USER MOD reduce.3.24.130724 H: found=0, std=0, add=1026, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1023 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 97 GLN : amide:sc= 1.61 K(o=4.4,f=2.2) USER MOD Set 1.2: A 99 SER OG : rot -154:sc= 1.54 USER MOD Set 1.3: A 104 THR OG1 : rot -129:sc= 1.3 USER MOD Set 2.1: A 51 HIS : no HE2:sc= 1.83 K(o=3.1,f=-12!) USER MOD Set 2.2: A 86 LYS NZ :NH3+ -160:sc= 1.26 (180deg=0) USER MOD Set 3.1: A 19 GLN : amide:sc= -0.135 X(o=-0.11,f=0) USER MOD Set 3.2: A 21 TYR OH : rot 48:sc= 0.0218 USER MOD Set 4.1: A 12 THR OG1 : rot 159:sc= 0.621 USER MOD Set 4.2: A 59 GLN : amide:sc= 0.497 X(o=1.1,f=1.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 170:sc= 1.3 (180deg=1.15) USER MOD Single : A 4 LYS NZ :NH3+ 165:sc= 1.27 (180deg=1.17) USER MOD Single : A 9 SER OG : rot 88:sc= 0.821 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.00369 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= 0.721 K(o=0.72,f=-0.021) USER MOD Single : A 36 HIS : no HE2:sc= 1.12 K(o=1.1,f=-3.8!) USER MOD Single : A 38 SER OG : rot 92:sc= 0.597 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.0629 USER MOD Single : A 42 HIS : no HE2:sc= 0.659 K(o=0.66,f=-5.1!) USER MOD Single : A 46 LYS NZ :NH3+ -168:sc= 2.32 (180deg=2.05) USER MOD Single : A 49 ASN : amide:sc= 1.17 K(o=1.2,f=-0.089) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 172:sc= 1.29 (180deg=0.934) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot -140:sc= -0.399 USER MOD Single : A 79 THR OG1 : rot 175:sc= 1.04 USER MOD Single : A 80 GLN :FLIP amide:sc= 0 F(o=-1.9,f=0) USER MOD Single : A 85 LYS NZ :NH3+ -177:sc= 2.33 (180deg=2.31) USER MOD Single : A 88 SER OG : rot 160:sc= 0.72 USER MOD Single : A 89 LYS NZ :NH3+ 167:sc= 1.91 (180deg=1.77) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 156:sc= 1.37 USER MOD Single : A 106 GLN : amide:sc= 0.994 K(o=0.99,f=0) USER MOD Single : A 109 ASN : amide:sc= 1.39 K(o=1.4,f=-2.1!) USER MOD Single : A 110 THR OG1 : rot 140:sc= 0.0601 USER MOD Single : A 112 LYS NZ :NH3+ -138:sc= 3.31 (180deg=0.773) USER MOD Single : A 114 LYS NZ :NH3+ 169:sc= 1.21 (180deg=1.15) USER MOD Single : A 121 MET CE :methyl 174:sc= 0 (180deg=-0.0346) USER MOD Single : A 122 SER OG : rot 180:sc= 0.0185 USER MOD Single : A 123 ASN : amide:sc= -0.265 K(o=-0.26,f=-0.81) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.467 -25.614 -9.256 1.00 0.00 N ATOM 2 CA MET A 1 -4.056 -26.022 -9.184 1.00 0.00 C ATOM 3 C MET A 1 -3.229 -25.055 -10.012 1.00 0.00 C ATOM 4 O MET A 1 -3.642 -24.719 -11.117 1.00 0.00 O ATOM 5 CB MET A 1 -3.886 -27.480 -9.655 1.00 0.00 C ATOM 6 CG MET A 1 -2.460 -27.997 -9.435 1.00 0.00 C ATOM 7 SD MET A 1 -2.205 -29.756 -9.795 1.00 0.00 S ATOM 8 CE MET A 1 -2.348 -29.769 -11.604 1.00 0.00 C ATOM 0 H1 MET A 1 -6.065 -26.356 -8.838 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.599 -24.726 -8.731 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.737 -25.471 -10.250 1.00 0.00 H new ATOM 0 HA MET A 1 -3.707 -25.986 -8.152 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.589 -28.118 -9.118 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.137 -27.550 -10.714 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.781 -27.414 -10.057 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.181 -27.812 -8.398 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.213 -30.786 -11.972 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.334 -29.406 -11.894 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.583 -29.123 -12.034 1.00 0.00 H new ATOM 20 N ALA A 2 -2.053 -24.680 -9.508 1.00 0.00 N ATOM 21 CA ALA A 2 -1.083 -23.823 -10.180 1.00 0.00 C ATOM 22 C ALA A 2 0.337 -24.284 -9.831 1.00 0.00 C ATOM 23 O ALA A 2 0.516 -25.100 -8.923 1.00 0.00 O ATOM 24 CB ALA A 2 -1.309 -22.376 -9.735 1.00 0.00 C ATOM 0 H ALA A 2 -1.740 -24.978 -8.584 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.208 -23.886 -11.261 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.589 -21.726 -10.232 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -2.320 -22.067 -10.001 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.179 -22.303 -8.655 1.00 0.00 H new ATOM 30 N ALA A 3 1.334 -23.785 -10.570 1.00 0.00 N ATOM 31 CA ALA A 3 2.743 -24.012 -10.268 1.00 0.00 C ATOM 32 C ALA A 3 3.112 -23.484 -8.876 1.00 0.00 C ATOM 33 O ALA A 3 2.524 -22.510 -8.412 1.00 0.00 O ATOM 34 CB ALA A 3 3.606 -23.342 -11.346 1.00 0.00 C ATOM 0 H ALA A 3 1.180 -23.210 -11.398 1.00 0.00 H new ATOM 0 HA ALA A 3 2.930 -25.086 -10.266 1.00 0.00 H new ATOM 0 HB1 ALA A 3 4.660 -23.509 -11.124 1.00 0.00 H new ATOM 0 HB2 ALA A 3 3.368 -23.769 -12.320 1.00 0.00 H new ATOM 0 HB3 ALA A 3 3.404 -22.271 -11.360 1.00 0.00 H new ATOM 40 N LYS A 4 4.139 -24.083 -8.260 1.00 0.00 N ATOM 41 CA LYS A 4 4.667 -23.629 -6.971 1.00 0.00 C ATOM 42 C LYS A 4 5.413 -22.294 -7.073 1.00 0.00 C ATOM 43 O LYS A 4 5.383 -21.521 -6.129 1.00 0.00 O ATOM 44 CB LYS A 4 5.567 -24.707 -6.333 1.00 0.00 C ATOM 45 CG LYS A 4 6.721 -25.181 -7.238 1.00 0.00 C ATOM 46 CD LYS A 4 7.934 -25.707 -6.460 1.00 0.00 C ATOM 47 CE LYS A 4 9.046 -26.029 -7.466 1.00 0.00 C ATOM 48 NZ LYS A 4 10.285 -26.507 -6.812 1.00 0.00 N ATOM 0 H LYS A 4 4.625 -24.894 -8.642 1.00 0.00 H new ATOM 0 HA LYS A 4 3.806 -23.462 -6.324 1.00 0.00 H new ATOM 0 HB2 LYS A 4 5.985 -24.314 -5.406 1.00 0.00 H new ATOM 0 HB3 LYS A 4 4.952 -25.567 -6.066 1.00 0.00 H new ATOM 0 HG2 LYS A 4 6.355 -25.967 -7.898 1.00 0.00 H new ATOM 0 HG3 LYS A 4 7.038 -24.353 -7.873 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.276 -24.963 -5.741 1.00 0.00 H new ATOM 0 HD3 LYS A 4 7.665 -26.598 -5.893 1.00 0.00 H new ATOM 0 HE2 LYS A 4 8.691 -26.788 -8.163 1.00 0.00 H new ATOM 0 HE3 LYS A 4 9.270 -25.138 -8.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 10.905 -26.946 -7.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 10.777 -25.704 -6.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 10.044 -27.208 -6.082 1.00 0.00 H new ATOM 62 N PHE A 5 6.071 -22.044 -8.214 1.00 0.00 N ATOM 63 CA PHE A 5 7.091 -21.012 -8.409 1.00 0.00 C ATOM 64 C PHE A 5 8.261 -21.164 -7.421 1.00 0.00 C ATOM 65 O PHE A 5 8.199 -21.903 -6.439 1.00 0.00 O ATOM 66 CB PHE A 5 6.460 -19.605 -8.416 1.00 0.00 C ATOM 67 CG PHE A 5 5.400 -19.398 -9.483 1.00 0.00 C ATOM 68 CD1 PHE A 5 4.077 -19.813 -9.248 1.00 0.00 C ATOM 69 CD2 PHE A 5 5.727 -18.793 -10.709 1.00 0.00 C ATOM 70 CE1 PHE A 5 3.097 -19.657 -10.241 1.00 0.00 C ATOM 71 CE2 PHE A 5 4.738 -18.617 -11.692 1.00 0.00 C ATOM 72 CZ PHE A 5 3.424 -19.053 -11.464 1.00 0.00 C ATOM 0 H PHE A 5 5.896 -22.582 -9.063 1.00 0.00 H new ATOM 0 HA PHE A 5 7.533 -21.151 -9.395 1.00 0.00 H new ATOM 0 HB2 PHE A 5 6.016 -19.414 -7.439 1.00 0.00 H new ATOM 0 HB3 PHE A 5 7.249 -18.867 -8.557 1.00 0.00 H new ATOM 0 HD1 PHE A 5 3.813 -20.254 -8.298 1.00 0.00 H new ATOM 0 HD2 PHE A 5 6.738 -18.463 -10.896 1.00 0.00 H new ATOM 0 HE1 PHE A 5 2.089 -20.003 -10.063 1.00 0.00 H new ATOM 0 HE2 PHE A 5 4.991 -18.143 -12.629 1.00 0.00 H new ATOM 0 HZ PHE A 5 2.669 -18.924 -12.225 1.00 0.00 H new ATOM 82 N GLU A 6 9.392 -20.530 -7.736 1.00 0.00 N ATOM 83 CA GLU A 6 10.593 -20.563 -6.908 1.00 0.00 C ATOM 84 C GLU A 6 11.443 -19.339 -7.250 1.00 0.00 C ATOM 85 O GLU A 6 11.348 -18.806 -8.356 1.00 0.00 O ATOM 86 CB GLU A 6 11.362 -21.873 -7.159 1.00 0.00 C ATOM 87 CG GLU A 6 12.309 -22.231 -6.004 1.00 0.00 C ATOM 88 CD GLU A 6 12.817 -23.676 -6.122 1.00 0.00 C ATOM 89 OE1 GLU A 6 11.995 -24.609 -5.902 1.00 0.00 O ATOM 90 OE2 GLU A 6 13.997 -23.856 -6.483 1.00 0.00 O ATOM 0 H GLU A 6 9.498 -19.973 -8.584 1.00 0.00 H new ATOM 0 HA GLU A 6 10.335 -20.532 -5.849 1.00 0.00 H new ATOM 0 HB2 GLU A 6 10.650 -22.686 -7.306 1.00 0.00 H new ATOM 0 HB3 GLU A 6 11.937 -21.782 -8.081 1.00 0.00 H new ATOM 0 HG2 GLU A 6 13.156 -21.545 -6.000 1.00 0.00 H new ATOM 0 HG3 GLU A 6 11.791 -22.102 -5.054 1.00 0.00 H new ATOM 97 N VAL A 7 12.199 -18.835 -6.281 1.00 0.00 N ATOM 98 CA VAL A 7 13.076 -17.682 -6.432 1.00 0.00 C ATOM 99 C VAL A 7 14.008 -17.825 -7.636 1.00 0.00 C ATOM 100 O VAL A 7 14.590 -18.875 -7.881 1.00 0.00 O ATOM 101 CB VAL A 7 13.818 -17.413 -5.105 1.00 0.00 C ATOM 102 CG1 VAL A 7 12.784 -17.135 -4.004 1.00 0.00 C ATOM 103 CG2 VAL A 7 14.719 -18.561 -4.634 1.00 0.00 C ATOM 0 H VAL A 7 12.218 -19.230 -5.341 1.00 0.00 H new ATOM 0 HA VAL A 7 12.472 -16.801 -6.650 1.00 0.00 H new ATOM 0 HB VAL A 7 14.469 -16.560 -5.294 1.00 0.00 H new ATOM 0 HG11 VAL A 7 13.298 -16.944 -3.062 1.00 0.00 H new ATOM 0 HG12 VAL A 7 12.188 -16.264 -4.276 1.00 0.00 H new ATOM 0 HG13 VAL A 7 12.131 -18.000 -3.892 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.200 -18.285 -3.696 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.117 -19.457 -4.483 1.00 0.00 H new ATOM 0 HG23 VAL A 7 15.481 -18.758 -5.388 1.00 0.00 H new ATOM 113 N GLY A 8 14.136 -16.742 -8.395 1.00 0.00 N ATOM 114 CA GLY A 8 14.975 -16.680 -9.579 1.00 0.00 C ATOM 115 C GLY A 8 14.310 -17.237 -10.839 1.00 0.00 C ATOM 116 O GLY A 8 14.841 -16.996 -11.924 1.00 0.00 O ATOM 0 H GLY A 8 13.649 -15.868 -8.198 1.00 0.00 H new ATOM 0 HA2 GLY A 8 15.258 -15.643 -9.758 1.00 0.00 H new ATOM 0 HA3 GLY A 8 15.895 -17.234 -9.390 1.00 0.00 H new ATOM 120 N SER A 9 13.148 -17.894 -10.738 1.00 0.00 N ATOM 121 CA SER A 9 12.340 -18.221 -11.908 1.00 0.00 C ATOM 122 C SER A 9 11.821 -16.945 -12.578 1.00 0.00 C ATOM 123 O SER A 9 11.763 -15.883 -11.948 1.00 0.00 O ATOM 124 CB SER A 9 11.172 -19.132 -11.514 1.00 0.00 C ATOM 125 OG SER A 9 11.611 -20.237 -10.756 1.00 0.00 O ATOM 0 H SER A 9 12.750 -18.208 -9.853 1.00 0.00 H new ATOM 0 HA SER A 9 12.969 -18.753 -12.622 1.00 0.00 H new ATOM 0 HB2 SER A 9 10.443 -18.562 -10.939 1.00 0.00 H new ATOM 0 HB3 SER A 9 10.665 -19.484 -12.412 1.00 0.00 H new ATOM 0 HG SER A 9 11.634 -19.994 -9.807 1.00 0.00 H new ATOM 131 N VAL A 10 11.369 -17.060 -13.829 1.00 0.00 N ATOM 132 CA VAL A 10 10.858 -15.949 -14.616 1.00 0.00 C ATOM 133 C VAL A 10 9.632 -16.461 -15.358 1.00 0.00 C ATOM 134 O VAL A 10 9.683 -17.501 -16.012 1.00 0.00 O ATOM 135 CB VAL A 10 11.934 -15.406 -15.584 1.00 0.00 C ATOM 136 CG1 VAL A 10 11.432 -14.159 -16.328 1.00 0.00 C ATOM 137 CG2 VAL A 10 13.236 -15.015 -14.870 1.00 0.00 C ATOM 0 H VAL A 10 11.350 -17.949 -14.328 1.00 0.00 H new ATOM 0 HA VAL A 10 10.587 -15.110 -13.975 1.00 0.00 H new ATOM 0 HB VAL A 10 12.134 -16.223 -16.277 1.00 0.00 H new ATOM 0 HG11 VAL A 10 12.210 -13.799 -17.002 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.542 -14.413 -16.904 1.00 0.00 H new ATOM 0 HG13 VAL A 10 11.187 -13.379 -15.607 1.00 0.00 H new ATOM 0 HG21 VAL A 10 13.953 -14.641 -15.600 1.00 0.00 H new ATOM 0 HG22 VAL A 10 13.028 -14.238 -14.135 1.00 0.00 H new ATOM 0 HG23 VAL A 10 13.652 -15.888 -14.367 1.00 0.00 H new ATOM 147 N TYR A 11 8.531 -15.724 -15.242 1.00 0.00 N ATOM 148 CA TYR A 11 7.256 -16.019 -15.884 1.00 0.00 C ATOM 149 C TYR A 11 6.624 -14.706 -16.358 1.00 0.00 C ATOM 150 O TYR A 11 7.238 -13.644 -16.250 1.00 0.00 O ATOM 151 CB TYR A 11 6.368 -16.764 -14.876 1.00 0.00 C ATOM 152 CG TYR A 11 6.778 -18.205 -14.623 1.00 0.00 C ATOM 153 CD1 TYR A 11 6.291 -19.236 -15.452 1.00 0.00 C ATOM 154 CD2 TYR A 11 7.622 -18.523 -13.541 1.00 0.00 C ATOM 155 CE1 TYR A 11 6.633 -20.576 -15.200 1.00 0.00 C ATOM 156 CE2 TYR A 11 7.950 -19.863 -13.269 1.00 0.00 C ATOM 157 CZ TYR A 11 7.458 -20.893 -14.100 1.00 0.00 C ATOM 158 OH TYR A 11 7.772 -22.189 -13.826 1.00 0.00 O ATOM 0 H TYR A 11 8.502 -14.875 -14.678 1.00 0.00 H new ATOM 0 HA TYR A 11 7.385 -16.657 -16.758 1.00 0.00 H new ATOM 0 HB2 TYR A 11 6.382 -16.224 -13.929 1.00 0.00 H new ATOM 0 HB3 TYR A 11 5.339 -16.750 -15.236 1.00 0.00 H new ATOM 0 HD1 TYR A 11 5.650 -18.994 -16.287 1.00 0.00 H new ATOM 0 HD2 TYR A 11 8.019 -17.735 -12.918 1.00 0.00 H new ATOM 0 HE1 TYR A 11 6.266 -21.360 -15.846 1.00 0.00 H new ATOM 0 HE2 TYR A 11 8.578 -20.104 -12.424 1.00 0.00 H new ATOM 0 HH TYR A 11 8.349 -22.225 -13.035 1.00 0.00 H new ATOM 168 N THR A 12 5.405 -14.763 -16.884 1.00 0.00 N ATOM 169 CA THR A 12 4.644 -13.592 -17.296 1.00 0.00 C ATOM 170 C THR A 12 3.337 -13.550 -16.505 1.00 0.00 C ATOM 171 O THR A 12 2.792 -14.590 -16.141 1.00 0.00 O ATOM 172 CB THR A 12 4.431 -13.652 -18.817 1.00 0.00 C ATOM 173 OG1 THR A 12 5.678 -13.811 -19.481 1.00 0.00 O ATOM 174 CG2 THR A 12 3.795 -12.385 -19.381 1.00 0.00 C ATOM 0 H THR A 12 4.910 -15.642 -17.038 1.00 0.00 H new ATOM 0 HA THR A 12 5.178 -12.667 -17.082 1.00 0.00 H new ATOM 0 HB THR A 12 3.763 -14.497 -18.987 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.527 -14.178 -20.377 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.671 -12.489 -20.459 1.00 0.00 H new ATOM 0 HG22 THR A 12 2.821 -12.229 -18.917 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.438 -11.530 -19.171 1.00 0.00 H new ATOM 182 N GLY A 13 2.849 -12.345 -16.223 1.00 0.00 N ATOM 183 CA GLY A 13 1.619 -12.098 -15.489 1.00 0.00 C ATOM 184 C GLY A 13 1.017 -10.762 -15.907 1.00 0.00 C ATOM 185 O GLY A 13 1.554 -10.093 -16.792 1.00 0.00 O ATOM 0 H GLY A 13 3.318 -11.486 -16.511 1.00 0.00 H new ATOM 0 HA2 GLY A 13 0.907 -12.901 -15.678 1.00 0.00 H new ATOM 0 HA3 GLY A 13 1.820 -12.095 -14.418 1.00 0.00 H new ATOM 189 N LYS A 14 -0.100 -10.367 -15.291 1.00 0.00 N ATOM 190 CA LYS A 14 -0.764 -9.094 -15.573 1.00 0.00 C ATOM 191 C LYS A 14 -0.863 -8.256 -14.311 1.00 0.00 C ATOM 192 O LYS A 14 -1.170 -8.779 -13.242 1.00 0.00 O ATOM 193 CB LYS A 14 -2.144 -9.330 -16.198 1.00 0.00 C ATOM 194 CG LYS A 14 -2.013 -9.652 -17.692 1.00 0.00 C ATOM 195 CD LYS A 14 -3.386 -9.830 -18.348 1.00 0.00 C ATOM 196 CE LYS A 14 -3.210 -10.180 -19.831 1.00 0.00 C ATOM 197 NZ LYS A 14 -4.510 -10.388 -20.508 1.00 0.00 N ATOM 0 H LYS A 14 -0.571 -10.925 -14.579 1.00 0.00 H new ATOM 0 HA LYS A 14 -0.164 -8.541 -16.296 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.645 -10.152 -15.686 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -2.766 -8.445 -16.065 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.470 -8.850 -18.192 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.426 -10.562 -17.820 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -3.942 -10.619 -17.842 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -3.969 -8.915 -18.247 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -2.665 -9.379 -20.331 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -2.605 -11.082 -19.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -4.347 -10.622 -21.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -5.020 -11.169 -20.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -5.078 -9.519 -20.444 1.00 0.00 H new ATOM 211 N VAL A 15 -0.575 -6.972 -14.440 1.00 0.00 N ATOM 212 CA VAL A 15 -0.561 -6.030 -13.342 1.00 0.00 C ATOM 213 C VAL A 15 -2.003 -5.808 -12.894 1.00 0.00 C ATOM 214 O VAL A 15 -2.854 -5.424 -13.699 1.00 0.00 O ATOM 215 CB VAL A 15 0.125 -4.726 -13.781 1.00 0.00 C ATOM 216 CG1 VAL A 15 0.452 -3.864 -12.554 1.00 0.00 C ATOM 217 CG2 VAL A 15 1.425 -4.954 -14.569 1.00 0.00 C ATOM 0 H VAL A 15 -0.339 -6.548 -15.337 1.00 0.00 H new ATOM 0 HA VAL A 15 0.011 -6.415 -12.498 1.00 0.00 H new ATOM 0 HB VAL A 15 -0.582 -4.224 -14.442 1.00 0.00 H new ATOM 0 HG11 VAL A 15 0.938 -2.943 -12.876 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -0.469 -3.623 -12.023 1.00 0.00 H new ATOM 0 HG13 VAL A 15 1.120 -4.414 -11.891 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.856 -3.992 -14.847 1.00 0.00 H new ATOM 0 HG22 VAL A 15 2.134 -5.504 -13.950 1.00 0.00 H new ATOM 0 HG23 VAL A 15 1.208 -5.528 -15.470 1.00 0.00 H new ATOM 227 N THR A 16 -2.260 -6.015 -11.608 1.00 0.00 N ATOM 228 CA THR A 16 -3.587 -6.033 -11.009 1.00 0.00 C ATOM 229 C THR A 16 -3.807 -4.849 -10.070 1.00 0.00 C ATOM 230 O THR A 16 -4.944 -4.591 -9.693 1.00 0.00 O ATOM 231 CB THR A 16 -3.806 -7.382 -10.299 1.00 0.00 C ATOM 232 OG1 THR A 16 -2.608 -7.844 -9.693 1.00 0.00 O ATOM 233 CG2 THR A 16 -4.264 -8.439 -11.307 1.00 0.00 C ATOM 0 H THR A 16 -1.519 -6.182 -10.927 1.00 0.00 H new ATOM 0 HA THR A 16 -4.330 -5.928 -11.799 1.00 0.00 H new ATOM 0 HB THR A 16 -4.566 -7.227 -9.533 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.776 -8.701 -9.248 1.00 0.00 H new ATOM 0 HG21 THR A 16 -4.416 -9.389 -10.794 1.00 0.00 H new ATOM 0 HG22 THR A 16 -5.200 -8.121 -11.767 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.503 -8.560 -12.078 1.00 0.00 H new ATOM 241 N GLY A 17 -2.772 -4.071 -9.752 1.00 0.00 N ATOM 242 CA GLY A 17 -2.929 -2.805 -9.058 1.00 0.00 C ATOM 243 C GLY A 17 -1.594 -2.098 -8.927 1.00 0.00 C ATOM 244 O GLY A 17 -0.543 -2.692 -9.173 1.00 0.00 O ATOM 0 H GLY A 17 -1.804 -4.306 -9.971 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -3.630 -2.171 -9.601 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -3.354 -2.977 -8.069 1.00 0.00 H new ATOM 248 N LEU A 18 -1.643 -0.834 -8.507 1.00 0.00 N ATOM 249 CA LEU A 18 -0.487 -0.036 -8.115 1.00 0.00 C ATOM 250 C LEU A 18 -0.708 0.458 -6.686 1.00 0.00 C ATOM 251 O LEU A 18 -1.836 0.478 -6.195 1.00 0.00 O ATOM 252 CB LEU A 18 -0.323 1.179 -9.047 1.00 0.00 C ATOM 253 CG LEU A 18 -0.068 0.871 -10.535 1.00 0.00 C ATOM 254 CD1 LEU A 18 0.089 2.171 -11.328 1.00 0.00 C ATOM 255 CD2 LEU A 18 1.170 0.005 -10.776 1.00 0.00 C ATOM 0 H LEU A 18 -2.521 -0.322 -8.428 1.00 0.00 H new ATOM 0 HA LEU A 18 0.413 -0.648 -8.181 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.223 1.790 -8.974 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.504 1.785 -8.677 1.00 0.00 H new ATOM 0 HG LEU A 18 -0.938 0.308 -10.873 1.00 0.00 H new ATOM 0 HD11 LEU A 18 0.269 1.938 -12.377 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.821 2.764 -11.239 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.932 2.739 -10.933 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.288 -0.172 -11.845 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.053 0.518 -10.393 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.053 -0.949 -10.261 1.00 0.00 H new ATOM 267 N GLN A 19 0.388 0.820 -6.024 1.00 0.00 N ATOM 268 CA GLN A 19 0.433 1.441 -4.711 1.00 0.00 C ATOM 269 C GLN A 19 1.657 2.359 -4.697 1.00 0.00 C ATOM 270 O GLN A 19 2.631 2.111 -5.419 1.00 0.00 O ATOM 271 CB GLN A 19 0.604 0.391 -3.596 1.00 0.00 C ATOM 272 CG GLN A 19 -0.473 -0.703 -3.549 1.00 0.00 C ATOM 273 CD GLN A 19 -0.253 -1.640 -2.366 1.00 0.00 C ATOM 274 OE1 GLN A 19 -0.964 -1.605 -1.367 1.00 0.00 O ATOM 275 NE2 GLN A 19 0.750 -2.503 -2.433 1.00 0.00 N ATOM 0 H GLN A 19 1.319 0.678 -6.415 1.00 0.00 H new ATOM 0 HA GLN A 19 -0.498 1.979 -4.530 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.577 -0.086 -3.716 1.00 0.00 H new ATOM 0 HB3 GLN A 19 0.617 0.905 -2.635 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -1.459 -0.244 -3.475 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -0.456 -1.274 -4.477 1.00 0.00 H new ATOM 0 HE21 GLN A 19 1.342 -2.533 -3.263 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.930 -3.137 -1.655 1.00 0.00 H new ATOM 284 N ALA A 20 1.684 3.332 -3.783 1.00 0.00 N ATOM 285 CA ALA A 20 2.816 4.245 -3.601 1.00 0.00 C ATOM 286 C ALA A 20 4.144 3.548 -3.243 1.00 0.00 C ATOM 287 O ALA A 20 5.179 4.205 -3.178 1.00 0.00 O ATOM 288 CB ALA A 20 2.452 5.278 -2.531 1.00 0.00 C ATOM 0 H ALA A 20 0.912 3.510 -3.141 1.00 0.00 H new ATOM 0 HA ALA A 20 2.994 4.723 -4.564 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.288 5.963 -2.387 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.574 5.839 -2.851 1.00 0.00 H new ATOM 0 HB3 ALA A 20 2.235 4.768 -1.592 1.00 0.00 H new ATOM 294 N TYR A 21 4.156 2.229 -3.011 1.00 0.00 N ATOM 295 CA TYR A 21 5.351 1.451 -2.674 1.00 0.00 C ATOM 296 C TYR A 21 5.526 0.166 -3.500 1.00 0.00 C ATOM 297 O TYR A 21 6.479 -0.578 -3.255 1.00 0.00 O ATOM 298 CB TYR A 21 5.349 1.159 -1.168 1.00 0.00 C ATOM 299 CG TYR A 21 4.289 0.174 -0.698 1.00 0.00 C ATOM 300 CD1 TYR A 21 3.008 0.626 -0.323 1.00 0.00 C ATOM 301 CD2 TYR A 21 4.590 -1.199 -0.624 1.00 0.00 C ATOM 302 CE1 TYR A 21 2.037 -0.285 0.133 1.00 0.00 C ATOM 303 CE2 TYR A 21 3.624 -2.117 -0.175 1.00 0.00 C ATOM 304 CZ TYR A 21 2.345 -1.662 0.211 1.00 0.00 C ATOM 305 OH TYR A 21 1.418 -2.561 0.640 1.00 0.00 O ATOM 0 H TYR A 21 3.311 1.660 -3.054 1.00 0.00 H new ATOM 0 HA TYR A 21 6.216 2.060 -2.938 1.00 0.00 H new ATOM 0 HB2 TYR A 21 6.329 0.773 -0.888 1.00 0.00 H new ATOM 0 HB3 TYR A 21 5.211 2.098 -0.633 1.00 0.00 H new ATOM 0 HD1 TYR A 21 2.770 1.678 -0.386 1.00 0.00 H new ATOM 0 HD2 TYR A 21 5.569 -1.550 -0.914 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.058 0.068 0.423 1.00 0.00 H new ATOM 0 HE2 TYR A 21 3.861 -3.170 -0.126 1.00 0.00 H new ATOM 0 HH TYR A 21 0.571 -2.405 0.173 1.00 0.00 H new ATOM 315 N GLY A 22 4.683 -0.102 -4.499 1.00 0.00 N ATOM 316 CA GLY A 22 4.839 -1.270 -5.354 1.00 0.00 C ATOM 317 C GLY A 22 3.603 -1.548 -6.202 1.00 0.00 C ATOM 318 O GLY A 22 2.613 -0.835 -6.096 1.00 0.00 O ATOM 0 H GLY A 22 3.880 0.482 -4.733 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.698 -1.124 -6.009 1.00 0.00 H new ATOM 0 HA3 GLY A 22 5.054 -2.142 -4.736 1.00 0.00 H new ATOM 322 N ALA A 23 3.659 -2.584 -7.038 1.00 0.00 N ATOM 323 CA ALA A 23 2.574 -2.966 -7.935 1.00 0.00 C ATOM 324 C ALA A 23 2.251 -4.442 -7.752 1.00 0.00 C ATOM 325 O ALA A 23 3.148 -5.263 -7.557 1.00 0.00 O ATOM 326 CB ALA A 23 2.983 -2.695 -9.382 1.00 0.00 C ATOM 0 H ALA A 23 4.475 -3.191 -7.111 1.00 0.00 H new ATOM 0 HA ALA A 23 1.687 -2.377 -7.700 1.00 0.00 H new ATOM 0 HB1 ALA A 23 2.170 -2.981 -10.050 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.198 -1.634 -9.507 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.873 -3.276 -9.624 1.00 0.00 H new ATOM 332 N PHE A 24 0.969 -4.784 -7.786 1.00 0.00 N ATOM 333 CA PHE A 24 0.534 -6.168 -7.758 1.00 0.00 C ATOM 334 C PHE A 24 0.549 -6.720 -9.178 1.00 0.00 C ATOM 335 O PHE A 24 0.132 -6.031 -10.107 1.00 0.00 O ATOM 336 CB PHE A 24 -0.873 -6.259 -7.160 1.00 0.00 C ATOM 337 CG PHE A 24 -0.976 -5.798 -5.721 1.00 0.00 C ATOM 338 CD1 PHE A 24 -0.184 -6.402 -4.727 1.00 0.00 C ATOM 339 CD2 PHE A 24 -1.884 -4.782 -5.369 1.00 0.00 C ATOM 340 CE1 PHE A 24 -0.310 -6.003 -3.386 1.00 0.00 C ATOM 341 CE2 PHE A 24 -2.011 -4.385 -4.028 1.00 0.00 C ATOM 342 CZ PHE A 24 -1.232 -5.003 -3.035 1.00 0.00 C ATOM 0 H PHE A 24 0.206 -4.109 -7.834 1.00 0.00 H new ATOM 0 HA PHE A 24 1.209 -6.757 -7.137 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -1.552 -5.662 -7.769 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.214 -7.292 -7.222 1.00 0.00 H new ATOM 0 HD1 PHE A 24 0.522 -7.174 -4.996 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -2.484 -4.307 -6.131 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.302 -6.465 -2.625 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.708 -3.604 -3.760 1.00 0.00 H new ATOM 0 HZ PHE A 24 -1.342 -4.709 -2.002 1.00 0.00 H new ATOM 352 N VAL A 25 0.986 -7.966 -9.345 1.00 0.00 N ATOM 353 CA VAL A 25 0.967 -8.684 -10.612 1.00 0.00 C ATOM 354 C VAL A 25 0.437 -10.080 -10.309 1.00 0.00 C ATOM 355 O VAL A 25 0.996 -10.799 -9.475 1.00 0.00 O ATOM 356 CB VAL A 25 2.369 -8.706 -11.256 1.00 0.00 C ATOM 357 CG1 VAL A 25 2.317 -9.316 -12.662 1.00 0.00 C ATOM 358 CG2 VAL A 25 2.997 -7.308 -11.355 1.00 0.00 C ATOM 0 H VAL A 25 1.374 -8.517 -8.579 1.00 0.00 H new ATOM 0 HA VAL A 25 0.324 -8.193 -11.342 1.00 0.00 H new ATOM 0 HB VAL A 25 2.989 -9.318 -10.601 1.00 0.00 H new ATOM 0 HG11 VAL A 25 3.318 -9.320 -13.094 1.00 0.00 H new ATOM 0 HG12 VAL A 25 1.944 -10.338 -12.601 1.00 0.00 H new ATOM 0 HG13 VAL A 25 1.652 -8.724 -13.291 1.00 0.00 H new ATOM 0 HG21 VAL A 25 3.982 -7.383 -11.816 1.00 0.00 H new ATOM 0 HG22 VAL A 25 2.360 -6.665 -11.963 1.00 0.00 H new ATOM 0 HG23 VAL A 25 3.095 -6.882 -10.357 1.00 0.00 H new ATOM 368 N ALA A 26 -0.692 -10.429 -10.920 1.00 0.00 N ATOM 369 CA ALA A 26 -1.236 -11.772 -10.891 1.00 0.00 C ATOM 370 C ALA A 26 -0.564 -12.654 -11.944 1.00 0.00 C ATOM 371 O ALA A 26 -0.175 -12.190 -13.016 1.00 0.00 O ATOM 372 CB ALA A 26 -2.749 -11.703 -11.071 1.00 0.00 C ATOM 0 H ALA A 26 -1.259 -9.772 -11.456 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.029 -12.234 -9.925 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.164 -12.711 -11.050 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.185 -11.114 -10.264 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.981 -11.235 -12.028 1.00 0.00 H new ATOM 378 N LEU A 27 -0.468 -13.943 -11.627 1.00 0.00 N ATOM 379 CA LEU A 27 0.232 -14.964 -12.409 1.00 0.00 C ATOM 380 C LEU A 27 -0.737 -16.057 -12.861 1.00 0.00 C ATOM 381 O LEU A 27 -0.524 -16.673 -13.902 1.00 0.00 O ATOM 382 CB LEU A 27 1.328 -15.604 -11.534 1.00 0.00 C ATOM 383 CG LEU A 27 2.583 -14.732 -11.349 1.00 0.00 C ATOM 384 CD1 LEU A 27 3.421 -15.269 -10.183 1.00 0.00 C ATOM 385 CD2 LEU A 27 3.448 -14.717 -12.612 1.00 0.00 C ATOM 0 H LEU A 27 -0.894 -14.323 -10.782 1.00 0.00 H new ATOM 0 HA LEU A 27 0.669 -14.492 -13.289 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.908 -15.828 -10.553 1.00 0.00 H new ATOM 0 HB3 LEU A 27 1.623 -16.554 -11.979 1.00 0.00 H new ATOM 0 HG LEU A 27 2.251 -13.715 -11.142 1.00 0.00 H new ATOM 0 HD11 LEU A 27 4.308 -14.648 -10.056 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.829 -15.246 -9.268 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.723 -16.295 -10.394 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.325 -14.092 -12.445 1.00 0.00 H new ATOM 0 HD22 LEU A 27 3.766 -15.733 -12.847 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.870 -14.316 -13.444 1.00 0.00 H new ATOM 397 N ASP A 28 -1.777 -16.308 -12.067 1.00 0.00 N ATOM 398 CA ASP A 28 -2.807 -17.318 -12.273 1.00 0.00 C ATOM 399 C ASP A 28 -4.033 -16.880 -11.466 1.00 0.00 C ATOM 400 O ASP A 28 -3.911 -16.020 -10.586 1.00 0.00 O ATOM 401 CB ASP A 28 -2.292 -18.686 -11.799 1.00 0.00 C ATOM 402 CG ASP A 28 -3.336 -19.789 -11.959 1.00 0.00 C ATOM 403 OD1 ASP A 28 -3.511 -20.243 -13.111 1.00 0.00 O ATOM 404 OD2 ASP A 28 -3.961 -20.128 -10.932 1.00 0.00 O ATOM 0 H ASP A 28 -1.930 -15.777 -11.210 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.068 -17.414 -13.327 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.399 -18.951 -12.365 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -1.998 -18.617 -10.752 1.00 0.00 H new ATOM 409 N GLU A 29 -5.207 -17.438 -11.754 1.00 0.00 N ATOM 410 CA GLU A 29 -6.423 -17.273 -10.956 1.00 0.00 C ATOM 411 C GLU A 29 -6.229 -17.550 -9.451 1.00 0.00 C ATOM 412 O GLU A 29 -6.976 -17.001 -8.638 1.00 0.00 O ATOM 413 CB GLU A 29 -7.531 -18.167 -11.536 1.00 0.00 C ATOM 414 CG GLU A 29 -7.983 -17.710 -12.931 1.00 0.00 C ATOM 415 CD GLU A 29 -9.137 -18.564 -13.472 1.00 0.00 C ATOM 416 OE1 GLU A 29 -10.302 -18.216 -13.169 1.00 0.00 O ATOM 417 OE2 GLU A 29 -8.860 -19.535 -14.212 1.00 0.00 O ATOM 0 H GLU A 29 -5.344 -18.034 -12.571 1.00 0.00 H new ATOM 0 HA GLU A 29 -6.706 -16.222 -11.020 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -7.172 -19.195 -11.592 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -8.387 -18.164 -10.861 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -8.295 -16.666 -12.887 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -7.140 -17.762 -13.620 1.00 0.00 H new ATOM 424 N GLU A 30 -5.194 -18.305 -9.068 1.00 0.00 N ATOM 425 CA GLU A 30 -4.917 -18.699 -7.688 1.00 0.00 C ATOM 426 C GLU A 30 -3.521 -18.246 -7.230 1.00 0.00 C ATOM 427 O GLU A 30 -3.131 -18.553 -6.103 1.00 0.00 O ATOM 428 CB GLU A 30 -5.084 -20.226 -7.525 1.00 0.00 C ATOM 429 CG GLU A 30 -6.485 -20.762 -7.871 1.00 0.00 C ATOM 430 CD GLU A 30 -6.647 -22.263 -7.526 1.00 0.00 C ATOM 431 OE1 GLU A 30 -6.079 -23.156 -8.218 1.00 0.00 O ATOM 432 OE2 GLU A 30 -7.357 -22.565 -6.540 1.00 0.00 O ATOM 0 H GLU A 30 -4.508 -18.668 -9.730 1.00 0.00 H new ATOM 0 HA GLU A 30 -5.641 -18.196 -7.047 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -4.352 -20.727 -8.158 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.852 -20.495 -6.495 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -7.235 -20.185 -7.330 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.675 -20.614 -8.934 1.00 0.00 H new ATOM 439 N THR A 31 -2.764 -17.492 -8.043 1.00 0.00 N ATOM 440 CA THR A 31 -1.395 -17.097 -7.712 1.00 0.00 C ATOM 441 C THR A 31 -1.147 -15.657 -8.154 1.00 0.00 C ATOM 442 O THR A 31 -1.409 -15.276 -9.295 1.00 0.00 O ATOM 443 CB THR A 31 -0.382 -18.057 -8.366 1.00 0.00 C ATOM 444 OG1 THR A 31 -0.756 -19.407 -8.199 1.00 0.00 O ATOM 445 CG2 THR A 31 1.006 -17.884 -7.748 1.00 0.00 C ATOM 0 H THR A 31 -3.087 -17.142 -8.945 1.00 0.00 H new ATOM 0 HA THR A 31 -1.262 -17.155 -6.632 1.00 0.00 H new ATOM 0 HB THR A 31 -0.366 -17.809 -9.427 1.00 0.00 H new ATOM 0 HG1 THR A 31 -0.092 -19.986 -8.628 1.00 0.00 H new ATOM 0 HG21 THR A 31 1.705 -18.571 -8.225 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.346 -16.859 -7.898 1.00 0.00 H new ATOM 0 HG23 THR A 31 0.958 -18.098 -6.680 1.00 0.00 H new ATOM 453 N GLN A 32 -0.603 -14.831 -7.258 1.00 0.00 N ATOM 454 CA GLN A 32 -0.430 -13.393 -7.429 1.00 0.00 C ATOM 455 C GLN A 32 0.648 -12.919 -6.449 1.00 0.00 C ATOM 456 O GLN A 32 0.833 -13.527 -5.392 1.00 0.00 O ATOM 457 CB GLN A 32 -1.804 -12.732 -7.183 1.00 0.00 C ATOM 458 CG GLN A 32 -1.876 -11.200 -7.303 1.00 0.00 C ATOM 459 CD GLN A 32 -1.826 -10.494 -5.951 1.00 0.00 C ATOM 460 OE1 GLN A 32 -2.710 -10.645 -5.120 1.00 0.00 O ATOM 461 NE2 GLN A 32 -0.805 -9.690 -5.701 1.00 0.00 N ATOM 0 H GLN A 32 -0.258 -15.163 -6.357 1.00 0.00 H new ATOM 0 HA GLN A 32 -0.097 -13.121 -8.431 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -2.517 -13.160 -7.888 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -2.139 -13.009 -6.183 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -1.049 -10.850 -7.920 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -2.797 -10.924 -7.817 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -0.070 -9.567 -6.398 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -0.753 -9.193 -4.812 1.00 0.00 H new ATOM 470 N GLY A 33 1.372 -11.855 -6.808 1.00 0.00 N ATOM 471 CA GLY A 33 2.488 -11.343 -6.028 1.00 0.00 C ATOM 472 C GLY A 33 2.636 -9.832 -6.182 1.00 0.00 C ATOM 473 O GLY A 33 1.782 -9.171 -6.786 1.00 0.00 O ATOM 0 H GLY A 33 1.193 -11.323 -7.660 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.341 -11.589 -4.976 1.00 0.00 H new ATOM 0 HA3 GLY A 33 3.409 -11.833 -6.344 1.00 0.00 H new ATOM 477 N LEU A 34 3.709 -9.286 -5.606 1.00 0.00 N ATOM 478 CA LEU A 34 3.944 -7.856 -5.417 1.00 0.00 C ATOM 479 C LEU A 34 5.385 -7.557 -5.817 1.00 0.00 C ATOM 480 O LEU A 34 6.299 -8.202 -5.315 1.00 0.00 O ATOM 481 CB LEU A 34 3.696 -7.508 -3.933 1.00 0.00 C ATOM 482 CG LEU A 34 4.244 -6.147 -3.440 1.00 0.00 C ATOM 483 CD1 LEU A 34 3.572 -4.945 -4.108 1.00 0.00 C ATOM 484 CD2 LEU A 34 4.015 -6.019 -1.929 1.00 0.00 C ATOM 0 H LEU A 34 4.472 -9.857 -5.242 1.00 0.00 H new ATOM 0 HA LEU A 34 3.272 -7.256 -6.031 1.00 0.00 H new ATOM 0 HB2 LEU A 34 2.621 -7.528 -3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.136 -8.295 -3.320 1.00 0.00 H new ATOM 0 HG LEU A 34 5.303 -6.135 -3.699 1.00 0.00 H new ATOM 0 HD11 LEU A 34 4.003 -4.023 -3.717 1.00 0.00 H new ATOM 0 HD12 LEU A 34 3.731 -4.991 -5.185 1.00 0.00 H new ATOM 0 HD13 LEU A 34 2.503 -4.963 -3.898 1.00 0.00 H new ATOM 0 HD21 LEU A 34 4.401 -5.060 -1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.948 -6.079 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 34 4.533 -6.827 -1.413 1.00 0.00 H new ATOM 496 N VAL A 35 5.597 -6.587 -6.696 1.00 0.00 N ATOM 497 CA VAL A 35 6.905 -5.999 -6.952 1.00 0.00 C ATOM 498 C VAL A 35 6.985 -4.685 -6.179 1.00 0.00 C ATOM 499 O VAL A 35 6.109 -3.831 -6.324 1.00 0.00 O ATOM 500 CB VAL A 35 7.140 -5.882 -8.478 1.00 0.00 C ATOM 501 CG1 VAL A 35 5.975 -5.273 -9.273 1.00 0.00 C ATOM 502 CG2 VAL A 35 8.398 -5.073 -8.798 1.00 0.00 C ATOM 0 H VAL A 35 4.852 -6.180 -7.261 1.00 0.00 H new ATOM 0 HA VAL A 35 7.722 -6.626 -6.595 1.00 0.00 H new ATOM 0 HB VAL A 35 7.247 -6.920 -8.794 1.00 0.00 H new ATOM 0 HG11 VAL A 35 6.237 -5.234 -10.330 1.00 0.00 H new ATOM 0 HG12 VAL A 35 5.085 -5.888 -9.142 1.00 0.00 H new ATOM 0 HG13 VAL A 35 5.776 -4.264 -8.911 1.00 0.00 H new ATOM 0 HG21 VAL A 35 8.528 -5.014 -9.879 1.00 0.00 H new ATOM 0 HG22 VAL A 35 8.298 -4.068 -8.389 1.00 0.00 H new ATOM 0 HG23 VAL A 35 9.266 -5.560 -8.354 1.00 0.00 H new ATOM 512 N HIS A 36 8.017 -4.533 -5.349 1.00 0.00 N ATOM 513 CA HIS A 36 8.264 -3.292 -4.630 1.00 0.00 C ATOM 514 C HIS A 36 8.716 -2.219 -5.627 1.00 0.00 C ATOM 515 O HIS A 36 9.344 -2.529 -6.640 1.00 0.00 O ATOM 516 CB HIS A 36 9.319 -3.496 -3.537 1.00 0.00 C ATOM 517 CG HIS A 36 9.200 -4.795 -2.778 1.00 0.00 C ATOM 518 ND1 HIS A 36 10.172 -5.761 -2.766 1.00 0.00 N ATOM 519 CD2 HIS A 36 8.154 -5.251 -2.015 1.00 0.00 C ATOM 520 CE1 HIS A 36 9.730 -6.771 -2.005 1.00 0.00 C ATOM 521 NE2 HIS A 36 8.499 -6.518 -1.524 1.00 0.00 N ATOM 0 H HIS A 36 8.700 -5.266 -5.159 1.00 0.00 H new ATOM 0 HA HIS A 36 7.344 -2.969 -4.142 1.00 0.00 H new ATOM 0 HB2 HIS A 36 10.308 -3.447 -3.992 1.00 0.00 H new ATOM 0 HB3 HIS A 36 9.253 -2.670 -2.829 1.00 0.00 H new ATOM 0 HD1 HIS A 36 11.069 -5.719 -3.249 1.00 0.00 H new ATOM 0 HD2 HIS A 36 7.229 -4.727 -1.826 1.00 0.00 H new ATOM 0 HE1 HIS A 36 10.290 -7.672 -1.803 1.00 0.00 H new ATOM 529 N ILE A 37 8.418 -0.953 -5.335 1.00 0.00 N ATOM 530 CA ILE A 37 8.754 0.186 -6.188 1.00 0.00 C ATOM 531 C ILE A 37 10.239 0.238 -6.566 1.00 0.00 C ATOM 532 O ILE A 37 10.552 0.537 -7.714 1.00 0.00 O ATOM 533 CB ILE A 37 8.198 1.484 -5.564 1.00 0.00 C ATOM 534 CG1 ILE A 37 8.284 2.633 -6.578 1.00 0.00 C ATOM 535 CG2 ILE A 37 8.879 1.829 -4.225 1.00 0.00 C ATOM 536 CD1 ILE A 37 7.481 3.871 -6.156 1.00 0.00 C ATOM 0 H ILE A 37 7.927 -0.686 -4.482 1.00 0.00 H new ATOM 0 HA ILE A 37 8.261 0.061 -7.152 1.00 0.00 H new ATOM 0 HB ILE A 37 7.147 1.323 -5.324 1.00 0.00 H new ATOM 0 HG12 ILE A 37 9.329 2.914 -6.712 1.00 0.00 H new ATOM 0 HG13 ILE A 37 7.921 2.284 -7.545 1.00 0.00 H new ATOM 0 HG21 ILE A 37 8.453 2.750 -3.827 1.00 0.00 H new ATOM 0 HG22 ILE A 37 8.717 1.018 -3.515 1.00 0.00 H new ATOM 0 HG23 ILE A 37 9.949 1.964 -4.385 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.583 4.647 -6.915 1.00 0.00 H new ATOM 0 HD12 ILE A 37 6.430 3.604 -6.049 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.859 4.243 -5.204 1.00 0.00 H new ATOM 548 N SER A 38 11.152 -0.135 -5.670 1.00 0.00 N ATOM 549 CA SER A 38 12.584 -0.220 -5.947 1.00 0.00 C ATOM 550 C SER A 38 12.947 -1.286 -6.996 1.00 0.00 C ATOM 551 O SER A 38 13.977 -1.196 -7.668 1.00 0.00 O ATOM 552 CB SER A 38 13.308 -0.463 -4.616 1.00 0.00 C ATOM 553 OG SER A 38 12.626 -1.407 -3.802 1.00 0.00 O ATOM 0 H SER A 38 10.911 -0.391 -4.713 1.00 0.00 H new ATOM 0 HA SER A 38 12.907 0.721 -6.392 1.00 0.00 H new ATOM 0 HB2 SER A 38 14.319 -0.819 -4.813 1.00 0.00 H new ATOM 0 HB3 SER A 38 13.401 0.480 -4.077 1.00 0.00 H new ATOM 0 HG SER A 38 12.970 -2.306 -3.986 1.00 0.00 H new ATOM 559 N GLU A 39 12.102 -2.292 -7.184 1.00 0.00 N ATOM 560 CA GLU A 39 12.308 -3.392 -8.105 1.00 0.00 C ATOM 561 C GLU A 39 11.550 -3.177 -9.422 1.00 0.00 C ATOM 562 O GLU A 39 11.613 -4.046 -10.298 1.00 0.00 O ATOM 563 CB GLU A 39 11.892 -4.701 -7.414 1.00 0.00 C ATOM 564 CG GLU A 39 12.961 -5.315 -6.504 1.00 0.00 C ATOM 565 CD GLU A 39 13.088 -4.664 -5.125 1.00 0.00 C ATOM 566 OE1 GLU A 39 13.921 -3.727 -5.018 1.00 0.00 O ATOM 567 OE2 GLU A 39 12.499 -5.232 -4.177 1.00 0.00 O ATOM 0 H GLU A 39 11.220 -2.362 -6.676 1.00 0.00 H new ATOM 0 HA GLU A 39 13.364 -3.448 -8.369 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.995 -4.514 -6.823 1.00 0.00 H new ATOM 0 HB3 GLU A 39 11.624 -5.430 -8.179 1.00 0.00 H new ATOM 0 HG2 GLU A 39 12.738 -6.374 -6.370 1.00 0.00 H new ATOM 0 HG3 GLU A 39 13.925 -5.253 -7.009 1.00 0.00 H new ATOM 574 N VAL A 40 10.859 -2.044 -9.598 1.00 0.00 N ATOM 575 CA VAL A 40 10.169 -1.698 -10.839 1.00 0.00 C ATOM 576 C VAL A 40 11.154 -1.348 -11.960 1.00 0.00 C ATOM 577 O VAL A 40 10.883 -1.703 -13.104 1.00 0.00 O ATOM 578 CB VAL A 40 9.139 -0.583 -10.558 1.00 0.00 C ATOM 579 CG1 VAL A 40 8.471 -0.018 -11.814 1.00 0.00 C ATOM 580 CG2 VAL A 40 8.011 -1.118 -9.659 1.00 0.00 C ATOM 0 H VAL A 40 10.764 -1.335 -8.871 1.00 0.00 H new ATOM 0 HA VAL A 40 9.624 -2.568 -11.204 1.00 0.00 H new ATOM 0 HB VAL A 40 9.710 0.214 -10.082 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.762 0.760 -11.530 1.00 0.00 H new ATOM 0 HG12 VAL A 40 9.231 0.406 -12.471 1.00 0.00 H new ATOM 0 HG13 VAL A 40 7.944 -0.817 -12.336 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.290 -0.323 -9.467 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.511 -1.948 -10.158 1.00 0.00 H new ATOM 0 HG23 VAL A 40 8.431 -1.462 -8.714 1.00 0.00 H new ATOM 590 N THR A 41 12.318 -0.762 -11.645 1.00 0.00 N ATOM 591 CA THR A 41 13.292 -0.299 -12.635 1.00 0.00 C ATOM 592 C THR A 41 14.683 -0.270 -11.974 1.00 0.00 C ATOM 593 O THR A 41 14.813 -0.129 -10.760 1.00 0.00 O ATOM 594 CB THR A 41 12.847 1.089 -13.161 1.00 0.00 C ATOM 595 OG1 THR A 41 11.607 0.991 -13.825 1.00 0.00 O ATOM 596 CG2 THR A 41 13.798 1.746 -14.165 1.00 0.00 C ATOM 0 H THR A 41 12.610 -0.596 -10.682 1.00 0.00 H new ATOM 0 HA THR A 41 13.347 -0.969 -13.493 1.00 0.00 H new ATOM 0 HB THR A 41 12.814 1.702 -12.260 1.00 0.00 H new ATOM 0 HG1 THR A 41 11.339 1.876 -14.150 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.395 2.712 -14.470 1.00 0.00 H new ATOM 0 HG22 THR A 41 14.774 1.890 -13.701 1.00 0.00 H new ATOM 0 HG23 THR A 41 13.904 1.104 -15.040 1.00 0.00 H new ATOM 604 N HIS A 42 15.742 -0.401 -12.783 1.00 0.00 N ATOM 605 CA HIS A 42 17.152 -0.387 -12.366 1.00 0.00 C ATOM 606 C HIS A 42 17.678 1.043 -12.091 1.00 0.00 C ATOM 607 O HIS A 42 18.803 1.400 -12.451 1.00 0.00 O ATOM 608 CB HIS A 42 17.981 -1.150 -13.421 1.00 0.00 C ATOM 609 CG HIS A 42 17.909 -0.572 -14.815 1.00 0.00 C ATOM 610 ND1 HIS A 42 18.435 0.641 -15.187 1.00 0.00 N ATOM 611 CD2 HIS A 42 17.348 -1.132 -15.932 1.00 0.00 C ATOM 612 CE1 HIS A 42 18.205 0.815 -16.495 1.00 0.00 C ATOM 613 NE2 HIS A 42 17.514 -0.222 -16.987 1.00 0.00 N ATOM 0 H HIS A 42 15.636 -0.525 -13.790 1.00 0.00 H new ATOM 0 HA HIS A 42 17.252 -0.897 -11.408 1.00 0.00 H new ATOM 0 HB2 HIS A 42 19.023 -1.167 -13.102 1.00 0.00 H new ATOM 0 HB3 HIS A 42 17.640 -2.185 -13.453 1.00 0.00 H new ATOM 0 HD1 HIS A 42 18.918 1.297 -14.573 1.00 0.00 H new ATOM 0 HD2 HIS A 42 16.866 -2.097 -15.990 1.00 0.00 H new ATOM 0 HE1 HIS A 42 18.530 1.669 -17.071 1.00 0.00 H new ATOM 621 N GLY A 43 16.832 1.899 -11.523 1.00 0.00 N ATOM 622 CA GLY A 43 17.111 3.298 -11.245 1.00 0.00 C ATOM 623 C GLY A 43 16.013 3.867 -10.351 1.00 0.00 C ATOM 624 O GLY A 43 15.123 3.131 -9.930 1.00 0.00 O ATOM 0 H GLY A 43 15.894 1.621 -11.233 1.00 0.00 H new ATOM 0 HA2 GLY A 43 18.080 3.397 -10.756 1.00 0.00 H new ATOM 0 HA3 GLY A 43 17.165 3.861 -12.177 1.00 0.00 H new ATOM 628 N PHE A 44 16.061 5.174 -10.076 1.00 0.00 N ATOM 629 CA PHE A 44 15.029 5.829 -9.281 1.00 0.00 C ATOM 630 C PHE A 44 13.670 5.754 -9.989 1.00 0.00 C ATOM 631 O PHE A 44 13.583 5.840 -11.226 1.00 0.00 O ATOM 632 CB PHE A 44 15.421 7.285 -8.975 1.00 0.00 C ATOM 633 CG PHE A 44 14.614 7.934 -7.866 1.00 0.00 C ATOM 634 CD1 PHE A 44 14.601 7.369 -6.576 1.00 0.00 C ATOM 635 CD2 PHE A 44 13.890 9.116 -8.114 1.00 0.00 C ATOM 636 CE1 PHE A 44 13.855 7.971 -5.549 1.00 0.00 C ATOM 637 CE2 PHE A 44 13.161 9.725 -7.079 1.00 0.00 C ATOM 638 CZ PHE A 44 13.135 9.150 -5.800 1.00 0.00 C ATOM 0 H PHE A 44 16.805 5.795 -10.394 1.00 0.00 H new ATOM 0 HA PHE A 44 14.939 5.302 -8.331 1.00 0.00 H new ATOM 0 HB2 PHE A 44 16.476 7.315 -8.704 1.00 0.00 H new ATOM 0 HB3 PHE A 44 15.308 7.877 -9.883 1.00 0.00 H new ATOM 0 HD1 PHE A 44 15.166 6.471 -6.376 1.00 0.00 H new ATOM 0 HD2 PHE A 44 13.895 9.555 -9.101 1.00 0.00 H new ATOM 0 HE1 PHE A 44 13.835 7.526 -4.565 1.00 0.00 H new ATOM 0 HE2 PHE A 44 12.619 10.639 -7.269 1.00 0.00 H new ATOM 0 HZ PHE A 44 12.562 9.613 -5.010 1.00 0.00 H new ATOM 648 N VAL A 45 12.612 5.677 -9.181 1.00 0.00 N ATOM 649 CA VAL A 45 11.224 5.556 -9.604 1.00 0.00 C ATOM 650 C VAL A 45 10.469 6.642 -8.836 1.00 0.00 C ATOM 651 O VAL A 45 9.902 6.389 -7.781 1.00 0.00 O ATOM 652 CB VAL A 45 10.720 4.110 -9.365 1.00 0.00 C ATOM 653 CG1 VAL A 45 9.243 3.918 -9.741 1.00 0.00 C ATOM 654 CG2 VAL A 45 11.515 3.099 -10.202 1.00 0.00 C ATOM 0 H VAL A 45 12.709 5.699 -8.166 1.00 0.00 H new ATOM 0 HA VAL A 45 11.072 5.714 -10.672 1.00 0.00 H new ATOM 0 HB VAL A 45 10.854 3.941 -8.296 1.00 0.00 H new ATOM 0 HG11 VAL A 45 8.950 2.885 -9.551 1.00 0.00 H new ATOM 0 HG12 VAL A 45 8.625 4.586 -9.142 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.104 4.146 -10.798 1.00 0.00 H new ATOM 0 HG21 VAL A 45 11.138 2.094 -10.013 1.00 0.00 H new ATOM 0 HG22 VAL A 45 11.403 3.335 -11.260 1.00 0.00 H new ATOM 0 HG23 VAL A 45 12.569 3.149 -9.928 1.00 0.00 H new ATOM 664 N LYS A 46 10.579 7.890 -9.309 1.00 0.00 N ATOM 665 CA LYS A 46 9.928 9.030 -8.660 1.00 0.00 C ATOM 666 C LYS A 46 8.413 8.879 -8.530 1.00 0.00 C ATOM 667 O LYS A 46 7.873 9.384 -7.551 1.00 0.00 O ATOM 668 CB LYS A 46 10.321 10.357 -9.321 1.00 0.00 C ATOM 669 CG LYS A 46 9.981 10.517 -10.812 1.00 0.00 C ATOM 670 CD LYS A 46 10.474 11.892 -11.294 1.00 0.00 C ATOM 671 CE LYS A 46 10.321 12.083 -12.807 1.00 0.00 C ATOM 672 NZ LYS A 46 8.931 12.383 -13.202 1.00 0.00 N ATOM 0 H LYS A 46 11.115 8.134 -10.142 1.00 0.00 H new ATOM 0 HA LYS A 46 10.305 9.046 -7.637 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.837 11.166 -8.774 1.00 0.00 H new ATOM 0 HB3 LYS A 46 11.396 10.491 -9.202 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.452 9.724 -11.393 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.905 10.428 -10.964 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.918 12.674 -10.776 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.523 12.012 -11.022 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.971 12.894 -13.135 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.654 11.180 -13.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 8.839 12.303 -14.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 8.286 11.708 -12.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 8.687 13.350 -12.907 1.00 0.00 H new ATOM 686 N ASP A 47 7.776 8.167 -9.457 1.00 0.00 N ATOM 687 CA ASP A 47 6.406 7.701 -9.308 1.00 0.00 C ATOM 688 C ASP A 47 6.256 6.393 -10.081 1.00 0.00 C ATOM 689 O ASP A 47 6.796 6.262 -11.187 1.00 0.00 O ATOM 690 CB ASP A 47 5.426 8.754 -9.824 1.00 0.00 C ATOM 691 CG ASP A 47 4.008 8.354 -9.411 1.00 0.00 C ATOM 692 OD1 ASP A 47 3.426 7.478 -10.088 1.00 0.00 O ATOM 693 OD2 ASP A 47 3.486 8.886 -8.409 1.00 0.00 O ATOM 0 H ASP A 47 8.205 7.896 -10.342 1.00 0.00 H new ATOM 0 HA ASP A 47 6.181 7.531 -8.255 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.676 9.734 -9.416 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.495 8.834 -10.909 1.00 0.00 H new ATOM 698 N ILE A 48 5.594 5.400 -9.490 1.00 0.00 N ATOM 699 CA ILE A 48 5.409 4.091 -10.098 1.00 0.00 C ATOM 700 C ILE A 48 4.604 4.137 -11.403 1.00 0.00 C ATOM 701 O ILE A 48 4.939 3.377 -12.309 1.00 0.00 O ATOM 702 CB ILE A 48 4.842 3.121 -9.037 1.00 0.00 C ATOM 703 CG1 ILE A 48 4.978 1.671 -9.523 1.00 0.00 C ATOM 704 CG2 ILE A 48 3.397 3.470 -8.635 1.00 0.00 C ATOM 705 CD1 ILE A 48 4.724 0.655 -8.405 1.00 0.00 C ATOM 0 H ILE A 48 5.168 5.486 -8.567 1.00 0.00 H new ATOM 0 HA ILE A 48 6.378 3.708 -10.419 1.00 0.00 H new ATOM 0 HB ILE A 48 5.433 3.231 -8.128 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.274 1.496 -10.337 1.00 0.00 H new ATOM 0 HG13 ILE A 48 5.978 1.519 -9.929 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.045 2.759 -7.888 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.368 4.477 -8.219 1.00 0.00 H new ATOM 0 HG23 ILE A 48 2.753 3.421 -9.513 1.00 0.00 H new ATOM 0 HD11 ILE A 48 4.832 -0.355 -8.800 1.00 0.00 H new ATOM 0 HD12 ILE A 48 5.445 0.810 -7.602 1.00 0.00 H new ATOM 0 HD13 ILE A 48 3.714 0.786 -8.016 1.00 0.00 H new ATOM 717 N ASN A 49 3.600 5.007 -11.542 1.00 0.00 N ATOM 718 CA ASN A 49 2.785 5.054 -12.764 1.00 0.00 C ATOM 719 C ASN A 49 3.564 5.541 -13.997 1.00 0.00 C ATOM 720 O ASN A 49 3.142 5.314 -15.129 1.00 0.00 O ATOM 721 CB ASN A 49 1.499 5.872 -12.541 1.00 0.00 C ATOM 722 CG ASN A 49 1.554 7.272 -13.151 1.00 0.00 C ATOM 723 OD1 ASN A 49 0.937 7.559 -14.179 1.00 0.00 O ATOM 724 ND2 ASN A 49 2.286 8.166 -12.513 1.00 0.00 N ATOM 0 H ASN A 49 3.331 5.686 -10.829 1.00 0.00 H new ATOM 0 HA ASN A 49 2.500 4.025 -12.984 1.00 0.00 H new ATOM 0 HB2 ASN A 49 0.655 5.331 -12.969 1.00 0.00 H new ATOM 0 HB3 ASN A 49 1.313 5.958 -11.470 1.00 0.00 H new ATOM 0 HD21 ASN A 49 2.351 9.120 -12.869 1.00 0.00 H new ATOM 0 HD22 ASN A 49 2.787 7.903 -11.664 1.00 0.00 H new ATOM 731 N GLU A 50 4.720 6.177 -13.805 1.00 0.00 N ATOM 732 CA GLU A 50 5.613 6.520 -14.905 1.00 0.00 C ATOM 733 C GLU A 50 6.453 5.320 -15.382 1.00 0.00 C ATOM 734 O GLU A 50 7.092 5.417 -16.439 1.00 0.00 O ATOM 735 CB GLU A 50 6.521 7.685 -14.483 1.00 0.00 C ATOM 736 CG GLU A 50 5.773 9.012 -14.292 1.00 0.00 C ATOM 737 CD GLU A 50 6.757 10.153 -13.986 1.00 0.00 C ATOM 738 OE1 GLU A 50 7.391 10.661 -14.937 1.00 0.00 O ATOM 739 OE2 GLU A 50 6.948 10.561 -12.820 1.00 0.00 O ATOM 0 H GLU A 50 5.060 6.466 -12.888 1.00 0.00 H new ATOM 0 HA GLU A 50 4.997 6.821 -15.752 1.00 0.00 H new ATOM 0 HB2 GLU A 50 7.023 7.424 -13.551 1.00 0.00 H new ATOM 0 HB3 GLU A 50 7.297 7.821 -15.236 1.00 0.00 H new ATOM 0 HG2 GLU A 50 5.205 9.247 -15.192 1.00 0.00 H new ATOM 0 HG3 GLU A 50 5.055 8.916 -13.477 1.00 0.00 H new ATOM 746 N HIS A 51 6.480 4.214 -14.627 1.00 0.00 N ATOM 747 CA HIS A 51 7.422 3.104 -14.815 1.00 0.00 C ATOM 748 C HIS A 51 6.730 1.733 -14.902 1.00 0.00 C ATOM 749 O HIS A 51 7.333 0.785 -15.397 1.00 0.00 O ATOM 750 CB HIS A 51 8.470 3.128 -13.687 1.00 0.00 C ATOM 751 CG HIS A 51 9.285 4.403 -13.610 1.00 0.00 C ATOM 752 ND1 HIS A 51 8.887 5.562 -12.988 1.00 0.00 N ATOM 753 CD2 HIS A 51 10.540 4.630 -14.112 1.00 0.00 C ATOM 754 CE1 HIS A 51 9.862 6.467 -13.132 1.00 0.00 C ATOM 755 NE2 HIS A 51 10.918 5.947 -13.788 1.00 0.00 N ATOM 0 H HIS A 51 5.834 4.063 -13.852 1.00 0.00 H new ATOM 0 HA HIS A 51 7.914 3.247 -15.777 1.00 0.00 H new ATOM 0 HB2 HIS A 51 7.962 2.979 -12.734 1.00 0.00 H new ATOM 0 HB3 HIS A 51 9.149 2.286 -13.822 1.00 0.00 H new ATOM 0 HD1 HIS A 51 8.002 5.707 -12.501 1.00 0.00 H new ATOM 0 HD2 HIS A 51 11.138 3.919 -14.663 1.00 0.00 H new ATOM 0 HE1 HIS A 51 9.809 7.483 -12.769 1.00 0.00 H new ATOM 763 N LEU A 52 5.469 1.623 -14.474 1.00 0.00 N ATOM 764 CA LEU A 52 4.602 0.466 -14.682 1.00 0.00 C ATOM 765 C LEU A 52 3.156 0.946 -14.848 1.00 0.00 C ATOM 766 O LEU A 52 2.868 2.123 -14.645 1.00 0.00 O ATOM 767 CB LEU A 52 4.717 -0.499 -13.488 1.00 0.00 C ATOM 768 CG LEU A 52 4.537 -1.973 -13.901 1.00 0.00 C ATOM 769 CD1 LEU A 52 5.805 -2.529 -14.544 1.00 0.00 C ATOM 770 CD2 LEU A 52 4.175 -2.824 -12.685 1.00 0.00 C ATOM 0 H LEU A 52 5.009 2.369 -13.953 1.00 0.00 H new ATOM 0 HA LEU A 52 4.908 -0.066 -15.583 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.692 -0.374 -13.016 1.00 0.00 H new ATOM 0 HB3 LEU A 52 3.966 -0.240 -12.742 1.00 0.00 H new ATOM 0 HG LEU A 52 3.729 -2.013 -14.632 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.645 -3.570 -14.824 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.047 -1.947 -15.434 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.630 -2.467 -13.834 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.051 -3.863 -12.992 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.972 -2.757 -11.944 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.244 -2.460 -12.251 1.00 0.00 H new ATOM 782 N SER A 53 2.237 0.030 -15.149 1.00 0.00 N ATOM 783 CA SER A 53 0.865 0.327 -15.534 1.00 0.00 C ATOM 784 C SER A 53 -0.015 -0.837 -15.077 1.00 0.00 C ATOM 785 O SER A 53 0.287 -1.991 -15.368 1.00 0.00 O ATOM 786 CB SER A 53 0.768 0.462 -17.062 1.00 0.00 C ATOM 787 OG SER A 53 1.629 1.476 -17.552 1.00 0.00 O ATOM 0 H SER A 53 2.437 -0.970 -15.130 1.00 0.00 H new ATOM 0 HA SER A 53 0.541 1.261 -15.075 1.00 0.00 H new ATOM 0 HB2 SER A 53 1.023 -0.489 -17.529 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.260 0.690 -17.343 1.00 0.00 H new ATOM 0 HG SER A 53 1.544 1.535 -18.527 1.00 0.00 H new ATOM 793 N VAL A 54 -1.071 -0.572 -14.305 1.00 0.00 N ATOM 794 CA VAL A 54 -2.139 -1.541 -14.072 1.00 0.00 C ATOM 795 C VAL A 54 -2.832 -1.912 -15.388 1.00 0.00 C ATOM 796 O VAL A 54 -2.953 -1.084 -16.290 1.00 0.00 O ATOM 797 CB VAL A 54 -3.080 -1.020 -12.962 1.00 0.00 C ATOM 798 CG1 VAL A 54 -3.742 0.326 -13.292 1.00 0.00 C ATOM 799 CG2 VAL A 54 -4.154 -2.039 -12.578 1.00 0.00 C ATOM 0 H VAL A 54 -1.208 0.318 -13.826 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.730 -2.481 -13.700 1.00 0.00 H new ATOM 0 HB VAL A 54 -2.423 -0.861 -12.107 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -4.387 0.626 -12.466 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -2.972 1.082 -13.445 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -4.337 0.226 -14.200 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.787 -1.622 -11.795 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.763 -2.272 -13.451 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.678 -2.949 -12.214 1.00 0.00 H new ATOM 809 N GLY A 55 -3.309 -3.156 -15.465 1.00 0.00 N ATOM 810 CA GLY A 55 -4.026 -3.665 -16.617 1.00 0.00 C ATOM 811 C GLY A 55 -3.109 -3.856 -17.823 1.00 0.00 C ATOM 812 O GLY A 55 -3.577 -3.727 -18.951 1.00 0.00 O ATOM 0 H GLY A 55 -3.203 -3.840 -14.716 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.493 -4.616 -16.362 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.829 -2.976 -16.878 1.00 0.00 H new ATOM 816 N ASP A 56 -1.840 -4.196 -17.589 1.00 0.00 N ATOM 817 CA ASP A 56 -0.875 -4.517 -18.642 1.00 0.00 C ATOM 818 C ASP A 56 -0.241 -5.874 -18.339 1.00 0.00 C ATOM 819 O ASP A 56 -0.354 -6.359 -17.209 1.00 0.00 O ATOM 820 CB ASP A 56 0.185 -3.409 -18.714 1.00 0.00 C ATOM 821 CG ASP A 56 1.142 -3.561 -19.900 1.00 0.00 C ATOM 822 OD1 ASP A 56 0.708 -4.154 -20.915 1.00 0.00 O ATOM 823 OD2 ASP A 56 2.280 -3.053 -19.790 1.00 0.00 O ATOM 0 H ASP A 56 -1.448 -4.257 -16.649 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.371 -4.576 -19.611 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -0.314 -2.442 -18.781 1.00 0.00 H new ATOM 0 HB3 ASP A 56 0.762 -3.407 -17.789 1.00 0.00 H new ATOM 828 N GLU A 57 0.374 -6.514 -19.332 1.00 0.00 N ATOM 829 CA GLU A 57 1.043 -7.804 -19.214 1.00 0.00 C ATOM 830 C GLU A 57 2.561 -7.594 -19.187 1.00 0.00 C ATOM 831 O GLU A 57 3.111 -6.845 -19.985 1.00 0.00 O ATOM 832 CB GLU A 57 0.595 -8.679 -20.393 1.00 0.00 C ATOM 833 CG GLU A 57 1.134 -10.113 -20.319 1.00 0.00 C ATOM 834 CD GLU A 57 0.645 -10.972 -21.490 1.00 0.00 C ATOM 835 OE1 GLU A 57 1.296 -10.925 -22.558 1.00 0.00 O ATOM 836 OE2 GLU A 57 -0.407 -11.633 -21.290 1.00 0.00 O ATOM 0 H GLU A 57 0.420 -6.132 -20.276 1.00 0.00 H new ATOM 0 HA GLU A 57 0.775 -8.309 -18.286 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -0.494 -8.708 -20.422 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.927 -8.220 -21.324 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.224 -10.091 -20.316 1.00 0.00 H new ATOM 0 HG3 GLU A 57 0.822 -10.569 -19.380 1.00 0.00 H new ATOM 843 N VAL A 58 3.257 -8.255 -18.263 1.00 0.00 N ATOM 844 CA VAL A 58 4.671 -8.020 -17.980 1.00 0.00 C ATOM 845 C VAL A 58 5.337 -9.344 -17.614 1.00 0.00 C ATOM 846 O VAL A 58 4.745 -10.182 -16.922 1.00 0.00 O ATOM 847 CB VAL A 58 4.839 -6.966 -16.855 1.00 0.00 C ATOM 848 CG1 VAL A 58 4.397 -5.565 -17.301 1.00 0.00 C ATOM 849 CG2 VAL A 58 4.074 -7.308 -15.566 1.00 0.00 C ATOM 0 H VAL A 58 2.845 -8.983 -17.679 1.00 0.00 H new ATOM 0 HA VAL A 58 5.158 -7.619 -18.869 1.00 0.00 H new ATOM 0 HB VAL A 58 5.908 -6.978 -16.643 1.00 0.00 H new ATOM 0 HG11 VAL A 58 4.533 -4.862 -16.479 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.998 -5.248 -18.153 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.346 -5.589 -17.587 1.00 0.00 H new ATOM 0 HG21 VAL A 58 4.240 -6.525 -14.826 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.009 -7.382 -15.784 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.431 -8.260 -15.173 1.00 0.00 H new ATOM 859 N GLN A 59 6.580 -9.529 -18.067 1.00 0.00 N ATOM 860 CA GLN A 59 7.448 -10.562 -17.531 1.00 0.00 C ATOM 861 C GLN A 59 7.868 -10.155 -16.115 1.00 0.00 C ATOM 862 O GLN A 59 8.221 -8.997 -15.890 1.00 0.00 O ATOM 863 CB GLN A 59 8.691 -10.730 -18.417 1.00 0.00 C ATOM 864 CG GLN A 59 8.429 -11.562 -19.682 1.00 0.00 C ATOM 865 CD GLN A 59 7.524 -10.865 -20.702 1.00 0.00 C ATOM 866 OE1 GLN A 59 7.809 -9.766 -21.148 1.00 0.00 O ATOM 867 NE2 GLN A 59 6.425 -11.485 -21.092 1.00 0.00 N ATOM 0 H GLN A 59 7.003 -8.970 -18.808 1.00 0.00 H new ATOM 0 HA GLN A 59 6.916 -11.513 -17.507 1.00 0.00 H new ATOM 0 HB2 GLN A 59 9.057 -9.745 -18.708 1.00 0.00 H new ATOM 0 HB3 GLN A 59 9.481 -11.205 -17.836 1.00 0.00 H new ATOM 0 HG2 GLN A 59 9.382 -11.796 -20.156 1.00 0.00 H new ATOM 0 HG3 GLN A 59 7.975 -12.510 -19.395 1.00 0.00 H new ATOM 0 HE21 GLN A 59 6.196 -12.404 -20.713 1.00 0.00 H new ATOM 0 HE22 GLN A 59 5.805 -11.045 -21.772 1.00 0.00 H new ATOM 876 N VAL A 60 7.919 -11.108 -15.189 1.00 0.00 N ATOM 877 CA VAL A 60 8.295 -10.923 -13.789 1.00 0.00 C ATOM 878 C VAL A 60 9.304 -12.000 -13.393 1.00 0.00 C ATOM 879 O VAL A 60 9.118 -13.179 -13.714 1.00 0.00 O ATOM 880 CB VAL A 60 7.050 -10.972 -12.874 1.00 0.00 C ATOM 881 CG1 VAL A 60 6.372 -9.602 -12.792 1.00 0.00 C ATOM 882 CG2 VAL A 60 5.992 -12.008 -13.287 1.00 0.00 C ATOM 0 H VAL A 60 7.688 -12.078 -15.404 1.00 0.00 H new ATOM 0 HA VAL A 60 8.753 -9.941 -13.667 1.00 0.00 H new ATOM 0 HB VAL A 60 7.442 -11.276 -11.903 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.499 -9.666 -12.142 1.00 0.00 H new ATOM 0 HG12 VAL A 60 7.073 -8.873 -12.387 1.00 0.00 H new ATOM 0 HG13 VAL A 60 6.060 -9.290 -13.789 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.155 -11.972 -12.589 1.00 0.00 H new ATOM 0 HG22 VAL A 60 5.636 -11.783 -14.292 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.433 -13.004 -13.273 1.00 0.00 H new ATOM 892 N LYS A 61 10.378 -11.595 -12.706 1.00 0.00 N ATOM 893 CA LYS A 61 11.249 -12.540 -12.022 1.00 0.00 C ATOM 894 C LYS A 61 10.694 -12.749 -10.616 1.00 0.00 C ATOM 895 O LYS A 61 10.422 -11.780 -9.912 1.00 0.00 O ATOM 896 CB LYS A 61 12.689 -12.008 -12.003 1.00 0.00 C ATOM 897 CG LYS A 61 13.646 -13.016 -11.341 1.00 0.00 C ATOM 898 CD LYS A 61 15.073 -12.496 -11.121 1.00 0.00 C ATOM 899 CE LYS A 61 15.111 -11.427 -10.022 1.00 0.00 C ATOM 900 NZ LYS A 61 16.496 -11.018 -9.685 1.00 0.00 N ATOM 0 H LYS A 61 10.659 -10.619 -12.613 1.00 0.00 H new ATOM 0 HA LYS A 61 11.276 -13.499 -12.540 1.00 0.00 H new ATOM 0 HB2 LYS A 61 13.018 -11.805 -13.022 1.00 0.00 H new ATOM 0 HB3 LYS A 61 12.723 -11.062 -11.463 1.00 0.00 H new ATOM 0 HG2 LYS A 61 13.230 -13.313 -10.378 1.00 0.00 H new ATOM 0 HG3 LYS A 61 13.692 -13.913 -11.959 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.727 -13.325 -10.849 1.00 0.00 H new ATOM 0 HD3 LYS A 61 15.458 -12.079 -12.051 1.00 0.00 H new ATOM 0 HE2 LYS A 61 14.545 -10.554 -10.347 1.00 0.00 H new ATOM 0 HE3 LYS A 61 14.620 -11.810 -9.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 16.472 -10.295 -8.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 17.030 -11.845 -9.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 16.958 -10.627 -10.531 1.00 0.00 H new ATOM 914 N VAL A 62 10.552 -13.997 -10.187 1.00 0.00 N ATOM 915 CA VAL A 62 10.242 -14.345 -8.808 1.00 0.00 C ATOM 916 C VAL A 62 11.389 -13.875 -7.904 1.00 0.00 C ATOM 917 O VAL A 62 12.524 -14.347 -8.017 1.00 0.00 O ATOM 918 CB VAL A 62 9.975 -15.856 -8.700 1.00 0.00 C ATOM 919 CG1 VAL A 62 9.488 -16.202 -7.288 1.00 0.00 C ATOM 920 CG2 VAL A 62 8.903 -16.327 -9.700 1.00 0.00 C ATOM 0 H VAL A 62 10.651 -14.808 -10.798 1.00 0.00 H new ATOM 0 HA VAL A 62 9.334 -13.841 -8.476 1.00 0.00 H new ATOM 0 HB VAL A 62 10.915 -16.360 -8.925 1.00 0.00 H new ATOM 0 HG11 VAL A 62 9.301 -17.274 -7.220 1.00 0.00 H new ATOM 0 HG12 VAL A 62 10.249 -15.919 -6.561 1.00 0.00 H new ATOM 0 HG13 VAL A 62 8.567 -15.659 -7.078 1.00 0.00 H new ATOM 0 HG21 VAL A 62 8.747 -17.400 -9.588 1.00 0.00 H new ATOM 0 HG22 VAL A 62 7.968 -15.802 -9.505 1.00 0.00 H new ATOM 0 HG23 VAL A 62 9.234 -16.113 -10.716 1.00 0.00 H new ATOM 930 N LEU A 63 11.086 -12.927 -7.018 1.00 0.00 N ATOM 931 CA LEU A 63 12.043 -12.342 -6.087 1.00 0.00 C ATOM 932 C LEU A 63 12.055 -13.096 -4.760 1.00 0.00 C ATOM 933 O LEU A 63 13.124 -13.297 -4.195 1.00 0.00 O ATOM 934 CB LEU A 63 11.655 -10.875 -5.869 1.00 0.00 C ATOM 935 CG LEU A 63 12.639 -10.075 -4.995 1.00 0.00 C ATOM 936 CD1 LEU A 63 13.961 -9.815 -5.736 1.00 0.00 C ATOM 937 CD2 LEU A 63 11.988 -8.740 -4.623 1.00 0.00 C ATOM 0 H LEU A 63 10.148 -12.538 -6.928 1.00 0.00 H new ATOM 0 HA LEU A 63 13.048 -12.411 -6.503 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.572 -10.387 -6.840 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.668 -10.838 -5.408 1.00 0.00 H new ATOM 0 HG LEU A 63 12.866 -10.654 -4.100 1.00 0.00 H new ATOM 0 HD11 LEU A 63 14.634 -9.248 -5.092 1.00 0.00 H new ATOM 0 HD12 LEU A 63 14.425 -10.766 -5.998 1.00 0.00 H new ATOM 0 HD13 LEU A 63 13.763 -9.246 -6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 63 12.673 -8.161 -4.003 1.00 0.00 H new ATOM 0 HD22 LEU A 63 11.759 -8.181 -5.531 1.00 0.00 H new ATOM 0 HD23 LEU A 63 11.067 -8.926 -4.070 1.00 0.00 H new ATOM 949 N ALA A 64 10.891 -13.530 -4.271 1.00 0.00 N ATOM 950 CA ALA A 64 10.734 -14.287 -3.030 1.00 0.00 C ATOM 951 C ALA A 64 9.459 -15.116 -3.114 1.00 0.00 C ATOM 952 O ALA A 64 8.549 -14.759 -3.860 1.00 0.00 O ATOM 953 CB ALA A 64 10.662 -13.339 -1.830 1.00 0.00 C ATOM 0 H ALA A 64 10.004 -13.358 -4.744 1.00 0.00 H new ATOM 0 HA ALA A 64 11.594 -14.943 -2.897 1.00 0.00 H new ATOM 0 HB1 ALA A 64 10.545 -13.919 -0.915 1.00 0.00 H new ATOM 0 HB2 ALA A 64 11.579 -12.753 -1.774 1.00 0.00 H new ATOM 0 HB3 ALA A 64 9.810 -12.669 -1.946 1.00 0.00 H new ATOM 959 N VAL A 65 9.367 -16.173 -2.310 1.00 0.00 N ATOM 960 CA VAL A 65 8.158 -16.973 -2.112 1.00 0.00 C ATOM 961 C VAL A 65 8.069 -17.258 -0.609 1.00 0.00 C ATOM 962 O VAL A 65 9.095 -17.546 0.013 1.00 0.00 O ATOM 963 CB VAL A 65 8.250 -18.276 -2.940 1.00 0.00 C ATOM 964 CG1 VAL A 65 7.004 -19.154 -2.770 1.00 0.00 C ATOM 965 CG2 VAL A 65 8.437 -18.013 -4.445 1.00 0.00 C ATOM 0 H VAL A 65 10.158 -16.508 -1.760 1.00 0.00 H new ATOM 0 HA VAL A 65 7.262 -16.451 -2.448 1.00 0.00 H new ATOM 0 HB VAL A 65 9.128 -18.792 -2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.112 -20.058 -3.369 1.00 0.00 H new ATOM 0 HG12 VAL A 65 6.891 -19.425 -1.720 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.123 -18.603 -3.100 1.00 0.00 H new ATOM 0 HG21 VAL A 65 8.495 -18.963 -4.976 1.00 0.00 H new ATOM 0 HG22 VAL A 65 7.591 -17.438 -4.822 1.00 0.00 H new ATOM 0 HG23 VAL A 65 9.357 -17.451 -4.605 1.00 0.00 H new ATOM 975 N ASP A 66 6.869 -17.166 -0.031 1.00 0.00 N ATOM 976 CA ASP A 66 6.609 -17.479 1.372 1.00 0.00 C ATOM 977 C ASP A 66 5.222 -18.106 1.471 1.00 0.00 C ATOM 978 O ASP A 66 4.211 -17.401 1.467 1.00 0.00 O ATOM 979 CB ASP A 66 6.722 -16.223 2.246 1.00 0.00 C ATOM 980 CG ASP A 66 6.666 -16.543 3.746 1.00 0.00 C ATOM 981 OD1 ASP A 66 5.817 -17.352 4.169 1.00 0.00 O ATOM 982 OD2 ASP A 66 7.385 -15.850 4.510 1.00 0.00 O ATOM 0 H ASP A 66 6.036 -16.866 -0.537 1.00 0.00 H new ATOM 0 HA ASP A 66 7.354 -18.184 1.741 1.00 0.00 H new ATOM 0 HB2 ASP A 66 7.658 -15.711 2.022 1.00 0.00 H new ATOM 0 HB3 ASP A 66 5.915 -15.535 1.994 1.00 0.00 H new ATOM 987 N GLU A 67 5.185 -19.436 1.481 1.00 0.00 N ATOM 988 CA GLU A 67 3.949 -20.212 1.502 1.00 0.00 C ATOM 989 C GLU A 67 3.264 -20.187 2.875 1.00 0.00 C ATOM 990 O GLU A 67 2.084 -20.516 2.954 1.00 0.00 O ATOM 991 CB GLU A 67 4.243 -21.659 1.081 1.00 0.00 C ATOM 992 CG GLU A 67 4.567 -21.805 -0.417 1.00 0.00 C ATOM 993 CD GLU A 67 3.339 -21.629 -1.327 1.00 0.00 C ATOM 994 OE1 GLU A 67 3.086 -20.468 -1.724 1.00 0.00 O ATOM 995 OE2 GLU A 67 2.655 -22.647 -1.583 1.00 0.00 O ATOM 0 H GLU A 67 6.026 -20.013 1.475 1.00 0.00 H new ATOM 0 HA GLU A 67 3.259 -19.752 0.795 1.00 0.00 H new ATOM 0 HB2 GLU A 67 5.082 -22.036 1.665 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.381 -22.282 1.321 1.00 0.00 H new ATOM 0 HG2 GLU A 67 5.322 -21.068 -0.691 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.003 -22.789 -0.593 1.00 0.00 H new ATOM 1002 N GLU A 68 3.946 -19.756 3.943 1.00 0.00 N ATOM 1003 CA GLU A 68 3.315 -19.608 5.253 1.00 0.00 C ATOM 1004 C GLU A 68 2.456 -18.339 5.258 1.00 0.00 C ATOM 1005 O GLU A 68 1.308 -18.342 5.701 1.00 0.00 O ATOM 1006 CB GLU A 68 4.371 -19.533 6.368 1.00 0.00 C ATOM 1007 CG GLU A 68 5.379 -20.695 6.354 1.00 0.00 C ATOM 1008 CD GLU A 68 4.732 -22.082 6.502 1.00 0.00 C ATOM 1009 OE1 GLU A 68 4.072 -22.308 7.542 1.00 0.00 O ATOM 1010 OE2 GLU A 68 4.921 -22.905 5.576 1.00 0.00 O ATOM 0 H GLU A 68 4.934 -19.505 3.922 1.00 0.00 H new ATOM 0 HA GLU A 68 2.688 -20.479 5.442 1.00 0.00 H new ATOM 0 HB2 GLU A 68 4.915 -18.593 6.277 1.00 0.00 H new ATOM 0 HB3 GLU A 68 3.865 -19.516 7.333 1.00 0.00 H new ATOM 0 HG2 GLU A 68 5.941 -20.665 5.420 1.00 0.00 H new ATOM 0 HG3 GLU A 68 6.096 -20.551 7.162 1.00 0.00 H new ATOM 1017 N LYS A 69 3.002 -17.234 4.735 1.00 0.00 N ATOM 1018 CA LYS A 69 2.240 -16.015 4.459 1.00 0.00 C ATOM 1019 C LYS A 69 1.241 -16.227 3.317 1.00 0.00 C ATOM 1020 O LYS A 69 0.271 -15.469 3.245 1.00 0.00 O ATOM 1021 CB LYS A 69 3.215 -14.878 4.120 1.00 0.00 C ATOM 1022 CG LYS A 69 4.071 -14.481 5.334 1.00 0.00 C ATOM 1023 CD LYS A 69 5.103 -13.412 4.947 1.00 0.00 C ATOM 1024 CE LYS A 69 6.053 -13.040 6.097 1.00 0.00 C ATOM 1025 NZ LYS A 69 6.853 -14.193 6.572 1.00 0.00 N ATOM 0 H LYS A 69 3.990 -17.163 4.491 1.00 0.00 H new ATOM 0 HA LYS A 69 1.665 -15.752 5.347 1.00 0.00 H new ATOM 0 HB2 LYS A 69 3.865 -15.188 3.302 1.00 0.00 H new ATOM 0 HB3 LYS A 69 2.655 -14.011 3.770 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.429 -14.102 6.129 1.00 0.00 H new ATOM 0 HG3 LYS A 69 4.581 -15.360 5.728 1.00 0.00 H new ATOM 0 HD2 LYS A 69 5.690 -13.772 4.102 1.00 0.00 H new ATOM 0 HD3 LYS A 69 4.580 -12.516 4.613 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.725 -12.248 5.766 1.00 0.00 H new ATOM 0 HE3 LYS A 69 5.472 -12.639 6.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 7.569 -13.863 7.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 6.227 -14.881 7.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.325 -14.645 5.763 1.00 0.00 H new ATOM 1039 N GLY A 70 1.508 -17.168 2.407 1.00 0.00 N ATOM 1040 CA GLY A 70 0.765 -17.335 1.165 1.00 0.00 C ATOM 1041 C GLY A 70 1.032 -16.179 0.201 1.00 0.00 C ATOM 1042 O GLY A 70 0.102 -15.565 -0.323 1.00 0.00 O ATOM 0 H GLY A 70 2.262 -17.846 2.520 1.00 0.00 H new ATOM 0 HA2 GLY A 70 1.046 -18.277 0.694 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.302 -17.393 1.381 1.00 0.00 H new ATOM 1046 N LYS A 71 2.301 -15.791 0.036 1.00 0.00 N ATOM 1047 CA LYS A 71 2.714 -14.620 -0.738 1.00 0.00 C ATOM 1048 C LYS A 71 3.879 -14.970 -1.657 1.00 0.00 C ATOM 1049 O LYS A 71 4.661 -15.881 -1.396 1.00 0.00 O ATOM 1050 CB LYS A 71 3.126 -13.489 0.222 1.00 0.00 C ATOM 1051 CG LYS A 71 1.920 -12.832 0.910 1.00 0.00 C ATOM 1052 CD LYS A 71 2.347 -11.612 1.739 1.00 0.00 C ATOM 1053 CE LYS A 71 1.113 -10.953 2.368 1.00 0.00 C ATOM 1054 NZ LYS A 71 1.465 -9.769 3.189 1.00 0.00 N ATOM 0 H LYS A 71 3.086 -16.296 0.447 1.00 0.00 H new ATOM 0 HA LYS A 71 1.876 -14.290 -1.352 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.800 -13.888 0.980 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.681 -12.732 -0.331 1.00 0.00 H new ATOM 0 HG2 LYS A 71 1.192 -12.527 0.159 1.00 0.00 H new ATOM 0 HG3 LYS A 71 1.427 -13.559 1.556 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.045 -11.917 2.519 1.00 0.00 H new ATOM 0 HD3 LYS A 71 2.870 -10.896 1.106 1.00 0.00 H new ATOM 0 HE2 LYS A 71 0.422 -10.654 1.580 1.00 0.00 H new ATOM 0 HE3 LYS A 71 0.592 -11.681 2.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.600 -9.357 3.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.103 -10.057 3.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.939 -9.061 2.592 1.00 0.00 H new ATOM 1068 N ILE A 72 4.044 -14.148 -2.693 1.00 0.00 N ATOM 1069 CA ILE A 72 5.162 -14.147 -3.622 1.00 0.00 C ATOM 1070 C ILE A 72 5.555 -12.677 -3.802 1.00 0.00 C ATOM 1071 O ILE A 72 4.685 -11.809 -3.931 1.00 0.00 O ATOM 1072 CB ILE A 72 4.738 -14.826 -4.953 1.00 0.00 C ATOM 1073 CG1 ILE A 72 4.375 -16.308 -4.712 1.00 0.00 C ATOM 1074 CG2 ILE A 72 5.847 -14.720 -6.016 1.00 0.00 C ATOM 1075 CD1 ILE A 72 4.010 -17.104 -5.973 1.00 0.00 C ATOM 0 H ILE A 72 3.359 -13.426 -2.915 1.00 0.00 H new ATOM 0 HA ILE A 72 6.018 -14.715 -3.257 1.00 0.00 H new ATOM 0 HB ILE A 72 3.859 -14.301 -5.327 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.218 -16.797 -4.224 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.536 -16.352 -4.018 1.00 0.00 H new ATOM 0 HG21 ILE A 72 5.518 -15.205 -6.935 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.060 -13.670 -6.216 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.749 -15.210 -5.650 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.772 -18.132 -5.698 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.145 -16.647 -6.454 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.854 -17.099 -6.663 1.00 0.00 H new ATOM 1087 N SER A 73 6.855 -12.406 -3.840 1.00 0.00 N ATOM 1088 CA SER A 73 7.384 -11.119 -4.258 1.00 0.00 C ATOM 1089 C SER A 73 8.019 -11.273 -5.636 1.00 0.00 C ATOM 1090 O SER A 73 8.515 -12.346 -5.989 1.00 0.00 O ATOM 1091 CB SER A 73 8.388 -10.598 -3.231 1.00 0.00 C ATOM 1092 OG SER A 73 7.873 -10.712 -1.912 1.00 0.00 O ATOM 0 H SER A 73 7.574 -13.080 -3.579 1.00 0.00 H new ATOM 0 HA SER A 73 6.579 -10.387 -4.322 1.00 0.00 H new ATOM 0 HB2 SER A 73 9.319 -11.158 -3.311 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.624 -9.555 -3.444 1.00 0.00 H new ATOM 0 HG SER A 73 8.534 -10.374 -1.272 1.00 0.00 H new ATOM 1098 N LEU A 74 8.025 -10.207 -6.423 1.00 0.00 N ATOM 1099 CA LEU A 74 8.343 -10.212 -7.847 1.00 0.00 C ATOM 1100 C LEU A 74 9.275 -9.035 -8.135 1.00 0.00 C ATOM 1101 O LEU A 74 9.435 -8.140 -7.305 1.00 0.00 O ATOM 1102 CB LEU A 74 7.038 -10.093 -8.668 1.00 0.00 C ATOM 1103 CG LEU A 74 6.026 -11.240 -8.452 1.00 0.00 C ATOM 1104 CD1 LEU A 74 4.712 -10.937 -9.174 1.00 0.00 C ATOM 1105 CD2 LEU A 74 6.556 -12.589 -8.942 1.00 0.00 C ATOM 0 H LEU A 74 7.799 -9.275 -6.074 1.00 0.00 H new ATOM 0 HA LEU A 74 8.838 -11.142 -8.128 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.554 -9.149 -8.418 1.00 0.00 H new ATOM 0 HB3 LEU A 74 7.295 -10.049 -9.726 1.00 0.00 H new ATOM 0 HG LEU A 74 5.862 -11.308 -7.377 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.010 -11.755 -9.011 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.287 -10.012 -8.784 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.901 -10.828 -10.242 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.806 -13.360 -8.767 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.772 -12.529 -10.009 1.00 0.00 H new ATOM 0 HD23 LEU A 74 7.468 -12.840 -8.400 1.00 0.00 H new ATOM 1117 N SER A 75 9.866 -8.989 -9.321 1.00 0.00 N ATOM 1118 CA SER A 75 10.703 -7.882 -9.749 1.00 0.00 C ATOM 1119 C SER A 75 10.548 -7.661 -11.252 1.00 0.00 C ATOM 1120 O SER A 75 10.252 -8.610 -11.981 1.00 0.00 O ATOM 1121 CB SER A 75 12.151 -8.129 -9.293 1.00 0.00 C ATOM 1122 OG SER A 75 12.609 -9.442 -9.553 1.00 0.00 O ATOM 0 H SER A 75 9.776 -9.728 -10.018 1.00 0.00 H new ATOM 0 HA SER A 75 10.387 -6.951 -9.279 1.00 0.00 H new ATOM 0 HB2 SER A 75 12.808 -7.418 -9.794 1.00 0.00 H new ATOM 0 HB3 SER A 75 12.225 -7.932 -8.224 1.00 0.00 H new ATOM 0 HG SER A 75 13.146 -9.757 -8.796 1.00 0.00 H new ATOM 1128 N ILE A 76 10.806 -6.425 -11.697 1.00 0.00 N ATOM 1129 CA ILE A 76 10.662 -5.972 -13.078 1.00 0.00 C ATOM 1130 C ILE A 76 11.972 -5.367 -13.578 1.00 0.00 C ATOM 1131 O ILE A 76 12.284 -5.522 -14.752 1.00 0.00 O ATOM 1132 CB ILE A 76 9.483 -4.978 -13.203 1.00 0.00 C ATOM 1133 CG1 ILE A 76 8.108 -5.598 -12.893 1.00 0.00 C ATOM 1134 CG2 ILE A 76 9.428 -4.309 -14.588 1.00 0.00 C ATOM 1135 CD1 ILE A 76 7.646 -6.647 -13.904 1.00 0.00 C ATOM 0 H ILE A 76 11.134 -5.686 -11.075 1.00 0.00 H new ATOM 0 HA ILE A 76 10.433 -6.830 -13.711 1.00 0.00 H new ATOM 0 HB ILE A 76 9.688 -4.226 -12.442 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.144 -6.055 -11.904 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.365 -4.801 -12.849 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.584 -3.620 -14.626 1.00 0.00 H new ATOM 0 HG22 ILE A 76 10.353 -3.759 -14.764 1.00 0.00 H new ATOM 0 HG23 ILE A 76 9.308 -5.073 -15.356 1.00 0.00 H new ATOM 0 HD11 ILE A 76 6.669 -7.031 -13.609 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.574 -6.193 -14.892 1.00 0.00 H new ATOM 0 HD13 ILE A 76 8.365 -7.466 -13.932 1.00 0.00 H new ATOM 1147 N ARG A 77 12.827 -4.801 -12.721 1.00 0.00 N ATOM 1148 CA ARG A 77 14.183 -4.422 -13.127 1.00 0.00 C ATOM 1149 C ARG A 77 14.987 -5.607 -13.671 1.00 0.00 C ATOM 1150 O ARG A 77 15.971 -5.414 -14.371 1.00 0.00 O ATOM 1151 CB ARG A 77 14.892 -3.675 -11.988 1.00 0.00 C ATOM 1152 CG ARG A 77 15.369 -4.515 -10.792 1.00 0.00 C ATOM 1153 CD ARG A 77 16.142 -3.635 -9.796 1.00 0.00 C ATOM 1154 NE ARG A 77 16.694 -4.440 -8.684 1.00 0.00 N ATOM 1155 CZ ARG A 77 16.460 -4.237 -7.374 1.00 0.00 C ATOM 1156 NH1 ARG A 77 15.767 -3.196 -6.933 1.00 0.00 N ATOM 1157 NH2 ARG A 77 16.915 -5.123 -6.492 1.00 0.00 N ATOM 0 H ARG A 77 12.606 -4.596 -11.747 1.00 0.00 H new ATOM 0 HA ARG A 77 14.106 -3.731 -13.967 1.00 0.00 H new ATOM 0 HB2 ARG A 77 15.757 -3.161 -12.407 1.00 0.00 H new ATOM 0 HB3 ARG A 77 14.215 -2.907 -11.614 1.00 0.00 H new ATOM 0 HG2 ARG A 77 14.513 -4.972 -10.296 1.00 0.00 H new ATOM 0 HG3 ARG A 77 16.007 -5.327 -11.141 1.00 0.00 H new ATOM 0 HD2 ARG A 77 16.952 -3.122 -10.314 1.00 0.00 H new ATOM 0 HD3 ARG A 77 15.481 -2.866 -9.398 1.00 0.00 H new ATOM 0 HE ARG A 77 17.306 -5.217 -8.932 1.00 0.00 H new ATOM 0 HH11 ARG A 77 15.391 -2.516 -7.594 1.00 0.00 H new ATOM 0 HH12 ARG A 77 15.610 -3.075 -5.933 1.00 0.00 H new ATOM 0 HH21 ARG A 77 17.433 -5.941 -6.812 1.00 0.00 H new ATOM 0 HH22 ARG A 77 16.746 -4.984 -5.496 1.00 0.00 H new ATOM 1171 N ALA A 78 14.607 -6.827 -13.291 1.00 0.00 N ATOM 1172 CA ALA A 78 15.164 -8.063 -13.807 1.00 0.00 C ATOM 1173 C ALA A 78 14.681 -8.430 -15.217 1.00 0.00 C ATOM 1174 O ALA A 78 15.309 -9.287 -15.831 1.00 0.00 O ATOM 1175 CB ALA A 78 14.785 -9.174 -12.826 1.00 0.00 C ATOM 0 H ALA A 78 13.879 -6.980 -12.593 1.00 0.00 H new ATOM 0 HA ALA A 78 16.243 -7.934 -13.896 1.00 0.00 H new ATOM 0 HB1 ALA A 78 15.187 -10.124 -13.179 1.00 0.00 H new ATOM 0 HB2 ALA A 78 15.199 -8.948 -11.843 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.699 -9.243 -12.756 1.00 0.00 H new ATOM 1181 N THR A 79 13.568 -7.870 -15.703 1.00 0.00 N ATOM 1182 CA THR A 79 12.876 -8.337 -16.911 1.00 0.00 C ATOM 1183 C THR A 79 12.715 -7.225 -17.957 1.00 0.00 C ATOM 1184 O THR A 79 12.578 -7.513 -19.146 1.00 0.00 O ATOM 1185 CB THR A 79 11.505 -8.926 -16.522 1.00 0.00 C ATOM 1186 OG1 THR A 79 10.731 -7.975 -15.822 1.00 0.00 O ATOM 1187 CG2 THR A 79 11.620 -10.126 -15.576 1.00 0.00 C ATOM 0 H THR A 79 13.116 -7.069 -15.263 1.00 0.00 H new ATOM 0 HA THR A 79 13.489 -9.111 -17.372 1.00 0.00 H new ATOM 0 HB THR A 79 11.049 -9.225 -17.466 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.835 -8.338 -15.660 1.00 0.00 H new ATOM 0 HG21 THR A 79 10.624 -10.498 -15.337 1.00 0.00 H new ATOM 0 HG22 THR A 79 12.196 -10.916 -16.058 1.00 0.00 H new ATOM 0 HG23 THR A 79 12.122 -9.819 -14.659 1.00 0.00 H new ATOM 1195 N GLN A 80 12.733 -5.963 -17.532 1.00 0.00 N ATOM 1196 CA GLN A 80 12.560 -4.775 -18.352 1.00 0.00 C ATOM 1197 C GLN A 80 13.609 -3.730 -17.943 1.00 0.00 C ATOM 1198 O GLN A 80 14.367 -3.923 -16.987 1.00 0.00 O ATOM 1199 CB GLN A 80 11.128 -4.220 -18.194 1.00 0.00 C ATOM 1200 CG GLN A 80 10.020 -5.224 -18.556 1.00 0.00 C ATOM 1201 CD GLN A 80 8.652 -4.554 -18.700 1.00 0.00 C ATOM 1202 OE1 GLN A 80 8.017 -4.141 -17.609 1.00 0.00 O flip ATOM 1203 NE2 GLN A 80 8.148 -4.390 -19.801 1.00 0.00 N flip ATOM 0 H GLN A 80 12.877 -5.734 -16.549 1.00 0.00 H new ATOM 0 HA GLN A 80 12.702 -5.026 -19.403 1.00 0.00 H new ATOM 0 HB2 GLN A 80 10.987 -3.897 -17.163 1.00 0.00 H new ATOM 0 HB3 GLN A 80 11.021 -3.336 -18.823 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.277 -5.724 -19.490 1.00 0.00 H new ATOM 0 HG3 GLN A 80 9.965 -5.994 -17.787 1.00 0.00 H new ATOM 0 HE21 GLN A 80 8.637 -4.708 -20.638 1.00 0.00 H new ATOM 0 HE22 GLN A 80 7.239 -3.935 -19.883 1.00 0.00 H new ATOM 1212 N ALA A 81 13.653 -2.606 -18.665 1.00 0.00 N ATOM 1213 CA ALA A 81 14.664 -1.566 -18.520 1.00 0.00 C ATOM 1214 C ALA A 81 14.023 -0.174 -18.451 1.00 0.00 C ATOM 1215 O ALA A 81 12.862 0.008 -18.822 1.00 0.00 O ATOM 1216 CB ALA A 81 15.649 -1.664 -19.690 1.00 0.00 C ATOM 0 H ALA A 81 12.964 -2.393 -19.386 1.00 0.00 H new ATOM 0 HA ALA A 81 15.201 -1.715 -17.583 1.00 0.00 H new ATOM 0 HB1 ALA A 81 16.410 -0.890 -19.591 1.00 0.00 H new ATOM 0 HB2 ALA A 81 16.126 -2.644 -19.683 1.00 0.00 H new ATOM 0 HB3 ALA A 81 15.113 -1.528 -20.629 1.00 0.00 H new ATOM 1222 N ALA A 82 14.778 0.794 -17.924 1.00 0.00 N ATOM 1223 CA ALA A 82 14.384 2.198 -17.898 1.00 0.00 C ATOM 1224 C ALA A 82 14.117 2.740 -19.317 1.00 0.00 C ATOM 1225 O ALA A 82 14.750 2.277 -20.262 1.00 0.00 O ATOM 1226 CB ALA A 82 15.485 3.014 -17.206 1.00 0.00 C ATOM 0 H ALA A 82 15.689 0.619 -17.500 1.00 0.00 H new ATOM 0 HA ALA A 82 13.452 2.289 -17.340 1.00 0.00 H new ATOM 0 HB1 ALA A 82 15.198 4.065 -17.182 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.620 2.652 -16.187 1.00 0.00 H new ATOM 0 HB3 ALA A 82 16.419 2.905 -17.757 1.00 0.00 H new ATOM 1232 N PRO A 83 13.222 3.734 -19.467 1.00 0.00 N ATOM 1233 CA PRO A 83 13.033 4.424 -20.736 1.00 0.00 C ATOM 1234 C PRO A 83 14.281 5.240 -21.099 1.00 0.00 C ATOM 1235 O PRO A 83 15.058 5.617 -20.219 1.00 0.00 O ATOM 1236 CB PRO A 83 11.806 5.323 -20.534 1.00 0.00 C ATOM 1237 CG PRO A 83 11.795 5.590 -19.027 1.00 0.00 C ATOM 1238 CD PRO A 83 12.378 4.308 -18.431 1.00 0.00 C ATOM 0 HA PRO A 83 12.878 3.730 -21.562 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.890 6.248 -21.104 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.890 4.830 -20.860 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.397 6.462 -18.770 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.786 5.780 -18.661 1.00 0.00 H new ATOM 0 HD2 PRO A 83 12.955 4.523 -17.532 1.00 0.00 H new ATOM 0 HD3 PRO A 83 11.587 3.616 -18.144 1.00 0.00 H new ATOM 1246 N GLU A 84 14.387 5.624 -22.374 1.00 0.00 N ATOM 1247 CA GLU A 84 15.549 6.348 -22.899 1.00 0.00 C ATOM 1248 C GLU A 84 15.621 7.787 -22.368 1.00 0.00 C ATOM 1249 O GLU A 84 16.673 8.423 -22.393 1.00 0.00 O ATOM 1250 CB GLU A 84 15.485 6.371 -24.435 1.00 0.00 C ATOM 1251 CG GLU A 84 15.626 4.989 -25.092 1.00 0.00 C ATOM 1252 CD GLU A 84 17.001 4.346 -24.864 1.00 0.00 C ATOM 1253 OE1 GLU A 84 17.957 4.763 -25.557 1.00 0.00 O ATOM 1254 OE2 GLU A 84 17.068 3.434 -24.012 1.00 0.00 O ATOM 0 H GLU A 84 13.668 5.441 -23.074 1.00 0.00 H new ATOM 0 HA GLU A 84 16.445 5.826 -22.563 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.536 6.811 -24.741 1.00 0.00 H new ATOM 0 HB3 GLU A 84 16.275 7.022 -24.811 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.854 4.327 -24.700 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.450 5.084 -26.164 1.00 0.00 H new ATOM 1261 N LYS A 85 14.497 8.340 -21.899 1.00 0.00 N ATOM 1262 CA LYS A 85 14.377 9.691 -21.359 1.00 0.00 C ATOM 1263 C LYS A 85 13.250 9.686 -20.333 1.00 0.00 C ATOM 1264 O LYS A 85 12.355 8.838 -20.410 1.00 0.00 O ATOM 1265 CB LYS A 85 14.083 10.644 -22.532 1.00 0.00 C ATOM 1266 CG LYS A 85 14.046 12.149 -22.211 1.00 0.00 C ATOM 1267 CD LYS A 85 15.353 12.679 -21.597 1.00 0.00 C ATOM 1268 CE LYS A 85 15.433 14.212 -21.613 1.00 0.00 C ATOM 1269 NZ LYS A 85 14.461 14.844 -20.691 1.00 0.00 N ATOM 0 H LYS A 85 13.611 7.834 -21.887 1.00 0.00 H new ATOM 0 HA LYS A 85 15.290 10.024 -20.865 1.00 0.00 H new ATOM 0 HB2 LYS A 85 14.838 10.479 -23.301 1.00 0.00 H new ATOM 0 HB3 LYS A 85 13.122 10.365 -22.964 1.00 0.00 H new ATOM 0 HG2 LYS A 85 13.833 12.702 -23.126 1.00 0.00 H new ATOM 0 HG3 LYS A 85 13.225 12.345 -21.522 1.00 0.00 H new ATOM 0 HD2 LYS A 85 15.437 12.325 -20.570 1.00 0.00 H new ATOM 0 HD3 LYS A 85 16.201 12.269 -22.146 1.00 0.00 H new ATOM 0 HE2 LYS A 85 16.442 14.522 -21.340 1.00 0.00 H new ATOM 0 HE3 LYS A 85 15.253 14.571 -22.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 14.522 15.879 -20.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.499 14.532 -20.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 14.679 14.566 -19.713 1.00 0.00 H new ATOM 1283 N LYS A 86 13.283 10.626 -19.390 1.00 0.00 N ATOM 1284 CA LYS A 86 12.193 10.924 -18.466 1.00 0.00 C ATOM 1285 C LYS A 86 11.971 12.438 -18.482 1.00 0.00 C ATOM 1286 O LYS A 86 12.767 13.175 -19.062 1.00 0.00 O ATOM 1287 CB LYS A 86 12.551 10.439 -17.050 1.00 0.00 C ATOM 1288 CG LYS A 86 12.850 8.932 -16.978 1.00 0.00 C ATOM 1289 CD LYS A 86 13.092 8.478 -15.532 1.00 0.00 C ATOM 1290 CE LYS A 86 13.613 7.034 -15.509 1.00 0.00 C ATOM 1291 NZ LYS A 86 13.758 6.515 -14.129 1.00 0.00 N ATOM 0 H LYS A 86 14.098 11.221 -19.244 1.00 0.00 H new ATOM 0 HA LYS A 86 11.281 10.410 -18.769 1.00 0.00 H new ATOM 0 HB2 LYS A 86 13.420 10.992 -16.694 1.00 0.00 H new ATOM 0 HB3 LYS A 86 11.727 10.671 -16.375 1.00 0.00 H new ATOM 0 HG2 LYS A 86 12.015 8.373 -17.402 1.00 0.00 H new ATOM 0 HG3 LYS A 86 13.727 8.704 -17.584 1.00 0.00 H new ATOM 0 HD2 LYS A 86 13.812 9.140 -15.051 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.166 8.547 -14.962 1.00 0.00 H new ATOM 0 HE2 LYS A 86 12.929 6.394 -16.067 1.00 0.00 H new ATOM 0 HE3 LYS A 86 14.577 6.989 -16.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 14.408 5.703 -14.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 14.139 7.263 -13.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 12.829 6.214 -13.772 1.00 0.00 H new ATOM 1305 N GLU A 87 10.904 12.901 -17.834 1.00 0.00 N ATOM 1306 CA GLU A 87 10.590 14.320 -17.700 1.00 0.00 C ATOM 1307 C GLU A 87 10.171 14.574 -16.250 1.00 0.00 C ATOM 1308 O GLU A 87 9.756 13.645 -15.546 1.00 0.00 O ATOM 1309 CB GLU A 87 9.453 14.701 -18.662 1.00 0.00 C ATOM 1310 CG GLU A 87 9.807 14.580 -20.160 1.00 0.00 C ATOM 1311 CD GLU A 87 11.005 15.434 -20.617 1.00 0.00 C ATOM 1312 OE1 GLU A 87 11.138 16.559 -20.095 1.00 0.00 O ATOM 1313 OE2 GLU A 87 11.830 14.943 -21.432 1.00 0.00 O ATOM 0 H GLU A 87 10.224 12.291 -17.381 1.00 0.00 H new ATOM 0 HA GLU A 87 11.459 14.928 -17.950 1.00 0.00 H new ATOM 0 HB2 GLU A 87 8.592 14.066 -18.454 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.150 15.728 -18.456 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.019 13.535 -20.385 1.00 0.00 H new ATOM 0 HG3 GLU A 87 8.934 14.862 -20.748 1.00 0.00 H new ATOM 1320 N SER A 88 10.280 15.823 -15.790 1.00 0.00 N ATOM 1321 CA SER A 88 10.024 16.200 -14.402 1.00 0.00 C ATOM 1322 C SER A 88 8.574 15.883 -14.011 1.00 0.00 C ATOM 1323 O SER A 88 8.322 15.179 -13.023 1.00 0.00 O ATOM 1324 CB SER A 88 10.343 17.693 -14.227 1.00 0.00 C ATOM 1325 OG SER A 88 11.606 17.995 -14.785 1.00 0.00 O ATOM 0 H SER A 88 10.552 16.609 -16.380 1.00 0.00 H new ATOM 0 HA SER A 88 10.666 15.621 -13.738 1.00 0.00 H new ATOM 0 HB2 SER A 88 9.572 18.295 -14.708 1.00 0.00 H new ATOM 0 HB3 SER A 88 10.335 17.952 -13.168 1.00 0.00 H new ATOM 0 HG SER A 88 11.664 18.957 -14.961 1.00 0.00 H new ATOM 1331 N LYS A 89 7.629 16.409 -14.794 1.00 0.00 N ATOM 1332 CA LYS A 89 6.207 16.097 -14.710 1.00 0.00 C ATOM 1333 C LYS A 89 5.944 14.727 -15.366 1.00 0.00 C ATOM 1334 O LYS A 89 6.568 14.448 -16.385 1.00 0.00 O ATOM 1335 CB LYS A 89 5.472 17.226 -15.450 1.00 0.00 C ATOM 1336 CG LYS A 89 3.942 17.090 -15.476 1.00 0.00 C ATOM 1337 CD LYS A 89 3.301 18.114 -16.430 1.00 0.00 C ATOM 1338 CE LYS A 89 2.066 17.549 -17.149 1.00 0.00 C ATOM 1339 NZ LYS A 89 2.431 16.517 -18.150 1.00 0.00 N ATOM 0 H LYS A 89 7.843 17.085 -15.527 1.00 0.00 H new ATOM 0 HA LYS A 89 5.858 16.033 -13.679 1.00 0.00 H new ATOM 0 HB2 LYS A 89 5.730 18.176 -14.982 1.00 0.00 H new ATOM 0 HB3 LYS A 89 5.837 17.266 -16.476 1.00 0.00 H new ATOM 0 HG2 LYS A 89 3.671 16.081 -15.787 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.546 17.230 -14.470 1.00 0.00 H new ATOM 0 HD2 LYS A 89 3.016 19.003 -15.867 1.00 0.00 H new ATOM 0 HD3 LYS A 89 4.037 18.428 -17.170 1.00 0.00 H new ATOM 0 HE2 LYS A 89 1.385 17.118 -16.415 1.00 0.00 H new ATOM 0 HE3 LYS A 89 1.531 18.360 -17.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 1.576 16.008 -18.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 2.872 16.973 -18.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.102 15.845 -17.727 1.00 0.00 H new ATOM 1353 N PRO A 90 4.993 13.915 -14.868 1.00 0.00 N ATOM 1354 CA PRO A 90 4.522 12.724 -15.563 1.00 0.00 C ATOM 1355 C PRO A 90 4.108 13.007 -17.015 1.00 0.00 C ATOM 1356 O PRO A 90 3.636 14.098 -17.365 1.00 0.00 O ATOM 1357 CB PRO A 90 3.347 12.189 -14.738 1.00 0.00 C ATOM 1358 CG PRO A 90 3.627 12.720 -13.330 1.00 0.00 C ATOM 1359 CD PRO A 90 4.325 14.057 -13.585 1.00 0.00 C ATOM 0 HA PRO A 90 5.324 11.990 -15.642 1.00 0.00 H new ATOM 0 HB2 PRO A 90 2.392 12.549 -15.120 1.00 0.00 H new ATOM 0 HB3 PRO A 90 3.307 11.100 -14.756 1.00 0.00 H new ATOM 0 HG2 PRO A 90 2.707 12.850 -12.760 1.00 0.00 H new ATOM 0 HG3 PRO A 90 4.260 12.038 -12.763 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.606 14.876 -13.607 1.00 0.00 H new ATOM 0 HD3 PRO A 90 5.040 14.282 -12.794 1.00 0.00 H new ATOM 1367 N ARG A 91 4.194 11.980 -17.864 1.00 0.00 N ATOM 1368 CA ARG A 91 3.981 12.130 -19.308 1.00 0.00 C ATOM 1369 C ARG A 91 2.515 12.293 -19.714 1.00 0.00 C ATOM 1370 O ARG A 91 2.234 12.693 -20.836 1.00 0.00 O ATOM 1371 CB ARG A 91 4.673 10.981 -20.060 1.00 0.00 C ATOM 1372 CG ARG A 91 4.039 9.594 -19.847 1.00 0.00 C ATOM 1373 CD ARG A 91 4.821 8.487 -20.573 1.00 0.00 C ATOM 1374 NE ARG A 91 6.144 8.246 -19.963 1.00 0.00 N ATOM 1375 CZ ARG A 91 6.429 7.322 -19.032 1.00 0.00 C ATOM 1376 NH1 ARG A 91 5.516 6.454 -18.610 1.00 0.00 N ATOM 1377 NH2 ARG A 91 7.657 7.241 -18.540 1.00 0.00 N ATOM 0 H ARG A 91 4.412 11.027 -17.574 1.00 0.00 H new ATOM 0 HA ARG A 91 4.442 13.074 -19.600 1.00 0.00 H new ATOM 0 HB2 ARG A 91 4.667 11.208 -21.126 1.00 0.00 H new ATOM 0 HB3 ARG A 91 5.717 10.939 -19.749 1.00 0.00 H new ATOM 0 HG2 ARG A 91 4.002 9.372 -18.780 1.00 0.00 H new ATOM 0 HG3 ARG A 91 3.010 9.606 -20.206 1.00 0.00 H new ATOM 0 HD2 ARG A 91 4.241 7.564 -20.556 1.00 0.00 H new ATOM 0 HD3 ARG A 91 4.950 8.763 -21.620 1.00 0.00 H new ATOM 0 HE ARG A 91 6.913 8.837 -20.279 1.00 0.00 H new ATOM 0 HH11 ARG A 91 4.572 6.480 -18.995 1.00 0.00 H new ATOM 0 HH12 ARG A 91 5.759 5.762 -17.901 1.00 0.00 H new ATOM 0 HH21 ARG A 91 8.381 7.879 -18.869 1.00 0.00 H new ATOM 0 HH22 ARG A 91 7.878 6.540 -17.832 1.00 0.00 H new ATOM 1391 N LYS A 92 1.558 11.997 -18.828 1.00 0.00 N ATOM 1392 CA LYS A 92 0.135 12.224 -19.100 1.00 0.00 C ATOM 1393 C LYS A 92 -0.103 13.717 -19.384 1.00 0.00 C ATOM 1394 O LYS A 92 0.513 14.551 -18.711 1.00 0.00 O ATOM 1395 CB LYS A 92 -0.724 11.724 -17.926 1.00 0.00 C ATOM 1396 CG LYS A 92 -0.590 10.204 -17.722 1.00 0.00 C ATOM 1397 CD LYS A 92 -1.464 9.667 -16.576 1.00 0.00 C ATOM 1398 CE LYS A 92 -2.978 9.722 -16.853 1.00 0.00 C ATOM 1399 NZ LYS A 92 -3.407 8.774 -17.909 1.00 0.00 N ATOM 0 H LYS A 92 1.746 11.596 -17.909 1.00 0.00 H new ATOM 0 HA LYS A 92 -0.162 11.657 -19.982 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -0.427 12.240 -17.013 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.769 11.975 -18.108 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.861 9.695 -18.647 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.453 9.962 -17.519 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -1.181 8.634 -16.373 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -1.251 10.240 -15.673 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -3.519 9.501 -15.933 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -3.251 10.735 -17.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -4.434 8.855 -18.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -2.915 8.998 -18.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -3.174 7.803 -17.619 1.00 0.00 H new ATOM 1413 N PRO A 93 -1.064 14.084 -20.251 1.00 0.00 N ATOM 1414 CA PRO A 93 -1.209 15.456 -20.736 1.00 0.00 C ATOM 1415 C PRO A 93 -1.553 16.475 -19.639 1.00 0.00 C ATOM 1416 O PRO A 93 -1.216 17.644 -19.775 1.00 0.00 O ATOM 1417 CB PRO A 93 -2.274 15.409 -21.838 1.00 0.00 C ATOM 1418 CG PRO A 93 -3.045 14.115 -21.568 1.00 0.00 C ATOM 1419 CD PRO A 93 -1.983 13.202 -20.951 1.00 0.00 C ATOM 0 HA PRO A 93 -0.252 15.813 -21.118 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -2.930 16.279 -21.794 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -1.820 15.402 -22.829 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -3.881 14.278 -20.888 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -3.457 13.692 -22.484 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -2.434 12.484 -20.266 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -1.466 12.628 -21.720 1.00 0.00 H new ATOM 1427 N LYS A 94 -2.147 16.041 -18.521 1.00 0.00 N ATOM 1428 CA LYS A 94 -2.471 16.891 -17.368 1.00 0.00 C ATOM 1429 C LYS A 94 -2.058 16.261 -16.037 1.00 0.00 C ATOM 1430 O LYS A 94 -2.583 16.633 -14.994 1.00 0.00 O ATOM 1431 CB LYS A 94 -3.955 17.301 -17.426 1.00 0.00 C ATOM 1432 CG LYS A 94 -4.942 16.122 -17.390 1.00 0.00 C ATOM 1433 CD LYS A 94 -6.398 16.613 -17.382 1.00 0.00 C ATOM 1434 CE LYS A 94 -7.366 15.420 -17.360 1.00 0.00 C ATOM 1435 NZ LYS A 94 -8.785 15.849 -17.373 1.00 0.00 N ATOM 0 H LYS A 94 -2.422 15.068 -18.389 1.00 0.00 H new ATOM 0 HA LYS A 94 -1.876 17.803 -17.428 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -4.169 17.964 -16.588 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.126 17.874 -18.337 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -4.777 15.480 -18.256 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -4.756 15.516 -16.504 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -6.570 17.245 -16.511 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -6.586 17.226 -18.263 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -7.173 14.782 -18.223 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -7.178 14.819 -16.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.401 15.011 -17.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -8.978 16.436 -16.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -8.973 16.401 -18.234 1.00 0.00 H new ATOM 1449 N ALA A 95 -1.147 15.281 -16.080 1.00 0.00 N ATOM 1450 CA ALA A 95 -0.638 14.549 -14.920 1.00 0.00 C ATOM 1451 C ALA A 95 -1.739 13.992 -13.998 1.00 0.00 C ATOM 1452 O ALA A 95 -1.468 13.760 -12.825 1.00 0.00 O ATOM 1453 CB ALA A 95 0.411 15.384 -14.160 1.00 0.00 C ATOM 0 H ALA A 95 -0.731 14.967 -16.957 1.00 0.00 H new ATOM 0 HA ALA A 95 -0.140 13.661 -15.310 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.774 14.818 -13.302 1.00 0.00 H new ATOM 0 HB2 ALA A 95 1.245 15.612 -14.824 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.043 16.313 -13.816 1.00 0.00 H new ATOM 1459 N ALA A 96 -2.938 13.712 -14.522 1.00 0.00 N ATOM 1460 CA ALA A 96 -4.047 13.113 -13.772 1.00 0.00 C ATOM 1461 C ALA A 96 -3.847 11.596 -13.599 1.00 0.00 C ATOM 1462 O ALA A 96 -4.595 10.793 -14.161 1.00 0.00 O ATOM 1463 CB ALA A 96 -5.366 13.462 -14.473 1.00 0.00 C ATOM 0 H ALA A 96 -3.168 13.899 -15.498 1.00 0.00 H new ATOM 0 HA ALA A 96 -4.078 13.525 -12.763 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -6.198 13.021 -13.923 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -5.485 14.545 -14.505 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.353 13.068 -15.489 1.00 0.00 H new ATOM 1469 N GLN A 97 -2.706 11.217 -13.024 1.00 0.00 N ATOM 1470 CA GLN A 97 -2.355 9.841 -12.707 1.00 0.00 C ATOM 1471 C GLN A 97 -3.316 9.183 -11.705 1.00 0.00 C ATOM 1472 O GLN A 97 -4.154 9.831 -11.087 1.00 0.00 O ATOM 1473 CB GLN A 97 -0.898 9.790 -12.214 1.00 0.00 C ATOM 1474 CG GLN A 97 -0.669 10.455 -10.848 1.00 0.00 C ATOM 1475 CD GLN A 97 0.760 10.273 -10.353 1.00 0.00 C ATOM 1476 OE1 GLN A 97 1.685 10.785 -10.975 1.00 0.00 O ATOM 1477 NE2 GLN A 97 0.950 9.595 -9.232 1.00 0.00 N ATOM 0 H GLN A 97 -1.981 11.883 -12.759 1.00 0.00 H new ATOM 0 HA GLN A 97 -2.452 9.255 -13.621 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -0.583 8.748 -12.155 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -0.260 10.275 -12.953 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -0.894 11.519 -10.921 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -1.361 10.033 -10.119 1.00 0.00 H new ATOM 0 HE21 GLN A 97 0.155 9.184 -8.744 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.892 9.484 -8.857 1.00 0.00 H new ATOM 1486 N VAL A 98 -3.122 7.881 -11.516 1.00 0.00 N ATOM 1487 CA VAL A 98 -3.699 7.077 -10.445 1.00 0.00 C ATOM 1488 C VAL A 98 -2.545 6.403 -9.702 1.00 0.00 C ATOM 1489 O VAL A 98 -1.516 6.130 -10.323 1.00 0.00 O ATOM 1490 CB VAL A 98 -4.709 6.069 -11.036 1.00 0.00 C ATOM 1491 CG1 VAL A 98 -5.948 6.805 -11.570 1.00 0.00 C ATOM 1492 CG2 VAL A 98 -4.135 5.212 -12.180 1.00 0.00 C ATOM 0 H VAL A 98 -2.528 7.331 -12.137 1.00 0.00 H new ATOM 0 HA VAL A 98 -4.258 7.687 -9.735 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.965 5.401 -10.214 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -6.651 6.082 -11.983 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -6.426 7.351 -10.756 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -5.647 7.505 -12.349 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -4.903 4.529 -12.543 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -3.812 5.861 -12.994 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -3.283 4.639 -11.813 1.00 0.00 H new ATOM 1502 N SER A 99 -2.705 6.146 -8.406 1.00 0.00 N ATOM 1503 CA SER A 99 -1.620 5.668 -7.543 1.00 0.00 C ATOM 1504 C SER A 99 -2.052 4.469 -6.700 1.00 0.00 C ATOM 1505 O SER A 99 -1.222 3.622 -6.396 1.00 0.00 O ATOM 1506 CB SER A 99 -1.112 6.822 -6.674 1.00 0.00 C ATOM 1507 OG SER A 99 -0.662 7.899 -7.488 1.00 0.00 O ATOM 0 H SER A 99 -3.594 6.263 -7.920 1.00 0.00 H new ATOM 0 HA SER A 99 -0.801 5.319 -8.172 1.00 0.00 H new ATOM 0 HB2 SER A 99 -1.908 7.166 -6.014 1.00 0.00 H new ATOM 0 HB3 SER A 99 -0.298 6.475 -6.038 1.00 0.00 H new ATOM 0 HG SER A 99 0.008 8.421 -6.999 1.00 0.00 H new ATOM 1513 N GLU A 100 -3.353 4.340 -6.447 1.00 0.00 N ATOM 1514 CA GLU A 100 -4.030 3.163 -5.912 1.00 0.00 C ATOM 1515 C GLU A 100 -5.369 3.092 -6.649 1.00 0.00 C ATOM 1516 O GLU A 100 -5.722 2.098 -7.277 1.00 0.00 O ATOM 1517 CB GLU A 100 -4.301 3.324 -4.403 1.00 0.00 C ATOM 1518 CG GLU A 100 -3.062 3.177 -3.501 1.00 0.00 C ATOM 1519 CD GLU A 100 -2.130 4.398 -3.437 1.00 0.00 C ATOM 1520 OE1 GLU A 100 -2.609 5.523 -3.745 1.00 0.00 O ATOM 1521 OE2 GLU A 100 -0.950 4.213 -3.044 1.00 0.00 O ATOM 0 H GLU A 100 -4.004 5.106 -6.622 1.00 0.00 H new ATOM 0 HA GLU A 100 -3.422 2.268 -6.047 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -4.743 4.306 -4.231 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -5.042 2.584 -4.101 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -3.398 2.947 -2.490 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -2.484 2.320 -3.847 1.00 0.00 H new ATOM 1528 N GLU A 101 -6.039 4.241 -6.647 1.00 0.00 N ATOM 1529 CA GLU A 101 -7.168 4.650 -7.462 1.00 0.00 C ATOM 1530 C GLU A 101 -6.831 6.099 -7.865 1.00 0.00 C ATOM 1531 O GLU A 101 -5.648 6.457 -7.925 1.00 0.00 O ATOM 1532 CB GLU A 101 -8.465 4.534 -6.633 1.00 0.00 C ATOM 1533 CG GLU A 101 -8.818 3.088 -6.244 1.00 0.00 C ATOM 1534 CD GLU A 101 -10.176 2.987 -5.529 1.00 0.00 C ATOM 1535 OE1 GLU A 101 -10.195 3.121 -4.283 1.00 0.00 O ATOM 1536 OE2 GLU A 101 -11.188 2.801 -6.243 1.00 0.00 O ATOM 0 H GLU A 101 -5.771 4.985 -6.003 1.00 0.00 H new ATOM 0 HA GLU A 101 -7.333 4.034 -8.346 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.362 5.131 -5.727 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -9.290 4.960 -7.203 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -8.835 2.468 -7.140 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -8.038 2.689 -5.595 1.00 0.00 H new ATOM 1543 N ALA A 102 -7.818 6.971 -8.100 1.00 0.00 N ATOM 1544 CA ALA A 102 -7.628 8.427 -8.175 1.00 0.00 C ATOM 1545 C ALA A 102 -7.296 9.057 -6.801 1.00 0.00 C ATOM 1546 O ALA A 102 -7.796 10.128 -6.460 1.00 0.00 O ATOM 1547 CB ALA A 102 -8.875 9.052 -8.813 1.00 0.00 C ATOM 0 H ALA A 102 -8.785 6.683 -8.246 1.00 0.00 H new ATOM 0 HA ALA A 102 -6.759 8.637 -8.799 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.749 10.133 -8.875 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.014 8.644 -9.814 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -9.749 8.823 -8.203 1.00 0.00 H new ATOM 1553 N SER A 103 -6.529 8.347 -5.968 1.00 0.00 N ATOM 1554 CA SER A 103 -5.997 8.809 -4.695 1.00 0.00 C ATOM 1555 C SER A 103 -5.211 10.114 -4.867 1.00 0.00 C ATOM 1556 O SER A 103 -5.450 11.088 -4.154 1.00 0.00 O ATOM 1557 CB SER A 103 -5.129 7.692 -4.077 1.00 0.00 C ATOM 1558 OG SER A 103 -4.479 6.873 -5.048 1.00 0.00 O ATOM 0 H SER A 103 -6.252 7.388 -6.179 1.00 0.00 H new ATOM 0 HA SER A 103 -6.820 9.029 -4.015 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.376 8.143 -3.431 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.756 7.064 -3.444 1.00 0.00 H new ATOM 0 HG SER A 103 -3.685 6.460 -4.649 1.00 0.00 H new ATOM 1564 N THR A 104 -4.279 10.145 -5.813 1.00 0.00 N ATOM 1565 CA THR A 104 -3.663 11.370 -6.294 1.00 0.00 C ATOM 1566 C THR A 104 -4.672 12.157 -7.149 1.00 0.00 C ATOM 1567 O THR A 104 -5.216 11.601 -8.099 1.00 0.00 O ATOM 1568 CB THR A 104 -2.416 11.002 -7.115 1.00 0.00 C ATOM 1569 OG1 THR A 104 -2.640 9.804 -7.834 1.00 0.00 O ATOM 1570 CG2 THR A 104 -1.222 10.773 -6.181 1.00 0.00 C ATOM 0 H THR A 104 -3.927 9.305 -6.272 1.00 0.00 H new ATOM 0 HA THR A 104 -3.366 12.001 -5.456 1.00 0.00 H new ATOM 0 HB THR A 104 -2.210 11.822 -7.803 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.904 9.179 -7.666 1.00 0.00 H new ATOM 0 HG21 THR A 104 -0.343 10.513 -6.771 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.023 11.683 -5.615 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.450 9.960 -5.492 1.00 0.00 H new ATOM 1578 N PRO A 105 -4.900 13.460 -6.898 1.00 0.00 N ATOM 1579 CA PRO A 105 -5.674 14.289 -7.820 1.00 0.00 C ATOM 1580 C PRO A 105 -4.874 14.535 -9.110 1.00 0.00 C ATOM 1581 O PRO A 105 -5.400 14.456 -10.220 1.00 0.00 O ATOM 1582 CB PRO A 105 -5.950 15.595 -7.062 1.00 0.00 C ATOM 1583 CG PRO A 105 -4.822 15.683 -6.028 1.00 0.00 C ATOM 1584 CD PRO A 105 -4.436 14.226 -5.753 1.00 0.00 C ATOM 0 HA PRO A 105 -6.606 13.814 -8.126 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -5.941 16.453 -7.734 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -6.928 15.576 -6.582 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -3.975 16.252 -6.412 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.156 16.183 -5.119 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.358 14.126 -5.629 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -4.897 13.868 -4.833 1.00 0.00 H new ATOM 1592 N GLN A 106 -3.581 14.825 -8.954 1.00 0.00 N ATOM 1593 CA GLN A 106 -2.575 14.903 -9.998 1.00 0.00 C ATOM 1594 C GLN A 106 -1.250 14.382 -9.413 1.00 0.00 C ATOM 1595 O GLN A 106 -1.125 14.187 -8.198 1.00 0.00 O ATOM 1596 CB GLN A 106 -2.405 16.358 -10.474 1.00 0.00 C ATOM 1597 CG GLN A 106 -3.598 16.915 -11.264 1.00 0.00 C ATOM 1598 CD GLN A 106 -3.355 18.358 -11.700 1.00 0.00 C ATOM 1599 OE1 GLN A 106 -3.469 19.293 -10.920 1.00 0.00 O ATOM 1600 NE2 GLN A 106 -3.024 18.581 -12.961 1.00 0.00 N ATOM 0 H GLN A 106 -3.190 15.023 -8.033 1.00 0.00 H new ATOM 0 HA GLN A 106 -2.877 14.303 -10.856 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -2.233 16.993 -9.605 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -1.512 16.421 -11.096 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -3.777 16.294 -12.142 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -4.497 16.866 -10.650 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -2.930 17.799 -13.609 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -2.863 19.535 -13.285 1.00 0.00 H new ATOM 1609 N GLY A 107 -0.263 14.160 -10.281 1.00 0.00 N ATOM 1610 CA GLY A 107 1.094 13.792 -9.899 1.00 0.00 C ATOM 1611 C GLY A 107 1.877 14.965 -9.309 1.00 0.00 C ATOM 1612 O GLY A 107 1.366 16.077 -9.170 1.00 0.00 O ATOM 0 H GLY A 107 -0.391 14.233 -11.290 1.00 0.00 H new ATOM 0 HA2 GLY A 107 1.055 12.982 -9.170 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.622 13.410 -10.772 1.00 0.00 H new ATOM 1616 N PHE A 108 3.148 14.716 -8.996 1.00 0.00 N ATOM 1617 CA PHE A 108 4.092 15.668 -8.414 1.00 0.00 C ATOM 1618 C PHE A 108 5.498 15.375 -8.962 1.00 0.00 C ATOM 1619 O PHE A 108 5.679 14.445 -9.749 1.00 0.00 O ATOM 1620 CB PHE A 108 4.017 15.560 -6.880 1.00 0.00 C ATOM 1621 CG PHE A 108 4.793 16.613 -6.111 1.00 0.00 C ATOM 1622 CD1 PHE A 108 4.447 17.972 -6.228 1.00 0.00 C ATOM 1623 CD2 PHE A 108 5.865 16.233 -5.282 1.00 0.00 C ATOM 1624 CE1 PHE A 108 5.180 18.947 -5.529 1.00 0.00 C ATOM 1625 CE2 PHE A 108 6.592 17.208 -4.579 1.00 0.00 C ATOM 1626 CZ PHE A 108 6.254 18.565 -4.706 1.00 0.00 C ATOM 0 H PHE A 108 3.568 13.799 -9.149 1.00 0.00 H new ATOM 0 HA PHE A 108 3.844 16.694 -8.686 1.00 0.00 H new ATOM 0 HB2 PHE A 108 2.970 15.614 -6.580 1.00 0.00 H new ATOM 0 HB3 PHE A 108 4.383 14.577 -6.584 1.00 0.00 H new ATOM 0 HD1 PHE A 108 3.618 18.266 -6.855 1.00 0.00 H new ATOM 0 HD2 PHE A 108 6.129 15.190 -5.186 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.918 19.990 -5.624 1.00 0.00 H new ATOM 0 HE2 PHE A 108 7.412 16.914 -3.940 1.00 0.00 H new ATOM 0 HZ PHE A 108 6.819 19.315 -4.172 1.00 0.00 H new ATOM 1636 N ASN A 109 6.498 16.176 -8.581 1.00 0.00 N ATOM 1637 CA ASN A 109 7.872 16.047 -9.054 1.00 0.00 C ATOM 1638 C ASN A 109 8.830 16.088 -7.867 1.00 0.00 C ATOM 1639 O ASN A 109 8.786 17.015 -7.067 1.00 0.00 O ATOM 1640 CB ASN A 109 8.203 17.190 -10.021 1.00 0.00 C ATOM 1641 CG ASN A 109 9.688 17.178 -10.354 1.00 0.00 C ATOM 1642 OD1 ASN A 109 10.432 18.069 -9.983 1.00 0.00 O ATOM 1643 ND2 ASN A 109 10.152 16.165 -11.067 1.00 0.00 N ATOM 0 H ASN A 109 6.369 16.945 -7.923 1.00 0.00 H new ATOM 0 HA ASN A 109 7.980 15.096 -9.575 1.00 0.00 H new ATOM 0 HB2 ASN A 109 7.617 17.086 -10.934 1.00 0.00 H new ATOM 0 HB3 ASN A 109 7.930 18.146 -9.574 1.00 0.00 H new ATOM 0 HD21 ASN A 109 11.141 16.124 -11.311 1.00 0.00 H new ATOM 0 HD22 ASN A 109 9.520 15.425 -11.372 1.00 0.00 H new ATOM 1650 N THR A 110 9.701 15.085 -7.766 1.00 0.00 N ATOM 1651 CA THR A 110 10.734 14.987 -6.741 1.00 0.00 C ATOM 1652 C THR A 110 11.888 15.965 -6.998 1.00 0.00 C ATOM 1653 O THR A 110 12.333 16.665 -6.085 1.00 0.00 O ATOM 1654 CB THR A 110 11.242 13.531 -6.721 1.00 0.00 C ATOM 1655 OG1 THR A 110 11.464 13.067 -8.049 1.00 0.00 O ATOM 1656 CG2 THR A 110 10.207 12.594 -6.089 1.00 0.00 C ATOM 0 H THR A 110 9.706 14.297 -8.414 1.00 0.00 H new ATOM 0 HA THR A 110 10.312 15.257 -5.773 1.00 0.00 H new ATOM 0 HB THR A 110 12.165 13.524 -6.141 1.00 0.00 H new ATOM 0 HG1 THR A 110 12.284 12.531 -8.075 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.592 11.574 -6.088 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.010 12.908 -5.064 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.282 12.632 -6.665 1.00 0.00 H new ATOM 1664 N LEU A 111 12.389 15.996 -8.238 1.00 0.00 N ATOM 1665 CA LEU A 111 13.509 16.816 -8.688 1.00 0.00 C ATOM 1666 C LEU A 111 13.386 16.996 -10.204 1.00 0.00 C ATOM 1667 O LEU A 111 12.938 16.080 -10.903 1.00 0.00 O ATOM 1668 CB LEU A 111 14.830 16.110 -8.324 1.00 0.00 C ATOM 1669 CG LEU A 111 16.113 16.886 -8.694 1.00 0.00 C ATOM 1670 CD1 LEU A 111 16.215 18.224 -7.948 1.00 0.00 C ATOM 1671 CD2 LEU A 111 17.347 16.042 -8.351 1.00 0.00 C ATOM 0 H LEU A 111 12.003 15.421 -8.987 1.00 0.00 H new ATOM 0 HA LEU A 111 13.499 17.793 -8.206 1.00 0.00 H new ATOM 0 HB2 LEU A 111 14.837 15.918 -7.251 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.855 15.140 -8.822 1.00 0.00 H new ATOM 0 HG LEU A 111 16.068 17.090 -9.764 1.00 0.00 H new ATOM 0 HD11 LEU A 111 17.133 18.734 -8.240 1.00 0.00 H new ATOM 0 HD12 LEU A 111 15.357 18.847 -8.200 1.00 0.00 H new ATOM 0 HD13 LEU A 111 16.227 18.041 -6.873 1.00 0.00 H new ATOM 0 HD21 LEU A 111 18.250 16.594 -8.614 1.00 0.00 H new ATOM 0 HD22 LEU A 111 17.353 15.824 -7.283 1.00 0.00 H new ATOM 0 HD23 LEU A 111 17.316 15.108 -8.912 1.00 0.00 H new ATOM 1683 N LYS A 112 13.757 18.172 -10.717 1.00 0.00 N ATOM 1684 CA LYS A 112 13.753 18.470 -12.150 1.00 0.00 C ATOM 1685 C LYS A 112 14.652 17.469 -12.888 1.00 0.00 C ATOM 1686 O LYS A 112 15.761 17.212 -12.427 1.00 0.00 O ATOM 1687 CB LYS A 112 14.219 19.922 -12.337 1.00 0.00 C ATOM 1688 CG LYS A 112 13.832 20.521 -13.697 1.00 0.00 C ATOM 1689 CD LYS A 112 14.412 21.941 -13.805 1.00 0.00 C ATOM 1690 CE LYS A 112 14.032 22.696 -15.086 1.00 0.00 C ATOM 1691 NZ LYS A 112 14.329 21.939 -16.319 1.00 0.00 N ATOM 0 H LYS A 112 14.072 18.953 -10.141 1.00 0.00 H new ATOM 0 HA LYS A 112 12.753 18.370 -12.572 1.00 0.00 H new ATOM 0 HB2 LYS A 112 13.793 20.537 -11.544 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.302 19.964 -12.226 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.213 19.897 -14.505 1.00 0.00 H new ATOM 0 HG3 LYS A 112 12.747 20.549 -13.801 1.00 0.00 H new ATOM 0 HD2 LYS A 112 14.077 22.521 -12.945 1.00 0.00 H new ATOM 0 HD3 LYS A 112 15.499 21.880 -13.745 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.968 22.931 -15.059 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.567 23.645 -15.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.738 22.579 -17.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.007 21.180 -16.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.451 21.524 -16.692 1.00 0.00 H new ATOM 1705 N ASP A 113 14.204 16.969 -14.044 1.00 0.00 N ATOM 1706 CA ASP A 113 14.920 15.943 -14.817 1.00 0.00 C ATOM 1707 C ASP A 113 16.295 16.425 -15.300 1.00 0.00 C ATOM 1708 O ASP A 113 17.260 15.671 -15.328 1.00 0.00 O ATOM 1709 CB ASP A 113 14.073 15.506 -16.016 1.00 0.00 C ATOM 1710 CG ASP A 113 14.830 14.509 -16.896 1.00 0.00 C ATOM 1711 OD1 ASP A 113 14.975 13.350 -16.445 1.00 0.00 O ATOM 1712 OD2 ASP A 113 15.178 14.904 -18.037 1.00 0.00 O ATOM 0 H ASP A 113 13.328 17.265 -14.475 1.00 0.00 H new ATOM 0 HA ASP A 113 15.088 15.097 -14.151 1.00 0.00 H new ATOM 0 HB2 ASP A 113 13.146 15.053 -15.664 1.00 0.00 H new ATOM 0 HB3 ASP A 113 13.797 16.379 -16.607 1.00 0.00 H new ATOM 1717 N LYS A 114 16.421 17.720 -15.599 1.00 0.00 N ATOM 1718 CA LYS A 114 17.676 18.378 -15.935 1.00 0.00 C ATOM 1719 C LYS A 114 17.617 19.770 -15.327 1.00 0.00 C ATOM 1720 O LYS A 114 16.648 20.494 -15.577 1.00 0.00 O ATOM 1721 CB LYS A 114 17.809 18.428 -17.464 1.00 0.00 C ATOM 1722 CG LYS A 114 19.190 18.935 -17.916 1.00 0.00 C ATOM 1723 CD LYS A 114 19.205 19.386 -19.387 1.00 0.00 C ATOM 1724 CE LYS A 114 18.438 20.708 -19.524 1.00 0.00 C ATOM 1725 NZ LYS A 114 18.413 21.239 -20.905 1.00 0.00 N ATOM 0 H LYS A 114 15.624 18.356 -15.613 1.00 0.00 H new ATOM 0 HA LYS A 114 18.545 17.848 -15.545 1.00 0.00 H new ATOM 0 HB2 LYS A 114 17.638 17.432 -17.874 1.00 0.00 H new ATOM 0 HB3 LYS A 114 17.035 19.078 -17.872 1.00 0.00 H new ATOM 0 HG2 LYS A 114 19.492 19.768 -17.282 1.00 0.00 H new ATOM 0 HG3 LYS A 114 19.927 18.144 -17.775 1.00 0.00 H new ATOM 0 HD2 LYS A 114 20.232 19.512 -19.730 1.00 0.00 H new ATOM 0 HD3 LYS A 114 18.750 18.622 -20.017 1.00 0.00 H new ATOM 0 HE2 LYS A 114 17.414 20.561 -19.182 1.00 0.00 H new ATOM 0 HE3 LYS A 114 18.890 21.450 -18.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 17.732 22.022 -20.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 19.360 21.584 -21.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 18.130 20.484 -21.562 1.00 0.00 H new ATOM 1739 N LEU A 115 18.624 20.151 -14.542 1.00 0.00 N ATOM 1740 CA LEU A 115 18.692 21.463 -13.911 1.00 0.00 C ATOM 1741 C LEU A 115 18.741 22.556 -14.976 1.00 0.00 C ATOM 1742 O LEU A 115 19.598 22.535 -15.859 1.00 0.00 O ATOM 1743 CB LEU A 115 19.910 21.528 -12.977 1.00 0.00 C ATOM 1744 CG LEU A 115 20.086 22.884 -12.258 1.00 0.00 C ATOM 1745 CD1 LEU A 115 18.897 23.208 -11.344 1.00 0.00 C ATOM 1746 CD2 LEU A 115 21.363 22.853 -11.416 1.00 0.00 C ATOM 0 H LEU A 115 19.420 19.551 -14.326 1.00 0.00 H new ATOM 0 HA LEU A 115 17.797 21.626 -13.310 1.00 0.00 H new ATOM 0 HB2 LEU A 115 19.821 20.741 -12.228 1.00 0.00 H new ATOM 0 HB3 LEU A 115 20.809 21.317 -13.556 1.00 0.00 H new ATOM 0 HG LEU A 115 20.147 23.657 -13.024 1.00 0.00 H new ATOM 0 HD11 LEU A 115 19.063 24.170 -10.859 1.00 0.00 H new ATOM 0 HD12 LEU A 115 17.984 23.254 -11.937 1.00 0.00 H new ATOM 0 HD13 LEU A 115 18.799 22.431 -10.586 1.00 0.00 H new ATOM 0 HD21 LEU A 115 21.488 23.810 -10.909 1.00 0.00 H new ATOM 0 HD22 LEU A 115 21.291 22.056 -10.676 1.00 0.00 H new ATOM 0 HD23 LEU A 115 22.221 22.671 -12.063 1.00 0.00 H new ATOM 1758 N GLU A 116 17.820 23.512 -14.866 1.00 0.00 N ATOM 1759 CA GLU A 116 17.790 24.767 -15.610 1.00 0.00 C ATOM 1760 C GLU A 116 17.179 25.825 -14.677 1.00 0.00 C ATOM 1761 O GLU A 116 16.589 25.463 -13.655 1.00 0.00 O ATOM 1762 CB GLU A 116 16.895 24.639 -16.854 1.00 0.00 C ATOM 1763 CG GLU A 116 17.291 23.524 -17.831 1.00 0.00 C ATOM 1764 CD GLU A 116 16.301 23.375 -18.981 1.00 0.00 C ATOM 1765 OE1 GLU A 116 15.104 23.220 -18.654 1.00 0.00 O ATOM 1766 OE2 GLU A 116 16.764 23.252 -20.140 1.00 0.00 O ATOM 0 H GLU A 116 17.034 23.426 -14.221 1.00 0.00 H new ATOM 0 HA GLU A 116 18.796 25.035 -15.933 1.00 0.00 H new ATOM 0 HB2 GLU A 116 15.869 24.467 -16.528 1.00 0.00 H new ATOM 0 HB3 GLU A 116 16.905 25.589 -17.388 1.00 0.00 H new ATOM 0 HG2 GLU A 116 18.282 23.734 -18.234 1.00 0.00 H new ATOM 0 HG3 GLU A 116 17.360 22.580 -17.291 1.00 0.00 H new ATOM 1773 N GLU A 117 17.209 27.104 -15.069 1.00 0.00 N ATOM 1774 CA GLU A 117 16.748 28.219 -14.225 1.00 0.00 C ATOM 1775 C GLU A 117 15.690 29.078 -14.940 1.00 0.00 C ATOM 1776 O GLU A 117 15.045 29.923 -14.320 1.00 0.00 O ATOM 1777 CB GLU A 117 17.946 29.079 -13.765 1.00 0.00 C ATOM 1778 CG GLU A 117 18.929 28.323 -12.855 1.00 0.00 C ATOM 1779 CD GLU A 117 20.061 29.224 -12.339 1.00 0.00 C ATOM 1780 OE1 GLU A 117 21.082 29.330 -13.060 1.00 0.00 O ATOM 1781 OE2 GLU A 117 19.896 29.790 -11.234 1.00 0.00 O ATOM 0 H GLU A 117 17.554 27.399 -15.983 1.00 0.00 H new ATOM 0 HA GLU A 117 16.270 27.793 -13.343 1.00 0.00 H new ATOM 0 HB2 GLU A 117 18.481 29.442 -14.643 1.00 0.00 H new ATOM 0 HB3 GLU A 117 17.572 29.955 -13.235 1.00 0.00 H new ATOM 0 HG2 GLU A 117 18.387 27.904 -12.007 1.00 0.00 H new ATOM 0 HG3 GLU A 117 19.357 27.485 -13.405 1.00 0.00 H new ATOM 1788 N TRP A 118 15.466 28.865 -16.241 1.00 0.00 N ATOM 1789 CA TRP A 118 14.386 29.513 -16.982 1.00 0.00 C ATOM 1790 C TRP A 118 12.997 29.022 -16.538 1.00 0.00 C ATOM 1791 O TRP A 118 12.859 28.032 -15.808 1.00 0.00 O ATOM 1792 CB TRP A 118 14.612 29.346 -18.497 1.00 0.00 C ATOM 1793 CG TRP A 118 14.389 28.004 -19.123 1.00 0.00 C ATOM 1794 CD1 TRP A 118 14.398 26.810 -18.489 1.00 0.00 C ATOM 1795 CD2 TRP A 118 14.123 27.691 -20.528 1.00 0.00 C ATOM 1796 NE1 TRP A 118 14.184 25.793 -19.392 1.00 0.00 N ATOM 1797 CE2 TRP A 118 14.013 26.276 -20.669 1.00 0.00 C ATOM 1798 CE3 TRP A 118 13.953 28.464 -21.696 1.00 0.00 C ATOM 1799 CZ2 TRP A 118 13.763 25.663 -21.905 1.00 0.00 C ATOM 1800 CZ3 TRP A 118 13.694 27.863 -22.941 1.00 0.00 C ATOM 1801 CH2 TRP A 118 13.601 26.465 -23.049 1.00 0.00 C ATOM 0 H TRP A 118 16.033 28.235 -16.809 1.00 0.00 H new ATOM 0 HA TRP A 118 14.407 30.578 -16.753 1.00 0.00 H new ATOM 0 HB2 TRP A 118 13.963 30.058 -19.006 1.00 0.00 H new ATOM 0 HB3 TRP A 118 15.639 29.642 -18.711 1.00 0.00 H new ATOM 0 HD1 TRP A 118 14.551 26.674 -17.429 1.00 0.00 H new ATOM 0 HE1 TRP A 118 14.156 24.804 -19.145 1.00 0.00 H new ATOM 0 HE3 TRP A 118 14.023 29.540 -21.633 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 13.696 24.588 -21.978 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 13.566 28.479 -23.819 1.00 0.00 H new ATOM 0 HH2 TRP A 118 13.406 26.008 -24.008 1.00 0.00 H new ATOM 1812 N ILE A 119 11.954 29.724 -16.998 1.00 0.00 N ATOM 1813 CA ILE A 119 10.551 29.387 -16.737 1.00 0.00 C ATOM 1814 C ILE A 119 10.137 28.050 -17.353 1.00 0.00 C ATOM 1815 O ILE A 119 9.233 27.430 -16.802 1.00 0.00 O ATOM 1816 CB ILE A 119 9.603 30.535 -17.167 1.00 0.00 C ATOM 1817 CG1 ILE A 119 9.584 30.750 -18.696 1.00 0.00 C ATOM 1818 CG2 ILE A 119 9.982 31.829 -16.415 1.00 0.00 C ATOM 1819 CD1 ILE A 119 8.558 31.798 -19.150 1.00 0.00 C ATOM 0 H ILE A 119 12.065 30.559 -17.574 1.00 0.00 H new ATOM 0 HA ILE A 119 10.458 29.266 -15.658 1.00 0.00 H new ATOM 0 HB ILE A 119 8.586 30.250 -16.896 1.00 0.00 H new ATOM 0 HG12 ILE A 119 10.577 31.057 -19.025 1.00 0.00 H new ATOM 0 HG13 ILE A 119 9.365 29.801 -19.186 1.00 0.00 H new ATOM 0 HG21 ILE A 119 9.314 32.635 -16.719 1.00 0.00 H new ATOM 0 HG22 ILE A 119 9.889 31.666 -15.341 1.00 0.00 H new ATOM 0 HG23 ILE A 119 11.010 32.100 -16.653 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.597 31.900 -20.235 1.00 0.00 H new ATOM 0 HD12 ILE A 119 7.559 31.482 -18.851 1.00 0.00 H new ATOM 0 HD13 ILE A 119 8.789 32.757 -18.687 1.00 0.00 H new ATOM 1831 N GLU A 120 10.802 27.610 -18.437 1.00 0.00 N ATOM 1832 CA GLU A 120 10.673 26.302 -19.112 1.00 0.00 C ATOM 1833 C GLU A 120 9.336 26.116 -19.841 1.00 0.00 C ATOM 1834 O GLU A 120 9.289 25.545 -20.926 1.00 0.00 O ATOM 1835 CB GLU A 120 10.952 25.199 -18.080 1.00 0.00 C ATOM 1836 CG GLU A 120 11.051 23.746 -18.571 1.00 0.00 C ATOM 1837 CD GLU A 120 11.340 22.787 -17.393 1.00 0.00 C ATOM 1838 OE1 GLU A 120 11.143 23.206 -16.222 1.00 0.00 O ATOM 1839 OE2 GLU A 120 11.889 21.680 -17.595 1.00 0.00 O ATOM 0 H GLU A 120 11.494 28.201 -18.899 1.00 0.00 H new ATOM 0 HA GLU A 120 11.411 26.246 -19.912 1.00 0.00 H new ATOM 0 HB2 GLU A 120 11.888 25.444 -17.577 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.165 25.242 -17.327 1.00 0.00 H new ATOM 0 HG2 GLU A 120 10.120 23.458 -19.060 1.00 0.00 H new ATOM 0 HG3 GLU A 120 11.842 23.662 -19.316 1.00 0.00 H new ATOM 1846 N MET A 121 8.253 26.671 -19.299 1.00 0.00 N ATOM 1847 CA MET A 121 6.935 26.735 -19.902 1.00 0.00 C ATOM 1848 C MET A 121 6.256 27.985 -19.343 1.00 0.00 C ATOM 1849 O MET A 121 6.464 28.330 -18.179 1.00 0.00 O ATOM 1850 CB MET A 121 6.162 25.460 -19.533 1.00 0.00 C ATOM 1851 CG MET A 121 4.809 25.365 -20.245 1.00 0.00 C ATOM 1852 SD MET A 121 3.870 23.853 -19.900 1.00 0.00 S ATOM 1853 CE MET A 121 3.403 24.118 -18.168 1.00 0.00 C ATOM 0 H MET A 121 8.280 27.110 -18.378 1.00 0.00 H new ATOM 0 HA MET A 121 6.977 26.795 -20.990 1.00 0.00 H new ATOM 0 HB2 MET A 121 6.764 24.588 -19.787 1.00 0.00 H new ATOM 0 HB3 MET A 121 6.004 25.435 -18.455 1.00 0.00 H new ATOM 0 HG2 MET A 121 4.203 26.225 -19.959 1.00 0.00 H new ATOM 0 HG3 MET A 121 4.975 25.435 -21.320 1.00 0.00 H new ATOM 0 HE1 MET A 121 2.731 23.322 -17.846 1.00 0.00 H new ATOM 0 HE2 MET A 121 4.297 24.112 -17.545 1.00 0.00 H new ATOM 0 HE3 MET A 121 2.899 25.080 -18.070 1.00 0.00 H new ATOM 1863 N SER A 122 5.417 28.638 -20.149 1.00 0.00 N ATOM 1864 CA SER A 122 4.801 29.928 -19.835 1.00 0.00 C ATOM 1865 C SER A 122 3.930 29.913 -18.571 1.00 0.00 C ATOM 1866 O SER A 122 3.634 30.977 -18.041 1.00 0.00 O ATOM 1867 CB SER A 122 3.980 30.384 -21.050 1.00 0.00 C ATOM 1868 OG SER A 122 4.704 30.171 -22.253 1.00 0.00 O ATOM 0 H SER A 122 5.140 28.275 -21.061 1.00 0.00 H new ATOM 0 HA SER A 122 5.606 30.630 -19.619 1.00 0.00 H new ATOM 0 HB2 SER A 122 3.038 29.837 -21.085 1.00 0.00 H new ATOM 0 HB3 SER A 122 3.731 31.441 -20.951 1.00 0.00 H new ATOM 0 HG SER A 122 4.164 30.466 -23.016 1.00 0.00 H new ATOM 1874 N ASN A 123 3.512 28.730 -18.102 1.00 0.00 N ATOM 1875 CA ASN A 123 2.690 28.550 -16.904 1.00 0.00 C ATOM 1876 C ASN A 123 3.174 27.356 -16.062 1.00 0.00 C ATOM 1877 O ASN A 123 2.373 26.610 -15.494 1.00 0.00 O ATOM 1878 CB ASN A 123 1.217 28.411 -17.330 1.00 0.00 C ATOM 1879 CG ASN A 123 0.253 28.474 -16.149 1.00 0.00 C ATOM 1880 OD1 ASN A 123 0.450 29.225 -15.204 1.00 0.00 O ATOM 1881 ND2 ASN A 123 -0.822 27.703 -16.184 1.00 0.00 N ATOM 0 H ASN A 123 3.744 27.849 -18.560 1.00 0.00 H new ATOM 0 HA ASN A 123 2.785 29.424 -16.260 1.00 0.00 H new ATOM 0 HB2 ASN A 123 0.971 29.204 -18.037 1.00 0.00 H new ATOM 0 HB3 ASN A 123 1.082 27.464 -17.853 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -1.495 27.732 -15.418 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -0.977 27.080 -16.977 1.00 0.00 H new ATOM 1888 N ARG A 124 4.488 27.070 -16.053 1.00 0.00 N ATOM 1889 CA ARG A 124 5.050 26.134 -15.071 1.00 0.00 C ATOM 1890 C ARG A 124 4.674 26.593 -13.653 1.00 0.00 C ATOM 1891 O ARG A 124 4.697 27.784 -13.358 1.00 0.00 O ATOM 1892 CB ARG A 124 6.579 26.019 -15.240 1.00 0.00 C ATOM 1893 CG ARG A 124 7.154 24.818 -14.464 1.00 0.00 C ATOM 1894 CD ARG A 124 8.685 24.713 -14.539 1.00 0.00 C ATOM 1895 NE ARG A 124 9.354 25.819 -13.827 1.00 0.00 N ATOM 1896 CZ ARG A 124 10.571 26.299 -14.122 1.00 0.00 C ATOM 1897 NH1 ARG A 124 11.400 25.640 -14.926 1.00 0.00 N ATOM 1898 NH2 ARG A 124 10.978 27.447 -13.586 1.00 0.00 N ATOM 0 H ARG A 124 5.167 27.466 -16.703 1.00 0.00 H new ATOM 0 HA ARG A 124 4.631 25.142 -15.237 1.00 0.00 H new ATOM 0 HB2 ARG A 124 6.821 25.917 -16.298 1.00 0.00 H new ATOM 0 HB3 ARG A 124 7.053 26.937 -14.892 1.00 0.00 H new ATOM 0 HG2 ARG A 124 6.854 24.894 -13.419 1.00 0.00 H new ATOM 0 HG3 ARG A 124 6.716 23.900 -14.855 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.004 23.762 -14.112 1.00 0.00 H new ATOM 0 HD3 ARG A 124 8.997 24.714 -15.583 1.00 0.00 H new ATOM 0 HE ARG A 124 8.852 26.251 -13.051 1.00 0.00 H new ATOM 0 HH11 ARG A 124 11.115 24.749 -15.333 1.00 0.00 H new ATOM 0 HH12 ARG A 124 12.321 26.025 -15.136 1.00 0.00 H new ATOM 0 HH21 ARG A 124 10.365 27.960 -12.952 1.00 0.00 H new ATOM 0 HH22 ARG A 124 11.903 27.814 -13.809 1.00 0.00 H new ATOM 1912 N LYS A 125 4.362 25.650 -12.759 1.00 0.00 N ATOM 1913 CA LYS A 125 4.206 25.930 -11.334 1.00 0.00 C ATOM 1914 C LYS A 125 5.470 26.631 -10.814 1.00 0.00 C ATOM 1915 O LYS A 125 6.580 26.189 -11.118 1.00 0.00 O ATOM 1916 CB LYS A 125 3.929 24.603 -10.602 1.00 0.00 C ATOM 1917 CG LYS A 125 3.617 24.737 -9.102 1.00 0.00 C ATOM 1918 CD LYS A 125 2.304 25.481 -8.811 1.00 0.00 C ATOM 1919 CE LYS A 125 2.030 25.491 -7.301 1.00 0.00 C ATOM 1920 NZ LYS A 125 0.762 26.181 -6.967 1.00 0.00 N ATOM 0 H LYS A 125 4.211 24.672 -13.006 1.00 0.00 H new ATOM 0 HA LYS A 125 3.365 26.599 -11.152 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.090 24.106 -11.089 1.00 0.00 H new ATOM 0 HB3 LYS A 125 4.796 23.953 -10.720 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.567 23.742 -8.660 1.00 0.00 H new ATOM 0 HG3 LYS A 125 4.438 25.262 -8.614 1.00 0.00 H new ATOM 0 HD2 LYS A 125 2.365 26.503 -9.185 1.00 0.00 H new ATOM 0 HD3 LYS A 125 1.479 24.999 -9.335 1.00 0.00 H new ATOM 0 HE2 LYS A 125 1.991 24.465 -6.934 1.00 0.00 H new ATOM 0 HE3 LYS A 125 2.856 25.983 -6.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 0.618 26.163 -5.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 0.807 27.167 -7.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -0.030 25.697 -7.436 1.00 0.00 H new ATOM 1934 N ASP A 126 5.289 27.623 -9.940 1.00 0.00 N ATOM 1935 CA ASP A 126 6.365 28.289 -9.189 1.00 0.00 C ATOM 1936 C ASP A 126 6.796 27.434 -7.984 1.00 0.00 C ATOM 1937 O ASP A 126 6.703 27.823 -6.823 1.00 0.00 O ATOM 1938 CB ASP A 126 5.930 29.711 -8.799 1.00 0.00 C ATOM 1939 CG ASP A 126 7.053 30.497 -8.106 1.00 0.00 C ATOM 1940 OD1 ASP A 126 8.204 30.381 -8.590 1.00 0.00 O ATOM 1941 OD2 ASP A 126 6.726 31.250 -7.157 1.00 0.00 O ATOM 0 H ASP A 126 4.365 27.999 -9.726 1.00 0.00 H new ATOM 0 HA ASP A 126 7.247 28.389 -9.821 1.00 0.00 H new ATOM 0 HB2 ASP A 126 5.612 30.249 -9.692 1.00 0.00 H new ATOM 0 HB3 ASP A 126 5.067 29.655 -8.136 1.00 0.00 H new ATOM 1946 N LEU A 127 7.064 26.153 -8.246 1.00 0.00 N ATOM 1947 CA LEU A 127 7.509 25.203 -7.239 1.00 0.00 C ATOM 1948 C LEU A 127 8.835 25.657 -6.611 1.00 0.00 C ATOM 1949 O LEU A 127 9.775 26.024 -7.313 1.00 0.00 O ATOM 1950 CB LEU A 127 7.619 23.809 -7.881 1.00 0.00 C ATOM 1951 CG LEU A 127 8.008 22.685 -6.900 1.00 0.00 C ATOM 1952 CD1 LEU A 127 6.971 22.508 -5.782 1.00 0.00 C ATOM 1953 CD2 LEU A 127 8.128 21.355 -7.656 1.00 0.00 C ATOM 0 H LEU A 127 6.975 25.747 -9.177 1.00 0.00 H new ATOM 0 HA LEU A 127 6.782 25.153 -6.429 1.00 0.00 H new ATOM 0 HB2 LEU A 127 6.663 23.558 -8.342 1.00 0.00 H new ATOM 0 HB3 LEU A 127 8.358 23.848 -8.681 1.00 0.00 H new ATOM 0 HG LEU A 127 8.960 22.968 -6.451 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.288 21.706 -5.116 1.00 0.00 H new ATOM 0 HD12 LEU A 127 6.884 23.436 -5.217 1.00 0.00 H new ATOM 0 HD13 LEU A 127 6.004 22.257 -6.219 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.403 20.564 -6.959 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.172 21.113 -8.121 1.00 0.00 H new ATOM 0 HD23 LEU A 127 8.894 21.442 -8.426 1.00 0.00 H new ATOM 1965 N ILE A 128 8.930 25.533 -5.288 1.00 0.00 N ATOM 1966 CA ILE A 128 10.089 25.885 -4.474 1.00 0.00 C ATOM 1967 C ILE A 128 10.302 24.804 -3.410 1.00 0.00 C ATOM 1968 O ILE A 128 9.498 23.879 -3.275 1.00 0.00 O ATOM 1969 CB ILE A 128 9.926 27.315 -3.883 1.00 0.00 C ATOM 1970 CG1 ILE A 128 8.565 27.643 -3.232 1.00 0.00 C ATOM 1971 CG2 ILE A 128 10.164 28.362 -4.984 1.00 0.00 C ATOM 1972 CD1 ILE A 128 8.231 26.810 -1.992 1.00 0.00 C ATOM 0 H ILE A 128 8.161 25.166 -4.728 1.00 0.00 H new ATOM 0 HA ILE A 128 10.990 25.918 -5.087 1.00 0.00 H new ATOM 0 HB ILE A 128 10.665 27.346 -3.082 1.00 0.00 H new ATOM 0 HG12 ILE A 128 8.554 28.698 -2.958 1.00 0.00 H new ATOM 0 HG13 ILE A 128 7.779 27.498 -3.973 1.00 0.00 H new ATOM 0 HG21 ILE A 128 10.049 29.362 -4.566 1.00 0.00 H new ATOM 0 HG22 ILE A 128 11.172 28.249 -5.382 1.00 0.00 H new ATOM 0 HG23 ILE A 128 9.440 28.218 -5.786 1.00 0.00 H new ATOM 0 HD11 ILE A 128 7.258 27.110 -1.604 1.00 0.00 H new ATOM 0 HD12 ILE A 128 8.205 25.754 -2.259 1.00 0.00 H new ATOM 0 HD13 ILE A 128 8.992 26.973 -1.229 1.00 0.00 H new ATOM 1984 N LYS A 129 11.415 24.875 -2.676 1.00 0.00 N ATOM 1985 CA LYS A 129 11.701 24.009 -1.532 1.00 0.00 C ATOM 1986 C LYS A 129 10.787 24.358 -0.345 1.00 0.00 C ATOM 1987 O LYS A 129 11.221 25.056 0.564 1.00 0.00 O ATOM 1988 CB LYS A 129 13.203 24.108 -1.206 1.00 0.00 C ATOM 1989 CG LYS A 129 13.703 23.108 -0.148 1.00 0.00 C ATOM 1990 CD LYS A 129 13.499 21.622 -0.490 1.00 0.00 C ATOM 1991 CE LYS A 129 14.224 21.220 -1.782 1.00 0.00 C ATOM 1992 NZ LYS A 129 14.092 19.773 -2.067 1.00 0.00 N ATOM 0 H LYS A 129 12.156 25.550 -2.865 1.00 0.00 H new ATOM 0 HA LYS A 129 11.482 22.968 -1.769 1.00 0.00 H new ATOM 0 HB2 LYS A 129 13.770 23.957 -2.124 1.00 0.00 H new ATOM 0 HB3 LYS A 129 13.419 25.119 -0.860 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.766 23.282 0.017 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.196 23.319 0.794 1.00 0.00 H new ATOM 0 HD2 LYS A 129 13.862 21.008 0.334 1.00 0.00 H new ATOM 0 HD3 LYS A 129 12.433 21.418 -0.595 1.00 0.00 H new ATOM 0 HE2 LYS A 129 13.820 21.792 -2.617 1.00 0.00 H new ATOM 0 HE3 LYS A 129 15.280 21.478 -1.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 14.596 19.545 -2.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 14.501 19.226 -1.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 13.086 19.530 -2.171 1.00 0.00 H new ATOM 2006 N LYS A 130 9.513 23.979 -0.447 1.00 0.00 N ATOM 2007 CA LYS A 130 8.543 24.084 0.628 1.00 0.00 C ATOM 2008 C LYS A 130 9.091 23.397 1.871 1.00 0.00 C ATOM 2009 O LYS A 130 9.550 22.242 1.716 1.00 0.00 O ATOM 2010 CB LYS A 130 7.202 23.496 0.158 1.00 0.00 C ATOM 2011 CG LYS A 130 6.058 23.645 1.174 1.00 0.00 C ATOM 2012 CD LYS A 130 5.682 25.107 1.462 1.00 0.00 C ATOM 2013 CE LYS A 130 4.463 25.160 2.391 1.00 0.00 C ATOM 2014 NZ LYS A 130 4.060 26.549 2.707 1.00 0.00 N ATOM 2015 OXT LYS A 130 8.968 24.042 2.934 1.00 0.00 O ATOM 0 H LYS A 130 9.124 23.582 -1.302 1.00 0.00 H new ATOM 0 HA LYS A 130 8.363 25.126 0.892 1.00 0.00 H new ATOM 0 HB2 LYS A 130 6.911 23.982 -0.773 1.00 0.00 H new ATOM 0 HB3 LYS A 130 7.340 22.438 -0.064 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.180 23.119 0.800 1.00 0.00 H new ATOM 0 HG3 LYS A 130 6.346 23.161 2.107 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.524 25.624 1.923 1.00 0.00 H new ATOM 0 HD3 LYS A 130 5.462 25.625 0.529 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.628 24.639 1.922 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.690 24.630 3.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 3.233 26.536 3.337 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 4.846 27.040 3.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 3.817 27.049 1.828 1.00 0.00 H new TER 2029 LYS A 130