HG22 VAL A 125 15.253 3.326 -3.434 1.00 0.00 H new ATOM 0 HG23 VAL A 125 14.988 5.086 -3.423 1.00 0.00 H new ATOM 1948 N GLU A 126 16.278 3.152 -8.003 1.00 0.00 N ATOM 1949 CA GLU A 126 15.968 2.693 -9.351 1.00 0.00 C ATOM 1950 C GLU A 126 14.703 1.840 -9.359 1.00 0.00 C ATOM 1951 O GLU A 126 14.559 0.916 -8.557 1.00 0.00 O ATOM 1952 CB GLU A 126 17.142 1.901 -9.931 1.00 0.00 C ATOM 1953 CG GLU A 126 17.029 1.608 -11.420 1.00 0.00 C ATOM 1954 CD GLU A 126 17.220 2.854 -12.238 1.00 0.00 C ATOM 1955 OE1 GLU A 126 17.603 3.854 -11.681 1.00 0.00 O ATOM 1956 OE2 GLU A 126 17.093 2.779 -13.437 1.00 0.00 O ATOM 0 H GLU A 126 17.031 2.639 -7.545 1.00 0.00 H new ATOM 0 HA GLU A 126 15.794 3.570 -9.974 1.00 0.00 H new ATOM 0 HB2 GLU A 126 18.063 2.456 -9.751 1.00 0.00 H new ATOM 0 HB3 GLU A 126 17.229 0.957 -9.393 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.775 0.866 -11.704 1.00 0.00 H new ATOM 0 HG3 GLU A 126 16.052 1.176 -11.635 1.00 0.00 H new ATOM 1963 N SER A 127 13.788 2.156 -10.268 1.00 0.00 N ATOM 1964 CA SER A 127 12.504 1.466 -10.335 1.00 0.00 C ATOM 1965 C SER A 127 12.700 -0.016 -10.637 1.00 0.00 C ATOM 1966 O SER A 127 11.878 -0.851 -10.259 1.00 0.00 O ATOM 1967 CB SER A 127 11.619 2.109 -11.384 1.00 0.00 C ATOM 1968 OG SER A 127 12.135 1.953 -12.678 1.00 0.00 O ATOM 0 H SER A 127 13.911 2.886 -10.970 1.00 0.00 H new ATOM 0 HA SER A 127 12.016 1.552 -9.364 1.00 0.00 H new ATOM 0 HB2 SER A 127 10.623 1.669 -11.336 1.00 0.00 H new ATOM 0 HB3 SER A 127 11.509 3.171 -11.164 1.00 0.00 H new ATOM 0 HG SER A 127 11.534 2.380 -13.324 1.00 0.00 H new ATOM 1974 N ARG A 128 13.793 -0.335 -11.321 1.00 0.00 N ATOM 1975 CA ARG A 128 14.143 -1.723 -11.598 1.00 0.00 C ATOM 1976 C ARG A 128 14.446 -2.477 -10.307 1.00 0.00 C ATOM 1977 O ARG A 128 14.092 -3.646 -10.162 1.00 0.00 O ATOM 1978 CB ARG A 128 15.286 -1.839 -12.597 1.00 0.00 C ATOM 1979 CG ARG A 128 14.926 -1.470 -14.027 1.00 0.00 C ATOM 1980 CD ARG A 128 16.059 -1.552 -14.984 1.00 0.00 C ATOM 1981 NE ARG A 128 15.713 -1.223 -16.357 1.00 0.00 N ATOM 1982 CZ ARG A 128 16.589 -1.188 -17.380 1.00 0.00 C ATOM 1983 NH1 ARG A 128 17.868 -1.423 -17.185 1.00 0.00 N ATOM 1984 NH2 ARG A 128 16.133 -0.886 -18.584 1.00 0.00 N ATOM 0 H ARG A 128 14.452 0.349 -11.694 1.00 0.00 H new ATOM 0 HA ARG A 128 13.275 -2.190 -12.063 1.00 0.00 H new ATOM 0 HB2 ARG A 128 16.104 -1.199 -12.267 1.00 0.00 H new ATOM 0 HB3 ARG A 128 15.658 -2.864 -12.584 1.00 0.00 H new ATOM 0 HG2 ARG A 128 14.128 -2.129 -14.370 1.00 0.00 H new ATOM 0 HG3 ARG A 128 14.529 -0.455 -14.039 1.00 0.00 H new ATOM 0 HD2 ARG A 128 16.849 -0.879 -14.651 1.00 0.00 H new ATOM 0 HD3 ARG A 128 16.468 -2.562 -14.958 1.00 0.00 H new ATOM 0 HE ARG A 128 14.738 -1.003 -16.560 1.00 0.00 H new ATOM 0 HH11 ARG A 128 18.210 -1.636 -16.248 1.00 0.00 H new ATOM 0 HH12 ARG A 128 18.518 -1.392 -17.971 1.00 0.00 H new ATOM 0 HH21 ARG A 128 15.142 -0.687 -18.719 1.00 0.00 H new ATOM 0 HH22 ARG A 128 16.773 -0.852 -19.378 1.00 0.00 H new ATOM 1998 N GLN A 129 15.106 -1.797 -9.374 1.00 0.00 N ATOM 1999 CA GLN A 129 15.395 -2.379 -8.068 1.00 0.00 C ATOM 2000 C GLN A 129 14.113 -2.589 -7.270 1.00 0.00 C ATOM 2001 O GLN A 129 13.927 -3.629 -6.637 1.00 0.00 O ATOM 2002 CB GLN A 129 16.355 -1.483 -7.281 1.00 0.00 C ATOM 2003 CG GLN A 129 17.763 -1.428 -7.850 1.00 0.00 C ATOM 2004 CD GLN A 129 18.587 -0.305 -7.247 1.00 0.00 C ATOM 2005 OE1 GLN A 129 17.943 0.538 -6.449 1.00 0.00 O flip ATOM 2006 NE2 GLN A 129 19.791 -0.198 -7.496 1.00 0.00 N flip ATOM 0 H GLN A 129 15.450 -0.845 -9.498 1.00 0.00 H new ATOM 0 HA GLN A 129 15.867 -3.348 -8.231 1.00 0.00 H new ATOM 0 HB2 GLN A 129 15.948 -0.472 -7.250 1.00 0.00 H new ATOM 0 HB3 GLN A 129 16.405 -1.838 -6.252 1.00 0.00 H new ATOM 0 HG2 GLN A 129 18.263 -2.380 -7.669 1.00 0.00 H new ATOM 0 HG3 GLN A 129 17.710 -1.297 -8.931 1.00 0.00 H new ATOM 0 HE21 GLN A 129 20.245 -0.869 -8.115 1.00 0.00 H new ATOM 0 HE22 GLN A 129 20.332 0.562 -7.082 1.00 0.00 H new ATOM 2015 N ALA A 130 13.231 -1.596 -7.304 1.00 0.00 N ATOM 2016 CA ALA A 130 11.935 -1.702 -6.645 1.00 0.00 C ATOM 2017 C ALA A 130 11.094 -2.814 -7.262 1.00 0.00 C ATOM 2018 O ALA A 130 10.402 -3.546 -6.553 1.00 0.00 O ATOM 2019 CB ALA A 130 11.195 -0.376 -6.719 1.00 0.00 C ATOM 0 H ALA A 130 13.390 -0.709 -7.781 1.00 0.00 H new ATOM 0 HA ALA A 130 12.108 -1.951 -5.598 1.00 0.00 H new ATOM 0 HB1 ALA A 130 10.229 -0.470 -6.223 1.00 0.00 H new ATOM 0 HB2 ALA A 130 11.783 0.397 -6.224 1.00 0.00 H new ATOM 0 HB3 ALA A 130 11.042 -0.103 -7.763 1.00 0.00 H new ATOM 2025 N GLN A 131 11.159 -2.936 -8.583 1.00 0.00 N ATOM 2026 CA GLN A 131 10.434 -3.986 -9.291 1.00 0.00 C ATOM 2027 C GLN A 131 10.954 -5.365 -8.897 1.00 0.00 C ATOM 2028 O GLN A 131 10.175 -6.290 -8.669 1.00 0.00 O ATOM 2029 CB GLN A 131 10.557 -3.796 -10.804 1.00 0.00 C ATOM 2030 CG GLN A 131 9.834 -4.851 -11.624 1.00 0.00 C ATOM 2031 CD GLN A 131 10.033 -4.661 -13.116 1.00 0.00 C ATOM 2032 OE1 GLN A 131 9.305 -3.903 -13.762 1.00 0.00 O ATOM 2033 NE2 GLN A 131 11.020 -5.354 -13.674 1.00 0.00 N ATOM 0 H GLN A 131 11.706 -2.321 -9.186 1.00 0.00 H new ATOM 0 HA GLN A 131 9.383 -3.917 -9.010 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.165 -2.814 -11.069 1.00 0.00 H new ATOM 0 HB3 GLN A 131 11.613 -3.801 -11.075 1.00 0.00 H new ATOM 0 HG2 GLN A 131 10.192 -5.839 -11.336 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.769 -4.818 -11.395 1.00 0.00 H new ATOM 0 HE21 GLN A 131 11.598 -5.970 -13.102 1.00 0.00 H new ATOM 0 HE22 GLN A 131 11.200 -5.270 -14.675 1.00 0.00 H new ATOM 2042 N ASP A 132 12.273 -5.494 -8.819 1.00 0.00 N ATOM 2043 CA ASP A 132 12.896 -6.752 -8.425 1.00 0.00 C ATOM 2044 C ASP A 132 12.557 -7.097 -6.978 1.00 0.00 C ATOM 2045 O ASP A 132 12.316 -8.258 -6.645 1.00 0.00 O ATOM 2046 CB ASP A 132 14.413 -6.682 -8.610 1.00 0.00 C ATOM 2047 CG ASP A 132 14.874 -6.738 -10.061 1.00 0.00 C ATOM 2048 OD1 ASP A 132 14.072 -7.061 -10.906 1.00 0.00 O ATOM 2049 OD2 ASP A 132 15.970 -6.310 -10.332 1.00 0.00 O ATOM 0 H ASP A 132 12.932 -4.743 -9.023 1.00 0.00 H new ATOM 0 HA ASP A 132 12.501 -7.539 -9.068 1.00 0.00 H new ATOM 0 HB2 ASP A 132 14.779 -5.759 -8.161 1.00 0.00 H new ATOM 0 HB3 ASP A 132 14.872 -7.506 -8.064 1.00 0.00 H new ATOM 2054 N LEU A 133 12.541 -6.082 -6.123 1.00 0.00 N ATOM 2055 CA LEU A 133 12.142 -6.261 -4.730 1.00 0.00 C ATOM 2056 C LEU A 133 10.701 -6.750 -4.636 1.00 0.00 C ATOM 2057 O LEU A 133 10.395 -7.672 -3.880 1.00 0.00 O ATOM 2058 CB LEU A 133 12.315 -4.949 -3.954 1.00 0.00 C ATOM 2059 CG LEU A 133 11.896 -5.003 -2.479 1.00 0.00 C ATOM 2060 CD1 LEU A 133 12.766 -6.000 -1.725 1.00 0.00 C ATOM 2061 CD2 LEU A 133 12.011 -3.616 -1.867 1.00 0.00 C ATOM 0 H LEU A 133 12.799 -5.126 -6.368 1.00 0.00 H new ATOM 0 HA LEU A 133 12.787 -7.019 -4.284 1.00 0.00 H new ATOM 0 HB2 LEU A 133 13.362 -4.649 -4.007 1.00 0.00 H new ATOM 0 HB3 LEU A 133 11.735 -4.172 -4.452 1.00 0.00 H new ATOM 0 HG LEU A 133 10.860 -5.333 -2.407 1.00 0.00 H new ATOM 0 HD11 LEU A 133 12.461 -6.031 -0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 133 12.651 -6.990 -2.166 1.00 0.00 H new ATOM 0 HD13 LEU A 133 13.810 -5.693 -1.789 1.00 0.00 H new ATOM 0 HD21 LEU A 133 11.713 -3.655 -0.819 1.00 0.00 H new ATOM 0 HD22 LEU A 133 13.043 -3.271 -1.939 1.00 0.00 H new ATOM 0 HD23 LEU A 133 11.360 -2.926 -2.404 1.00 0.00 H new ATOM 2073 N ALA A 134 9.818 -6.127 -5.409 1.00 0.00 N ATOM 2074 CA ALA A 134 8.425 -6.555 -5.477 1.00 0.00 C ATOM 2075 C ALA A 134 8.309 -7.949 -6.082 1.00 0.00 C ATOM 2076 O ALA A 134 7.492 -8.761 -5.643 1.00 0.00 O ATOM 2077 CB ALA A 134 7.606 -5.559 -6.283 1.00 0.00 C ATOM 0 H ALA A 134 10.042 -5.324 -5.997 1.00 0.00 H new ATOM 0 HA ALA A 134 8.032 -6.594 -4.461 1.00 0.00 H new ATOM 0 HB1 ALA A 134 6.569 -5.891 -6.326 1.00 0.00 H new ATOM 0 HB2 ALA A 134 7.654 -4.579 -5.808 1.00 0.00 H new ATOM 0 HB3 ALA A 134 8.007 -5.492 -7.294 1.00 0.00 H new ATOM 2083 N ARG A 135 9.129 -8.224 -7.091 1.00 0.00 N ATOM 2084 CA ARG A 135 9.090 -9.507 -7.781 1.00 0.00 C ATOM 2085 C ARG A 135 9.476 -10.643 -6.837 1.00 0.00 C ATOM 2086 O ARG A 135 8.885 -11.723 -6.877 1.00 0.00 O ATOM 2087 CB ARG A 135 9.944 -9.508 -9.040 1.00 0.00 C ATOM 2088 CG ARG A 135 9.918 -10.809 -9.828 1.00 0.00 C ATOM 2089 CD ARG A 135 10.681 -10.768 -11.101 1.00 0.00 C ATOM 2090 NE ARG A 135 10.688 -12.020 -11.840 1.00 0.00 N ATOM 2091 CZ ARG A 135 11.370 -12.230 -12.984 1.00 0.00 C ATOM 2092 NH1 ARG A 135 12.069 -11.267 -13.542 1.00 0.00 N ATOM 2093 NH2 ARG A 135 11.299 -13.426 -13.542 1.00 0.00 N ATOM 0 H ARG A 135 9.829 -7.574 -7.449 1.00 0.00 H new ATOM 0 HA ARG A 135 8.062 -9.673 -8.104 1.00 0.00 H new ATOM 0 HB2 ARG A 135 9.609 -8.699 -9.690 1.00 0.00 H new ATOM 0 HB3 ARG A 135 10.975 -9.288 -8.763 1.00 0.00 H new ATOM 0 HG2 ARG A 135 10.319 -11.607 -9.203 1.00 0.00 H new ATOM 0 HG3 ARG A 135 8.882 -11.067 -10.047 1.00 0.00 H new ATOM 0 HD2 ARG A 135 10.262 -9.988 -11.736 1.00 0.00 H new ATOM 0 HD3 ARG A 135 11.710 -10.483 -10.884 1.00 0.00 H new ATOM 0 HE ARG A 135 10.138 -12.794 -11.467 1.00 0.00 H new ATOM 0 HH11 ARG A 135 12.101 -10.344 -13.109 1.00 0.00 H new ATOM 0 HH12 ARG A 135 12.579 -11.443 -14.408 1.00 0.00 H new ATOM 0 HH21 ARG A 135 10.739 -14.159 -13.107 1.00 0.00 H new ATOM 0 HH22 ARG A 135 11.804 -13.616 -14.408 1.00 0.00 H new ATOM 2107 N SER A 136 10.470 -10.393 -5.993 1.00 0.00 N ATOM 2108 CA SER A 136 10.909 -11.381 -5.014 1.00 0.00 C ATOM 2109 C SER A 136 9.824 -11.632 -3.972 1.00 0.00 C ATOM 2110 O SER A 136 9.773 -12.699 -3.357 1.00 0.00 O ATOM 2111 CB SER A 136 12.191 -10.924 -4.345 1.00 0.00 C ATOM 2112 OG SER A 136 11.988 -9.800 -3.533 1.00 0.00 O ATOM 0 H SER A 136 10.988 -9.514 -5.967 1.00 0.00 H new ATOM 0 HA SER A 136 11.101 -12.318 -5.536 1.00 0.00 H new ATOM 0 HB2 SER A 136 12.596 -11.738 -3.743 1.00 0.00 H new ATOM 0 HB3 SER A 136 12.935 -10.691 -5.107 1.00 0.00 H new ATOM 0 HG SER A 136 11.335 -9.204 -3.956 1.00 0.00 H new ATOM 2118 N TYR A 137 8.956 -10.644 -3.780 1.00 0.00 N ATOM 2119 CA TYR A 137 7.839 -10.778 -2.852 1.00 0.00 C ATOM 2120 C TYR A 137 6.602 -11.319 -3.562 1.00 0.00 C ATOM 2121 O TYR A 137 5.577 -11.580 -2.934 1.00 0.00 O ATOM 2122 CB TYR A 137 7.524 -9.432 -2.195 1.00 0.00 C ATOM 2123 CG TYR A 137 8.603 -8.942 -1.254 1.00 0.00 C ATOM 2124 CD1 TYR A 137 9.643 -9.774 -0.867 1.00 0.00 C ATOM 2125 CD2 TYR A 137 8.578 -7.647 -0.757 1.00 0.00 C ATOM 2126 CE1 TYR A 137 10.630 -9.331 -0.007 1.00 0.00 C ATOM 2127 CE2 TYR A 137 9.560 -7.194 0.102 1.00 0.00 C ATOM 2128 CZ TYR A 137 10.585 -8.039 0.475 1.00 0.00 C ATOM 2129 OH TYR A 137 11.566 -7.592 1.330 1.00 0.00 O ATOM 0 H TYR A 137 9.005 -9.742 -4.254 1.00 0.00 H new ATOM 0 HA TYR A 137 8.128 -11.488 -2.077 1.00 0.00 H new ATOM 0 HB2 TYR A 137 7.369 -8.686 -2.974 1.00 0.00 H new ATOM 0 HB3 TYR A 137 6.587 -9.518 -1.645 1.00 0.00 H new ATOM 0 HD1 TYR A 137 9.682 -10.785 -1.244 1.00 0.00 H new ATOM 0 HD2 TYR A 137 7.778 -6.982 -1.047 1.00 0.00 H new ATOM 0 HE1 TYR A 137 11.432 -9.992 0.286 1.00 0.00 H new ATOM 0 HE2 TYR A 137 9.526 -6.183 0.480 1.00 0.00 H new ATOM 0 HH TYR A 137 11.984 -8.357 1.777 1.00 0.00 H new ATOM 2139 N GLY A 138 6.707 -11.482 -4.878 1.00 0.00 N ATOM 2140 CA GLY A 138 5.615 -12.054 -5.642 1.00 0.00 C ATOM 2141 C GLY A 138 4.480 -11.071 -5.856 1.00 0.00 C ATOM 2142 O GLY A 138 3.329 -11.470 -6.029 1.00 0.00 O ATOM 0 H GLY A 138 7.528 -11.228 -5.427 1.00 0.00 H new ATOM 0 HA2 GLY A 138 5.989 -12.389 -6.610 1.00 0.00 H new ATOM 0 HA3 GLY A 138 5.236 -12.935 -5.124 1.00 0.00 H new ATOM 2146 N ILE A 139 4.805 -9.782 -5.841 1.00 0.00 N ATOM 2147 CA ILE A 139 3.791 -8.739 -5.920 1.00 0.00 C ATOM 2148 C ILE A 139 4.116 -7.740 -7.025 1.00 0.00 C ATOM 2149 O ILE A 139 5.264 -7.591 -7.444 1.00 0.00 O ATOM 2150 CB ILE A 139 3.649 -7.987 -4.584 1.00 0.00 C ATOM 2151 CG1 ILE A 139 4.958 -7.279 -4.227 1.00 0.00 C ATOM 2152 CG2 ILE A 139 3.239 -8.944 -3.476 1.00 0.00 C ATOM 2153 CD1 ILE A 139 4.844 -6.340 -3.050 1.00 0.00 C ATOM 0 H ILE A 139 5.762 -9.436 -5.775 1.00 0.00 H new ATOM 0 HA ILE A 139 2.847 -9.233 -6.148 1.00 0.00 H new ATOM 0 HB ILE A 139 2.869 -7.233 -4.692 1.00 0.00 H new ATOM 0 HG12 ILE A 139 5.718 -8.029 -4.008 1.00 0.00 H new ATOM 0 HG13 ILE A 139 5.305 -6.718 -5.095 1.00 0.00 H new ATOM 0 HG21 ILE A 139 3.143 -8.396 -2.539 1.00 0.00 H new ATOM 0 HG22 ILE A 139 2.283 -9.403 -3.727 1.00 0.00 H new ATOM 0 HG23 ILE A 139 3.997 -9.720 -3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 139 5.812 -5.877 -2.859 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.109 -5.566 -3.272 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.529 -6.898 -2.168 1.00 0.00 H new ATOM 2165 N PRO A 140 3.082 -7.036 -7.509 1.00 0.00 N ATOM 2166 CA PRO A 140 3.235 -6.020 -8.555 1.00 0.00 C ATOM 2167 C PRO A 140 3.824 -4.719 -8.017 1.00 0.00 C ATOM 2168 O PRO A 140 3.697 -4.413 -6.832 1.00 0.00 O ATOM 2169 CB PRO A 140 1.814 -5.823 -9.089 1.00 0.00 C ATOM 2170 CG PRO A 140 0.934 -6.104 -7.919 1.00 0.00 C ATOM 2171 CD PRO A 140 1.628 -7.199 -7.154 1.00 0.00 C ATOM 0 HA PRO A 140 3.934 -6.332 -9.331 1.00 0.00 H new ATOM 0 HB2 PRO A 140 1.667 -4.809 -9.462 1.00 0.00 H new ATOM 0 HB3 PRO A 140 1.603 -6.501 -9.916 1.00 0.00 H new ATOM 0 HG2 PRO A 140 0.804 -5.215 -7.302 1.00 0.00 H new ATOM 0 HG3 PRO A 140 -0.059 -6.417 -8.240 1.00 0.00 H new ATOM 0 HD2 PRO A 140 1.467 -7.098 -6.081 1.00 0.00 H new ATOM 0 HD3 PRO A 140 1.256 -8.182 -7.441 1.00 0.00 H new ATOM 2179 N TYR A 141 4.469 -3.959 -8.895 1.00 0.00 N ATOM 2180 CA TYR A 141 5.027 -2.665 -8.523 1.00 0.00 C ATOM 2181 C TYR A 141 4.396 -1.542 -9.342 1.00 0.00 C ATOM 2182 O TYR A 141 4.325 -1.620 -10.569 1.00 0.00 O ATOM 2183 CB TYR A 141 6.546 -2.664 -8.707 1.00 0.00 C ATOM 2184 CG TYR A 141 7.180 -1.299 -8.559 1.00 0.00 C ATOM 2185 CD1 TYR A 141 7.113 -0.607 -7.358 1.00 0.00 C ATOM 2186 CD2 TYR A 141 7.847 -0.706 -9.621 1.00 0.00 C ATOM 2187 CE1 TYR A 141 7.690 0.640 -7.217 1.00 0.00 C ATOM 2188 CE2 TYR A 141 8.429 0.540 -9.492 1.00 0.00 C ATOM 2189 CZ TYR A 141 8.348 1.210 -8.288 1.00 0.00 C ATOM 2190 OH TYR A 141 8.927 2.452 -8.154 1.00 0.00 O ATOM 0 H TYR A 141 4.618 -4.217 -9.870 1.00 0.00 H new ATOM 0 HA TYR A 141 4.800 -2.490 -7.471 1.00 0.00 H new ATOM 0 HB2 TYR A 141 6.991 -3.341 -7.978 1.00 0.00 H new ATOM 0 HB3 TYR A 141 6.783 -3.059 -9.695 1.00 0.00 H new ATOM 0 HD1 TYR A 141 6.600 -1.052 -6.518 1.00 0.00 H new ATOM 0 HD2 TYR A 141 7.912 -1.227 -10.565 1.00 0.00 H new ATOM 0 HE1 TYR A 141 7.627 1.165 -6.275 1.00 0.00 H new ATOM 0 HE2 TYR A 141 8.945 0.988 -10.329 1.00 0.00 H new ATOM 0 HH TYR A 141 9.350 2.709 -9.000 1.00 0.00 H new ATOM 2200 N ILE A 142 3.942 -0.500 -8.654 1.00 0.00 N ATOM 2201 CA ILE A 142 3.268 0.612 -9.311 1.00 0.00 C ATOM 2202 C ILE A 142 3.990 1.928 -9.041 1.00 0.00 C ATOM 2203 O ILE A 142 4.224 2.294 -7.888 1.00 0.00 O ATOM 2204 CB ILE A 142 1.803 0.735 -8.853 1.00 0.00 C ATOM 2205 CG1 ILE A 142 1.024 -0.534 -9.210 1.00 0.00 C ATOM 2206 CG2 ILE A 142 1.151 1.958 -9.479 1.00 0.00 C ATOM 2207 CD1 ILE A 142 -0.376 -0.570 -8.642 1.00 0.00 C ATOM 0 H ILE A 142 4.029 -0.403 -7.642 1.00 0.00 H new ATOM 0 HA ILE A 142 3.286 0.405 -10.381 1.00 0.00 H new ATOM 0 HB ILE A 142 1.787 0.855 -7.770 1.00 0.00 H new ATOM 0 HG12 ILE A 142 0.968 -0.622 -10.295 1.00 0.00 H new ATOM 0 HG13 ILE A 142 1.575 -1.402 -8.848 1.00 0.00 H new ATOM 0 HG21 ILE A 142 0.116 2.030 -9.145 1.00 0.00 H new ATOM 0 HG22 ILE A 142 1.693 2.854 -9.177 1.00 0.00 H new ATOM 0 HG23 ILE A 142 1.176 1.868 -10.565 1.00 0.00 H new ATOM 0 HD11 ILE A 142 -0.865 -1.498 -8.937 1.00 0.00 H new ATOM 0 HD12 ILE A 142 -0.329 -0.515 -7.554 1.00 0.00 H new ATOM 0 HD13 ILE A 142 -0.946 0.277 -9.024 1.00 0.00 H new ATOM 2219 N GLU A 143 4.339 2.637 -10.110 1.00 0.00 N ATOM 2220 CA GLU A 143 4.840 4.000 -9.992 1.00 0.00 C ATOM 2221 C GLU A 143 3.693 5.006 -10.018 1.00 0.00 C ATOM 2222 O GLU A 143 2.811 4.937 -10.874 1.00 0.00 O ATOM 2223 CB GLU A 143 5.836 4.304 -11.114 1.00 0.00 C ATOM 2224 CG GLU A 143 7.093 3.446 -11.088 1.00 0.00 C ATOM 2225 CD GLU A 143 8.019 3.799 -12.219 1.00 0.00 C ATOM 2226 OE1 GLU A 143 7.591 3.755 -13.347 1.00 0.00 O ATOM 2227 OE2 GLU A 143 9.119 4.222 -11.950 1.00 0.00 O ATOM 0 H GLU A 143 4.284 2.289 -11.067 1.00 0.00 H new ATOM 0 HA GLU A 143 5.353 4.089 -9.034 1.00 0.00 H new ATOM 0 HB2 GLU A 143 5.337 4.167 -12.073 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.125 5.353 -11.052 1.00 0.00 H new ATOM 0 HG2 GLU A 143 7.609 3.581 -10.137 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.819 2.393 -11.155 1.00 0.00 H new ATOM 2234 N THR A 144 3.713 5.942 -9.073 1.00 0.00 N ATOM 2235 CA THR A 144 2.634 6.911 -8.936 1.00 0.00 C ATOM 2236 C THR A 144 3.176 8.290 -8.570 1.00 0.00 C ATOM 2237 O THR A 144 4.316 8.420 -8.124 1.00 0.00 O ATOM 2238 CB THR A 144 1.612 6.472 -7.871 1.00 0.00 C ATOM 2239 OG1 THR A 144 0.482 7.354 -7.896 1.00 0.00 O ATOM 2240 CG2 THR A 144 2.240 6.498 -6.486 1.00 0.00 C ATOM 0 H THR A 144 4.465 6.049 -8.392 1.00 0.00 H new ATOM 0 HA THR A 144 2.135 6.965 -9.903 1.00 0.00 H new ATOM 0 HB THR A 144 1.292 5.454 -8.095 1.00 0.00 H new ATOM 0 HG1 THR A 144 0.015 7.311 -7.036 1.00 0.00 H new ATOM 0 HG21 THR A 144 1.503 6.185 -5.746 1.00 0.00 H new ATOM 0 HG22 THR A 144 3.092 5.818 -6.460 1.00 0.00 H new ATOM 0 HG23 THR A 144 2.576 7.510 -6.258 1.00 0.00 H new ATOM 2248 N SER A 145 2.353 9.314 -8.763 1.00 0.00 N ATOM 2249 CA SER A 145 2.669 10.651 -8.275 1.00 0.00 C ATOM 2250 C SER A 145 1.468 11.270 -7.566 1.00 0.00 C ATOM 2251 O SER A 145 0.416 11.474 -8.170 1.00 0.00 O ATOM 2252 CB SER A 145 3.121 11.533 -9.422 1.00 0.00 C ATOM 2253 OG SER A 145 3.402 12.840 -9.001 1.00 0.00 O ATOM 0 H SER A 145 1.462 9.244 -9.254 1.00 0.00 H new ATOM 0 HA SER A 145 3.482 10.570 -7.553 1.00 0.00 H new ATOM 0 HB2 SER A 145 4.010 11.102 -9.882 1.00 0.00 H new ATOM 0 HB3 SER A 145 2.346 11.558 -10.188 1.00 0.00 H new ATOM 0 HG SER A 145 3.962 13.286 -9.670 1.00 0.00 H new ATOM 2259 N ALA A 146 1.635 11.566 -6.281 1.00 0.00 N ATOM 2260 CA ALA A 146 0.544 12.092 -5.470 1.00 0.00 C ATOM 2261 C ALA A 146 -0.057 13.342 -6.104 1.00 0.00 C ATOM 2262 O ALA A 146 -1.199 13.705 -5.821 1.00 0.00 O ATOM 2263 CB ALA A 146 1.031 12.393 -4.061 1.00 0.00 C ATOM 0 H ALA A 146 2.516 11.450 -5.779 1.00 0.00 H new ATOM 0 HA ALA A 146 -0.236 11.333 -5.417 1.00 0.00 H new ATOM 0 HB1 ALA A 146 0.206 12.785 -3.467 1.00 0.00 H new ATOM 0 HB2 ALA A 146 1.406 11.478 -3.602 1.00 0.00 H new ATOM 0 HB3 ALA A 146 1.831 13.132 -4.103 1.00 0.00 H new ATOM 2269 N LYS A 147 0.719 13.997 -6.959 1.00 0.00 N ATOM 2270 CA LYS A 147 0.297 15.254 -7.567 1.00 0.00 C ATOM 2271 C LYS A 147 -1.023 15.082 -8.310 1.00 0.00 C ATOM 2272 O LYS A 147 -2.038 15.672 -7.938 1.00 0.00 O ATOM 2273 CB LYS A 147 1.375 15.777 -8.519 1.00 0.00 C ATOM 2274 CG LYS A 147 1.057 17.128 -9.145 1.00 0.00 C ATOM 2275 CD LYS A 147 2.201 17.613 -10.023 1.00 0.00 C ATOM 2276 CE LYS A 147 1.873 18.949 -10.674 1.00 0.00 C ATOM 2277 NZ LYS A 147 2.985 19.437 -11.534 1.00 0.00 N ATOM 0 H LYS A 147 1.644 13.679 -7.247 1.00 0.00 H new ATOM 0 HA LYS A 147 0.150 15.982 -6.770 1.00 0.00 H new ATOM 0 HB2 LYS A 147 2.317 15.854 -7.975 1.00 0.00 H new ATOM 0 HB3 LYS A 147 1.525 15.047 -9.315 1.00 0.00 H new ATOM 0 HG2 LYS A 147 0.147 17.051 -9.740 1.00 0.00 H new ATOM 0 HG3 LYS A 147 0.863 17.859 -8.360 1.00 0.00 H new ATOM 0 HD2 LYS A 147 3.106 17.711 -9.423 1.00 0.00 H new ATOM 0 HD3 LYS A 147 2.409 16.872 -10.795 1.00 0.00 H new ATOM 0 HE2 LYS A 147 0.968 18.848 -11.274 1.00 0.00 H new ATOM 0 HE3 LYS A 147 1.662 19.687 -9.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 2.721 20.349 -11.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 3.842 19.558 -10.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 3.170 18.745 -12.288 1.00 0.00 H new ATOM 2291 N THR A 148 -1.006 14.270 -9.362 1.00 0.00 N ATOM 2292 CA THR A 148 -2.212 13.982 -10.126 1.00 0.00 C ATOM 2293 C THR A 148 -2.259 12.518 -10.549 1.00 0.00 C ATOM 2294 O THR A 148 -3.316 11.887 -10.519 1.00 0.00 O ATOM 2295 CB THR A 148 -2.314 14.872 -11.379 1.00 0.00 C ATOM 2296 OG1 THR A 148 -1.097 14.784 -12.131 1.00 0.00 O ATOM 2297 CG2 THR A 148 -2.558 16.320 -10.984 1.00 0.00 C ATOM 0 H THR A 148 -0.168 13.800 -9.704 1.00 0.00 H new ATOM 0 HA THR A 148 -3.057 14.195 -9.471 1.00 0.00 H new ATOM 0 HB THR A 148 -3.150 14.525 -11.987 1.00 0.00 H new ATOM 0 HG1 THR A 148 -1.164 15.349 -12.929 1.00 0.00 H new ATOM 0 HG21 THR A 148 -2.627 16.935 -11.881 1.00 0.00 H new ATOM 0 HG22 THR A 148 -3.489 16.392 -10.422 1.00 0.00 H new ATOM 0 HG23 THR A 148 -1.733 16.672 -10.365 1.00 0.00 H new ATOM 2305 N ARG A 149 -1.108 11.983 -10.942 1.00 0.00 N ATOM 2306 CA ARG A 149 -1.033 10.615 -11.443 1.00 0.00 C ATOM 2307 C ARG A 149 -1.442 9.618 -10.363 1.00 0.00 C ATOM 2308 O ARG A 149 -0.666 9.319 -9.456 1.00 0.00 O ATOM 2309 CB ARG A 149 0.337 10.287 -12.018 1.00 0.00 C ATOM 2310 CG ARG A 149 0.539 8.828 -12.395 1.00 0.00 C ATOM 2311 CD ARG A 149 1.940 8.475 -12.742 1.00 0.00 C ATOM 2312 NE ARG A 149 2.218 7.047 -12.743 1.00 0.00 N ATOM 2313 CZ ARG A 149 2.099 6.245 -13.820 1.00 0.00 C ATOM 2314 NH1 ARG A 149 1.673 6.716 -14.971 1.00 0.00 N ATOM 2315 NH2 ARG A 149 2.399 4.966 -13.682 1.00 0.00 N ATOM 0 H ARG A 149 -0.215 12.475 -10.923 1.00 0.00 H new ATOM 0 HA ARG A 149 -1.743 10.531 -12.266 1.00 0.00 H new ATOM 0 HB2 ARG A 149 0.501 10.902 -12.903 1.00 0.00 H new ATOM 0 HB3 ARG A 149 1.098 10.568 -11.290 1.00 0.00 H new ATOM 0 HG2 ARG A 149 0.214 8.202 -11.564 1.00 0.00 H new ATOM 0 HG3 ARG A 149 -0.104 8.592 -13.243 1.00 0.00 H new ATOM 0 HD2 ARG A 149 2.170 8.878 -13.728 1.00 0.00 H new ATOM 0 HD3 ARG A 149 2.610 8.963 -12.034 1.00 0.00 H new ATOM 0 HE ARG A 149 2.524 6.623 -11.867 1.00 0.00 H new ATOM 0 HH11 ARG A 149 1.427 7.702 -15.059 1.00 0.00 H new ATOM 0 HH12 ARG A 149 1.589 6.096 -15.776 1.00 0.00 H new ATOM 0 HH21 ARG A 149 2.711 4.610 -12.778 1.00 0.00 H new ATOM 0 HH22 ARG A 149 2.319 4.334 -14.479 1.00 0.00 H new ATOM 2329 N GLN A 150 -2.665 9.109 -10.468 1.00 0.00 N ATOM 2330 CA GLN A 150 -3.191 8.175 -9.479 1.00 0.00 C ATOM 2331 C GLN A 150 -2.741 6.750 -9.781 1.00 0.00 C ATOM 2332 O GLN A 150 -3.191 6.138 -10.748 1.00 0.00 O ATOM 2333 CB GLN A 150 -4.721 8.238 -9.442 1.00 0.00 C ATOM 2334 CG GLN A 150 -5.281 9.641 -9.274 1.00 0.00 C ATOM 2335 CD GLN A 150 -4.960 10.234 -7.915 1.00 0.00 C ATOM 2336 OE1 GLN A 150 -5.246 9.632 -6.876 1.00 0.00 O ATOM 2337 NE2 GLN A 150 -4.367 11.421 -7.914 1.00 0.00 N ATOM 0 H GLN A 150 -3.310 9.327 -11.227 1.00 0.00 H new ATOM 0 HA GLN A 150 -2.799 8.465 -8.504 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -5.114 7.810 -10.364 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -5.080 7.615 -8.623 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -4.876 10.286 -10.054 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -6.362 9.616 -9.410 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -4.149 11.883 -8.797 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -4.129 11.872 -7.030 1.00 0.00 H new ATOM 2346 N GLY A 151 -1.846 6.228 -8.948 1.00 0.00 N ATOM 2347 CA GLY A 151 -1.559 4.806 -8.964 1.00 0.00 C ATOM 2348 C GLY A 151 -2.118 4.088 -7.751 1.00 0.00 C ATOM 2349 O GLY A 151 -2.082 2.860 -7.677 1.00 0.00 O ATOM 0 H GLY A 151 -1.315 6.765 -8.262 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -1.977 4.364 -9.869 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.480 4.657 -9.006 1.00 0.00 H new ATOM 2353 N VAL A 152 -2.632 4.856 -6.796 1.00 0.00 N ATOM 2354 CA VAL A 152 -3.166 4.289 -5.563 1.00 0.00 C ATOM 2355 C VAL A 152 -4.444 3.502 -5.829 1.00 0.00 C ATOM 2356 O VAL A 152 -4.728 2.514 -5.152 1.00 0.00 O ATOM 2357 CB VAL A 152 -3.455 5.381 -4.517 1.00 0.00 C ATOM 2358 CG1 VAL A 152 -4.668 6.203 -4.926 1.00 0.00 C ATOM 2359 CG2 VAL A 152 -3.671 4.761 -3.145 1.00 0.00 C ATOM 0 H VAL A 152 -2.690 5.873 -6.852 1.00 0.00 H new ATOM 0 HA VAL A 152 -2.403 3.617 -5.170 1.00 0.00 H new ATOM 0 HB VAL A 152 -2.591 6.044 -4.464 1.00 0.00 H new ATOM 0 HG11 VAL A 152 -4.858 6.970 -4.175 1.00 0.00 H new ATOM 0 HG12 VAL A 152 -4.478 6.677 -5.889 1.00 0.00 H new ATOM 0 HG13 VAL A 152 -5.538 5.552 -5.007 1.00 0.00 H new ATOM 0 HG21 VAL A 152 -3.874 5.548 -2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 152 -4.518 4.076 -3.185 1.00 0.00 H new ATOM 0 HG23 VAL A 152 -2.776 4.214 -2.848 1.00 0.00 H new ATOM 2369 N GLU A 153 -5.212 3.946 -6.820 1.00 0.00 N ATOM 2370 CA GLU A 153 -6.452 3.274 -7.184 1.00 0.00 C ATOM 2371 C GLU A 153 -6.174 1.871 -7.718 1.00 0.00 C ATOM 2372 O GLU A 153 -6.809 0.901 -7.303 1.00 0.00 O ATOM 2373 CB GLU A 153 -7.222 4.092 -8.223 1.00 0.00 C ATOM 2374 CG GLU A 153 -8.572 3.507 -8.609 1.00 0.00 C ATOM 2375 CD GLU A 153 -9.295 4.397 -9.582 1.00 0.00 C ATOM 2376 OE1 GLU A 153 -8.719 5.368 -10.009 1.00 0.00 O ATOM 2377 OE2 GLU A 153 -10.379 4.046 -9.986 1.00 0.00 O ATOM 0 H GLU A 153 -4.996 4.768 -7.384 1.00 0.00 H new ATOM 0 HA GLU A 153 -7.063 3.185 -6.286 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -7.374 5.099 -7.835 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -6.610 4.185 -9.120 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -8.430 2.521 -9.051 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -9.181 3.371 -7.715 1.00 0.00 H new ATOM 2384 N ASP A 154 -5.224 1.773 -8.641 1.00 0.00 N ATOM 2385 CA ASP A 154 -4.799 0.481 -9.166 1.00 0.00 C ATOM 2386 C ASP A 154 -4.262 -0.410 -8.051 1.00 0.00 C ATOM 2387 O ASP A 154 -4.488 -1.619 -8.046 1.00 0.00 O ATOM 2388 CB ASP A 154 -3.737 0.664 -10.253 1.00 0.00 C ATOM 2389 CG ASP A 154 -4.274 1.200 -11.574 1.00 0.00 C ATOM 2390 OD1 ASP A 154 -5.471 1.214 -11.743 1.00 0.00 O ATOM 2391 OD2 ASP A 154 -3.501 1.733 -12.333 1.00 0.00 O ATOM 0 H ASP A 154 -4.734 2.573 -9.041 1.00 0.00 H new ATOM 0 HA ASP A 154 -5.670 -0.005 -9.606 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -2.970 1.345 -9.884 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -3.251 -0.295 -10.434 1.00 0.00 H new ATOM 2396 N ALA A 155 -3.547 0.197 -7.108 1.00 0.00 N ATOM 2397 CA ALA A 155 -3.053 -0.524 -5.942 1.00 0.00 C ATOM 2398 C ALA A 155 -4.203 -1.069 -5.103 1.00 0.00 C ATOM 2399 O ALA A 155 -4.147 -2.195 -4.608 1.00 0.00 O ATOM 2400 CB ALA A 155 -2.163 0.380 -5.101 1.00 0.00 C ATOM 0 H ALA A 155 -3.298 1.186 -7.130 1.00 0.00 H new ATOM 0 HA ALA A 155 -2.464 -1.371 -6.293 1.00 0.00 H new ATOM 0 HB1 ALA A 155 -1.801 -0.171 -4.233 1.00 0.00 H new ATOM 0 HB2 ALA A 155 -1.315 0.714 -5.699 1.00 0.00 H new ATOM 0 HB3 ALA A 155 -2.735 1.246 -4.768 1.00 0.00 H new ATOM 2406 N PHE A 156 -5.247 -0.260 -4.945 1.00 0.00 N ATOM 2407 CA PHE A 156 -6.437 -0.684 -4.217 1.00 0.00 C ATOM 2408 C PHE A 156 -7.109 -1.866 -4.911 1.00 0.00 C ATOM 2409 O PHE A 156 -7.389 -2.889 -4.288 1.00 0.00 O ATOM 2410 CB PHE A 156 -7.423 0.478 -4.079 1.00 0.00 C ATOM 2411 CG PHE A 156 -6.987 1.530 -3.098 1.00 0.00 C ATOM 2412 CD1 PHE A 156 -5.974 1.271 -2.187 1.00 0.00 C ATOM 2413 CD2 PHE A 156 -7.590 2.778 -3.084 1.00 0.00 C ATOM 2414 CE1 PHE A 156 -5.572 2.237 -1.285 1.00 0.00 C ATOM 2415 CE2 PHE A 156 -7.189 3.746 -2.183 1.00 0.00 C ATOM 2416 CZ PHE A 156 -6.179 3.474 -1.282 1.00 0.00 C ATOM 0 H PHE A 156 -5.292 0.691 -5.311 1.00 0.00 H new ATOM 0 HA PHE A 156 -6.128 -1.002 -3.221 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -7.563 0.941 -5.056 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -8.392 0.086 -3.770 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -5.494 0.303 -2.183 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -8.382 2.996 -3.785 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -4.781 2.022 -0.581 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -7.666 4.715 -2.184 1.00 0.00 H new ATOM 0 HZ PHE A 156 -5.865 4.229 -0.576 1.00 0.00 H new ATOM 2426 N TYR A 157 -7.365 -1.715 -6.206 1.00 0.00 N ATOM 2427 CA TYR A 157 -8.145 -2.697 -6.952 1.00 0.00 C ATOM 2428 C TYR A 157 -7.398 -4.025 -7.044 1.00 0.00 C ATOM 2429 O TYR A 157 -7.974 -5.091 -6.823 1.00 0.00 O ATOM 2430 CB TYR A 157 -8.468 -2.174 -8.352 1.00 0.00 C ATOM 2431 CG TYR A 157 -9.390 -0.974 -8.361 1.00 0.00 C ATOM 2432 CD1 TYR A 157 -9.682 -0.292 -7.190 1.00 0.00 C ATOM 2433 CD2 TYR A 157 -9.963 -0.527 -9.542 1.00 0.00 C ATOM 2434 CE1 TYR A 157 -10.522 0.804 -7.193 1.00 0.00 C ATOM 2435 CE2 TYR A 157 -10.804 0.568 -9.557 1.00 0.00 C ATOM 2436 CZ TYR A 157 -11.082 1.231 -8.380 1.00 0.00 C ATOM 2437 OH TYR A 157 -11.920 2.323 -8.389 1.00 0.00 O ATOM 0 H TYR A 157 -7.044 -0.922 -6.761 1.00 0.00 H new ATOM 0 HA TYR A 157 -9.080 -2.864 -6.417 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -7.537 -1.909 -8.854 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -8.925 -2.976 -8.932 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -9.245 -0.623 -6.260 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -9.748 -1.044 -10.466 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.740 1.324 -6.272 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -11.242 0.904 -10.486 1.00 0.00 H new ATOM 0 HH TYR A 157 -11.517 3.041 -8.921 1.00 0.00 H new ATOM 2447 N THR A 158 -6.113 -3.953 -7.373 1.00 0.00 N ATOM 2448 CA THR A 158 -5.292 -5.148 -7.518 1.00 0.00 C ATOM 2449 C THR A 158 -5.248 -5.943 -6.218 1.00 0.00 C ATOM 2450 O THR A 158 -5.429 -7.162 -6.218 1.00 0.00 O ATOM 2451 CB THR A 158 -3.855 -4.799 -7.946 1.00 0.00 C ATOM 2452 OG1 THR A 158 -3.877 -4.167 -9.232 1.00 0.00 O ATOM 2453 CG2 THR A 158 -3.000 -6.056 -8.018 1.00 0.00 C ATOM 0 H THR A 158 -5.617 -3.078 -7.544 1.00 0.00 H new ATOM 0 HA THR A 158 -5.753 -5.755 -8.297 1.00 0.00 H new ATOM 0 HB THR A 158 -3.426 -4.122 -7.208 1.00 0.00 H new ATOM 0 HG1 THR A 158 -4.080 -3.214 -9.125 1.00 0.00 H new ATOM 0 HG21 THR A 158 -1.988 -5.790 -8.322 1.00 0.00 H new ATOM 0 HG22 THR A 158 -2.971 -6.533 -7.038 1.00 0.00 H new ATOM 0 HG23 THR A 158 -3.428 -6.746 -8.745 1.00 0.00 H new ATOM 2461 N LEU A 159 -5.004 -5.248 -5.113 1.00 0.00 N ATOM 2462 CA LEU A 159 -4.936 -5.891 -3.805 1.00 0.00 C ATOM 2463 C LEU A 159 -6.280 -6.509 -3.431 1.00 0.00 C ATOM 2464 O LEU A 159 -6.341 -7.629 -2.926 1.00 0.00 O ATOM 2465 CB LEU A 159 -4.496 -4.880 -2.738 1.00 0.00 C ATOM 2466 CG LEU A 159 -4.440 -5.424 -1.306 1.00 0.00 C ATOM 2467 CD1 LEU A 159 -3.531 -6.644 -1.246 1.00 0.00 C ATOM 2468 CD2 LEU A 159 -3.943 -4.335 -0.366 1.00 0.00 C ATOM 0 H LEU A 159 -4.850 -4.240 -5.096 1.00 0.00 H new ATOM 0 HA LEU A 159 -4.198 -6.691 -3.856 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -3.509 -4.501 -3.004 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -5.180 -4.031 -2.761 1.00 0.00 H new ATOM 0 HG LEU A 159 -5.439 -5.727 -0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -3.498 -7.023 -0.225 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -3.918 -7.419 -1.908 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -2.526 -6.365 -1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -3.904 -4.723 0.652 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -2.946 -4.017 -0.672 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -4.623 -3.484 -0.404 1.00 0.00 H new ATOM 2480 N VAL A 160 -7.356 -5.770 -3.685 1.00 0.00 N ATOM 2481 CA VAL A 160 -8.703 -6.269 -3.431 1.00 0.00 C ATOM 2482 C VAL A 160 -8.991 -7.516 -4.260 1.00 0.00 C ATOM 2483 O VAL A 160 -9.619 -8.461 -3.781 1.00 0.00 O ATOM 2484 CB VAL A 160 -9.769 -5.201 -3.738 1.00 0.00 C ATOM 2485 CG1 VAL A 160 -11.153 -5.831 -3.796 1.00 0.00 C ATOM 2486 CG2 VAL A 160 -9.732 -4.095 -2.695 1.00 0.00 C ATOM 0 H VAL A 160 -7.321 -4.825 -4.066 1.00 0.00 H new ATOM 0 HA VAL A 160 -8.752 -6.521 -2.372 1.00 0.00 H new ATOM 0 HB VAL A 160 -9.547 -4.764 -4.712 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -11.894 -5.062 -4.014 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -11.175 -6.589 -4.579 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -11.382 -6.294 -2.836 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -10.492 -3.349 -2.928 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -9.928 -4.517 -1.710 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -8.749 -3.624 -2.699 1.00 0.00 H new ATOM 2496 N ARG A 161 -8.528 -7.512 -5.506 1.00 0.00 N ATOM 2497 CA ARG A 161 -8.678 -8.669 -6.380 1.00 0.00 C ATOM 2498 C ARG A 161 -7.929 -9.874 -5.818 1.00 0.00 C ATOM 2499 O ARG A 161 -8.401 -11.007 -5.910 1.00 0.00 O ATOM 2500 CB ARG A 161 -8.260 -8.368 -7.811 1.00 0.00 C ATOM 2501 CG ARG A 161 -9.221 -7.480 -8.585 1.00 0.00 C ATOM 2502 CD ARG A 161 -8.737 -7.077 -9.929 1.00 0.00 C ATOM 2503 NE ARG A 161 -9.628 -6.183 -10.649 1.00 0.00 N ATOM 2504 CZ ARG A 161 -9.365 -5.646 -11.857 1.00 0.00 C ATOM 2505 NH1 ARG A 161 -8.223 -5.880 -12.466 1.00 0.00 N ATOM 2506 NH2 ARG A 161 -10.274 -4.859 -12.403 1.00 0.00 N ATOM 0 H ARG A 161 -8.046 -6.721 -5.933 1.00 0.00 H new ATOM 0 HA ARG A 161 -9.739 -8.916 -6.413 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -7.280 -7.891 -7.795 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -8.147 -9.310 -8.347 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -10.171 -8.004 -8.696 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -9.419 -6.582 -7.999 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -7.767 -6.593 -9.821 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -8.581 -7.974 -10.529 1.00 0.00 H new ATOM 0 HE ARG A 161 -10.517 -5.945 -10.208 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -7.522 -6.475 -12.024 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -8.038 -5.467 -13.380 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -11.148 -4.671 -11.911 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -10.102 -4.439 -13.316 1.00 0.00 H new ATOM 2520 N GLU A 162 -6.761 -9.622 -5.236 1.00 0.00 N ATOM 2521 CA GLU A 162 -5.970 -10.680 -4.619 1.00 0.00 C ATOM 2522 C GLU A 162 -6.619 -11.159 -3.322 1.00 0.00 C ATOM 2523 O GLU A 162 -6.614 -12.352 -3.018 1.00 0.00 O ATOM 2524 CB GLU A 162 -4.543 -10.197 -4.348 1.00 0.00 C ATOM 2525 CG GLU A 162 -3.707 -9.976 -5.600 1.00 0.00 C ATOM 2526 CD GLU A 162 -3.611 -11.232 -6.421 1.00 0.00 C ATOM 2527 OE1 GLU A 162 -3.230 -12.243 -5.882 1.00 0.00 O ATOM 2528 OE2 GLU A 162 -4.025 -11.209 -7.556 1.00 0.00 O ATOM 0 H GLU A 162 -6.341 -8.694 -5.179 1.00 0.00 H new ATOM 0 HA GLU A 162 -5.929 -11.519 -5.314 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -4.589 -9.264 -3.787 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -4.040 -10.926 -3.714 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -4.149 -9.180 -6.199 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -2.707 -9.645 -5.319 1.00 0.00 H new ATOM 2535 N ILE A 163 -7.175 -10.219 -2.564 1.00 0.00 N ATOM 2536 CA ILE A 163 -7.905 -10.554 -1.348 1.00 0.00 C ATOM 2537 C ILE A 163 -9.081 -11.477 -1.649 1.00 0.00 C ATOM 2538 O ILE A 163 -9.372 -12.397 -0.883 1.00 0.00 O ATOM 2539 CB ILE A 163 -8.425 -9.291 -0.636 1.00 0.00 C ATOM 2540 CG1 ILE A 163 -7.259 -8.490 -0.053 1.00 0.00 C ATOM 2541 CG2 ILE A 163 -9.416 -9.667 0.455 1.00 0.00 C ATOM 2542 CD1 ILE A 163 -7.638 -7.094 0.388 1.00 0.00 C ATOM 0 H ILE A 163 -7.134 -9.221 -2.771 1.00 0.00 H new ATOM 0 HA ILE A 163 -7.203 -11.067 -0.691 1.00 0.00 H new ATOM 0 HB ILE A 163 -8.940 -8.667 -1.366 1.00 0.00 H new ATOM 0 HG12 ILE A 163 -6.849 -9.031 0.799 1.00 0.00 H new ATOM 0 HG13 ILE A 163 -6.467 -8.423 -0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 163 -9.774 -8.763 0.948 1.00 0.00 H new ATOM 0 HG22 ILE A 163 -10.259 -10.198 0.013 1.00 0.00 H new ATOM 0 HG23 ILE A 163 -8.926 -10.310 1.186 1.00 0.00 H new ATOM 0 HD11 ILE A 163 -6.760 -6.588 0.790 1.00 0.00 H new ATOM 0 HD12 ILE A 163 -8.020 -6.534 -0.465 1.00 0.00 H new ATOM 0 HD13 ILE A 163 -8.407 -7.152 1.158 1.00 0.00 H new ATOM 2554 N ARG A 164 -9.751 -11.229 -2.770 1.00 0.00 N ATOM 2555 CA ARG A 164 -10.877 -12.054 -3.186 1.00 0.00 C ATOM 2556 C ARG A 164 -10.426 -13.483 -3.473 1.00 0.00 C ATOM 2557 O ARG A 164 -11.200 -14.430 -3.330 1.00 0.00 O ATOM 2558 CB ARG A 164 -11.625 -11.455 -4.368 1.00 0.00 C ATOM 2559 CG ARG A 164 -12.900 -12.187 -4.756 1.00 0.00 C ATOM 2560 CD ARG A 164 -13.435 -11.818 -6.091 1.00 0.00 C ATOM 2561 NE ARG A 164 -13.763 -10.410 -6.242 1.00 0.00 N ATOM 2562 CZ ARG A 164 -13.636 -9.713 -7.388 1.00 0.00 C ATOM 2563 NH1 ARG A 164 -13.157 -10.278 -8.474 1.00 0.00 N ATOM 2564 NH2 ARG A 164 -13.986 -8.439 -7.386 1.00 0.00 N ATOM 0 H ARG A 164 -9.532 -10.462 -3.406 1.00 0.00 H new ATOM 0 HA ARG A 164 -11.582 -12.083 -2.356 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -11.874 -10.420 -4.135 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -10.958 -11.436 -5.230 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -12.709 -13.260 -4.738 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -13.663 -11.987 -4.004 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -12.702 -12.090 -6.850 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -14.330 -12.409 -6.286 1.00 0.00 H new ATOM 0 HE ARG A 164 -14.114 -9.915 -5.422 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -12.875 -11.258 -8.457 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -13.067 -9.736 -9.334 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -14.341 -8.009 -6.532 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -13.901 -7.885 -8.239 1.00 0.00 H new ATOM 2578 N GLN A 165 -9.168 -13.631 -3.878 1.00 0.00 N ATOM 2579 CA GLN A 165 -8.664 -14.915 -4.351 1.00 0.00 C ATOM 2580 C GLN A 165 -7.869 -15.624 -3.260 1.00 0.00 C ATOM 2581 O GLN A 165 -7.420 -16.755 -3.438 1.00 0.00 O ATOM 2582 CB GLN A 165 -7.787 -14.724 -5.592 1.00 0.00 C ATOM 2583 CG GLN A 165 -8.518 -14.133 -6.785 1.00 0.00 C ATOM 2584 CD GLN A 165 -9.749 -14.934 -7.165 1.00 0.00 C ATOM 2585 OE1 GLN A 165 -9.646 -16.074 -7.630 1.00 0.00 O ATOM 2586 NE2 GLN A 165 -10.923 -14.342 -6.974 1.00 0.00 N ATOM 0 H GLN A 165 -8.480 -12.878 -3.888 1.00 0.00 H new ATOM 0 HA GLN A 165 -9.522 -15.534 -4.614 1.00 0.00 H new ATOM 0 HB2 GLN A 165 -6.950 -14.075 -5.335 1.00 0.00 H new ATOM 0 HB3 GLN A 165 -7.367 -15.688 -5.878 1.00 0.00 H new ATOM 0 HG2 GLN A 165 -8.811 -13.108 -6.557 1.00 0.00 H new ATOM 0 HG3 GLN A 165 -7.840 -14.088 -7.637 1.00 0.00 H new ATOM 0 HE21 GLN A 165 -10.962 -13.399 -6.587 1.00 0.00 H new ATOM 0 HE22 GLN A 165 -11.786 -14.831 -7.214 1.00 0.00 H new ATOM 2595 N HIS A 166 -7.699 -14.948 -2.126 1.00 0.00 N ATOM 2596 CA HIS A 166 -6.967 -15.518 -1.000 1.00 0.00 C ATOM 2597 C HIS A 166 -7.816 -15.488 0.269 1.00 0.00 C ATOM 2598 O HIS A 166 -8.002 -16.531 0.895 1.00 0.00 O ATOM 2599 CB HIS A 166 -5.651 -14.770 -0.771 1.00 0.00 C ATOM 2600 CG HIS A 166 -4.619 -15.032 -1.824 1.00 0.00 C ATOM 2601 ND1 HIS A 166 -4.619 -14.388 -3.042 1.00 0.00 N ATOM 2602 CD2 HIS A 166 -3.555 -15.869 -1.840 1.00 0.00 C ATOM 2603 CE1 HIS A 166 -3.598 -14.818 -3.763 1.00 0.00 C ATOM 2604 NE2 HIS A 166 -2.937 -15.716 -3.057 1.00 0.00 N ATOM 2605 OXT HIS A 166 -8.295 -14.454 0.645 1.00 0.00 O ATOM 0 H HIS A 166 -8.058 -14.007 -1.964 1.00 0.00 H new ATOM 0 HA HIS A 166 -6.738 -16.556 -1.241 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -5.854 -13.700 -0.732 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -5.246 -15.054 0.201 1.00 0.00 H new ATOM 0 HD1 HIS A 166 -5.300 -13.689 -3.340 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -3.249 -16.533 -1.045 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -3.347 -14.490 -4.761 1.00 0.00 H new