USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 946 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 37 THR OG1 : rot -73:sc= 0.281 USER MOD Set 1.2: A 69 THR OG1 : rot -75:sc= 1.28 USER MOD Single : A 1 GLY N :NH3+ 154:sc= 0.27 (180deg=-1.2!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot -102:sc= 1.15 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.291 K(o=-0.29,f=-1.5) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 0:sc= 0.438 USER MOD Single : A 28 LYS NZ :NH3+ 177:sc= 2.39 (180deg=2.36) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN :FLIP amide:sc= 0 F(o=-0.54,f=0) USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 40 LYS NZ :NH3+ -147:sc=-0.00111 (180deg=-0.711) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot -152:sc= 1.17 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 166:sc=-0.00293 (180deg=-0.133) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 26:sc= 0.363 USER MOD Single : A 68 THR OG1 : rot 94:sc= 1.11 USER MOD Single : A 71 LYS NZ :NH3+ -148:sc= 0.667 (180deg=0.167) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 MET CE :methyl 178:sc= -1.07 (180deg=-1.09) USER MOD Single : A 94 GLN : amide:sc= -0.0569 K(o=-0.057,f=-1.5) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.0314 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.251 F(o=-1.2,f=-0.25) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 162:sc= 1.3 (180deg=1.22) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= -0.0158 USER MOD Single : A 117 LYS NZ :NH3+ -147:sc= -0.0594 (180deg=-1.35) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= -0.0259 USER MOD Single : A 129 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.41) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -39.454 8.894 -7.864 1.00 0.00 N ATOM 2 CA GLY A 1 -39.248 9.205 -6.443 1.00 0.00 C ATOM 3 C GLY A 1 -38.712 7.934 -5.835 1.00 0.00 C ATOM 4 O GLY A 1 -39.451 6.952 -5.799 1.00 0.00 O ATOM 0 H1 GLY A 1 -40.195 9.513 -8.251 1.00 0.00 H new ATOM 0 H2 GLY A 1 -38.567 9.048 -8.385 1.00 0.00 H new ATOM 0 H3 GLY A 1 -39.746 7.901 -7.963 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -38.545 10.029 -6.318 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -40.181 9.507 -5.967 1.00 0.00 H new ATOM 8 N ASP A 2 -37.429 7.941 -5.481 1.00 0.00 N ATOM 9 CA ASP A 2 -36.535 6.812 -5.723 1.00 0.00 C ATOM 10 C ASP A 2 -35.493 6.830 -4.610 1.00 0.00 C ATOM 11 O ASP A 2 -35.197 7.921 -4.105 1.00 0.00 O ATOM 12 CB ASP A 2 -35.840 6.953 -7.107 1.00 0.00 C ATOM 13 CG ASP A 2 -36.689 7.645 -8.183 1.00 0.00 C ATOM 14 OD1 ASP A 2 -36.747 8.900 -8.184 1.00 0.00 O ATOM 15 OD2 ASP A 2 -37.536 7.011 -8.844 1.00 0.00 O ATOM 0 H ASP A 2 -36.980 8.731 -5.018 1.00 0.00 H new ATOM 0 HA ASP A 2 -37.090 5.874 -5.729 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -34.914 7.513 -6.978 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -35.565 5.960 -7.463 1.00 0.00 H new ATOM 20 N ASP A 3 -34.939 5.666 -4.263 1.00 0.00 N ATOM 21 CA ASP A 3 -34.023 5.474 -3.136 1.00 0.00 C ATOM 22 C ASP A 3 -32.863 4.551 -3.548 1.00 0.00 C ATOM 23 O ASP A 3 -32.612 4.373 -4.744 1.00 0.00 O ATOM 24 CB ASP A 3 -34.794 4.990 -1.896 1.00 0.00 C ATOM 25 CG ASP A 3 -35.160 3.506 -1.974 1.00 0.00 C ATOM 26 OD1 ASP A 3 -36.061 3.174 -2.777 1.00 0.00 O ATOM 27 OD2 ASP A 3 -34.544 2.732 -1.211 1.00 0.00 O ATOM 0 H ASP A 3 -35.122 4.803 -4.775 1.00 0.00 H new ATOM 0 HA ASP A 3 -33.571 6.425 -2.856 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -34.190 5.165 -1.006 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -35.704 5.580 -1.785 1.00 0.00 H new ATOM 32 N ASP A 4 -32.052 4.094 -2.590 1.00 0.00 N ATOM 33 CA ASP A 4 -30.737 3.505 -2.837 1.00 0.00 C ATOM 34 C ASP A 4 -30.330 2.681 -1.610 1.00 0.00 C ATOM 35 O ASP A 4 -30.384 3.211 -0.497 1.00 0.00 O ATOM 36 CB ASP A 4 -29.708 4.637 -3.082 1.00 0.00 C ATOM 37 CG ASP A 4 -28.830 4.422 -4.314 1.00 0.00 C ATOM 38 OD1 ASP A 4 -28.522 3.260 -4.668 1.00 0.00 O ATOM 39 OD2 ASP A 4 -28.407 5.420 -4.954 1.00 0.00 O ATOM 0 H ASP A 4 -32.298 4.125 -1.601 1.00 0.00 H new ATOM 0 HA ASP A 4 -30.770 2.860 -3.715 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -30.241 5.582 -3.189 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -29.068 4.729 -2.204 1.00 0.00 H new ATOM 44 N GLU A 5 -29.875 1.433 -1.781 1.00 0.00 N ATOM 45 CA GLU A 5 -29.455 0.544 -0.687 1.00 0.00 C ATOM 46 C GLU A 5 -28.016 0.046 -0.959 1.00 0.00 C ATOM 47 O GLU A 5 -27.814 -1.106 -1.362 1.00 0.00 O ATOM 48 CB GLU A 5 -30.504 -0.582 -0.473 1.00 0.00 C ATOM 49 CG GLU A 5 -30.995 -0.738 0.980 1.00 0.00 C ATOM 50 CD GLU A 5 -29.913 -1.197 1.966 1.00 0.00 C ATOM 51 OE1 GLU A 5 -28.921 -0.458 2.160 1.00 0.00 O ATOM 52 OE2 GLU A 5 -30.048 -2.294 2.566 1.00 0.00 O ATOM 0 H GLU A 5 -29.786 1.003 -2.702 1.00 0.00 H new ATOM 0 HA GLU A 5 -29.418 1.080 0.261 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -31.364 -0.385 -1.113 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -30.073 -1.528 -0.800 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -31.398 0.216 1.319 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -31.815 -1.455 0.999 1.00 0.00 H new ATOM 59 N PRO A 6 -26.990 0.907 -0.821 1.00 0.00 N ATOM 60 CA PRO A 6 -25.632 0.634 -1.298 1.00 0.00 C ATOM 61 C PRO A 6 -24.831 -0.289 -0.356 1.00 0.00 C ATOM 62 O PRO A 6 -23.819 0.126 0.227 1.00 0.00 O ATOM 63 CB PRO A 6 -25.004 2.027 -1.459 1.00 0.00 C ATOM 64 CG PRO A 6 -25.680 2.831 -0.349 1.00 0.00 C ATOM 65 CD PRO A 6 -27.107 2.305 -0.423 1.00 0.00 C ATOM 0 HA PRO A 6 -25.633 0.077 -2.235 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -23.921 1.999 -1.337 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -25.203 2.450 -2.444 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -25.225 2.649 0.625 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -25.628 3.905 -0.530 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -27.609 2.398 0.540 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -27.696 2.870 -1.145 1.00 0.00 H new ATOM 73 N GLY A 7 -25.209 -1.565 -0.242 1.00 0.00 N ATOM 74 CA GLY A 7 -24.519 -2.528 0.611 1.00 0.00 C ATOM 75 C GLY A 7 -24.349 -3.898 -0.030 1.00 0.00 C ATOM 76 O GLY A 7 -25.276 -4.710 -0.051 1.00 0.00 O ATOM 0 H GLY A 7 -26.006 -1.958 -0.742 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -23.537 -2.133 0.870 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -25.074 -2.638 1.543 1.00 0.00 H new ATOM 80 N GLY A 8 -23.145 -4.202 -0.515 1.00 0.00 N ATOM 81 CA GLY A 8 -22.862 -5.477 -1.148 1.00 0.00 C ATOM 82 C GLY A 8 -21.402 -5.658 -1.527 1.00 0.00 C ATOM 83 O GLY A 8 -20.586 -5.969 -0.654 1.00 0.00 O ATOM 0 H GLY A 8 -22.346 -3.570 -0.477 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -23.156 -6.281 -0.473 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -23.476 -5.572 -2.044 1.00 0.00 H new ATOM 87 N LYS A 9 -21.096 -5.513 -2.820 1.00 0.00 N ATOM 88 CA LYS A 9 -19.805 -5.852 -3.418 1.00 0.00 C ATOM 89 C LYS A 9 -18.680 -5.114 -2.705 1.00 0.00 C ATOM 90 O LYS A 9 -18.830 -3.960 -2.289 1.00 0.00 O ATOM 91 CB LYS A 9 -19.812 -5.523 -4.923 1.00 0.00 C ATOM 92 CG LYS A 9 -20.354 -6.677 -5.778 1.00 0.00 C ATOM 93 CD LYS A 9 -19.306 -7.756 -6.098 1.00 0.00 C ATOM 94 CE LYS A 9 -18.460 -7.371 -7.321 1.00 0.00 C ATOM 95 NZ LYS A 9 -17.867 -8.531 -8.026 1.00 0.00 N ATOM 0 H LYS A 9 -21.762 -5.145 -3.499 1.00 0.00 H new ATOM 0 HA LYS A 9 -19.634 -6.922 -3.303 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -20.418 -4.634 -5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -18.798 -5.284 -5.243 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -21.192 -7.140 -5.257 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -20.743 -6.273 -6.713 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -18.656 -7.901 -5.235 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -19.806 -8.707 -6.284 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -19.082 -6.812 -8.020 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -17.660 -6.703 -7.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -17.311 -8.196 -8.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -17.248 -9.054 -7.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -18.626 -9.159 -8.361 1.00 0.00 H new ATOM 109 N GLY A 10 -17.530 -5.767 -2.619 1.00 0.00 N ATOM 110 CA GLY A 10 -16.418 -5.304 -1.815 1.00 0.00 C ATOM 111 C GLY A 10 -16.502 -5.793 -0.368 1.00 0.00 C ATOM 112 O GLY A 10 -17.409 -6.538 0.028 1.00 0.00 O ATOM 0 H GLY A 10 -17.345 -6.641 -3.112 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -15.484 -5.649 -2.259 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -16.393 -4.214 -1.827 1.00 0.00 H new ATOM 116 N ALA A 11 -15.537 -5.342 0.430 1.00 0.00 N ATOM 117 CA ALA A 11 -15.457 -5.465 1.881 1.00 0.00 C ATOM 118 C ALA A 11 -14.795 -4.199 2.417 1.00 0.00 C ATOM 119 O ALA A 11 -14.263 -3.413 1.633 1.00 0.00 O ATOM 120 CB ALA A 11 -14.629 -6.679 2.283 1.00 0.00 C ATOM 0 H ALA A 11 -14.732 -4.845 0.050 1.00 0.00 H new ATOM 0 HA ALA A 11 -16.458 -5.592 2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.586 -6.746 3.370 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -15.089 -7.582 1.881 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.619 -6.578 1.886 1.00 0.00 H new ATOM 126 N MET A 12 -14.825 -3.990 3.733 1.00 0.00 N ATOM 127 CA MET A 12 -14.085 -2.900 4.351 1.00 0.00 C ATOM 128 C MET A 12 -12.664 -3.421 4.594 1.00 0.00 C ATOM 129 O MET A 12 -12.510 -4.612 4.904 1.00 0.00 O ATOM 130 CB MET A 12 -14.788 -2.475 5.651 1.00 0.00 C ATOM 131 CG MET A 12 -16.166 -1.896 5.312 1.00 0.00 C ATOM 132 SD MET A 12 -17.445 -2.016 6.585 1.00 0.00 S ATOM 133 CE MET A 12 -17.104 -0.499 7.512 1.00 0.00 C ATOM 0 H MET A 12 -15.355 -4.564 4.389 1.00 0.00 H new ATOM 0 HA MET A 12 -14.043 -2.013 3.719 1.00 0.00 H new ATOM 0 HB2 MET A 12 -14.894 -3.331 6.318 1.00 0.00 H new ATOM 0 HB3 MET A 12 -14.188 -1.733 6.177 1.00 0.00 H new ATOM 0 HG2 MET A 12 -16.038 -0.844 5.059 1.00 0.00 H new ATOM 0 HG3 MET A 12 -16.532 -2.397 4.416 1.00 0.00 H new ATOM 0 HE1 MET A 12 -17.807 -0.413 8.341 1.00 0.00 H new ATOM 0 HE2 MET A 12 -16.086 -0.531 7.901 1.00 0.00 H new ATOM 0 HE3 MET A 12 -17.213 0.362 6.853 1.00 0.00 H new ATOM 143 N TYR A 13 -11.644 -2.573 4.451 1.00 0.00 N ATOM 144 CA TYR A 13 -10.267 -2.907 4.798 1.00 0.00 C ATOM 145 C TYR A 13 -9.520 -1.636 5.221 1.00 0.00 C ATOM 146 O TYR A 13 -10.037 -0.521 5.095 1.00 0.00 O ATOM 147 CB TYR A 13 -9.559 -3.617 3.624 1.00 0.00 C ATOM 148 CG TYR A 13 -8.982 -2.682 2.577 1.00 0.00 C ATOM 149 CD1 TYR A 13 -9.793 -2.215 1.530 1.00 0.00 C ATOM 150 CD2 TYR A 13 -7.651 -2.229 2.689 1.00 0.00 C ATOM 151 CE1 TYR A 13 -9.294 -1.255 0.635 1.00 0.00 C ATOM 152 CE2 TYR A 13 -7.173 -1.224 1.834 1.00 0.00 C ATOM 153 CZ TYR A 13 -7.999 -0.722 0.810 1.00 0.00 C ATOM 154 OH TYR A 13 -7.564 0.297 0.022 1.00 0.00 O ATOM 0 H TYR A 13 -11.755 -1.627 4.087 1.00 0.00 H new ATOM 0 HA TYR A 13 -10.269 -3.602 5.638 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -8.755 -4.236 4.022 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -10.269 -4.289 3.141 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.798 -2.593 1.413 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -6.998 -2.657 3.435 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -9.904 -0.923 -0.192 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -6.173 -0.836 1.961 1.00 0.00 H new ATOM 0 HH TYR A 13 -6.964 -0.056 -0.668 1.00 0.00 H new ATOM 164 N GLU A 14 -8.304 -1.818 5.720 1.00 0.00 N ATOM 165 CA GLU A 14 -7.354 -0.812 6.155 1.00 0.00 C ATOM 166 C GLU A 14 -5.975 -1.313 5.705 1.00 0.00 C ATOM 167 O GLU A 14 -5.702 -2.517 5.786 1.00 0.00 O ATOM 168 CB GLU A 14 -7.503 -0.710 7.680 1.00 0.00 C ATOM 169 CG GLU A 14 -6.532 0.231 8.404 1.00 0.00 C ATOM 170 CD GLU A 14 -6.890 0.353 9.896 1.00 0.00 C ATOM 171 OE1 GLU A 14 -8.099 0.415 10.234 1.00 0.00 O ATOM 172 OE2 GLU A 14 -5.966 0.392 10.740 1.00 0.00 O ATOM 0 H GLU A 14 -7.928 -2.759 5.840 1.00 0.00 H new ATOM 0 HA GLU A 14 -7.507 0.183 5.738 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -8.520 -0.386 7.902 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -7.387 -1.709 8.101 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -5.513 -0.142 8.300 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -6.559 1.216 7.938 1.00 0.00 H new ATOM 179 N VAL A 15 -5.106 -0.429 5.215 1.00 0.00 N ATOM 180 CA VAL A 15 -3.727 -0.771 4.873 1.00 0.00 C ATOM 181 C VAL A 15 -2.814 0.133 5.686 1.00 0.00 C ATOM 182 O VAL A 15 -3.119 1.302 5.932 1.00 0.00 O ATOM 183 CB VAL A 15 -3.483 -0.718 3.351 1.00 0.00 C ATOM 184 CG1 VAL A 15 -3.748 0.657 2.719 1.00 0.00 C ATOM 185 CG2 VAL A 15 -2.053 -1.186 3.026 1.00 0.00 C ATOM 0 H VAL A 15 -5.341 0.549 5.044 1.00 0.00 H new ATOM 0 HA VAL A 15 -3.505 -1.806 5.134 1.00 0.00 H new ATOM 0 HB VAL A 15 -4.212 -1.396 2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -3.553 0.609 1.648 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -4.787 0.940 2.886 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -3.092 1.399 3.174 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -1.893 -1.144 1.949 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -1.335 -0.535 3.525 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -1.918 -2.210 3.374 1.00 0.00 H new ATOM 195 N THR A 16 -1.686 -0.435 6.094 1.00 0.00 N ATOM 196 CA THR A 16 -0.660 0.256 6.843 1.00 0.00 C ATOM 197 C THR A 16 0.611 0.090 6.008 1.00 0.00 C ATOM 198 O THR A 16 1.188 -1.003 5.976 1.00 0.00 O ATOM 199 CB THR A 16 -0.594 -0.338 8.265 1.00 0.00 C ATOM 200 OG1 THR A 16 -1.874 -0.766 8.722 1.00 0.00 O ATOM 201 CG2 THR A 16 -0.116 0.699 9.264 1.00 0.00 C ATOM 0 H THR A 16 -1.460 -1.412 5.906 1.00 0.00 H new ATOM 0 HA THR A 16 -0.840 1.320 6.998 1.00 0.00 H new ATOM 0 HB THR A 16 0.093 -1.182 8.202 1.00 0.00 H new ATOM 0 HG1 THR A 16 -1.791 -1.138 9.625 1.00 0.00 H new ATOM 0 HG21 THR A 16 -0.078 0.255 10.259 1.00 0.00 H new ATOM 0 HG22 THR A 16 0.879 1.044 8.982 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.805 1.544 9.269 1.00 0.00 H new ATOM 209 N ILE A 17 0.962 1.114 5.227 1.00 0.00 N ATOM 210 CA ILE A 17 2.247 1.186 4.544 1.00 0.00 C ATOM 211 C ILE A 17 3.189 1.876 5.518 1.00 0.00 C ATOM 212 O ILE A 17 2.827 2.873 6.144 1.00 0.00 O ATOM 213 CB ILE A 17 2.151 1.937 3.195 1.00 0.00 C ATOM 214 CG1 ILE A 17 3.521 2.038 2.492 1.00 0.00 C ATOM 215 CG2 ILE A 17 1.615 3.372 3.339 1.00 0.00 C ATOM 216 CD1 ILE A 17 4.139 0.717 2.037 1.00 0.00 C ATOM 0 H ILE A 17 0.358 1.917 5.053 1.00 0.00 H new ATOM 0 HA ILE A 17 2.609 0.193 4.279 1.00 0.00 H new ATOM 0 HB ILE A 17 1.454 1.343 2.604 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.414 2.685 1.621 1.00 0.00 H new ATOM 0 HG13 ILE A 17 4.220 2.529 3.170 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.572 3.844 2.358 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.616 3.345 3.773 1.00 0.00 H new ATOM 0 HG23 ILE A 17 2.277 3.944 3.988 1.00 0.00 H new ATOM 0 HD11 ILE A 17 5.098 0.910 1.557 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.289 0.069 2.901 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.471 0.228 1.328 1.00 0.00 H new ATOM 228 N GLU A 18 4.391 1.337 5.662 1.00 0.00 N ATOM 229 CA GLU A 18 5.344 1.810 6.637 1.00 0.00 C ATOM 230 C GLU A 18 6.692 1.864 5.921 1.00 0.00 C ATOM 231 O GLU A 18 7.441 0.883 5.917 1.00 0.00 O ATOM 232 CB GLU A 18 5.298 0.879 7.866 1.00 0.00 C ATOM 233 CG GLU A 18 3.920 0.808 8.571 1.00 0.00 C ATOM 234 CD GLU A 18 3.837 -0.246 9.687 1.00 0.00 C ATOM 235 OE1 GLU A 18 4.614 -0.137 10.663 1.00 0.00 O ATOM 236 OE2 GLU A 18 2.982 -1.161 9.576 1.00 0.00 O ATOM 0 H GLU A 18 4.728 0.556 5.099 1.00 0.00 H new ATOM 0 HA GLU A 18 5.130 2.806 7.024 1.00 0.00 H new ATOM 0 HB2 GLU A 18 5.584 -0.126 7.555 1.00 0.00 H new ATOM 0 HB3 GLU A 18 6.043 1.214 8.587 1.00 0.00 H new ATOM 0 HG2 GLU A 18 3.689 1.786 8.993 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.154 0.593 7.826 1.00 0.00 H new ATOM 243 N GLN A 19 6.963 2.974 5.225 1.00 0.00 N ATOM 244 CA GLN A 19 8.176 3.184 4.436 1.00 0.00 C ATOM 245 C GLN A 19 9.248 3.751 5.373 1.00 0.00 C ATOM 246 O GLN A 19 8.932 4.406 6.369 1.00 0.00 O ATOM 247 CB GLN A 19 7.925 4.144 3.243 1.00 0.00 C ATOM 248 CG GLN A 19 6.562 3.925 2.544 1.00 0.00 C ATOM 249 CD GLN A 19 6.167 4.905 1.436 1.00 0.00 C ATOM 250 OE1 GLN A 19 5.078 4.789 0.875 1.00 0.00 O ATOM 251 NE2 GLN A 19 6.979 5.896 1.117 1.00 0.00 N ATOM 0 H GLN A 19 6.326 3.770 5.196 1.00 0.00 H new ATOM 0 HA GLN A 19 8.503 2.237 4.008 1.00 0.00 H new ATOM 0 HB2 GLN A 19 7.980 5.173 3.598 1.00 0.00 H new ATOM 0 HB3 GLN A 19 8.723 4.017 2.512 1.00 0.00 H new ATOM 0 HG2 GLN A 19 6.559 2.921 2.121 1.00 0.00 H new ATOM 0 HG3 GLN A 19 5.785 3.951 3.308 1.00 0.00 H new ATOM 0 HE21 GLN A 19 7.881 5.987 1.585 1.00 0.00 H new ATOM 0 HE22 GLN A 19 6.705 6.570 0.402 1.00 0.00 H new ATOM 260 N SER A 20 10.526 3.543 5.062 1.00 0.00 N ATOM 261 CA SER A 20 11.636 4.051 5.850 1.00 0.00 C ATOM 262 C SER A 20 12.891 3.927 4.990 1.00 0.00 C ATOM 263 O SER A 20 12.940 3.125 4.046 1.00 0.00 O ATOM 264 CB SER A 20 11.751 3.271 7.180 1.00 0.00 C ATOM 265 OG SER A 20 12.795 3.738 8.020 1.00 0.00 O ATOM 0 H SER A 20 10.819 3.009 4.244 1.00 0.00 H new ATOM 0 HA SER A 20 11.488 5.096 6.124 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.805 3.341 7.716 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.916 2.216 6.961 1.00 0.00 H new ATOM 0 HG SER A 20 12.815 3.207 8.843 1.00 0.00 H new ATOM 271 N GLY A 21 13.903 4.721 5.323 1.00 0.00 N ATOM 272 CA GLY A 21 15.157 4.789 4.603 1.00 0.00 C ATOM 273 C GLY A 21 14.977 5.537 3.286 1.00 0.00 C ATOM 274 O GLY A 21 14.646 6.727 3.272 1.00 0.00 O ATOM 0 H GLY A 21 13.866 5.350 6.125 1.00 0.00 H new ATOM 0 HA2 GLY A 21 15.907 5.291 5.214 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.527 3.782 4.409 1.00 0.00 H new ATOM 278 N ASP A 22 15.184 4.837 2.173 1.00 0.00 N ATOM 279 CA ASP A 22 15.283 5.404 0.834 1.00 0.00 C ATOM 280 C ASP A 22 14.098 4.903 0.020 1.00 0.00 C ATOM 281 O ASP A 22 14.103 3.766 -0.457 1.00 0.00 O ATOM 282 CB ASP A 22 16.630 5.030 0.190 1.00 0.00 C ATOM 283 CG ASP A 22 17.522 6.246 -0.036 1.00 0.00 C ATOM 284 OD1 ASP A 22 17.353 6.912 -1.086 1.00 0.00 O ATOM 285 OD2 ASP A 22 18.458 6.461 0.765 1.00 0.00 O ATOM 0 H ASP A 22 15.291 3.823 2.181 1.00 0.00 H new ATOM 0 HA ASP A 22 15.250 6.493 0.873 1.00 0.00 H new ATOM 0 HB2 ASP A 22 17.149 4.315 0.828 1.00 0.00 H new ATOM 0 HB3 ASP A 22 16.449 4.533 -0.763 1.00 0.00 H new ATOM 290 N PHE A 23 13.041 5.710 -0.076 1.00 0.00 N ATOM 291 CA PHE A 23 11.786 5.360 -0.742 1.00 0.00 C ATOM 292 C PHE A 23 11.405 6.272 -1.906 1.00 0.00 C ATOM 293 O PHE A 23 10.540 5.879 -2.691 1.00 0.00 O ATOM 294 CB PHE A 23 10.664 5.323 0.311 1.00 0.00 C ATOM 295 CG PHE A 23 10.636 6.560 1.192 1.00 0.00 C ATOM 296 CD1 PHE A 23 10.065 7.760 0.725 1.00 0.00 C ATOM 297 CD2 PHE A 23 11.273 6.534 2.448 1.00 0.00 C ATOM 298 CE1 PHE A 23 10.156 8.929 1.502 1.00 0.00 C ATOM 299 CE2 PHE A 23 11.345 7.699 3.228 1.00 0.00 C ATOM 300 CZ PHE A 23 10.795 8.901 2.752 1.00 0.00 C ATOM 0 H PHE A 23 13.034 6.651 0.318 1.00 0.00 H new ATOM 0 HA PHE A 23 11.932 4.380 -1.197 1.00 0.00 H new ATOM 0 HB2 PHE A 23 9.703 5.221 -0.193 1.00 0.00 H new ATOM 0 HB3 PHE A 23 10.790 4.440 0.938 1.00 0.00 H new ATOM 0 HD1 PHE A 23 9.558 7.782 -0.228 1.00 0.00 H new ATOM 0 HD2 PHE A 23 11.707 5.615 2.812 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.732 9.852 1.135 1.00 0.00 H new ATOM 0 HE2 PHE A 23 11.824 7.671 4.196 1.00 0.00 H new ATOM 0 HZ PHE A 23 10.863 9.801 3.346 1.00 0.00 H new ATOM 310 N ARG A 24 12.042 7.432 -2.077 1.00 0.00 N ATOM 311 CA ARG A 24 11.694 8.420 -3.104 1.00 0.00 C ATOM 312 C ARG A 24 12.670 8.405 -4.284 1.00 0.00 C ATOM 313 O ARG A 24 12.781 9.400 -5.002 1.00 0.00 O ATOM 314 CB ARG A 24 11.463 9.811 -2.481 1.00 0.00 C ATOM 315 CG ARG A 24 12.646 10.408 -1.701 1.00 0.00 C ATOM 316 CD ARG A 24 12.289 11.841 -1.282 1.00 0.00 C ATOM 317 NE ARG A 24 13.266 12.416 -0.341 1.00 0.00 N ATOM 318 CZ ARG A 24 13.490 13.724 -0.161 1.00 0.00 C ATOM 319 NH1 ARG A 24 12.943 14.641 -0.950 1.00 0.00 N ATOM 320 NH2 ARG A 24 14.269 14.147 0.824 1.00 0.00 N ATOM 0 H ARG A 24 12.829 7.718 -1.495 1.00 0.00 H new ATOM 0 HA ARG A 24 10.739 8.131 -3.544 1.00 0.00 H new ATOM 0 HB2 ARG A 24 11.193 10.504 -3.278 1.00 0.00 H new ATOM 0 HB3 ARG A 24 10.606 9.748 -1.810 1.00 0.00 H new ATOM 0 HG2 ARG A 24 12.864 9.801 -0.822 1.00 0.00 H new ATOM 0 HG3 ARG A 24 13.544 10.408 -2.319 1.00 0.00 H new ATOM 0 HD2 ARG A 24 12.230 12.471 -2.169 1.00 0.00 H new ATOM 0 HD3 ARG A 24 11.301 11.846 -0.822 1.00 0.00 H new ATOM 0 HE ARG A 24 13.817 11.765 0.219 1.00 0.00 H new ATOM 0 HH11 ARG A 24 12.334 14.356 -1.717 1.00 0.00 H new ATOM 0 HH12 ARG A 24 13.132 15.630 -0.789 1.00 0.00 H new ATOM 0 HH21 ARG A 24 14.705 13.474 1.454 1.00 0.00 H new ATOM 0 HH22 ARG A 24 14.433 15.146 0.952 1.00 0.00 H new ATOM 334 N SER A 25 13.395 7.300 -4.485 1.00 0.00 N ATOM 335 CA SER A 25 14.139 7.023 -5.700 1.00 0.00 C ATOM 336 C SER A 25 14.099 5.523 -6.035 1.00 0.00 C ATOM 337 O SER A 25 15.133 4.851 -6.044 1.00 0.00 O ATOM 338 CB SER A 25 15.555 7.582 -5.546 1.00 0.00 C ATOM 339 OG SER A 25 15.490 8.990 -5.357 1.00 0.00 O ATOM 0 H SER A 25 13.477 6.561 -3.786 1.00 0.00 H new ATOM 0 HA SER A 25 13.680 7.521 -6.554 1.00 0.00 H new ATOM 0 HB2 SER A 25 16.053 7.113 -4.697 1.00 0.00 H new ATOM 0 HB3 SER A 25 16.148 7.350 -6.431 1.00 0.00 H new ATOM 0 HG SER A 25 14.553 9.278 -5.364 1.00 0.00 H new ATOM 345 N PHE A 26 12.889 5.005 -6.285 1.00 0.00 N ATOM 346 CA PHE A 26 12.627 3.704 -6.915 1.00 0.00 C ATOM 347 C PHE A 26 11.371 3.785 -7.799 1.00 0.00 C ATOM 348 O PHE A 26 10.339 4.272 -7.327 1.00 0.00 O ATOM 349 CB PHE A 26 12.449 2.617 -5.841 1.00 0.00 C ATOM 350 CG PHE A 26 13.750 2.062 -5.297 1.00 0.00 C ATOM 351 CD1 PHE A 26 14.587 1.310 -6.143 1.00 0.00 C ATOM 352 CD2 PHE A 26 14.133 2.295 -3.960 1.00 0.00 C ATOM 353 CE1 PHE A 26 15.807 0.810 -5.663 1.00 0.00 C ATOM 354 CE2 PHE A 26 15.357 1.795 -3.481 1.00 0.00 C ATOM 355 CZ PHE A 26 16.197 1.058 -4.337 1.00 0.00 C ATOM 0 H PHE A 26 12.031 5.501 -6.044 1.00 0.00 H new ATOM 0 HA PHE A 26 13.481 3.442 -7.540 1.00 0.00 H new ATOM 0 HB2 PHE A 26 11.870 3.030 -5.015 1.00 0.00 H new ATOM 0 HB3 PHE A 26 11.866 1.798 -6.262 1.00 0.00 H new ATOM 0 HD1 PHE A 26 14.290 1.118 -7.163 1.00 0.00 H new ATOM 0 HD2 PHE A 26 13.486 2.858 -3.304 1.00 0.00 H new ATOM 0 HE1 PHE A 26 16.447 0.234 -6.314 1.00 0.00 H new ATOM 0 HE2 PHE A 26 15.652 1.976 -2.458 1.00 0.00 H new ATOM 0 HZ PHE A 26 17.142 0.683 -3.974 1.00 0.00 H new ATOM 365 N ILE A 27 11.408 3.288 -9.040 1.00 0.00 N ATOM 366 CA ILE A 27 10.307 3.416 -10.010 1.00 0.00 C ATOM 367 C ILE A 27 9.155 2.448 -9.683 1.00 0.00 C ATOM 368 O ILE A 27 9.114 1.306 -10.157 1.00 0.00 O ATOM 369 CB ILE A 27 10.830 3.222 -11.453 1.00 0.00 C ATOM 370 CG1 ILE A 27 12.038 4.126 -11.788 1.00 0.00 C ATOM 371 CG2 ILE A 27 9.739 3.496 -12.506 1.00 0.00 C ATOM 372 CD1 ILE A 27 11.819 5.637 -11.622 1.00 0.00 C ATOM 0 H ILE A 27 12.212 2.779 -9.407 1.00 0.00 H new ATOM 0 HA ILE A 27 9.902 4.425 -9.936 1.00 0.00 H new ATOM 0 HB ILE A 27 11.141 2.178 -11.491 1.00 0.00 H new ATOM 0 HG12 ILE A 27 12.874 3.829 -11.155 1.00 0.00 H new ATOM 0 HG13 ILE A 27 12.335 3.934 -12.819 1.00 0.00 H new ATOM 0 HG21 ILE A 27 10.151 3.348 -13.504 1.00 0.00 H new ATOM 0 HG22 ILE A 27 8.905 2.811 -12.352 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.388 4.523 -12.407 1.00 0.00 H new ATOM 0 HD11 ILE A 27 12.734 6.168 -11.885 1.00 0.00 H new ATOM 0 HD12 ILE A 27 11.010 5.961 -12.276 1.00 0.00 H new ATOM 0 HD13 ILE A 27 11.558 5.855 -10.586 1.00 0.00 H new ATOM 384 N LYS A 28 8.193 2.890 -8.869 1.00 0.00 N ATOM 385 CA LYS A 28 7.015 2.108 -8.488 1.00 0.00 C ATOM 386 C LYS A 28 5.830 3.014 -8.152 1.00 0.00 C ATOM 387 O LYS A 28 6.008 4.226 -8.096 1.00 0.00 O ATOM 388 CB LYS A 28 7.381 1.096 -7.376 1.00 0.00 C ATOM 389 CG LYS A 28 8.372 1.546 -6.282 1.00 0.00 C ATOM 390 CD LYS A 28 7.786 2.612 -5.366 1.00 0.00 C ATOM 391 CE LYS A 28 8.790 3.116 -4.319 1.00 0.00 C ATOM 392 NZ LYS A 28 9.421 4.387 -4.733 1.00 0.00 N ATOM 0 H LYS A 28 8.212 3.819 -8.449 1.00 0.00 H new ATOM 0 HA LYS A 28 6.681 1.515 -9.339 1.00 0.00 H new ATOM 0 HB2 LYS A 28 6.457 0.792 -6.884 1.00 0.00 H new ATOM 0 HB3 LYS A 28 7.794 0.208 -7.855 1.00 0.00 H new ATOM 0 HG2 LYS A 28 8.667 0.682 -5.686 1.00 0.00 H new ATOM 0 HG3 LYS A 28 9.276 1.933 -6.752 1.00 0.00 H new ATOM 0 HD2 LYS A 28 7.443 3.453 -5.968 1.00 0.00 H new ATOM 0 HD3 LYS A 28 6.911 2.207 -4.858 1.00 0.00 H new ATOM 0 HE2 LYS A 28 8.281 3.256 -3.365 1.00 0.00 H new ATOM 0 HE3 LYS A 28 9.561 2.362 -4.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 10.054 4.722 -3.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 9.969 4.235 -5.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.684 5.100 -4.908 1.00 0.00 H new ATOM 406 N SER A 29 4.645 2.437 -7.943 1.00 0.00 N ATOM 407 CA SER A 29 3.363 3.137 -7.779 1.00 0.00 C ATOM 408 C SER A 29 2.532 2.455 -6.690 1.00 0.00 C ATOM 409 O SER A 29 2.874 1.349 -6.253 1.00 0.00 O ATOM 410 CB SER A 29 2.589 3.090 -9.105 1.00 0.00 C ATOM 411 OG SER A 29 3.333 3.583 -10.204 1.00 0.00 O ATOM 0 H SER A 29 4.545 1.424 -7.880 1.00 0.00 H new ATOM 0 HA SER A 29 3.553 4.172 -7.493 1.00 0.00 H new ATOM 0 HB2 SER A 29 2.292 2.061 -9.308 1.00 0.00 H new ATOM 0 HB3 SER A 29 1.673 3.672 -9.004 1.00 0.00 H new ATOM 0 HG SER A 29 2.790 3.526 -11.018 1.00 0.00 H new ATOM 417 N VAL A 30 1.431 3.081 -6.263 1.00 0.00 N ATOM 418 CA VAL A 30 0.583 2.608 -5.173 1.00 0.00 C ATOM 419 C VAL A 30 -0.876 2.757 -5.605 1.00 0.00 C ATOM 420 O VAL A 30 -1.459 3.843 -5.620 1.00 0.00 O ATOM 421 CB VAL A 30 0.907 3.326 -3.851 1.00 0.00 C ATOM 422 CG1 VAL A 30 0.308 2.566 -2.665 1.00 0.00 C ATOM 423 CG2 VAL A 30 2.412 3.415 -3.589 1.00 0.00 C ATOM 0 H VAL A 30 1.100 3.952 -6.678 1.00 0.00 H new ATOM 0 HA VAL A 30 0.776 1.554 -4.971 1.00 0.00 H new ATOM 0 HB VAL A 30 0.485 4.326 -3.947 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.548 3.089 -1.739 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.774 2.508 -2.779 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.724 1.559 -2.631 1.00 0.00 H new ATOM 0 HG21 VAL A 30 2.587 3.930 -2.644 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.832 2.411 -3.538 1.00 0.00 H new ATOM 0 HG23 VAL A 30 2.890 3.968 -4.398 1.00 0.00 H new ATOM 433 N VAL A 31 -1.453 1.638 -6.022 1.00 0.00 N ATOM 434 CA VAL A 31 -2.825 1.514 -6.477 1.00 0.00 C ATOM 435 C VAL A 31 -3.671 1.301 -5.216 1.00 0.00 C ATOM 436 O VAL A 31 -3.953 0.163 -4.828 1.00 0.00 O ATOM 437 CB VAL A 31 -2.872 0.344 -7.477 1.00 0.00 C ATOM 438 CG1 VAL A 31 -4.250 0.091 -8.091 1.00 0.00 C ATOM 439 CG2 VAL A 31 -1.902 0.559 -8.660 1.00 0.00 C ATOM 0 H VAL A 31 -0.950 0.751 -6.052 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.215 2.387 -7.000 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.588 -0.516 -6.870 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.191 -0.749 -8.783 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.964 -0.139 -7.300 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.578 0.981 -8.628 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.966 -0.289 -9.342 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.172 1.472 -9.190 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -0.883 0.646 -8.284 1.00 0.00 H new ATOM 449 N VAL A 32 -4.009 2.396 -4.530 1.00 0.00 N ATOM 450 CA VAL A 32 -4.699 2.347 -3.249 1.00 0.00 C ATOM 451 C VAL A 32 -5.919 3.272 -3.262 1.00 0.00 C ATOM 452 O VAL A 32 -5.918 4.344 -2.659 1.00 0.00 O ATOM 453 CB VAL A 32 -3.706 2.579 -2.081 1.00 0.00 C ATOM 454 CG1 VAL A 32 -2.900 3.884 -2.176 1.00 0.00 C ATOM 455 CG2 VAL A 32 -4.365 2.511 -0.691 1.00 0.00 C ATOM 0 H VAL A 32 -3.809 3.342 -4.853 1.00 0.00 H new ATOM 0 HA VAL A 32 -5.102 1.349 -3.078 1.00 0.00 H new ATOM 0 HB VAL A 32 -3.014 1.745 -2.193 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.232 3.962 -1.318 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.313 3.883 -3.094 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.583 4.734 -2.183 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.611 2.682 0.078 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -5.139 3.275 -0.617 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -4.812 1.527 -0.548 1.00 0.00 H new ATOM 465 N VAL A 33 -6.995 2.865 -3.927 1.00 0.00 N ATOM 466 CA VAL A 33 -8.287 3.514 -3.751 1.00 0.00 C ATOM 467 C VAL A 33 -9.392 2.495 -3.933 1.00 0.00 C ATOM 468 O VAL A 33 -9.170 1.425 -4.496 1.00 0.00 O ATOM 469 CB VAL A 33 -8.411 4.707 -4.708 1.00 0.00 C ATOM 470 CG1 VAL A 33 -8.699 4.253 -6.151 1.00 0.00 C ATOM 471 CG2 VAL A 33 -9.445 5.712 -4.184 1.00 0.00 C ATOM 0 H VAL A 33 -6.997 2.091 -4.591 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.376 3.913 -2.740 1.00 0.00 H new ATOM 0 HB VAL A 33 -7.450 5.221 -4.743 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -8.780 5.126 -6.798 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.887 3.616 -6.501 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -9.635 3.695 -6.177 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -9.519 6.551 -4.875 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -10.416 5.224 -4.099 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -9.135 6.076 -3.204 1.00 0.00 H new ATOM 481 N ALA A 34 -10.589 2.807 -3.449 1.00 0.00 N ATOM 482 CA ALA A 34 -11.727 1.940 -3.664 1.00 0.00 C ATOM 483 C ALA A 34 -12.366 2.318 -4.994 1.00 0.00 C ATOM 484 O ALA A 34 -12.488 3.503 -5.316 1.00 0.00 O ATOM 485 CB ALA A 34 -12.712 2.117 -2.516 1.00 0.00 C ATOM 0 H ALA A 34 -10.790 3.649 -2.910 1.00 0.00 H new ATOM 0 HA ALA A 34 -11.423 0.894 -3.696 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -13.573 1.466 -2.671 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -12.226 1.857 -1.576 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -13.044 3.155 -2.478 1.00 0.00 H new ATOM 491 N ASN A 35 -12.890 1.324 -5.713 1.00 0.00 N ATOM 492 CA ASN A 35 -13.581 1.549 -6.988 1.00 0.00 C ATOM 493 C ASN A 35 -15.028 1.997 -6.781 1.00 0.00 C ATOM 494 O ASN A 35 -15.892 1.769 -7.628 1.00 0.00 O ATOM 495 CB ASN A 35 -13.467 0.359 -7.949 1.00 0.00 C ATOM 496 CG ASN A 35 -13.050 0.888 -9.321 1.00 0.00 C ATOM 497 OD1 ASN A 35 -11.775 1.219 -9.503 1.00 0.00 O flip ATOM 498 ND2 ASN A 35 -13.896 1.089 -10.182 1.00 0.00 N flip ATOM 0 H ASN A 35 -12.849 0.344 -5.432 1.00 0.00 H new ATOM 0 HA ASN A 35 -13.061 2.373 -7.477 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -12.734 -0.358 -7.580 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -14.420 -0.166 -8.018 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -14.867 0.825 -10.015 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -13.630 1.521 -11.067 1.00 0.00 H new ATOM 505 N GLY A 36 -15.329 2.541 -5.605 1.00 0.00 N ATOM 506 CA GLY A 36 -16.672 2.856 -5.194 1.00 0.00 C ATOM 507 C GLY A 36 -16.627 3.909 -4.111 1.00 0.00 C ATOM 508 O GLY A 36 -16.750 5.100 -4.395 1.00 0.00 O ATOM 0 H GLY A 36 -14.624 2.775 -4.906 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -17.250 3.217 -6.045 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -17.172 1.960 -4.826 1.00 0.00 H new ATOM 512 N THR A 37 -16.417 3.431 -2.885 1.00 0.00 N ATOM 513 CA THR A 37 -16.479 4.239 -1.678 1.00 0.00 C ATOM 514 C THR A 37 -15.338 5.275 -1.647 1.00 0.00 C ATOM 515 O THR A 37 -14.425 5.255 -2.486 1.00 0.00 O ATOM 516 CB THR A 37 -16.537 3.281 -0.469 1.00 0.00 C ATOM 517 OG1 THR A 37 -16.906 3.931 0.721 1.00 0.00 O ATOM 518 CG2 THR A 37 -15.209 2.567 -0.204 1.00 0.00 C ATOM 0 H THR A 37 -16.195 2.452 -2.705 1.00 0.00 H new ATOM 0 HA THR A 37 -17.381 4.850 -1.645 1.00 0.00 H new ATOM 0 HB THR A 37 -17.297 2.551 -0.749 1.00 0.00 H new ATOM 0 HG1 THR A 37 -16.158 4.477 1.041 1.00 0.00 H new ATOM 0 HG21 THR A 37 -15.316 1.909 0.658 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.932 1.978 -1.078 1.00 0.00 H new ATOM 0 HG23 THR A 37 -14.433 3.305 -0.003 1.00 0.00 H new ATOM 526 N GLN A 38 -15.374 6.175 -0.665 1.00 0.00 N ATOM 527 CA GLN A 38 -14.373 7.212 -0.447 1.00 0.00 C ATOM 528 C GLN A 38 -13.293 6.727 0.518 1.00 0.00 C ATOM 529 O GLN A 38 -13.496 5.782 1.293 1.00 0.00 O ATOM 530 CB GLN A 38 -15.088 8.472 0.068 1.00 0.00 C ATOM 531 CG GLN A 38 -15.622 9.256 -1.139 1.00 0.00 C ATOM 532 CD GLN A 38 -16.704 10.283 -0.818 1.00 0.00 C ATOM 533 OE1 GLN A 38 -17.524 10.120 0.080 1.00 0.00 O ATOM 534 NE2 GLN A 38 -16.811 11.324 -1.627 1.00 0.00 N ATOM 0 H GLN A 38 -16.127 6.201 0.022 1.00 0.00 H new ATOM 0 HA GLN A 38 -13.865 7.451 -1.381 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -15.906 8.198 0.734 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -14.400 9.089 0.646 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -14.787 9.768 -1.618 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -16.020 8.547 -1.865 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -16.130 11.461 -2.374 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -17.574 11.989 -1.504 1.00 0.00 H new ATOM 543 N LEU A 39 -12.138 7.382 0.455 1.00 0.00 N ATOM 544 CA LEU A 39 -10.967 7.082 1.269 1.00 0.00 C ATOM 545 C LEU A 39 -10.942 7.945 2.529 1.00 0.00 C ATOM 546 O LEU A 39 -11.636 8.963 2.627 1.00 0.00 O ATOM 547 CB LEU A 39 -9.703 7.283 0.399 1.00 0.00 C ATOM 548 CG LEU A 39 -8.875 6.014 0.114 1.00 0.00 C ATOM 549 CD1 LEU A 39 -7.983 5.664 1.299 1.00 0.00 C ATOM 550 CD2 LEU A 39 -9.716 4.780 -0.252 1.00 0.00 C ATOM 0 H LEU A 39 -11.987 8.162 -0.185 1.00 0.00 H new ATOM 0 HA LEU A 39 -11.001 6.047 1.609 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.006 7.718 -0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.059 8.011 0.891 1.00 0.00 H new ATOM 0 HG LEU A 39 -8.274 6.266 -0.759 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.410 4.765 1.070 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.299 6.490 1.496 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -8.601 5.487 2.179 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -9.057 3.932 -0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -10.391 4.543 0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.298 4.989 -1.150 1.00 0.00 H new ATOM 562 N LYS A 40 -10.135 7.537 3.505 1.00 0.00 N ATOM 563 CA LYS A 40 -9.834 8.248 4.723 1.00 0.00 C ATOM 564 C LYS A 40 -8.333 8.467 4.814 1.00 0.00 C ATOM 565 O LYS A 40 -7.570 7.526 4.608 1.00 0.00 O ATOM 566 CB LYS A 40 -10.359 7.421 5.898 1.00 0.00 C ATOM 567 CG LYS A 40 -10.065 8.151 7.206 1.00 0.00 C ATOM 568 CD LYS A 40 -11.064 7.767 8.295 1.00 0.00 C ATOM 569 CE LYS A 40 -12.284 8.679 8.197 1.00 0.00 C ATOM 570 NZ LYS A 40 -13.529 8.008 7.779 1.00 0.00 N ATOM 0 H LYS A 40 -9.648 6.642 3.453 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.314 9.227 4.741 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -11.432 7.260 5.792 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.888 6.438 5.904 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.054 7.914 7.538 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -10.102 9.228 7.040 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -11.363 6.725 8.181 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.603 7.860 9.278 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -12.449 9.147 9.168 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -12.065 9.480 7.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -14.107 8.667 7.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -13.297 7.175 7.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -14.062 7.709 8.621 1.00 0.00 H new ATOM 584 N ASP A 41 -7.936 9.702 5.115 1.00 0.00 N ATOM 585 CA ASP A 41 -6.547 10.123 5.218 1.00 0.00 C ATOM 586 C ASP A 41 -6.067 9.777 6.619 1.00 0.00 C ATOM 587 O ASP A 41 -6.706 10.165 7.605 1.00 0.00 O ATOM 588 CB ASP A 41 -6.394 11.648 5.041 1.00 0.00 C ATOM 589 CG ASP A 41 -5.857 12.155 3.708 1.00 0.00 C ATOM 590 OD1 ASP A 41 -5.207 11.365 2.991 1.00 0.00 O ATOM 591 OD2 ASP A 41 -5.990 13.374 3.453 1.00 0.00 O ATOM 0 H ASP A 41 -8.596 10.458 5.299 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.974 9.623 4.437 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -7.370 12.104 5.205 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -5.735 12.013 5.829 1.00 0.00 H new ATOM 596 N GLY A 42 -4.879 9.179 6.720 1.00 0.00 N ATOM 597 CA GLY A 42 -4.178 8.986 7.986 1.00 0.00 C ATOM 598 C GLY A 42 -3.582 10.286 8.539 1.00 0.00 C ATOM 599 O GLY A 42 -2.795 10.255 9.485 1.00 0.00 O ATOM 0 H GLY A 42 -4.372 8.812 5.915 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -4.869 8.568 8.718 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -3.380 8.256 7.847 1.00 0.00 H new ATOM 603 N ALA A 43 -3.903 11.443 7.950 1.00 0.00 N ATOM 604 CA ALA A 43 -3.631 12.734 8.549 1.00 0.00 C ATOM 605 C ALA A 43 -4.420 12.841 9.847 1.00 0.00 C ATOM 606 O ALA A 43 -3.829 12.963 10.923 1.00 0.00 O ATOM 607 CB ALA A 43 -4.003 13.865 7.585 1.00 0.00 C ATOM 0 H ALA A 43 -4.361 11.500 7.040 1.00 0.00 H new ATOM 0 HA ALA A 43 -2.566 12.827 8.763 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.791 14.826 8.053 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -3.418 13.770 6.670 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.065 13.804 7.345 1.00 0.00 H new ATOM 613 N THR A 44 -5.744 12.818 9.711 1.00 0.00 N ATOM 614 CA THR A 44 -6.695 13.351 10.676 1.00 0.00 C ATOM 615 C THR A 44 -8.064 12.659 10.588 1.00 0.00 C ATOM 616 O THR A 44 -8.985 13.064 11.296 1.00 0.00 O ATOM 617 CB THR A 44 -6.849 14.861 10.403 1.00 0.00 C ATOM 618 OG1 THR A 44 -6.985 15.091 9.011 1.00 0.00 O ATOM 619 CG2 THR A 44 -5.651 15.677 10.897 1.00 0.00 C ATOM 0 H THR A 44 -6.198 12.411 8.893 1.00 0.00 H new ATOM 0 HA THR A 44 -6.316 13.169 11.682 1.00 0.00 H new ATOM 0 HB THR A 44 -7.737 15.182 10.948 1.00 0.00 H new ATOM 0 HG1 THR A 44 -7.084 16.052 8.846 1.00 0.00 H new ATOM 0 HG21 THR A 44 -5.814 16.732 10.678 1.00 0.00 H new ATOM 0 HG22 THR A 44 -5.538 15.543 11.973 1.00 0.00 H new ATOM 0 HG23 THR A 44 -4.747 15.338 10.392 1.00 0.00 H new ATOM 627 N GLY A 45 -8.241 11.640 9.736 1.00 0.00 N ATOM 628 CA GLY A 45 -9.540 11.002 9.552 1.00 0.00 C ATOM 629 C GLY A 45 -10.470 11.805 8.635 1.00 0.00 C ATOM 630 O GLY A 45 -11.690 11.665 8.729 1.00 0.00 O ATOM 0 H GLY A 45 -7.495 11.243 9.165 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -9.395 10.006 9.133 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -10.017 10.873 10.523 1.00 0.00 H new ATOM 634 N GLU A 46 -9.923 12.651 7.760 1.00 0.00 N ATOM 635 CA GLU A 46 -10.669 13.374 6.725 1.00 0.00 C ATOM 636 C GLU A 46 -11.268 12.389 5.706 1.00 0.00 C ATOM 637 O GLU A 46 -10.919 11.206 5.708 1.00 0.00 O ATOM 638 CB GLU A 46 -9.708 14.362 6.042 1.00 0.00 C ATOM 639 CG GLU A 46 -9.364 15.555 6.948 1.00 0.00 C ATOM 640 CD GLU A 46 -10.323 16.717 6.719 1.00 0.00 C ATOM 641 OE1 GLU A 46 -11.440 16.679 7.281 1.00 0.00 O ATOM 642 OE2 GLU A 46 -9.957 17.658 5.983 1.00 0.00 O ATOM 0 H GLU A 46 -8.924 12.858 7.750 1.00 0.00 H new ATOM 0 HA GLU A 46 -11.499 13.922 7.172 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -8.791 13.842 5.765 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -10.159 14.727 5.119 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.406 15.246 7.992 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -8.342 15.880 6.753 1.00 0.00 H new ATOM 649 N SER A 47 -12.151 12.850 4.819 1.00 0.00 N ATOM 650 CA SER A 47 -12.744 12.059 3.749 1.00 0.00 C ATOM 651 C SER A 47 -12.330 12.608 2.387 1.00 0.00 C ATOM 652 O SER A 47 -12.473 13.806 2.117 1.00 0.00 O ATOM 653 CB SER A 47 -14.268 11.980 3.925 1.00 0.00 C ATOM 654 OG SER A 47 -14.826 13.203 4.384 1.00 0.00 O ATOM 0 H SER A 47 -12.481 13.815 4.829 1.00 0.00 H new ATOM 0 HA SER A 47 -12.368 11.037 3.801 1.00 0.00 H new ATOM 0 HB2 SER A 47 -14.727 11.709 2.974 1.00 0.00 H new ATOM 0 HB3 SER A 47 -14.508 11.186 4.632 1.00 0.00 H new ATOM 0 HG SER A 47 -15.796 13.105 4.479 1.00 0.00 H new ATOM 660 N LEU A 48 -11.795 11.734 1.535 1.00 0.00 N ATOM 661 CA LEU A 48 -11.107 12.073 0.295 1.00 0.00 C ATOM 662 C LEU A 48 -11.822 11.347 -0.841 1.00 0.00 C ATOM 663 O LEU A 48 -12.610 10.428 -0.596 1.00 0.00 O ATOM 664 CB LEU A 48 -9.599 11.716 0.364 1.00 0.00 C ATOM 665 CG LEU A 48 -8.781 12.335 1.526 1.00 0.00 C ATOM 666 CD1 LEU A 48 -9.053 13.828 1.719 1.00 0.00 C ATOM 667 CD2 LEU A 48 -8.951 11.551 2.828 1.00 0.00 C ATOM 0 H LEU A 48 -11.832 10.728 1.699 1.00 0.00 H new ATOM 0 HA LEU A 48 -11.143 13.149 0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -9.510 10.631 0.428 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.136 12.019 -0.575 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.734 12.253 1.234 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -8.451 14.203 2.547 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -8.793 14.366 0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -10.109 13.980 1.941 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.360 12.020 3.615 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -10.002 11.548 3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.612 10.525 2.682 1.00 0.00 H new ATOM 679 N ALA A 49 -11.610 11.801 -2.071 1.00 0.00 N ATOM 680 CA ALA A 49 -12.301 11.319 -3.259 1.00 0.00 C ATOM 681 C ALA A 49 -11.928 9.872 -3.598 1.00 0.00 C ATOM 682 O ALA A 49 -11.059 9.251 -2.981 1.00 0.00 O ATOM 683 CB ALA A 49 -11.951 12.261 -4.423 1.00 0.00 C ATOM 0 H ALA A 49 -10.933 12.536 -2.274 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.375 11.320 -3.074 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.456 11.924 -5.328 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.276 13.273 -4.182 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.873 12.255 -4.585 1.00 0.00 H new ATOM 689 N SER A 50 -12.563 9.345 -4.640 1.00 0.00 N ATOM 690 CA SER A 50 -12.079 8.186 -5.365 1.00 0.00 C ATOM 691 C SER A 50 -12.408 8.350 -6.860 1.00 0.00 C ATOM 692 O SER A 50 -13.362 9.063 -7.184 1.00 0.00 O ATOM 693 CB SER A 50 -12.665 6.911 -4.738 1.00 0.00 C ATOM 694 OG SER A 50 -14.082 6.898 -4.673 1.00 0.00 O ATOM 0 H SER A 50 -13.439 9.719 -5.006 1.00 0.00 H new ATOM 0 HA SER A 50 -10.995 8.097 -5.291 1.00 0.00 H new ATOM 0 HB2 SER A 50 -12.330 6.048 -5.314 1.00 0.00 H new ATOM 0 HB3 SER A 50 -12.264 6.797 -3.731 1.00 0.00 H new ATOM 0 HG SER A 50 -14.370 6.337 -3.923 1.00 0.00 H new ATOM 700 N PRO A 51 -11.676 7.691 -7.773 1.00 0.00 N ATOM 701 CA PRO A 51 -10.386 7.047 -7.539 1.00 0.00 C ATOM 702 C PRO A 51 -9.280 8.093 -7.290 1.00 0.00 C ATOM 703 O PRO A 51 -9.487 9.290 -7.505 1.00 0.00 O ATOM 704 CB PRO A 51 -10.120 6.256 -8.825 1.00 0.00 C ATOM 705 CG PRO A 51 -10.744 7.151 -9.890 1.00 0.00 C ATOM 706 CD PRO A 51 -11.994 7.681 -9.194 1.00 0.00 C ATOM 0 HA PRO A 51 -10.394 6.410 -6.654 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -9.054 6.103 -8.995 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.584 5.270 -8.799 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -10.073 7.957 -10.185 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -10.990 6.594 -10.794 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -12.245 8.681 -9.547 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -12.856 7.046 -9.398 1.00 0.00 H new ATOM 714 N VAL A 52 -8.125 7.622 -6.813 1.00 0.00 N ATOM 715 CA VAL A 52 -6.876 8.336 -6.599 1.00 0.00 C ATOM 716 C VAL A 52 -5.788 7.263 -6.752 1.00 0.00 C ATOM 717 O VAL A 52 -5.804 6.289 -6.002 1.00 0.00 O ATOM 718 CB VAL A 52 -6.819 8.967 -5.187 1.00 0.00 C ATOM 719 CG1 VAL A 52 -5.543 9.814 -5.075 1.00 0.00 C ATOM 720 CG2 VAL A 52 -8.040 9.829 -4.830 1.00 0.00 C ATOM 0 H VAL A 52 -8.039 6.642 -6.544 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.756 9.161 -7.301 1.00 0.00 H new ATOM 0 HB VAL A 52 -6.818 8.141 -4.476 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.491 10.264 -4.084 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.670 9.180 -5.232 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.560 10.600 -5.830 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.919 10.233 -3.825 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -8.127 10.649 -5.542 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.941 9.217 -4.869 1.00 0.00 H new ATOM 730 N ILE A 53 -4.890 7.354 -7.731 1.00 0.00 N ATOM 731 CA ILE A 53 -3.939 6.281 -8.037 1.00 0.00 C ATOM 732 C ILE A 53 -2.554 6.925 -8.029 1.00 0.00 C ATOM 733 O ILE A 53 -2.219 7.692 -8.930 1.00 0.00 O ATOM 734 CB ILE A 53 -4.361 5.558 -9.342 1.00 0.00 C ATOM 735 CG1 ILE A 53 -5.674 4.760 -9.095 1.00 0.00 C ATOM 736 CG2 ILE A 53 -3.257 4.619 -9.868 1.00 0.00 C ATOM 737 CD1 ILE A 53 -6.451 4.365 -10.356 1.00 0.00 C ATOM 0 H ILE A 53 -4.799 8.171 -8.335 1.00 0.00 H new ATOM 0 HA ILE A 53 -3.922 5.476 -7.302 1.00 0.00 H new ATOM 0 HB ILE A 53 -4.528 6.317 -10.106 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -5.429 3.854 -8.541 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -6.327 5.357 -8.458 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.597 4.134 -10.783 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.357 5.197 -10.076 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.036 3.861 -9.117 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -7.348 3.814 -10.073 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -6.735 5.263 -10.905 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -5.823 3.737 -10.988 1.00 0.00 H new ATOM 749 N LEU A 54 -1.798 6.697 -6.949 1.00 0.00 N ATOM 750 CA LEU A 54 -0.540 7.383 -6.702 1.00 0.00 C ATOM 751 C LEU A 54 0.538 6.757 -7.573 1.00 0.00 C ATOM 752 O LEU A 54 0.719 5.534 -7.585 1.00 0.00 O ATOM 753 CB LEU A 54 -0.117 7.303 -5.225 1.00 0.00 C ATOM 754 CG LEU A 54 -1.060 7.945 -4.184 1.00 0.00 C ATOM 755 CD1 LEU A 54 -1.524 9.353 -4.572 1.00 0.00 C ATOM 756 CD2 LEU A 54 -2.291 7.090 -3.861 1.00 0.00 C ATOM 0 H LEU A 54 -2.049 6.027 -6.223 1.00 0.00 H new ATOM 0 HA LEU A 54 -0.674 8.437 -6.947 1.00 0.00 H new ATOM 0 HB2 LEU A 54 0.006 6.252 -4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 54 0.862 7.772 -5.128 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.442 8.013 -3.289 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -2.183 9.745 -3.798 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.657 10.006 -4.676 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.062 9.311 -5.519 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.907 7.604 -3.123 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -2.871 6.929 -4.770 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.971 6.128 -3.460 1.00 0.00 H new ATOM 768 N SER A 55 1.268 7.609 -8.279 1.00 0.00 N ATOM 769 CA SER A 55 2.348 7.229 -9.168 1.00 0.00 C ATOM 770 C SER A 55 3.693 7.431 -8.470 1.00 0.00 C ATOM 771 O SER A 55 3.738 7.703 -7.270 1.00 0.00 O ATOM 772 CB SER A 55 2.208 8.048 -10.461 1.00 0.00 C ATOM 773 OG SER A 55 0.875 8.021 -10.957 1.00 0.00 O ATOM 0 H SER A 55 1.117 8.617 -8.245 1.00 0.00 H new ATOM 0 HA SER A 55 2.298 6.172 -9.429 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.506 9.080 -10.273 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.886 7.653 -11.217 1.00 0.00 H new ATOM 0 HG SER A 55 0.821 8.553 -11.778 1.00 0.00 H new ATOM 779 N ASP A 56 4.793 7.261 -9.205 1.00 0.00 N ATOM 780 CA ASP A 56 6.138 7.298 -8.648 1.00 0.00 C ATOM 781 C ASP A 56 6.443 8.641 -8.005 1.00 0.00 C ATOM 782 O ASP A 56 7.020 8.674 -6.917 1.00 0.00 O ATOM 783 CB ASP A 56 7.184 6.951 -9.715 1.00 0.00 C ATOM 784 CG ASP A 56 7.504 8.086 -10.690 1.00 0.00 C ATOM 785 OD1 ASP A 56 6.591 8.432 -11.476 1.00 0.00 O ATOM 786 OD2 ASP A 56 8.652 8.581 -10.673 1.00 0.00 O ATOM 0 H ASP A 56 4.771 7.093 -10.211 1.00 0.00 H new ATOM 0 HA ASP A 56 6.187 6.542 -7.864 1.00 0.00 H new ATOM 0 HB2 ASP A 56 8.105 6.648 -9.217 1.00 0.00 H new ATOM 0 HB3 ASP A 56 6.831 6.090 -10.284 1.00 0.00 H new ATOM 791 N GLU A 57 6.040 9.732 -8.649 1.00 0.00 N ATOM 792 CA GLU A 57 6.318 11.060 -8.140 1.00 0.00 C ATOM 793 C GLU A 57 5.422 11.364 -6.925 1.00 0.00 C ATOM 794 O GLU A 57 5.880 11.954 -5.949 1.00 0.00 O ATOM 795 CB GLU A 57 6.137 12.080 -9.276 1.00 0.00 C ATOM 796 CG GLU A 57 7.361 12.170 -10.213 1.00 0.00 C ATOM 797 CD GLU A 57 8.611 12.791 -9.566 1.00 0.00 C ATOM 798 OE1 GLU A 57 8.468 13.666 -8.679 1.00 0.00 O ATOM 799 OE2 GLU A 57 9.751 12.461 -9.958 1.00 0.00 O ATOM 0 H GLU A 57 5.519 9.717 -9.526 1.00 0.00 H new ATOM 0 HA GLU A 57 7.349 11.124 -7.792 1.00 0.00 H new ATOM 0 HB2 GLU A 57 5.258 11.810 -9.862 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.944 13.063 -8.846 1.00 0.00 H new ATOM 0 HG2 GLU A 57 7.608 11.169 -10.565 1.00 0.00 H new ATOM 0 HG3 GLU A 57 7.090 12.758 -11.090 1.00 0.00 H new ATOM 806 N GLU A 58 4.162 10.915 -6.942 1.00 0.00 N ATOM 807 CA GLU A 58 3.202 11.030 -5.833 1.00 0.00 C ATOM 808 C GLU A 58 3.518 10.072 -4.670 1.00 0.00 C ATOM 809 O GLU A 58 2.750 9.955 -3.709 1.00 0.00 O ATOM 810 CB GLU A 58 1.772 10.776 -6.354 1.00 0.00 C ATOM 811 CG GLU A 58 0.932 12.046 -6.544 1.00 0.00 C ATOM 812 CD GLU A 58 0.467 12.755 -5.267 1.00 0.00 C ATOM 813 OE1 GLU A 58 1.226 12.844 -4.278 1.00 0.00 O ATOM 814 OE2 GLU A 58 -0.653 13.322 -5.302 1.00 0.00 O ATOM 0 H GLU A 58 3.767 10.445 -7.756 1.00 0.00 H new ATOM 0 HA GLU A 58 3.283 12.043 -5.439 1.00 0.00 H new ATOM 0 HB2 GLU A 58 1.834 10.250 -7.307 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.257 10.115 -5.657 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.513 12.754 -7.135 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.051 11.788 -7.131 1.00 0.00 H new ATOM 821 N LEU A 59 4.629 9.341 -4.752 1.00 0.00 N ATOM 822 CA LEU A 59 5.087 8.456 -3.694 1.00 0.00 C ATOM 823 C LEU A 59 6.058 9.158 -2.743 1.00 0.00 C ATOM 824 O LEU A 59 6.698 8.494 -1.923 1.00 0.00 O ATOM 825 CB LEU A 59 5.682 7.185 -4.311 1.00 0.00 C ATOM 826 CG LEU A 59 4.917 5.935 -3.868 1.00 0.00 C ATOM 827 CD1 LEU A 59 5.570 4.742 -4.552 1.00 0.00 C ATOM 828 CD2 LEU A 59 4.999 5.697 -2.350 1.00 0.00 C ATOM 0 H LEU A 59 5.241 9.350 -5.568 1.00 0.00 H new ATOM 0 HA LEU A 59 4.233 8.168 -3.080 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.658 7.261 -5.398 1.00 0.00 H new ATOM 0 HB3 LEU A 59 6.729 7.094 -4.021 1.00 0.00 H new ATOM 0 HG LEU A 59 3.868 6.065 -4.133 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.052 3.828 -4.261 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.510 4.865 -5.633 1.00 0.00 H new ATOM 0 HD13 LEU A 59 6.616 4.678 -4.252 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.439 4.798 -2.092 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.041 5.572 -2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.574 6.552 -1.824 1.00 0.00 H new ATOM 840 N ALA A 60 6.179 10.486 -2.827 1.00 0.00 N ATOM 841 CA ALA A 60 6.994 11.324 -1.956 1.00 0.00 C ATOM 842 C ALA A 60 6.356 11.472 -0.560 1.00 0.00 C ATOM 843 O ALA A 60 6.352 12.557 0.022 1.00 0.00 O ATOM 844 CB ALA A 60 7.226 12.673 -2.650 1.00 0.00 C ATOM 0 H ALA A 60 5.687 11.027 -3.538 1.00 0.00 H new ATOM 0 HA ALA A 60 7.962 10.853 -1.786 1.00 0.00 H new ATOM 0 HB1 ALA A 60 7.835 13.312 -2.010 1.00 0.00 H new ATOM 0 HB2 ALA A 60 7.741 12.511 -3.597 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.267 13.156 -2.837 1.00 0.00 H new ATOM 850 N VAL A 61 5.868 10.374 0.012 1.00 0.00 N ATOM 851 CA VAL A 61 5.253 10.203 1.330 1.00 0.00 C ATOM 852 C VAL A 61 6.130 9.233 2.149 1.00 0.00 C ATOM 853 O VAL A 61 7.138 8.755 1.628 1.00 0.00 O ATOM 854 CB VAL A 61 3.789 9.742 1.147 1.00 0.00 C ATOM 855 CG1 VAL A 61 2.918 10.912 0.672 1.00 0.00 C ATOM 856 CG2 VAL A 61 3.632 8.585 0.146 1.00 0.00 C ATOM 0 H VAL A 61 5.896 9.486 -0.489 1.00 0.00 H new ATOM 0 HA VAL A 61 5.206 11.136 1.892 1.00 0.00 H new ATOM 0 HB VAL A 61 3.467 9.384 2.125 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.890 10.573 0.547 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.949 11.712 1.411 1.00 0.00 H new ATOM 0 HG13 VAL A 61 3.296 11.283 -0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.580 8.313 0.067 1.00 0.00 H new ATOM 0 HG22 VAL A 61 4.001 8.897 -0.831 1.00 0.00 H new ATOM 0 HG23 VAL A 61 4.204 7.724 0.492 1.00 0.00 H new ATOM 866 N GLU A 62 5.831 8.977 3.429 1.00 0.00 N ATOM 867 CA GLU A 62 6.690 8.162 4.310 1.00 0.00 C ATOM 868 C GLU A 62 5.880 7.113 5.064 1.00 0.00 C ATOM 869 O GLU A 62 6.232 5.933 5.082 1.00 0.00 O ATOM 870 CB GLU A 62 7.488 9.013 5.322 1.00 0.00 C ATOM 871 CG GLU A 62 7.983 10.356 4.774 1.00 0.00 C ATOM 872 CD GLU A 62 9.045 11.046 5.642 1.00 0.00 C ATOM 873 OE1 GLU A 62 9.778 10.363 6.392 1.00 0.00 O ATOM 874 OE2 GLU A 62 9.161 12.294 5.579 1.00 0.00 O ATOM 0 H GLU A 62 4.989 9.327 3.886 1.00 0.00 H new ATOM 0 HA GLU A 62 7.402 7.666 3.650 1.00 0.00 H new ATOM 0 HB2 GLU A 62 6.861 9.200 6.194 1.00 0.00 H new ATOM 0 HB3 GLU A 62 8.347 8.436 5.665 1.00 0.00 H new ATOM 0 HG2 GLU A 62 8.394 10.198 3.777 1.00 0.00 H new ATOM 0 HG3 GLU A 62 7.130 11.026 4.665 1.00 0.00 H new ATOM 881 N LYS A 63 4.808 7.539 5.729 1.00 0.00 N ATOM 882 CA LYS A 63 3.957 6.631 6.490 1.00 0.00 C ATOM 883 C LYS A 63 2.524 7.138 6.454 1.00 0.00 C ATOM 884 O LYS A 63 2.327 8.355 6.410 1.00 0.00 O ATOM 885 CB LYS A 63 4.495 6.539 7.931 1.00 0.00 C ATOM 886 CG LYS A 63 4.245 5.158 8.555 1.00 0.00 C ATOM 887 CD LYS A 63 5.545 4.497 9.038 1.00 0.00 C ATOM 888 CE LYS A 63 6.042 5.048 10.377 1.00 0.00 C ATOM 889 NZ LYS A 63 5.156 4.640 11.486 1.00 0.00 N ATOM 0 H LYS A 63 4.508 8.514 5.755 1.00 0.00 H new ATOM 0 HA LYS A 63 3.968 5.631 6.055 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.565 6.748 7.932 1.00 0.00 H new ATOM 0 HB3 LYS A 63 4.020 7.305 8.544 1.00 0.00 H new ATOM 0 HG2 LYS A 63 3.557 5.259 9.394 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.761 4.512 7.822 1.00 0.00 H new ATOM 0 HD2 LYS A 63 5.385 3.423 9.132 1.00 0.00 H new ATOM 0 HD3 LYS A 63 6.319 4.640 8.284 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.054 4.691 10.567 1.00 0.00 H new ATOM 0 HE3 LYS A 63 6.092 6.136 10.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.631 4.818 12.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.273 5.188 11.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 4.939 3.626 11.402 1.00 0.00 H new ATOM 903 N VAL A 64 1.549 6.226 6.476 1.00 0.00 N ATOM 904 CA VAL A 64 0.136 6.546 6.642 1.00 0.00 C ATOM 905 C VAL A 64 -0.621 5.261 7.008 1.00 0.00 C ATOM 906 O VAL A 64 -0.159 4.148 6.733 1.00 0.00 O ATOM 907 CB VAL A 64 -0.387 7.226 5.349 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.439 6.261 4.161 1.00 0.00 C ATOM 909 CG2 VAL A 64 -1.729 7.937 5.543 1.00 0.00 C ATOM 0 H VAL A 64 1.727 5.227 6.377 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.023 7.255 7.455 1.00 0.00 H new ATOM 0 HB VAL A 64 0.346 7.998 5.114 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.812 6.786 3.282 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.562 5.879 3.959 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -1.104 5.430 4.396 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -2.039 8.392 4.602 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -2.480 7.215 5.862 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -1.624 8.711 6.303 1.00 0.00 H new ATOM 919 N THR A 65 -1.832 5.418 7.542 1.00 0.00 N ATOM 920 CA THR A 65 -2.863 4.394 7.567 1.00 0.00 C ATOM 921 C THR A 65 -4.023 4.922 6.725 1.00 0.00 C ATOM 922 O THR A 65 -4.685 5.878 7.136 1.00 0.00 O ATOM 923 CB THR A 65 -3.314 4.109 9.005 1.00 0.00 C ATOM 924 OG1 THR A 65 -2.221 3.856 9.863 1.00 0.00 O ATOM 925 CG2 THR A 65 -4.244 2.900 9.033 1.00 0.00 C ATOM 0 H THR A 65 -2.126 6.290 7.981 1.00 0.00 H new ATOM 0 HA THR A 65 -2.488 3.453 7.165 1.00 0.00 H new ATOM 0 HB THR A 65 -3.833 5.000 9.358 1.00 0.00 H new ATOM 0 HG1 THR A 65 -2.550 3.681 10.769 1.00 0.00 H new ATOM 0 HG21 THR A 65 -4.558 2.706 10.059 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.120 3.101 8.417 1.00 0.00 H new ATOM 0 HG23 THR A 65 -3.719 2.028 8.644 1.00 0.00 H new ATOM 933 N LEU A 66 -4.254 4.349 5.544 1.00 0.00 N ATOM 934 CA LEU A 66 -5.374 4.719 4.685 1.00 0.00 C ATOM 935 C LEU A 66 -6.417 3.610 4.751 1.00 0.00 C ATOM 936 O LEU A 66 -6.073 2.423 4.666 1.00 0.00 O ATOM 937 CB LEU A 66 -4.886 4.930 3.247 1.00 0.00 C ATOM 938 CG LEU A 66 -3.961 6.148 3.071 1.00 0.00 C ATOM 939 CD1 LEU A 66 -3.342 6.096 1.675 1.00 0.00 C ATOM 940 CD2 LEU A 66 -4.651 7.498 3.305 1.00 0.00 C ATOM 0 H LEU A 66 -3.665 3.612 5.156 1.00 0.00 H new ATOM 0 HA LEU A 66 -5.819 5.654 5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.357 4.035 2.919 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.751 5.047 2.594 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.192 6.083 3.841 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.684 6.954 1.537 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.767 5.176 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.133 6.121 0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.931 8.304 3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.472 7.614 2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.041 7.536 4.322 1.00 0.00 H new ATOM 952 N SER A 67 -7.688 3.982 4.891 1.00 0.00 N ATOM 953 CA SER A 67 -8.775 3.037 5.091 1.00 0.00 C ATOM 954 C SER A 67 -10.009 3.505 4.336 1.00 0.00 C ATOM 955 O SER A 67 -10.177 4.691 4.039 1.00 0.00 O ATOM 956 CB SER A 67 -9.004 2.907 6.601 1.00 0.00 C ATOM 957 OG SER A 67 -9.859 1.849 6.986 1.00 0.00 O ATOM 0 H SER A 67 -7.990 4.956 4.868 1.00 0.00 H new ATOM 0 HA SER A 67 -8.534 2.051 4.694 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.039 2.771 7.089 1.00 0.00 H new ATOM 0 HB3 SER A 67 -9.420 3.844 6.972 1.00 0.00 H new ATOM 0 HG SER A 67 -9.837 1.146 6.304 1.00 0.00 H new ATOM 963 N THR A 68 -10.886 2.559 4.025 1.00 0.00 N ATOM 964 CA THR A 68 -12.044 2.815 3.187 1.00 0.00 C ATOM 965 C THR A 68 -13.242 3.122 4.074 1.00 0.00 C ATOM 966 O THR A 68 -13.516 2.403 5.040 1.00 0.00 O ATOM 967 CB THR A 68 -12.249 1.669 2.179 1.00 0.00 C ATOM 968 OG1 THR A 68 -12.627 0.430 2.761 1.00 0.00 O ATOM 969 CG2 THR A 68 -10.947 1.466 1.396 1.00 0.00 C ATOM 0 H THR A 68 -10.812 1.594 4.348 1.00 0.00 H new ATOM 0 HA THR A 68 -11.893 3.698 2.566 1.00 0.00 H new ATOM 0 HB THR A 68 -13.078 1.971 1.539 1.00 0.00 H new ATOM 0 HG1 THR A 68 -13.604 0.351 2.757 1.00 0.00 H new ATOM 0 HG21 THR A 68 -11.077 0.657 0.677 1.00 0.00 H new ATOM 0 HG22 THR A 68 -10.694 2.384 0.866 1.00 0.00 H new ATOM 0 HG23 THR A 68 -10.143 1.212 2.087 1.00 0.00 H new ATOM 977 N THR A 69 -13.957 4.201 3.758 1.00 0.00 N ATOM 978 CA THR A 69 -15.112 4.634 4.535 1.00 0.00 C ATOM 979 C THR A 69 -16.175 3.525 4.576 1.00 0.00 C ATOM 980 O THR A 69 -16.708 3.235 5.652 1.00 0.00 O ATOM 981 CB THR A 69 -15.625 5.982 3.994 1.00 0.00 C ATOM 982 OG1 THR A 69 -15.831 5.947 2.598 1.00 0.00 O ATOM 983 CG2 THR A 69 -14.612 7.089 4.300 1.00 0.00 C ATOM 0 H THR A 69 -13.750 4.797 2.957 1.00 0.00 H new ATOM 0 HA THR A 69 -14.830 4.808 5.574 1.00 0.00 H new ATOM 0 HB THR A 69 -16.577 6.181 4.486 1.00 0.00 H new ATOM 0 HG1 THR A 69 -14.966 5.985 2.139 1.00 0.00 H new ATOM 0 HG21 THR A 69 -14.983 8.038 3.914 1.00 0.00 H new ATOM 0 HG22 THR A 69 -14.471 7.166 5.378 1.00 0.00 H new ATOM 0 HG23 THR A 69 -13.660 6.852 3.826 1.00 0.00 H new ATOM 991 N GLY A 70 -16.413 2.857 3.441 1.00 0.00 N ATOM 992 CA GLY A 70 -17.295 1.710 3.290 1.00 0.00 C ATOM 993 C GLY A 70 -16.620 0.573 2.527 1.00 0.00 C ATOM 994 O GLY A 70 -15.419 0.326 2.686 1.00 0.00 O ATOM 0 H GLY A 70 -15.969 3.121 2.562 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -17.602 1.356 4.274 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -18.200 2.014 2.764 1.00 0.00 H new ATOM 998 N LYS A 71 -17.395 -0.176 1.734 1.00 0.00 N ATOM 999 CA LYS A 71 -16.920 -1.357 1.010 1.00 0.00 C ATOM 1000 C LYS A 71 -16.056 -0.934 -0.172 1.00 0.00 C ATOM 1001 O LYS A 71 -16.546 -0.357 -1.145 1.00 0.00 O ATOM 1002 CB LYS A 71 -18.086 -2.234 0.517 1.00 0.00 C ATOM 1003 CG LYS A 71 -19.050 -2.697 1.613 1.00 0.00 C ATOM 1004 CD LYS A 71 -18.466 -3.661 2.646 1.00 0.00 C ATOM 1005 CE LYS A 71 -19.442 -3.662 3.829 1.00 0.00 C ATOM 1006 NZ LYS A 71 -19.023 -4.508 4.962 1.00 0.00 N ATOM 0 H LYS A 71 -18.382 0.025 1.576 1.00 0.00 H new ATOM 0 HA LYS A 71 -16.326 -1.951 1.704 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -18.650 -1.677 -0.231 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -17.676 -3.112 0.019 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -19.426 -1.818 2.136 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -19.906 -3.177 1.139 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -18.360 -4.662 2.228 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -17.473 -3.340 2.961 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -19.567 -2.638 4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -20.417 -4.000 3.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -19.864 -4.896 5.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -18.432 -5.289 4.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -18.477 -3.937 5.639 1.00 0.00 H new ATOM 1020 N ALA A 72 -14.767 -1.254 -0.117 1.00 0.00 N ATOM 1021 CA ALA A 72 -13.889 -1.133 -1.258 1.00 0.00 C ATOM 1022 C ALA A 72 -14.158 -2.272 -2.213 1.00 0.00 C ATOM 1023 O ALA A 72 -14.090 -3.440 -1.827 1.00 0.00 O ATOM 1024 CB ALA A 72 -12.433 -1.206 -0.827 1.00 0.00 C ATOM 0 H ALA A 72 -14.309 -1.604 0.724 1.00 0.00 H new ATOM 0 HA ALA A 72 -14.076 -0.172 -1.737 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -11.789 -1.113 -1.702 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -12.219 -0.395 -0.131 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -12.246 -2.162 -0.339 1.00 0.00 H new ATOM 1030 N ILE A 73 -14.438 -1.902 -3.454 1.00 0.00 N ATOM 1031 CA ILE A 73 -14.625 -2.823 -4.553 1.00 0.00 C ATOM 1032 C ILE A 73 -13.283 -3.501 -4.853 1.00 0.00 C ATOM 1033 O ILE A 73 -13.177 -4.722 -4.755 1.00 0.00 O ATOM 1034 CB ILE A 73 -15.175 -2.050 -5.771 1.00 0.00 C ATOM 1035 CG1 ILE A 73 -16.325 -1.070 -5.448 1.00 0.00 C ATOM 1036 CG2 ILE A 73 -15.593 -3.033 -6.863 1.00 0.00 C ATOM 1037 CD1 ILE A 73 -17.508 -1.692 -4.706 1.00 0.00 C ATOM 0 H ILE A 73 -14.543 -0.925 -3.726 1.00 0.00 H new ATOM 0 HA ILE A 73 -15.348 -3.599 -4.302 1.00 0.00 H new ATOM 0 HB ILE A 73 -14.357 -1.420 -6.121 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -15.928 -0.251 -4.848 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -16.686 -0.636 -6.380 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -15.980 -2.482 -7.720 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -14.730 -3.623 -7.171 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -16.367 -3.696 -6.478 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -18.265 -0.929 -4.523 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -17.937 -2.491 -5.310 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -17.167 -2.100 -3.755 1.00 0.00 H new ATOM 1049 N GLU A 74 -12.278 -2.689 -5.193 1.00 0.00 N ATOM 1050 CA GLU A 74 -10.926 -3.082 -5.578 1.00 0.00 C ATOM 1051 C GLU A 74 -9.927 -2.593 -4.530 1.00 0.00 C ATOM 1052 O GLU A 74 -10.267 -1.712 -3.731 1.00 0.00 O ATOM 1053 CB GLU A 74 -10.637 -2.549 -6.998 1.00 0.00 C ATOM 1054 CG GLU A 74 -10.385 -1.053 -7.117 1.00 0.00 C ATOM 1055 CD GLU A 74 -8.959 -0.531 -7.130 1.00 0.00 C ATOM 1056 OE1 GLU A 74 -8.022 -1.152 -6.586 1.00 0.00 O ATOM 1057 OE2 GLU A 74 -8.810 0.569 -7.712 1.00 0.00 O ATOM 0 H GLU A 74 -12.398 -1.676 -5.206 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.827 -4.167 -5.613 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -9.767 -3.075 -7.391 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -11.481 -2.806 -7.638 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -10.865 -0.714 -8.035 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.902 -0.568 -6.289 1.00 0.00 H new ATOM 1064 N PHE A 75 -8.722 -3.165 -4.528 1.00 0.00 N ATOM 1065 CA PHE A 75 -7.513 -2.672 -3.881 1.00 0.00 C ATOM 1066 C PHE A 75 -6.315 -3.421 -4.487 1.00 0.00 C ATOM 1067 O PHE A 75 -6.499 -4.575 -4.885 1.00 0.00 O ATOM 1068 CB PHE A 75 -7.596 -2.981 -2.378 1.00 0.00 C ATOM 1069 CG PHE A 75 -6.416 -2.516 -1.556 1.00 0.00 C ATOM 1070 CD1 PHE A 75 -5.705 -1.351 -1.905 1.00 0.00 C ATOM 1071 CD2 PHE A 75 -6.006 -3.282 -0.449 1.00 0.00 C ATOM 1072 CE1 PHE A 75 -4.546 -1.006 -1.202 1.00 0.00 C ATOM 1073 CE2 PHE A 75 -4.886 -2.887 0.298 1.00 0.00 C ATOM 1074 CZ PHE A 75 -4.142 -1.767 -0.101 1.00 0.00 C ATOM 0 H PHE A 75 -8.558 -4.047 -5.014 1.00 0.00 H new ATOM 0 HA PHE A 75 -7.404 -1.597 -4.027 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.500 -2.521 -1.979 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -7.704 -4.058 -2.251 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -6.054 -0.726 -2.713 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.552 -4.172 -0.175 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -3.963 -0.151 -1.510 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -4.598 -3.444 1.177 1.00 0.00 H new ATOM 0 HZ PHE A 75 -3.252 -1.491 0.445 1.00 0.00 H new ATOM 1084 N ALA A 76 -5.090 -2.867 -4.485 1.00 0.00 N ATOM 1085 CA ALA A 76 -3.884 -3.614 -4.851 1.00 0.00 C ATOM 1086 C ALA A 76 -2.759 -3.460 -3.828 1.00 0.00 C ATOM 1087 O ALA A 76 -2.615 -2.414 -3.196 1.00 0.00 O ATOM 1088 CB ALA A 76 -3.390 -3.199 -6.237 1.00 0.00 C ATOM 0 H ALA A 76 -4.913 -1.895 -4.231 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.166 -4.667 -4.866 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -2.494 -3.766 -6.489 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.166 -3.401 -6.975 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.157 -2.134 -6.237 1.00 0.00 H new ATOM 1094 N VAL A 77 -1.918 -4.492 -3.721 1.00 0.00 N ATOM 1095 CA VAL A 77 -0.888 -4.647 -2.697 1.00 0.00 C ATOM 1096 C VAL A 77 0.353 -5.299 -3.336 1.00 0.00 C ATOM 1097 O VAL A 77 0.889 -6.305 -2.858 1.00 0.00 O ATOM 1098 CB VAL A 77 -1.445 -5.444 -1.488 1.00 0.00 C ATOM 1099 CG1 VAL A 77 -0.511 -5.259 -0.283 1.00 0.00 C ATOM 1100 CG2 VAL A 77 -2.848 -5.005 -1.042 1.00 0.00 C ATOM 0 H VAL A 77 -1.939 -5.275 -4.375 1.00 0.00 H new ATOM 0 HA VAL A 77 -0.586 -3.676 -2.304 1.00 0.00 H new ATOM 0 HB VAL A 77 -1.506 -6.480 -1.821 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -0.900 -5.818 0.568 1.00 0.00 H new ATOM 0 HG12 VAL A 77 0.484 -5.626 -0.534 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -0.453 -4.201 -0.026 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.166 -5.610 -0.193 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -2.825 -3.955 -0.751 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -3.550 -5.138 -1.865 1.00 0.00 H new ATOM 1110 N SER A 78 0.816 -4.749 -4.456 1.00 0.00 N ATOM 1111 CA SER A 78 2.059 -5.203 -5.068 1.00 0.00 C ATOM 1112 C SER A 78 3.261 -4.676 -4.283 1.00 0.00 C ATOM 1113 O SER A 78 3.131 -3.863 -3.361 1.00 0.00 O ATOM 1114 CB SER A 78 2.113 -4.815 -6.553 1.00 0.00 C ATOM 1115 OG SER A 78 2.291 -3.429 -6.764 1.00 0.00 O ATOM 0 H SER A 78 0.350 -3.991 -4.955 1.00 0.00 H new ATOM 0 HA SER A 78 2.097 -6.292 -5.027 1.00 0.00 H new ATOM 0 HB2 SER A 78 2.929 -5.356 -7.033 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.190 -5.133 -7.038 1.00 0.00 H new ATOM 0 HG SER A 78 2.319 -3.246 -7.726 1.00 0.00 H new ATOM 1121 N GLY A 79 4.450 -5.137 -4.657 1.00 0.00 N ATOM 1122 CA GLY A 79 5.723 -4.661 -4.141 1.00 0.00 C ATOM 1123 C GLY A 79 6.776 -4.544 -5.241 1.00 0.00 C ATOM 1124 O GLY A 79 7.903 -4.146 -4.949 1.00 0.00 O ATOM 0 H GLY A 79 4.554 -5.877 -5.351 1.00 0.00 H new ATOM 0 HA2 GLY A 79 5.582 -3.689 -3.668 1.00 0.00 H new ATOM 0 HA3 GLY A 79 6.079 -5.343 -3.369 1.00 0.00 H new ATOM 1128 N GLY A 80 6.439 -4.876 -6.493 1.00 0.00 N ATOM 1129 CA GLY A 80 7.377 -4.800 -7.602 1.00 0.00 C ATOM 1130 C GLY A 80 7.787 -3.364 -7.918 1.00 0.00 C ATOM 1131 O GLY A 80 7.084 -2.405 -7.565 1.00 0.00 O ATOM 0 H GLY A 80 5.510 -5.203 -6.758 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.265 -5.385 -7.364 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.927 -5.250 -8.487 1.00 0.00 H new ATOM 1135 N VAL A 81 8.919 -3.254 -8.609 1.00 0.00 N ATOM 1136 CA VAL A 81 9.594 -2.054 -9.100 1.00 0.00 C ATOM 1137 C VAL A 81 10.119 -2.402 -10.493 1.00 0.00 C ATOM 1138 O VAL A 81 10.051 -3.572 -10.895 1.00 0.00 O ATOM 1139 CB VAL A 81 10.712 -1.633 -8.105 1.00 0.00 C ATOM 1140 CG1 VAL A 81 11.275 -0.223 -8.333 1.00 0.00 C ATOM 1141 CG2 VAL A 81 10.198 -1.633 -6.658 1.00 0.00 C ATOM 0 H VAL A 81 9.441 -4.092 -8.866 1.00 0.00 H new ATOM 0 HA VAL A 81 8.929 -1.193 -9.172 1.00 0.00 H new ATOM 0 HB VAL A 81 11.495 -2.371 -8.280 1.00 0.00 H new ATOM 0 HG11 VAL A 81 12.048 -0.016 -7.593 1.00 0.00 H new ATOM 0 HG12 VAL A 81 11.703 -0.160 -9.333 1.00 0.00 H new ATOM 0 HG13 VAL A 81 10.474 0.509 -8.234 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.003 -1.335 -5.986 1.00 0.00 H new ATOM 0 HG22 VAL A 81 9.369 -0.931 -6.566 1.00 0.00 H new ATOM 0 HG23 VAL A 81 9.857 -2.634 -6.393 1.00 0.00 H new ATOM 1151 N VAL A 82 10.596 -1.406 -11.238 1.00 0.00 N ATOM 1152 CA VAL A 82 11.313 -1.616 -12.480 1.00 0.00 C ATOM 1153 C VAL A 82 12.671 -0.928 -12.365 1.00 0.00 C ATOM 1154 O VAL A 82 12.840 0.008 -11.583 1.00 0.00 O ATOM 1155 CB VAL A 82 10.452 -1.169 -13.679 1.00 0.00 C ATOM 1156 CG1 VAL A 82 10.202 0.340 -13.707 1.00 0.00 C ATOM 1157 CG2 VAL A 82 10.990 -1.617 -15.045 1.00 0.00 C ATOM 0 H VAL A 82 10.491 -0.423 -10.988 1.00 0.00 H new ATOM 0 HA VAL A 82 11.508 -2.672 -12.665 1.00 0.00 H new ATOM 0 HB VAL A 82 9.505 -1.683 -13.513 1.00 0.00 H new ATOM 0 HG11 VAL A 82 9.591 0.592 -14.574 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.682 0.640 -12.797 1.00 0.00 H new ATOM 0 HG13 VAL A 82 11.155 0.866 -13.770 1.00 0.00 H new ATOM 0 HG21 VAL A 82 10.326 -1.261 -15.832 1.00 0.00 H new ATOM 0 HG22 VAL A 82 11.987 -1.203 -15.197 1.00 0.00 H new ATOM 0 HG23 VAL A 82 11.040 -2.705 -15.077 1.00 0.00 H new ATOM 1167 N ASP A 83 13.631 -1.425 -13.133 1.00 0.00 N ATOM 1168 CA ASP A 83 15.035 -1.035 -13.107 1.00 0.00 C ATOM 1169 C ASP A 83 15.216 0.362 -13.701 1.00 0.00 C ATOM 1170 O ASP A 83 15.441 0.511 -14.904 1.00 0.00 O ATOM 1171 CB ASP A 83 15.845 -2.085 -13.871 1.00 0.00 C ATOM 1172 CG ASP A 83 17.335 -2.007 -13.575 1.00 0.00 C ATOM 1173 OD1 ASP A 83 17.679 -2.126 -12.380 1.00 0.00 O ATOM 1174 OD2 ASP A 83 18.142 -2.076 -14.532 1.00 0.00 O ATOM 0 H ASP A 83 13.442 -2.148 -13.827 1.00 0.00 H new ATOM 0 HA ASP A 83 15.394 -0.990 -12.079 1.00 0.00 H new ATOM 0 HB2 ASP A 83 15.479 -3.079 -13.613 1.00 0.00 H new ATOM 0 HB3 ASP A 83 15.684 -1.954 -14.941 1.00 0.00 H new ATOM 1179 N GLY A 84 15.033 1.402 -12.887 1.00 0.00 N ATOM 1180 CA GLY A 84 14.906 2.766 -13.371 1.00 0.00 C ATOM 1181 C GLY A 84 16.245 3.356 -13.795 1.00 0.00 C ATOM 1182 O GLY A 84 16.455 3.609 -14.985 1.00 0.00 O ATOM 0 H GLY A 84 14.969 1.316 -11.873 1.00 0.00 H new ATOM 0 HA2 GLY A 84 14.218 2.787 -14.216 1.00 0.00 H new ATOM 0 HA3 GLY A 84 14.469 3.387 -12.589 1.00 0.00 H new ATOM 1186 N GLU A 85 17.126 3.623 -12.832 1.00 0.00 N ATOM 1187 CA GLU A 85 18.319 4.447 -13.011 1.00 0.00 C ATOM 1188 C GLU A 85 19.250 4.238 -11.808 1.00 0.00 C ATOM 1189 O GLU A 85 18.767 3.905 -10.718 1.00 0.00 O ATOM 1190 CB GLU A 85 17.860 5.921 -13.105 1.00 0.00 C ATOM 1191 CG GLU A 85 18.184 6.592 -14.447 1.00 0.00 C ATOM 1192 CD GLU A 85 19.620 7.092 -14.584 1.00 0.00 C ATOM 1193 OE1 GLU A 85 20.333 7.227 -13.562 1.00 0.00 O ATOM 1194 OE2 GLU A 85 20.040 7.364 -15.731 1.00 0.00 O ATOM 0 H GLU A 85 17.027 3.263 -11.883 1.00 0.00 H new ATOM 0 HA GLU A 85 18.862 4.176 -13.916 1.00 0.00 H new ATOM 0 HB2 GLU A 85 16.784 5.967 -12.938 1.00 0.00 H new ATOM 0 HB3 GLU A 85 18.331 6.489 -12.303 1.00 0.00 H new ATOM 0 HG2 GLU A 85 17.983 5.882 -15.250 1.00 0.00 H new ATOM 0 HG3 GLU A 85 17.506 7.434 -14.589 1.00 0.00 H new ATOM 1201 N ASP A 86 20.553 4.471 -11.993 1.00 0.00 N ATOM 1202 CA ASP A 86 21.643 4.065 -11.089 1.00 0.00 C ATOM 1203 C ASP A 86 21.479 4.627 -9.672 1.00 0.00 C ATOM 1204 O ASP A 86 20.888 5.700 -9.483 1.00 0.00 O ATOM 1205 CB ASP A 86 23.006 4.514 -11.652 1.00 0.00 C ATOM 1206 CG ASP A 86 23.540 3.636 -12.786 1.00 0.00 C ATOM 1207 OD1 ASP A 86 23.342 2.404 -12.776 1.00 0.00 O ATOM 1208 OD2 ASP A 86 24.124 4.201 -13.743 1.00 0.00 O ATOM 0 H ASP A 86 20.896 4.970 -12.813 1.00 0.00 H new ATOM 0 HA ASP A 86 21.600 2.978 -11.025 1.00 0.00 H new ATOM 0 HB2 ASP A 86 22.917 5.539 -12.013 1.00 0.00 H new ATOM 0 HB3 ASP A 86 23.735 4.524 -10.842 1.00 0.00 H new ATOM 1213 N GLY A 87 22.020 3.926 -8.669 1.00 0.00 N ATOM 1214 CA GLY A 87 21.896 4.231 -7.247 1.00 0.00 C ATOM 1215 C GLY A 87 23.141 3.810 -6.457 1.00 0.00 C ATOM 1216 O GLY A 87 24.103 3.291 -7.026 1.00 0.00 O ATOM 0 H GLY A 87 22.582 3.092 -8.839 1.00 0.00 H new ATOM 0 HA2 GLY A 87 21.730 5.301 -7.119 1.00 0.00 H new ATOM 0 HA3 GLY A 87 21.021 3.722 -6.842 1.00 0.00 H new ATOM 1220 N VAL A 88 23.145 4.070 -5.143 1.00 0.00 N ATOM 1221 CA VAL A 88 24.323 3.893 -4.277 1.00 0.00 C ATOM 1222 C VAL A 88 24.026 3.227 -2.922 1.00 0.00 C ATOM 1223 O VAL A 88 24.971 2.821 -2.250 1.00 0.00 O ATOM 1224 CB VAL A 88 25.078 5.228 -4.085 1.00 0.00 C ATOM 1225 CG1 VAL A 88 25.605 5.797 -5.413 1.00 0.00 C ATOM 1226 CG2 VAL A 88 24.228 6.293 -3.376 1.00 0.00 C ATOM 0 H VAL A 88 22.324 4.413 -4.644 1.00 0.00 H new ATOM 0 HA VAL A 88 24.966 3.191 -4.808 1.00 0.00 H new ATOM 0 HB VAL A 88 25.927 4.986 -3.446 1.00 0.00 H new ATOM 0 HG11 VAL A 88 26.128 6.735 -5.225 1.00 0.00 H new ATOM 0 HG12 VAL A 88 26.292 5.083 -5.867 1.00 0.00 H new ATOM 0 HG13 VAL A 88 24.769 5.977 -6.089 1.00 0.00 H new ATOM 0 HG21 VAL A 88 24.809 7.209 -3.268 1.00 0.00 H new ATOM 0 HG22 VAL A 88 23.334 6.497 -3.966 1.00 0.00 H new ATOM 0 HG23 VAL A 88 23.937 5.930 -2.390 1.00 0.00 H new ATOM 1236 N VAL A 89 22.753 3.113 -2.522 1.00 0.00 N ATOM 1237 CA VAL A 89 22.257 2.208 -1.477 1.00 0.00 C ATOM 1238 C VAL A 89 23.130 2.173 -0.201 1.00 0.00 C ATOM 1239 O VAL A 89 23.604 1.119 0.220 1.00 0.00 O ATOM 1240 CB VAL A 89 21.934 0.819 -2.093 1.00 0.00 C ATOM 1241 CG1 VAL A 89 21.015 0.005 -1.167 1.00 0.00 C ATOM 1242 CG2 VAL A 89 21.199 0.933 -3.446 1.00 0.00 C ATOM 0 H VAL A 89 22.008 3.673 -2.936 1.00 0.00 H new ATOM 0 HA VAL A 89 21.320 2.614 -1.095 1.00 0.00 H new ATOM 0 HB VAL A 89 22.899 0.330 -2.229 1.00 0.00 H new ATOM 0 HG11 VAL A 89 20.805 -0.963 -1.622 1.00 0.00 H new ATOM 0 HG12 VAL A 89 21.507 -0.145 -0.206 1.00 0.00 H new ATOM 0 HG13 VAL A 89 20.081 0.545 -1.015 1.00 0.00 H new ATOM 0 HG21 VAL A 89 20.996 -0.065 -3.835 1.00 0.00 H new ATOM 0 HG22 VAL A 89 20.259 1.466 -3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 89 21.823 1.478 -4.154 1.00 0.00 H new ATOM 1252 N ASN A 90 23.312 3.325 0.463 1.00 0.00 N ATOM 1253 CA ASN A 90 24.176 3.407 1.650 1.00 0.00 C ATOM 1254 C ASN A 90 23.694 2.491 2.771 1.00 0.00 C ATOM 1255 O ASN A 90 24.522 1.868 3.438 1.00 0.00 O ATOM 1256 CB ASN A 90 24.270 4.828 2.228 1.00 0.00 C ATOM 1257 CG ASN A 90 25.224 5.716 1.449 1.00 0.00 C ATOM 1258 OD1 ASN A 90 26.436 5.556 1.533 1.00 0.00 O ATOM 1259 ND2 ASN A 90 24.714 6.672 0.692 1.00 0.00 N ATOM 0 H ASN A 90 22.875 4.208 0.200 1.00 0.00 H new ATOM 0 HA ASN A 90 25.158 3.094 1.296 1.00 0.00 H new ATOM 0 HB2 ASN A 90 23.279 5.281 2.230 1.00 0.00 H new ATOM 0 HB3 ASN A 90 24.598 4.773 3.266 1.00 0.00 H new ATOM 0 HD21 ASN A 90 25.332 7.290 0.166 1.00 0.00 H new ATOM 0 HD22 ASN A 90 23.703 6.791 0.633 1.00 0.00 H new ATOM 1266 N GLU A 91 22.385 2.428 3.026 1.00 0.00 N ATOM 1267 CA GLU A 91 21.801 1.649 4.112 1.00 0.00 C ATOM 1268 C GLU A 91 20.512 0.956 3.670 1.00 0.00 C ATOM 1269 O GLU A 91 19.869 1.423 2.727 1.00 0.00 O ATOM 1270 CB GLU A 91 21.501 2.569 5.304 1.00 0.00 C ATOM 1271 CG GLU A 91 22.728 2.727 6.204 1.00 0.00 C ATOM 1272 CD GLU A 91 22.356 3.243 7.598 1.00 0.00 C ATOM 1273 OE1 GLU A 91 21.397 4.046 7.704 1.00 0.00 O ATOM 1274 OE2 GLU A 91 23.004 2.819 8.581 1.00 0.00 O ATOM 0 H GLU A 91 21.691 2.928 2.471 1.00 0.00 H new ATOM 0 HA GLU A 91 22.520 0.883 4.402 1.00 0.00 H new ATOM 0 HB2 GLU A 91 21.185 3.547 4.941 1.00 0.00 H new ATOM 0 HB3 GLU A 91 20.673 2.160 5.883 1.00 0.00 H new ATOM 0 HG2 GLU A 91 23.236 1.767 6.297 1.00 0.00 H new ATOM 0 HG3 GLU A 91 23.432 3.416 5.739 1.00 0.00 H new ATOM 1281 N PRO A 92 20.100 -0.119 4.367 1.00 0.00 N ATOM 1282 CA PRO A 92 18.927 -0.908 4.026 1.00 0.00 C ATOM 1283 C PRO A 92 17.618 -0.161 4.337 1.00 0.00 C ATOM 1284 O PRO A 92 17.287 0.083 5.503 1.00 0.00 O ATOM 1285 CB PRO A 92 19.093 -2.207 4.793 1.00 0.00 C ATOM 1286 CG PRO A 92 19.889 -1.825 6.028 1.00 0.00 C ATOM 1287 CD PRO A 92 20.794 -0.720 5.502 1.00 0.00 C ATOM 0 HA PRO A 92 18.853 -1.103 2.956 1.00 0.00 H new ATOM 0 HB2 PRO A 92 18.127 -2.635 5.061 1.00 0.00 H new ATOM 0 HB3 PRO A 92 19.619 -2.954 4.198 1.00 0.00 H new ATOM 0 HG2 PRO A 92 19.245 -1.474 6.834 1.00 0.00 H new ATOM 0 HG3 PRO A 92 20.460 -2.666 6.420 1.00 0.00 H new ATOM 0 HD2 PRO A 92 20.988 0.023 6.275 1.00 0.00 H new ATOM 0 HD3 PRO A 92 21.760 -1.122 5.197 1.00 0.00 H new ATOM 1295 N MET A 93 16.871 0.205 3.293 1.00 0.00 N ATOM 1296 CA MET A 93 15.488 0.675 3.378 1.00 0.00 C ATOM 1297 C MET A 93 14.586 -0.435 3.901 1.00 0.00 C ATOM 1298 O MET A 93 14.877 -1.619 3.750 1.00 0.00 O ATOM 1299 CB MET A 93 15.030 1.181 1.991 1.00 0.00 C ATOM 1300 CG MET A 93 15.124 0.104 0.889 1.00 0.00 C ATOM 1301 SD MET A 93 13.614 -0.233 -0.055 1.00 0.00 S ATOM 1302 CE MET A 93 12.523 -0.848 1.253 1.00 0.00 C ATOM 0 H MET A 93 17.223 0.181 2.336 1.00 0.00 H new ATOM 0 HA MET A 93 15.423 1.505 4.081 1.00 0.00 H new ATOM 0 HB2 MET A 93 14.000 1.531 2.061 1.00 0.00 H new ATOM 0 HB3 MET A 93 15.639 2.038 1.705 1.00 0.00 H new ATOM 0 HG2 MET A 93 15.903 0.402 0.188 1.00 0.00 H new ATOM 0 HG3 MET A 93 15.451 -0.827 1.351 1.00 0.00 H new ATOM 0 HE1 MET A 93 11.540 -1.065 0.835 1.00 0.00 H new ATOM 0 HE2 MET A 93 12.945 -1.758 1.681 1.00 0.00 H new ATOM 0 HE3 MET A 93 12.426 -0.092 2.032 1.00 0.00 H new ATOM 1312 N GLN A 94 13.466 -0.061 4.512 1.00 0.00 N ATOM 1313 CA GLN A 94 12.575 -1.002 5.166 1.00 0.00 C ATOM 1314 C GLN A 94 11.153 -0.528 4.906 1.00 0.00 C ATOM 1315 O GLN A 94 10.689 0.465 5.462 1.00 0.00 O ATOM 1316 CB GLN A 94 12.976 -1.120 6.639 1.00 0.00 C ATOM 1317 CG GLN A 94 12.018 -1.956 7.501 1.00 0.00 C ATOM 1318 CD GLN A 94 12.636 -3.130 8.266 1.00 0.00 C ATOM 1319 OE1 GLN A 94 13.836 -3.218 8.515 1.00 0.00 O ATOM 1320 NE2 GLN A 94 11.807 -4.094 8.637 1.00 0.00 N ATOM 0 H GLN A 94 13.153 0.908 4.565 1.00 0.00 H new ATOM 0 HA GLN A 94 12.643 -2.017 4.774 1.00 0.00 H new ATOM 0 HB2 GLN A 94 13.972 -1.560 6.696 1.00 0.00 H new ATOM 0 HB3 GLN A 94 13.045 -0.119 7.064 1.00 0.00 H new ATOM 0 HG2 GLN A 94 11.540 -1.292 8.222 1.00 0.00 H new ATOM 0 HG3 GLN A 94 11.230 -2.346 6.856 1.00 0.00 H new ATOM 0 HE21 GLN A 94 10.811 -4.018 8.429 1.00 0.00 H new ATOM 0 HE22 GLN A 94 12.164 -4.912 9.131 1.00 0.00 H new ATOM 1329 N TRP A 95 10.502 -1.233 3.991 1.00 0.00 N ATOM 1330 CA TRP A 95 9.081 -1.129 3.669 1.00 0.00 C ATOM 1331 C TRP A 95 8.382 -2.279 4.359 1.00 0.00 C ATOM 1332 O TRP A 95 8.739 -3.434 4.115 1.00 0.00 O ATOM 1333 CB TRP A 95 8.841 -1.256 2.155 1.00 0.00 C ATOM 1334 CG TRP A 95 8.748 0.016 1.378 1.00 0.00 C ATOM 1335 CD1 TRP A 95 9.508 1.119 1.546 1.00 0.00 C ATOM 1336 CD2 TRP A 95 7.817 0.331 0.298 1.00 0.00 C ATOM 1337 NE1 TRP A 95 9.098 2.091 0.659 1.00 0.00 N ATOM 1338 CE2 TRP A 95 8.013 1.688 -0.086 1.00 0.00 C ATOM 1339 CE3 TRP A 95 6.818 -0.390 -0.388 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 7.205 2.324 -1.039 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 6.011 0.230 -1.361 1.00 0.00 C ATOM 1342 CH2 TRP A 95 6.188 1.590 -1.674 1.00 0.00 C ATOM 0 H TRP A 95 10.976 -1.933 3.420 1.00 0.00 H new ATOM 0 HA TRP A 95 8.705 -0.159 3.995 1.00 0.00 H new ATOM 0 HB2 TRP A 95 9.648 -1.854 1.732 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.918 -1.815 2.003 1.00 0.00 H new ATOM 0 HD1 TRP A 95 10.310 1.223 2.262 1.00 0.00 H new ATOM 0 HE1 TRP A 95 9.546 3.002 0.566 1.00 0.00 H new ATOM 0 HE3 TRP A 95 6.669 -1.436 -0.163 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 7.362 3.365 -1.282 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 5.250 -0.343 -1.871 1.00 0.00 H new ATOM 0 HH2 TRP A 95 5.546 2.068 -2.399 1.00 0.00 H new ATOM 1353 N VAL A 96 7.407 -1.986 5.206 1.00 0.00 N ATOM 1354 CA VAL A 96 6.523 -2.983 5.787 1.00 0.00 C ATOM 1355 C VAL A 96 5.134 -2.670 5.229 1.00 0.00 C ATOM 1356 O VAL A 96 4.783 -1.494 5.065 1.00 0.00 O ATOM 1357 CB VAL A 96 6.611 -2.950 7.327 1.00 0.00 C ATOM 1358 CG1 VAL A 96 5.999 -4.218 7.931 1.00 0.00 C ATOM 1359 CG2 VAL A 96 8.052 -2.801 7.850 1.00 0.00 C ATOM 0 H VAL A 96 7.205 -1.034 5.513 1.00 0.00 H new ATOM 0 HA VAL A 96 6.796 -4.005 5.525 1.00 0.00 H new ATOM 0 HB VAL A 96 6.050 -2.069 7.637 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.071 -4.175 9.018 1.00 0.00 H new ATOM 0 HG12 VAL A 96 4.951 -4.291 7.640 1.00 0.00 H new ATOM 0 HG13 VAL A 96 6.539 -5.092 7.566 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.044 -2.785 8.940 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.653 -3.642 7.504 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.480 -1.871 7.476 1.00 0.00 H new ATOM 1369 N VAL A 97 4.390 -3.708 4.852 1.00 0.00 N ATOM 1370 CA VAL A 97 3.083 -3.599 4.229 1.00 0.00 C ATOM 1371 C VAL A 97 2.223 -4.704 4.835 1.00 0.00 C ATOM 1372 O VAL A 97 2.488 -5.889 4.635 1.00 0.00 O ATOM 1373 CB VAL A 97 3.154 -3.684 2.683 1.00 0.00 C ATOM 1374 CG1 VAL A 97 1.925 -2.963 2.103 1.00 0.00 C ATOM 1375 CG2 VAL A 97 4.431 -3.081 2.068 1.00 0.00 C ATOM 0 H VAL A 97 4.693 -4.674 4.978 1.00 0.00 H new ATOM 0 HA VAL A 97 2.645 -2.620 4.425 1.00 0.00 H new ATOM 0 HB VAL A 97 3.172 -4.743 2.427 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.955 -3.011 1.014 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.016 -3.446 2.462 1.00 0.00 H new ATOM 0 HG13 VAL A 97 1.931 -1.920 2.421 1.00 0.00 H new ATOM 0 HG21 VAL A 97 4.396 -3.184 0.983 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.498 -2.025 2.330 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.304 -3.607 2.454 1.00 0.00 H new ATOM 1385 N THR A 98 1.214 -4.323 5.609 1.00 0.00 N ATOM 1386 CA THR A 98 0.344 -5.238 6.328 1.00 0.00 C ATOM 1387 C THR A 98 -1.080 -4.793 5.987 1.00 0.00 C ATOM 1388 O THR A 98 -1.393 -3.597 6.091 1.00 0.00 O ATOM 1389 CB THR A 98 0.670 -5.182 7.834 1.00 0.00 C ATOM 1390 OG1 THR A 98 2.068 -5.116 8.085 1.00 0.00 O ATOM 1391 CG2 THR A 98 0.163 -6.418 8.569 1.00 0.00 C ATOM 0 H THR A 98 0.974 -3.343 5.756 1.00 0.00 H new ATOM 0 HA THR A 98 0.475 -6.282 6.045 1.00 0.00 H new ATOM 0 HB THR A 98 0.175 -4.280 8.193 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.225 -5.080 9.052 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.413 -6.340 9.627 1.00 0.00 H new ATOM 0 HG22 THR A 98 -0.919 -6.491 8.456 1.00 0.00 H new ATOM 0 HG23 THR A 98 0.632 -7.308 8.150 1.00 0.00 H new ATOM 1399 N VAL A 99 -1.907 -5.716 5.491 1.00 0.00 N ATOM 1400 CA VAL A 99 -3.269 -5.419 5.064 1.00 0.00 C ATOM 1401 C VAL A 99 -4.225 -6.064 6.054 1.00 0.00 C ATOM 1402 O VAL A 99 -4.098 -7.254 6.371 1.00 0.00 O ATOM 1403 CB VAL A 99 -3.562 -5.902 3.629 1.00 0.00 C ATOM 1404 CG1 VAL A 99 -4.904 -5.298 3.188 1.00 0.00 C ATOM 1405 CG2 VAL A 99 -2.498 -5.521 2.592 1.00 0.00 C ATOM 0 H VAL A 99 -1.646 -6.695 5.375 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.401 -4.337 5.048 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.574 -6.991 3.666 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -5.135 -5.625 2.174 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -5.692 -5.630 3.864 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -4.839 -4.210 3.212 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -2.790 -5.903 1.614 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -2.407 -4.436 2.545 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.539 -5.953 2.879 1.00 0.00 H new ATOM 1415 N TYR A 100 -5.204 -5.280 6.493 1.00 0.00 N ATOM 1416 CA TYR A 100 -6.196 -5.671 7.464 1.00 0.00 C ATOM 1417 C TYR A 100 -7.541 -5.604 6.773 1.00 0.00 C ATOM 1418 O TYR A 100 -8.011 -4.533 6.395 1.00 0.00 O ATOM 1419 CB TYR A 100 -6.113 -4.799 8.716 1.00 0.00 C ATOM 1420 CG TYR A 100 -4.727 -4.813 9.332 1.00 0.00 C ATOM 1421 CD1 TYR A 100 -3.737 -3.917 8.887 1.00 0.00 C ATOM 1422 CD2 TYR A 100 -4.419 -5.754 10.328 1.00 0.00 C ATOM 1423 CE1 TYR A 100 -2.447 -3.947 9.449 1.00 0.00 C ATOM 1424 CE2 TYR A 100 -3.138 -5.772 10.911 1.00 0.00 C ATOM 1425 CZ TYR A 100 -2.147 -4.860 10.484 1.00 0.00 C ATOM 1426 OH TYR A 100 -0.937 -4.824 11.109 1.00 0.00 O ATOM 0 H TYR A 100 -5.325 -4.322 6.165 1.00 0.00 H new ATOM 0 HA TYR A 100 -6.028 -6.687 7.820 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -6.386 -3.775 8.462 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -6.839 -5.150 9.450 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -3.968 -3.203 8.110 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -5.166 -6.465 10.647 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -1.686 -3.271 9.088 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -2.912 -6.486 11.689 1.00 0.00 H new ATOM 0 HH TYR A 100 -0.903 -5.522 11.796 1.00 0.00 H new ATOM 1436 N LYS A 101 -8.138 -6.765 6.536 1.00 0.00 N ATOM 1437 CA LYS A 101 -9.535 -6.867 6.146 1.00 0.00 C ATOM 1438 C LYS A 101 -10.388 -6.416 7.334 1.00 0.00 C ATOM 1439 O LYS A 101 -9.875 -6.307 8.445 1.00 0.00 O ATOM 1440 CB LYS A 101 -9.810 -8.334 5.780 1.00 0.00 C ATOM 1441 CG LYS A 101 -10.673 -8.489 4.524 1.00 0.00 C ATOM 1442 CD LYS A 101 -10.788 -9.983 4.208 1.00 0.00 C ATOM 1443 CE LYS A 101 -11.498 -10.240 2.880 1.00 0.00 C ATOM 1444 NZ LYS A 101 -11.060 -11.515 2.274 1.00 0.00 N ATOM 0 H LYS A 101 -7.663 -7.665 6.610 1.00 0.00 H new ATOM 0 HA LYS A 101 -9.774 -6.239 5.288 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.861 -8.848 5.627 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -10.307 -8.824 6.617 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -11.661 -8.057 4.685 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.224 -7.956 3.686 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -9.791 -10.423 4.176 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -11.331 -10.481 5.011 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -12.576 -10.262 3.040 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -11.295 -9.419 2.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -11.560 -11.661 1.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.035 -11.483 2.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -11.276 -12.300 2.921 1.00 0.00 H new ATOM 1458 N ASN A 102 -11.697 -6.255 7.125 1.00 0.00 N ATOM 1459 CA ASN A 102 -12.736 -6.080 8.143 1.00 0.00 C ATOM 1460 C ASN A 102 -12.581 -7.094 9.295 1.00 0.00 C ATOM 1461 O ASN A 102 -13.214 -8.149 9.289 1.00 0.00 O ATOM 1462 CB ASN A 102 -14.168 -6.071 7.548 1.00 0.00 C ATOM 1463 CG ASN A 102 -14.657 -7.354 6.884 1.00 0.00 C ATOM 1464 OD1 ASN A 102 -14.078 -7.716 5.753 1.00 0.00 O flip ATOM 1465 ND2 ASN A 102 -15.616 -7.987 7.312 1.00 0.00 N flip ATOM 0 H ASN A 102 -12.084 -6.243 6.181 1.00 0.00 H new ATOM 0 HA ASN A 102 -12.590 -5.088 8.570 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -14.864 -5.819 8.348 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -14.223 -5.268 6.813 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -16.063 -7.707 8.185 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -15.967 -8.793 6.795 1.00 0.00 H new ATOM 1472 N GLY A 103 -11.717 -6.802 10.268 1.00 0.00 N ATOM 1473 CA GLY A 103 -11.558 -7.564 11.503 1.00 0.00 C ATOM 1474 C GLY A 103 -10.524 -8.693 11.456 1.00 0.00 C ATOM 1475 O GLY A 103 -10.585 -9.585 12.305 1.00 0.00 O ATOM 0 H GLY A 103 -11.088 -6.001 10.214 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -11.281 -6.875 12.301 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -12.524 -7.991 11.772 1.00 0.00 H new ATOM 1479 N LYS A 104 -9.599 -8.726 10.488 1.00 0.00 N ATOM 1480 CA LYS A 104 -8.403 -9.561 10.576 1.00 0.00 C ATOM 1481 C LYS A 104 -7.294 -9.004 9.704 1.00 0.00 C ATOM 1482 O LYS A 104 -7.514 -8.089 8.921 1.00 0.00 O ATOM 1483 CB LYS A 104 -8.685 -11.021 10.197 1.00 0.00 C ATOM 1484 CG LYS A 104 -9.009 -11.262 8.715 1.00 0.00 C ATOM 1485 CD LYS A 104 -10.503 -11.279 8.403 1.00 0.00 C ATOM 1486 CE LYS A 104 -11.213 -12.420 9.145 1.00 0.00 C ATOM 1487 NZ LYS A 104 -12.583 -12.638 8.649 1.00 0.00 N ATOM 0 H LYS A 104 -9.661 -8.178 9.630 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.083 -9.546 11.618 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -7.817 -11.623 10.465 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.520 -11.381 10.798 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.532 -10.485 8.118 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -8.573 -12.213 8.408 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -10.947 -10.325 8.687 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -10.652 -11.392 7.329 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -10.637 -13.338 9.032 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -11.246 -12.193 10.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -13.024 -13.417 9.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -13.142 -11.771 8.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -12.552 -12.880 7.638 1.00 0.00 H new ATOM 1501 N GLU A 105 -6.134 -9.632 9.768 1.00 0.00 N ATOM 1502 CA GLU A 105 -5.043 -9.472 8.822 1.00 0.00 C ATOM 1503 C GLU A 105 -5.241 -10.484 7.695 1.00 0.00 C ATOM 1504 O GLU A 105 -5.664 -11.612 7.959 1.00 0.00 O ATOM 1505 CB GLU A 105 -3.747 -9.765 9.584 1.00 0.00 C ATOM 1506 CG GLU A 105 -2.475 -9.538 8.762 1.00 0.00 C ATOM 1507 CD GLU A 105 -1.341 -10.418 9.278 1.00 0.00 C ATOM 1508 OE1 GLU A 105 -0.810 -10.127 10.373 1.00 0.00 O ATOM 1509 OE2 GLU A 105 -1.031 -11.440 8.624 1.00 0.00 O ATOM 0 H GLU A 105 -5.917 -10.295 10.512 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.007 -8.470 8.395 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -3.710 -9.135 10.473 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -3.766 -10.799 9.927 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -2.668 -9.762 7.713 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -2.183 -8.489 8.816 1.00 0.00 H new ATOM 1516 N ILE A 106 -4.894 -10.108 6.462 1.00 0.00 N ATOM 1517 CA ILE A 106 -4.733 -11.043 5.346 1.00 0.00 C ATOM 1518 C ILE A 106 -3.403 -10.849 4.614 1.00 0.00 C ATOM 1519 O ILE A 106 -3.130 -11.593 3.674 1.00 0.00 O ATOM 1520 CB ILE A 106 -5.933 -10.995 4.374 1.00 0.00 C ATOM 1521 CG1 ILE A 106 -6.142 -9.590 3.766 1.00 0.00 C ATOM 1522 CG2 ILE A 106 -7.190 -11.508 5.094 1.00 0.00 C ATOM 1523 CD1 ILE A 106 -7.035 -9.590 2.519 1.00 0.00 C ATOM 0 H ILE A 106 -4.715 -9.137 6.208 1.00 0.00 H new ATOM 0 HA ILE A 106 -4.711 -12.043 5.780 1.00 0.00 H new ATOM 0 HB ILE A 106 -5.721 -11.649 3.528 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -6.584 -8.939 4.520 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -5.171 -9.166 3.508 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -8.039 -11.476 4.411 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -7.028 -12.534 5.423 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -7.396 -10.878 5.959 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -7.138 -8.571 2.145 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -6.584 -10.215 1.748 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -8.018 -9.984 2.776 1.00 0.00 H new ATOM 1535 N GLU A 107 -2.562 -9.891 5.016 1.00 0.00 N ATOM 1536 CA GLU A 107 -1.207 -9.788 4.489 1.00 0.00 C ATOM 1537 C GLU A 107 -0.259 -9.261 5.542 1.00 0.00 C ATOM 1538 O GLU A 107 -0.682 -8.479 6.391 1.00 0.00 O ATOM 1539 CB GLU A 107 -1.166 -8.818 3.312 1.00 0.00 C ATOM 1540 CG GLU A 107 0.009 -9.103 2.361 1.00 0.00 C ATOM 1541 CD GLU A 107 0.046 -10.550 1.880 1.00 0.00 C ATOM 1542 OE1 GLU A 107 -0.930 -10.967 1.217 1.00 0.00 O ATOM 1543 OE2 GLU A 107 1.016 -11.251 2.238 1.00 0.00 O ATOM 0 H GLU A 107 -2.800 -9.178 5.705 1.00 0.00 H new ATOM 0 HA GLU A 107 -0.905 -10.787 4.175 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -2.103 -8.883 2.758 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -1.087 -7.798 3.687 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.060 -8.440 1.498 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.945 -8.870 2.868 1.00 0.00 H new ATOM 1550 N LYS A 108 1.025 -9.596 5.407 1.00 0.00 N ATOM 1551 CA LYS A 108 2.090 -9.149 6.299 1.00 0.00 C ATOM 1552 C LYS A 108 3.425 -9.353 5.598 1.00 0.00 C ATOM 1553 O LYS A 108 4.027 -10.430 5.659 1.00 0.00 O ATOM 1554 CB LYS A 108 1.982 -9.893 7.644 1.00 0.00 C ATOM 1555 CG LYS A 108 3.166 -9.651 8.596 1.00 0.00 C ATOM 1556 CD LYS A 108 2.774 -9.871 10.066 1.00 0.00 C ATOM 1557 CE LYS A 108 2.201 -8.577 10.663 1.00 0.00 C ATOM 1558 NZ LYS A 108 1.185 -8.834 11.699 1.00 0.00 N ATOM 0 H LYS A 108 1.359 -10.200 4.656 1.00 0.00 H new ATOM 0 HA LYS A 108 2.001 -8.087 6.528 1.00 0.00 H new ATOM 0 HB2 LYS A 108 1.062 -9.588 8.142 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.900 -10.962 7.449 1.00 0.00 H new ATOM 0 HG2 LYS A 108 3.985 -10.321 8.334 1.00 0.00 H new ATOM 0 HG3 LYS A 108 3.534 -8.633 8.467 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.036 -10.670 10.137 1.00 0.00 H new ATOM 0 HD3 LYS A 108 3.645 -10.189 10.638 1.00 0.00 H new ATOM 0 HE2 LYS A 108 3.012 -7.989 11.092 1.00 0.00 H new ATOM 0 HE3 LYS A 108 1.759 -7.978 9.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 1.053 -7.978 12.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.284 -9.089 11.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 1.500 -9.616 12.308 1.00 0.00 H new ATOM 1572 N LYS A 109 3.884 -8.328 4.891 1.00 0.00 N ATOM 1573 CA LYS A 109 5.096 -8.359 4.092 1.00 0.00 C ATOM 1574 C LYS A 109 6.043 -7.278 4.565 1.00 0.00 C ATOM 1575 O LYS A 109 5.644 -6.272 5.147 1.00 0.00 O ATOM 1576 CB LYS A 109 4.733 -8.212 2.604 1.00 0.00 C ATOM 1577 CG LYS A 109 4.444 -9.582 1.984 1.00 0.00 C ATOM 1578 CD LYS A 109 5.723 -10.418 1.799 1.00 0.00 C ATOM 1579 CE LYS A 109 5.803 -11.619 2.753 1.00 0.00 C ATOM 1580 NZ LYS A 109 4.878 -12.702 2.371 1.00 0.00 N ATOM 0 H LYS A 109 3.407 -7.427 4.859 1.00 0.00 H new ATOM 0 HA LYS A 109 5.607 -9.314 4.212 1.00 0.00 H new ATOM 0 HB2 LYS A 109 3.860 -7.567 2.499 1.00 0.00 H new ATOM 0 HB3 LYS A 109 5.552 -7.730 2.070 1.00 0.00 H new ATOM 0 HG2 LYS A 109 3.745 -10.126 2.619 1.00 0.00 H new ATOM 0 HG3 LYS A 109 3.958 -9.446 1.018 1.00 0.00 H new ATOM 0 HD2 LYS A 109 5.770 -10.775 0.770 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.593 -9.780 1.955 1.00 0.00 H new ATOM 0 HE2 LYS A 109 6.823 -12.003 2.765 1.00 0.00 H new ATOM 0 HE3 LYS A 109 5.575 -11.290 3.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 4.969 -13.490 3.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 3.901 -12.345 2.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 5.111 -13.036 1.414 1.00 0.00 H new ATOM 1594 N SER A 110 7.320 -7.528 4.324 1.00 0.00 N ATOM 1595 CA SER A 110 8.406 -6.634 4.670 1.00 0.00 C ATOM 1596 C SER A 110 9.541 -6.885 3.690 1.00 0.00 C ATOM 1597 O SER A 110 10.114 -7.978 3.659 1.00 0.00 O ATOM 1598 CB SER A 110 8.813 -6.849 6.132 1.00 0.00 C ATOM 1599 OG SER A 110 9.626 -5.819 6.657 1.00 0.00 O ATOM 0 H SER A 110 7.635 -8.385 3.869 1.00 0.00 H new ATOM 0 HA SER A 110 8.109 -5.588 4.590 1.00 0.00 H new ATOM 0 HB2 SER A 110 7.913 -6.934 6.741 1.00 0.00 H new ATOM 0 HB3 SER A 110 9.345 -7.797 6.215 1.00 0.00 H new ATOM 0 HG SER A 110 9.846 -6.020 7.591 1.00 0.00 H new ATOM 1605 N LEU A 111 9.871 -5.869 2.897 1.00 0.00 N ATOM 1606 CA LEU A 111 10.950 -5.846 1.905 1.00 0.00 C ATOM 1607 C LEU A 111 12.344 -5.787 2.563 1.00 0.00 C ATOM 1608 O LEU A 111 13.255 -5.139 2.050 1.00 0.00 O ATOM 1609 CB LEU A 111 10.737 -4.622 0.994 1.00 0.00 C ATOM 1610 CG LEU A 111 11.347 -4.752 -0.411 1.00 0.00 C ATOM 1611 CD1 LEU A 111 10.515 -5.676 -1.309 1.00 0.00 C ATOM 1612 CD2 LEU A 111 11.499 -3.371 -1.035 1.00 0.00 C ATOM 0 H LEU A 111 9.363 -4.985 2.929 1.00 0.00 H new ATOM 0 HA LEU A 111 10.917 -6.769 1.327 1.00 0.00 H new ATOM 0 HB2 LEU A 111 9.667 -4.442 0.895 1.00 0.00 H new ATOM 0 HB3 LEU A 111 11.164 -3.745 1.481 1.00 0.00 H new ATOM 0 HG LEU A 111 12.332 -5.208 -0.316 1.00 0.00 H new ATOM 0 HD11 LEU A 111 10.979 -5.742 -2.293 1.00 0.00 H new ATOM 0 HD12 LEU A 111 10.467 -6.670 -0.863 1.00 0.00 H new ATOM 0 HD13 LEU A 111 9.507 -5.274 -1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.932 -3.467 -2.031 1.00 0.00 H new ATOM 0 HD22 LEU A 111 10.521 -2.895 -1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.153 -2.761 -0.413 1.00 0.00 H new ATOM 1624 N VAL A 112 12.512 -6.377 3.746 1.00 0.00 N ATOM 1625 CA VAL A 112 13.708 -6.182 4.540 1.00 0.00 C ATOM 1626 C VAL A 112 14.788 -7.135 4.036 1.00 0.00 C ATOM 1627 O VAL A 112 14.592 -8.357 4.037 1.00 0.00 O ATOM 1628 CB VAL A 112 13.389 -6.265 6.044 1.00 0.00 C ATOM 1629 CG1 VAL A 112 12.786 -7.592 6.514 1.00 0.00 C ATOM 1630 CG2 VAL A 112 14.612 -5.893 6.882 1.00 0.00 C ATOM 0 H VAL A 112 11.824 -6.998 4.172 1.00 0.00 H new ATOM 0 HA VAL A 112 14.110 -5.176 4.418 1.00 0.00 H new ATOM 0 HB VAL A 112 12.598 -5.531 6.201 1.00 0.00 H new ATOM 0 HG11 VAL A 112 12.599 -7.547 7.587 1.00 0.00 H new ATOM 0 HG12 VAL A 112 11.848 -7.771 5.989 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.482 -8.404 6.301 1.00 0.00 H new ATOM 0 HG21 VAL A 112 14.361 -5.959 7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 112 15.429 -6.580 6.659 1.00 0.00 H new ATOM 0 HG23 VAL A 112 14.919 -4.874 6.645 1.00 0.00 H new ATOM 1640 N PHE A 113 15.916 -6.579 3.603 1.00 0.00 N ATOM 1641 CA PHE A 113 17.119 -7.276 3.162 1.00 0.00 C ATOM 1642 C PHE A 113 18.348 -6.488 3.619 1.00 0.00 C ATOM 1643 O PHE A 113 18.405 -5.278 3.431 1.00 0.00 O ATOM 1644 CB PHE A 113 17.111 -7.386 1.634 1.00 0.00 C ATOM 1645 CG PHE A 113 15.847 -7.978 1.046 1.00 0.00 C ATOM 1646 CD1 PHE A 113 15.623 -9.358 1.138 1.00 0.00 C ATOM 1647 CD2 PHE A 113 14.866 -7.155 0.466 1.00 0.00 C ATOM 1648 CE1 PHE A 113 14.420 -9.919 0.679 1.00 0.00 C ATOM 1649 CE2 PHE A 113 13.660 -7.714 0.011 1.00 0.00 C ATOM 1650 CZ PHE A 113 13.433 -9.093 0.115 1.00 0.00 C ATOM 0 H PHE A 113 16.020 -5.566 3.548 1.00 0.00 H new ATOM 0 HA PHE A 113 17.148 -8.277 3.593 1.00 0.00 H new ATOM 0 HB2 PHE A 113 17.261 -6.392 1.212 1.00 0.00 H new ATOM 0 HB3 PHE A 113 17.960 -7.996 1.323 1.00 0.00 H new ATOM 0 HD1 PHE A 113 16.382 -9.996 1.566 1.00 0.00 H new ATOM 0 HD2 PHE A 113 15.039 -6.093 0.370 1.00 0.00 H new ATOM 0 HE1 PHE A 113 14.254 -10.983 0.759 1.00 0.00 H new ATOM 0 HE2 PHE A 113 12.903 -7.077 -0.422 1.00 0.00 H new ATOM 0 HZ PHE A 113 12.505 -9.519 -0.236 1.00 0.00 H new ATOM 1660 N ARG A 114 19.326 -7.147 4.243 1.00 0.00 N ATOM 1661 CA ARG A 114 20.660 -6.601 4.503 1.00 0.00 C ATOM 1662 C ARG A 114 21.587 -7.777 4.823 1.00 0.00 C ATOM 1663 O ARG A 114 21.094 -8.827 5.226 1.00 0.00 O ATOM 1664 CB ARG A 114 20.657 -5.523 5.617 1.00 0.00 C ATOM 1665 CG ARG A 114 19.825 -5.841 6.879 1.00 0.00 C ATOM 1666 CD ARG A 114 18.431 -5.178 6.879 1.00 0.00 C ATOM 1667 NE ARG A 114 18.343 -4.087 7.865 1.00 0.00 N ATOM 1668 CZ ARG A 114 17.421 -3.120 7.939 1.00 0.00 C ATOM 1669 NH1 ARG A 114 16.443 -3.001 7.056 1.00 0.00 N ATOM 1670 NH2 ARG A 114 17.492 -2.228 8.909 1.00 0.00 N ATOM 0 H ARG A 114 19.210 -8.099 4.590 1.00 0.00 H new ATOM 0 HA ARG A 114 21.022 -6.076 3.619 1.00 0.00 H new ATOM 0 HB2 ARG A 114 21.688 -5.346 5.923 1.00 0.00 H new ATOM 0 HB3 ARG A 114 20.287 -4.591 5.190 1.00 0.00 H new ATOM 0 HG2 ARG A 114 19.705 -6.921 6.963 1.00 0.00 H new ATOM 0 HG3 ARG A 114 20.375 -5.512 7.760 1.00 0.00 H new ATOM 0 HD2 ARG A 114 18.215 -4.787 5.885 1.00 0.00 H new ATOM 0 HD3 ARG A 114 17.672 -5.929 7.099 1.00 0.00 H new ATOM 0 HE ARG A 114 19.073 -4.066 8.577 1.00 0.00 H new ATOM 0 HH11 ARG A 114 16.372 -3.661 6.282 1.00 0.00 H new ATOM 0 HH12 ARG A 114 15.760 -2.249 7.149 1.00 0.00 H new ATOM 0 HH21 ARG A 114 18.245 -2.279 9.595 1.00 0.00 H new ATOM 0 HH22 ARG A 114 16.793 -1.487 8.973 1.00 0.00 H new ATOM 1684 N ASP A 115 22.899 -7.592 4.660 1.00 0.00 N ATOM 1685 CA ASP A 115 23.992 -8.575 4.773 1.00 0.00 C ATOM 1686 C ASP A 115 23.696 -9.912 4.082 1.00 0.00 C ATOM 1687 O ASP A 115 24.044 -10.074 2.911 1.00 0.00 O ATOM 1688 CB ASP A 115 24.483 -8.755 6.228 1.00 0.00 C ATOM 1689 CG ASP A 115 25.784 -8.008 6.523 1.00 0.00 C ATOM 1690 OD1 ASP A 115 26.750 -8.110 5.733 1.00 0.00 O ATOM 1691 OD2 ASP A 115 25.825 -7.337 7.583 1.00 0.00 O ATOM 0 H ASP A 115 23.262 -6.668 4.424 1.00 0.00 H new ATOM 0 HA ASP A 115 24.823 -8.142 4.216 1.00 0.00 H new ATOM 0 HB2 ASP A 115 23.709 -8.406 6.911 1.00 0.00 H new ATOM 0 HB3 ASP A 115 24.629 -9.817 6.426 1.00 0.00 H new ATOM 1696 N GLY A 116 23.020 -10.844 4.748 1.00 0.00 N ATOM 1697 CA GLY A 116 22.649 -12.155 4.246 1.00 0.00 C ATOM 1698 C GLY A 116 21.702 -12.764 5.268 1.00 0.00 C ATOM 1699 O GLY A 116 21.999 -12.738 6.463 1.00 0.00 O ATOM 0 H GLY A 116 22.701 -10.692 5.705 1.00 0.00 H new ATOM 0 HA2 GLY A 116 22.167 -12.074 3.272 1.00 0.00 H new ATOM 0 HA3 GLY A 116 23.531 -12.782 4.114 1.00 0.00 H new ATOM 1703 N LYS A 117 20.526 -13.212 4.819 1.00 0.00 N ATOM 1704 CA LYS A 117 19.423 -13.642 5.684 1.00 0.00 C ATOM 1705 C LYS A 117 18.683 -14.829 5.053 1.00 0.00 C ATOM 1706 O LYS A 117 17.490 -14.997 5.294 1.00 0.00 O ATOM 1707 CB LYS A 117 18.465 -12.462 5.967 1.00 0.00 C ATOM 1708 CG LYS A 117 19.097 -11.224 6.637 1.00 0.00 C ATOM 1709 CD LYS A 117 18.281 -9.924 6.524 1.00 0.00 C ATOM 1710 CE LYS A 117 17.033 -9.861 7.417 1.00 0.00 C ATOM 1711 NZ LYS A 117 15.958 -10.781 6.997 1.00 0.00 N ATOM 0 H LYS A 117 20.310 -13.287 3.825 1.00 0.00 H new ATOM 0 HA LYS A 117 19.831 -13.972 6.639 1.00 0.00 H new ATOM 0 HB2 LYS A 117 18.015 -12.151 5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 117 17.656 -12.821 6.603 1.00 0.00 H new ATOM 0 HG2 LYS A 117 19.254 -11.444 7.693 1.00 0.00 H new ATOM 0 HG3 LYS A 117 20.080 -11.056 6.197 1.00 0.00 H new ATOM 0 HD2 LYS A 117 18.929 -9.083 6.771 1.00 0.00 H new ATOM 0 HD3 LYS A 117 17.974 -9.795 5.486 1.00 0.00 H new ATOM 0 HE2 LYS A 117 17.319 -10.094 8.443 1.00 0.00 H new ATOM 0 HE3 LYS A 117 16.648 -8.841 7.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 15.034 -10.355 7.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 16.031 -10.957 5.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 16.051 -11.681 7.510 1.00 0.00 H new ATOM 1725 N GLU A 118 19.362 -15.621 4.216 1.00 0.00 N ATOM 1726 CA GLU A 118 18.893 -16.871 3.607 1.00 0.00 C ATOM 1727 C GLU A 118 17.516 -16.807 2.902 1.00 0.00 C ATOM 1728 O GLU A 118 16.824 -17.820 2.777 1.00 0.00 O ATOM 1729 CB GLU A 118 19.072 -18.052 4.590 1.00 0.00 C ATOM 1730 CG GLU A 118 18.169 -18.090 5.842 1.00 0.00 C ATOM 1731 CD GLU A 118 18.615 -17.228 7.039 1.00 0.00 C ATOM 1732 OE1 GLU A 118 19.786 -16.803 7.128 1.00 0.00 O ATOM 1733 OE2 GLU A 118 17.796 -17.009 7.970 1.00 0.00 O ATOM 0 H GLU A 118 20.313 -15.392 3.928 1.00 0.00 H new ATOM 0 HA GLU A 118 19.544 -17.057 2.753 1.00 0.00 H new ATOM 0 HB2 GLU A 118 18.914 -18.977 4.035 1.00 0.00 H new ATOM 0 HB3 GLU A 118 20.109 -18.055 4.925 1.00 0.00 H new ATOM 0 HG2 GLU A 118 17.167 -17.775 5.550 1.00 0.00 H new ATOM 0 HG3 GLU A 118 18.093 -19.125 6.176 1.00 0.00 H new ATOM 1740 N ILE A 119 17.090 -15.637 2.416 1.00 0.00 N ATOM 1741 CA ILE A 119 15.778 -15.428 1.817 1.00 0.00 C ATOM 1742 C ILE A 119 15.651 -15.964 0.382 1.00 0.00 C ATOM 1743 O ILE A 119 16.634 -16.394 -0.224 1.00 0.00 O ATOM 1744 CB ILE A 119 15.414 -13.944 1.911 1.00 0.00 C ATOM 1745 CG1 ILE A 119 16.329 -13.026 1.080 1.00 0.00 C ATOM 1746 CG2 ILE A 119 15.367 -13.498 3.378 1.00 0.00 C ATOM 1747 CD1 ILE A 119 15.953 -12.940 -0.402 1.00 0.00 C ATOM 0 H ILE A 119 17.664 -14.794 2.431 1.00 0.00 H new ATOM 0 HA ILE A 119 15.061 -16.018 2.387 1.00 0.00 H new ATOM 0 HB ILE A 119 14.422 -13.842 1.471 1.00 0.00 H new ATOM 0 HG12 ILE A 119 16.305 -12.024 1.508 1.00 0.00 H new ATOM 0 HG13 ILE A 119 17.355 -13.383 1.163 1.00 0.00 H new ATOM 0 HG21 ILE A 119 15.107 -12.441 3.429 1.00 0.00 H new ATOM 0 HG22 ILE A 119 14.617 -14.082 3.912 1.00 0.00 H new ATOM 0 HG23 ILE A 119 16.343 -13.654 3.837 1.00 0.00 H new ATOM 0 HD11 ILE A 119 16.646 -12.274 -0.915 1.00 0.00 H new ATOM 0 HD12 ILE A 119 16.006 -13.933 -0.849 1.00 0.00 H new ATOM 0 HD13 ILE A 119 14.939 -12.552 -0.498 1.00 0.00 H new ATOM 1759 N SER A 120 14.442 -15.854 -0.190 1.00 0.00 N ATOM 1760 CA SER A 120 14.152 -16.115 -1.596 1.00 0.00 C ATOM 1761 C SER A 120 12.915 -15.304 -2.049 1.00 0.00 C ATOM 1762 O SER A 120 11.922 -15.900 -2.459 1.00 0.00 O ATOM 1763 CB SER A 120 13.962 -17.638 -1.750 1.00 0.00 C ATOM 1764 OG SER A 120 14.058 -18.075 -3.093 1.00 0.00 O ATOM 0 H SER A 120 13.616 -15.571 0.337 1.00 0.00 H new ATOM 0 HA SER A 120 14.970 -15.794 -2.241 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.712 -18.154 -1.151 1.00 0.00 H new ATOM 0 HB3 SER A 120 12.987 -17.919 -1.351 1.00 0.00 H new ATOM 0 HG SER A 120 13.931 -19.046 -3.131 1.00 0.00 H new ATOM 1770 N THR A 121 12.912 -13.965 -1.963 1.00 0.00 N ATOM 1771 CA THR A 121 11.866 -13.101 -2.544 1.00 0.00 C ATOM 1772 C THR A 121 12.378 -11.662 -2.724 1.00 0.00 C ATOM 1773 O THR A 121 13.333 -11.274 -2.042 1.00 0.00 O ATOM 1774 CB THR A 121 10.588 -13.056 -1.673 1.00 0.00 C ATOM 1775 OG1 THR A 121 10.832 -13.243 -0.283 1.00 0.00 O ATOM 1776 CG2 THR A 121 9.521 -14.071 -2.079 1.00 0.00 C ATOM 0 H THR A 121 13.644 -13.442 -1.482 1.00 0.00 H new ATOM 0 HA THR A 121 11.618 -13.538 -3.511 1.00 0.00 H new ATOM 0 HB THR A 121 10.222 -12.045 -1.854 1.00 0.00 H new ATOM 0 HG1 THR A 121 9.984 -13.201 0.207 1.00 0.00 H new ATOM 0 HG21 THR A 121 8.658 -13.975 -1.420 1.00 0.00 H new ATOM 0 HG22 THR A 121 9.214 -13.885 -3.108 1.00 0.00 H new ATOM 0 HG23 THR A 121 9.928 -15.079 -1.999 1.00 0.00 H new ATOM 1784 N ASP A 122 11.700 -10.859 -3.559 1.00 0.00 N ATOM 1785 CA ASP A 122 11.951 -9.425 -3.766 1.00 0.00 C ATOM 1786 C ASP A 122 10.837 -8.654 -4.510 1.00 0.00 C ATOM 1787 O ASP A 122 10.848 -7.425 -4.449 1.00 0.00 O ATOM 1788 CB ASP A 122 13.301 -9.181 -4.468 1.00 0.00 C ATOM 1789 CG ASP A 122 13.499 -10.085 -5.681 1.00 0.00 C ATOM 1790 OD1 ASP A 122 12.832 -9.892 -6.721 1.00 0.00 O ATOM 1791 OD2 ASP A 122 14.304 -11.037 -5.551 1.00 0.00 O ATOM 0 H ASP A 122 10.930 -11.206 -4.132 1.00 0.00 H new ATOM 0 HA ASP A 122 11.971 -9.021 -2.754 1.00 0.00 H new ATOM 0 HB2 ASP A 122 13.361 -8.139 -4.782 1.00 0.00 H new ATOM 0 HB3 ASP A 122 14.111 -9.347 -3.758 1.00 0.00 H new ATOM 1796 N ASP A 123 9.845 -9.303 -5.132 1.00 0.00 N ATOM 1797 CA ASP A 123 8.691 -8.654 -5.794 1.00 0.00 C ATOM 1798 C ASP A 123 7.397 -9.297 -5.271 1.00 0.00 C ATOM 1799 O ASP A 123 7.414 -10.454 -4.843 1.00 0.00 O ATOM 1800 CB ASP A 123 8.837 -8.789 -7.325 1.00 0.00 C ATOM 1801 CG ASP A 123 7.793 -8.047 -8.181 1.00 0.00 C ATOM 1802 OD1 ASP A 123 6.569 -8.214 -7.988 1.00 0.00 O ATOM 1803 OD2 ASP A 123 8.177 -7.449 -9.210 1.00 0.00 O ATOM 0 H ASP A 123 9.816 -10.321 -5.194 1.00 0.00 H new ATOM 0 HA ASP A 123 8.655 -7.589 -5.564 1.00 0.00 H new ATOM 0 HB2 ASP A 123 9.827 -8.430 -7.607 1.00 0.00 H new ATOM 0 HB3 ASP A 123 8.797 -9.848 -7.580 1.00 0.00 H new ATOM 1808 N LEU A 124 6.277 -8.569 -5.274 1.00 0.00 N ATOM 1809 CA LEU A 124 4.955 -9.060 -4.893 1.00 0.00 C ATOM 1810 C LEU A 124 3.964 -8.571 -5.938 1.00 0.00 C ATOM 1811 O LEU A 124 4.045 -7.410 -6.346 1.00 0.00 O ATOM 1812 CB LEU A 124 4.500 -8.498 -3.530 1.00 0.00 C ATOM 1813 CG LEU A 124 5.040 -9.146 -2.251 1.00 0.00 C ATOM 1814 CD1 LEU A 124 4.858 -10.663 -2.242 1.00 0.00 C ATOM 1815 CD2 LEU A 124 6.484 -8.742 -1.956 1.00 0.00 C ATOM 0 H LEU A 124 6.268 -7.588 -5.552 1.00 0.00 H new ATOM 0 HA LEU A 124 4.999 -10.147 -4.824 1.00 0.00 H new ATOM 0 HB2 LEU A 124 4.765 -7.441 -3.503 1.00 0.00 H new ATOM 0 HB3 LEU A 124 3.412 -8.554 -3.495 1.00 0.00 H new ATOM 0 HG LEU A 124 4.433 -8.754 -1.435 1.00 0.00 H new ATOM 0 HD11 LEU A 124 5.257 -11.072 -1.314 1.00 0.00 H new ATOM 0 HD12 LEU A 124 3.797 -10.903 -2.317 1.00 0.00 H new ATOM 0 HD13 LEU A 124 5.389 -11.098 -3.088 1.00 0.00 H new ATOM 0 HD21 LEU A 124 6.818 -9.229 -1.040 1.00 0.00 H new ATOM 0 HD22 LEU A 124 7.124 -9.049 -2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 124 6.542 -7.660 -1.834 1.00 0.00 H new ATOM 1827 N ASN A 125 2.975 -9.401 -6.272 1.00 0.00 N ATOM 1828 CA ASN A 125 1.921 -9.100 -7.233 1.00 0.00 C ATOM 1829 C ASN A 125 0.568 -9.517 -6.646 1.00 0.00 C ATOM 1830 O ASN A 125 0.203 -10.689 -6.733 1.00 0.00 O ATOM 1831 CB ASN A 125 2.223 -9.850 -8.536 1.00 0.00 C ATOM 1832 CG ASN A 125 1.364 -9.327 -9.669 1.00 0.00 C ATOM 1833 OD1 ASN A 125 0.268 -9.824 -9.929 1.00 0.00 O ATOM 1834 ND2 ASN A 125 1.868 -8.331 -10.375 1.00 0.00 N ATOM 0 H ASN A 125 2.886 -10.332 -5.865 1.00 0.00 H new ATOM 0 HA ASN A 125 1.880 -8.032 -7.446 1.00 0.00 H new ATOM 0 HB2 ASN A 125 3.277 -9.737 -8.790 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.041 -10.916 -8.398 1.00 0.00 H new ATOM 0 HD21 ASN A 125 1.346 -7.950 -11.164 1.00 0.00 H new ATOM 0 HD22 ASN A 125 2.779 -7.943 -10.131 1.00 0.00 H new ATOM 1841 N LEU A 126 -0.139 -8.610 -5.958 1.00 0.00 N ATOM 1842 CA LEU A 126 -1.420 -8.898 -5.314 1.00 0.00 C ATOM 1843 C LEU A 126 -2.431 -7.821 -5.709 1.00 0.00 C ATOM 1844 O LEU A 126 -2.128 -6.632 -5.596 1.00 0.00 O ATOM 1845 CB LEU A 126 -1.291 -8.950 -3.781 1.00 0.00 C ATOM 1846 CG LEU A 126 -0.494 -10.144 -3.221 1.00 0.00 C ATOM 1847 CD1 LEU A 126 1.019 -9.940 -3.211 1.00 0.00 C ATOM 1848 CD2 LEU A 126 -0.879 -10.390 -1.767 1.00 0.00 C ATOM 0 H LEU A 126 0.169 -7.646 -5.834 1.00 0.00 H new ATOM 0 HA LEU A 126 -1.757 -9.878 -5.650 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.817 -8.029 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -2.292 -8.970 -3.350 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.740 -10.974 -3.884 1.00 0.00 H new ATOM 0 HD11 LEU A 126 1.503 -10.827 -2.802 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.370 -9.772 -4.229 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.265 -9.075 -2.595 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.311 -11.236 -1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.656 -9.501 -1.176 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.945 -10.609 -1.705 1.00 0.00 H new ATOM 1860 N TYR A 127 -3.640 -8.219 -6.109 1.00 0.00 N ATOM 1861 CA TYR A 127 -4.749 -7.342 -6.492 1.00 0.00 C ATOM 1862 C TYR A 127 -6.041 -8.035 -6.070 1.00 0.00 C ATOM 1863 O TYR A 127 -6.223 -9.216 -6.370 1.00 0.00 O ATOM 1864 CB TYR A 127 -4.720 -7.068 -8.008 1.00 0.00 C ATOM 1865 CG TYR A 127 -5.803 -6.150 -8.570 1.00 0.00 C ATOM 1866 CD1 TYR A 127 -6.013 -4.872 -8.020 1.00 0.00 C ATOM 1867 CD2 TYR A 127 -6.557 -6.537 -9.697 1.00 0.00 C ATOM 1868 CE1 TYR A 127 -6.934 -3.977 -8.590 1.00 0.00 C ATOM 1869 CE2 TYR A 127 -7.487 -5.650 -10.275 1.00 0.00 C ATOM 1870 CZ TYR A 127 -7.668 -4.356 -9.734 1.00 0.00 C ATOM 1871 OH TYR A 127 -8.531 -3.481 -10.319 1.00 0.00 O ATOM 0 H TYR A 127 -3.884 -9.207 -6.178 1.00 0.00 H new ATOM 0 HA TYR A 127 -4.670 -6.373 -5.999 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.750 -6.637 -8.255 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.785 -8.025 -8.526 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -5.456 -4.574 -7.144 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -6.421 -7.521 -10.121 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -7.080 -3.000 -8.153 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -8.064 -5.960 -11.134 1.00 0.00 H new ATOM 0 HH TYR A 127 -8.951 -3.906 -11.096 1.00 0.00 H new ATOM 1881 N TYR A 128 -6.906 -7.315 -5.356 1.00 0.00 N ATOM 1882 CA TYR A 128 -8.115 -7.814 -4.726 1.00 0.00 C ATOM 1883 C TYR A 128 -9.284 -6.957 -5.186 1.00 0.00 C ATOM 1884 O TYR A 128 -9.617 -5.945 -4.562 1.00 0.00 O ATOM 1885 CB TYR A 128 -8.001 -7.706 -3.204 1.00 0.00 C ATOM 1886 CG TYR A 128 -6.962 -8.581 -2.555 1.00 0.00 C ATOM 1887 CD1 TYR A 128 -5.654 -8.105 -2.374 1.00 0.00 C ATOM 1888 CD2 TYR A 128 -7.339 -9.829 -2.037 1.00 0.00 C ATOM 1889 CE1 TYR A 128 -4.705 -8.897 -1.711 1.00 0.00 C ATOM 1890 CE2 TYR A 128 -6.390 -10.650 -1.416 1.00 0.00 C ATOM 1891 CZ TYR A 128 -5.067 -10.194 -1.266 1.00 0.00 C ATOM 1892 OH TYR A 128 -4.180 -10.990 -0.617 1.00 0.00 O ATOM 0 H TYR A 128 -6.770 -6.317 -5.197 1.00 0.00 H new ATOM 0 HA TYR A 128 -8.263 -8.858 -5.002 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -7.784 -6.669 -2.949 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -8.971 -7.945 -2.769 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -5.378 -7.129 -2.745 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -8.365 -10.158 -2.117 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -3.707 -8.522 -1.541 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -6.672 -11.628 -1.054 1.00 0.00 H new ATOM 0 HH TYR A 128 -4.610 -11.841 -0.389 1.00 0.00 H new ATOM 1902 N ASN A 129 -9.971 -7.398 -6.226 1.00 0.00 N ATOM 1903 CA ASN A 129 -11.075 -6.672 -6.861 1.00 0.00 C ATOM 1904 C ASN A 129 -12.175 -7.621 -7.275 1.00 0.00 C ATOM 1905 O ASN A 129 -12.013 -8.834 -7.021 1.00 0.00 O ATOM 1906 CB ASN A 129 -10.573 -5.828 -8.043 1.00 0.00 C ATOM 1907 CG ASN A 129 -10.524 -6.600 -9.361 1.00 0.00 C ATOM 1908 OD1 ASN A 129 -10.006 -7.713 -9.431 1.00 0.00 O ATOM 1909 ND2 ASN A 129 -11.014 -6.009 -10.434 1.00 0.00 N ATOM 0 H ASN A 129 -9.776 -8.296 -6.670 1.00 0.00 H new ATOM 0 HA ASN A 129 -11.497 -5.983 -6.129 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -11.222 -4.961 -8.162 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -9.576 -5.451 -7.814 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -10.967 -6.476 -11.340 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -11.440 -5.086 -10.358 1.00 0.00 H new TER 1916 ASN A 129