USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 908 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 6 SER OG : rot 94:sc= 0.0372 USER MOD Set 1.2: A 112 SER OG : rot 180:sc= 0.0423 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.169 X(o=-0.17,f=-0.014) USER MOD Single : A 15 LYS NZ :NH3+ -114:sc= -1.53 (180deg=-5.01!) USER MOD Single : A 18 SER OG : rot 17:sc= -0.621 USER MOD Single : A 21 SER OG : rot 170:sc= 0 USER MOD Single : A 23 THR OG1 : rot -41:sc= 0.0341 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 29:sc= -2.09 USER MOD Single : A 35 SER OG : rot 180:sc= -0.859 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.0569 X(o=-0.057,f=-0.022) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.095) USER MOD Single : A 49 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0.258 USER MOD Single : A 57 SER OG : rot -65:sc= 0.343 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.212 X(o=-0.21,f=-0.032) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -94:sc= 1.29! USER MOD Single : A 83 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0135) USER MOD Single : A 87 GLN : amide:sc= -0.308 X(o=-0.31,f=-0.34) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot -160:sc= -6.2! USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -36:sc= 0.235 USER MOD Single : A 101 ASN : amide:sc= -0.217 K(o=-0.22,f=-2.1!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl -164:sc= -3.58! (180deg=-4.64!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 37.154 0.694 -9.469 1.00 0.00 N ATOM 2 CA GLY A 1 36.531 0.765 -10.781 1.00 0.00 C ATOM 3 C GLY A 1 35.267 -0.094 -10.835 1.00 0.00 C ATOM 4 O GLY A 1 35.288 -1.260 -10.447 1.00 0.00 O ATOM 0 H1 GLY A 1 38.009 1.285 -9.458 1.00 0.00 H new ATOM 0 H2 GLY A 1 36.487 1.037 -8.749 1.00 0.00 H new ATOM 0 H3 GLY A 1 37.412 -0.292 -9.260 1.00 0.00 H new ATOM 0 HA2 GLY A 1 36.282 1.800 -11.013 1.00 0.00 H new ATOM 0 HA3 GLY A 1 37.236 0.429 -11.541 1.00 0.00 H new ATOM 8 N SER A 2 34.195 0.517 -11.319 1.00 0.00 N ATOM 9 CA SER A 2 32.923 -0.177 -11.429 1.00 0.00 C ATOM 10 C SER A 2 32.007 0.561 -12.407 1.00 0.00 C ATOM 11 O SER A 2 32.086 1.782 -12.537 1.00 0.00 O ATOM 12 CB SER A 2 32.246 -0.306 -10.063 1.00 0.00 C ATOM 13 OG SER A 2 32.178 -1.661 -9.628 1.00 0.00 O ATOM 0 H SER A 2 34.181 1.485 -11.639 1.00 0.00 H new ATOM 0 HA SER A 2 33.113 -1.182 -11.807 1.00 0.00 H new ATOM 0 HB2 SER A 2 32.795 0.284 -9.329 1.00 0.00 H new ATOM 0 HB3 SER A 2 31.239 0.109 -10.116 1.00 0.00 H new ATOM 0 HG SER A 2 31.741 -1.702 -8.752 1.00 0.00 H new ATOM 19 N SER A 3 31.160 -0.212 -13.072 1.00 0.00 N ATOM 20 CA SER A 3 30.230 0.353 -14.035 1.00 0.00 C ATOM 21 C SER A 3 29.341 -0.750 -14.613 1.00 0.00 C ATOM 22 O SER A 3 29.803 -1.864 -14.850 1.00 0.00 O ATOM 23 CB SER A 3 30.974 1.078 -15.159 1.00 0.00 C ATOM 24 OG SER A 3 30.229 2.183 -15.665 1.00 0.00 O ATOM 0 H SER A 3 31.099 -1.224 -12.963 1.00 0.00 H new ATOM 0 HA SER A 3 29.605 1.082 -13.520 1.00 0.00 H new ATOM 0 HB2 SER A 3 31.937 1.429 -14.789 1.00 0.00 H new ATOM 0 HB3 SER A 3 31.179 0.378 -15.969 1.00 0.00 H new ATOM 0 HG SER A 3 30.738 2.621 -16.379 1.00 0.00 H new ATOM 30 N GLY A 4 28.080 -0.400 -14.822 1.00 0.00 N ATOM 31 CA GLY A 4 27.122 -1.346 -15.367 1.00 0.00 C ATOM 32 C GLY A 4 26.347 -0.731 -16.535 1.00 0.00 C ATOM 33 O GLY A 4 26.830 0.195 -17.185 1.00 0.00 O ATOM 0 H GLY A 4 27.700 0.526 -14.624 1.00 0.00 H new ATOM 0 HA2 GLY A 4 27.642 -2.243 -15.703 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.426 -1.655 -14.587 1.00 0.00 H new ATOM 37 N SER A 5 25.159 -1.270 -16.764 1.00 0.00 N ATOM 38 CA SER A 5 24.313 -0.786 -17.841 1.00 0.00 C ATOM 39 C SER A 5 22.900 -0.518 -17.317 1.00 0.00 C ATOM 40 O SER A 5 22.098 -1.440 -17.185 1.00 0.00 O ATOM 41 CB SER A 5 24.268 -1.786 -18.998 1.00 0.00 C ATOM 42 OG SER A 5 24.329 -1.138 -20.267 1.00 0.00 O ATOM 0 H SER A 5 24.762 -2.037 -16.222 1.00 0.00 H new ATOM 0 HA SER A 5 24.737 0.145 -18.217 1.00 0.00 H new ATOM 0 HB2 SER A 5 25.101 -2.484 -18.907 1.00 0.00 H new ATOM 0 HB3 SER A 5 23.352 -2.373 -18.934 1.00 0.00 H new ATOM 0 HG SER A 5 24.299 -1.810 -20.979 1.00 0.00 H new ATOM 48 N SER A 6 22.640 0.750 -17.033 1.00 0.00 N ATOM 49 CA SER A 6 21.339 1.151 -16.527 1.00 0.00 C ATOM 50 C SER A 6 20.231 0.454 -17.319 1.00 0.00 C ATOM 51 O SER A 6 20.308 0.352 -18.543 1.00 0.00 O ATOM 52 CB SER A 6 21.165 2.670 -16.595 1.00 0.00 C ATOM 53 OG SER A 6 19.896 3.085 -16.098 1.00 0.00 O ATOM 0 H SER A 6 23.308 1.513 -17.144 1.00 0.00 H new ATOM 0 HA SER A 6 21.273 0.851 -15.481 1.00 0.00 H new ATOM 0 HB2 SER A 6 21.955 3.151 -16.019 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.276 3.002 -17.627 1.00 0.00 H new ATOM 0 HG SER A 6 19.978 3.326 -15.152 1.00 0.00 H new ATOM 59 N GLY A 7 19.226 -0.007 -16.590 1.00 0.00 N ATOM 60 CA GLY A 7 18.104 -0.692 -17.209 1.00 0.00 C ATOM 61 C GLY A 7 16.904 -0.747 -16.262 1.00 0.00 C ATOM 62 O GLY A 7 16.691 -1.749 -15.580 1.00 0.00 O ATOM 0 H GLY A 7 19.165 0.080 -15.576 1.00 0.00 H new ATOM 0 HA2 GLY A 7 17.823 -0.179 -18.129 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.399 -1.704 -17.486 1.00 0.00 H new ATOM 66 N LEU A 8 16.151 0.344 -16.249 1.00 0.00 N ATOM 67 CA LEU A 8 14.978 0.431 -15.397 1.00 0.00 C ATOM 68 C LEU A 8 15.418 0.459 -13.931 1.00 0.00 C ATOM 69 O LEU A 8 16.179 -0.400 -13.492 1.00 0.00 O ATOM 70 CB LEU A 8 13.993 -0.693 -15.721 1.00 0.00 C ATOM 71 CG LEU A 8 13.502 -0.759 -17.169 1.00 0.00 C ATOM 72 CD1 LEU A 8 13.121 -2.189 -17.555 1.00 0.00 C ATOM 73 CD2 LEU A 8 12.352 0.223 -17.403 1.00 0.00 C ATOM 0 H LEU A 8 16.331 1.174 -16.814 1.00 0.00 H new ATOM 0 HA LEU A 8 14.439 1.359 -15.587 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.464 -1.644 -15.475 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.126 -0.588 -15.069 1.00 0.00 H new ATOM 0 HG LEU A 8 14.322 -0.457 -17.821 1.00 0.00 H new ATOM 0 HD11 LEU A 8 12.776 -2.207 -18.589 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.991 -2.838 -17.452 1.00 0.00 H new ATOM 0 HD13 LEU A 8 12.325 -2.543 -16.900 1.00 0.00 H new ATOM 0 HD21 LEU A 8 12.022 0.156 -18.440 1.00 0.00 H new ATOM 0 HD22 LEU A 8 11.522 -0.024 -16.741 1.00 0.00 H new ATOM 0 HD23 LEU A 8 12.692 1.238 -17.195 1.00 0.00 H new ATOM 85 N ASN A 9 14.921 1.458 -13.216 1.00 0.00 N ATOM 86 CA ASN A 9 15.253 1.609 -11.810 1.00 0.00 C ATOM 87 C ASN A 9 14.234 0.843 -10.963 1.00 0.00 C ATOM 88 O ASN A 9 14.582 -0.128 -10.294 1.00 0.00 O ATOM 89 CB ASN A 9 15.208 3.079 -11.388 1.00 0.00 C ATOM 90 CG ASN A 9 16.353 3.868 -12.027 1.00 0.00 C ATOM 91 OD1 ASN A 9 16.350 4.171 -13.208 1.00 0.00 O ATOM 92 ND2 ASN A 9 17.331 4.180 -11.182 1.00 0.00 N ATOM 0 H ASN A 9 14.291 2.171 -13.584 1.00 0.00 H new ATOM 0 HA ASN A 9 16.260 1.221 -11.659 1.00 0.00 H new ATOM 0 HB2 ASN A 9 14.253 3.516 -11.680 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.273 3.152 -10.302 1.00 0.00 H new ATOM 0 HD21 ASN A 9 18.142 4.704 -11.511 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.271 3.895 -10.204 1.00 0.00 H new ATOM 99 N ASP A 10 12.995 1.310 -11.022 1.00 0.00 N ATOM 100 CA ASP A 10 11.923 0.680 -10.269 1.00 0.00 C ATOM 101 C ASP A 10 10.625 1.459 -10.491 1.00 0.00 C ATOM 102 O ASP A 10 10.517 2.620 -10.097 1.00 0.00 O ATOM 103 CB ASP A 10 12.226 0.686 -8.768 1.00 0.00 C ATOM 104 CG ASP A 10 12.019 2.033 -8.072 1.00 0.00 C ATOM 105 OD1 ASP A 10 12.515 3.039 -8.623 1.00 0.00 O ATOM 106 OD2 ASP A 10 11.368 2.025 -7.005 1.00 0.00 O ATOM 0 H ASP A 10 12.710 2.116 -11.579 1.00 0.00 H new ATOM 0 HA ASP A 10 11.828 -0.350 -10.614 1.00 0.00 H new ATOM 0 HB2 ASP A 10 11.595 -0.058 -8.282 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.259 0.373 -8.620 1.00 0.00 H new ATOM 111 N GLU A 11 9.672 0.789 -11.123 1.00 0.00 N ATOM 112 CA GLU A 11 8.385 1.404 -11.403 1.00 0.00 C ATOM 113 C GLU A 11 7.424 1.177 -10.235 1.00 0.00 C ATOM 114 O GLU A 11 6.742 2.104 -9.798 1.00 0.00 O ATOM 115 CB GLU A 11 7.796 0.869 -12.710 1.00 0.00 C ATOM 116 CG GLU A 11 7.290 -0.565 -12.538 1.00 0.00 C ATOM 117 CD GLU A 11 6.970 -1.199 -13.892 1.00 0.00 C ATOM 118 OE1 GLU A 11 7.800 -1.025 -14.811 1.00 0.00 O ATOM 119 OE2 GLU A 11 5.902 -1.843 -13.980 1.00 0.00 O ATOM 0 H GLU A 11 9.765 -0.173 -11.449 1.00 0.00 H new ATOM 0 HA GLU A 11 8.534 2.477 -11.522 1.00 0.00 H new ATOM 0 HB2 GLU A 11 6.977 1.511 -13.033 1.00 0.00 H new ATOM 0 HB3 GLU A 11 8.553 0.900 -13.493 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.043 -1.161 -12.022 1.00 0.00 H new ATOM 0 HG3 GLU A 11 6.398 -0.567 -11.912 1.00 0.00 H new ATOM 126 N LEU A 12 7.398 -0.060 -9.762 1.00 0.00 N ATOM 127 CA LEU A 12 6.532 -0.420 -8.653 1.00 0.00 C ATOM 128 C LEU A 12 7.240 -0.105 -7.334 1.00 0.00 C ATOM 129 O LEU A 12 6.676 0.558 -6.465 1.00 0.00 O ATOM 130 CB LEU A 12 6.080 -1.877 -8.775 1.00 0.00 C ATOM 131 CG LEU A 12 5.377 -2.254 -10.080 1.00 0.00 C ATOM 132 CD1 LEU A 12 4.807 -3.672 -10.007 1.00 0.00 C ATOM 133 CD2 LEU A 12 4.305 -1.224 -10.442 1.00 0.00 C ATOM 0 H LEU A 12 7.964 -0.826 -10.127 1.00 0.00 H new ATOM 0 HA LEU A 12 5.619 0.175 -8.676 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.953 -2.519 -8.657 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.408 -2.099 -7.946 1.00 0.00 H new ATOM 0 HG LEU A 12 6.116 -2.245 -10.881 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.313 -3.914 -10.948 1.00 0.00 H new ATOM 0 HD12 LEU A 12 5.616 -4.381 -9.829 1.00 0.00 H new ATOM 0 HD13 LEU A 12 4.086 -3.733 -9.192 1.00 0.00 H new ATOM 0 HD21 LEU A 12 3.820 -1.515 -11.374 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.562 -1.177 -9.646 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.768 -0.245 -10.565 1.00 0.00 H new ATOM 145 N LEU A 13 8.466 -0.595 -7.226 1.00 0.00 N ATOM 146 CA LEU A 13 9.257 -0.373 -6.027 1.00 0.00 C ATOM 147 C LEU A 13 9.202 1.108 -5.651 1.00 0.00 C ATOM 148 O LEU A 13 9.011 1.964 -6.513 1.00 0.00 O ATOM 149 CB LEU A 13 10.680 -0.906 -6.218 1.00 0.00 C ATOM 150 CG LEU A 13 11.204 -1.826 -5.115 1.00 0.00 C ATOM 151 CD1 LEU A 13 12.463 -2.566 -5.570 1.00 0.00 C ATOM 152 CD2 LEU A 13 11.435 -1.050 -3.816 1.00 0.00 C ATOM 0 H LEU A 13 8.931 -1.145 -7.948 1.00 0.00 H new ATOM 0 HA LEU A 13 8.841 -0.931 -5.188 1.00 0.00 H new ATOM 0 HB2 LEU A 13 10.721 -1.446 -7.164 1.00 0.00 H new ATOM 0 HB3 LEU A 13 11.356 -0.056 -6.307 1.00 0.00 H new ATOM 0 HG LEU A 13 10.443 -2.579 -4.910 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.815 -3.213 -4.767 1.00 0.00 H new ATOM 0 HD12 LEU A 13 12.233 -3.170 -6.448 1.00 0.00 H new ATOM 0 HD13 LEU A 13 13.240 -1.843 -5.820 1.00 0.00 H new ATOM 0 HD21 LEU A 13 11.808 -1.728 -3.048 1.00 0.00 H new ATOM 0 HD22 LEU A 13 12.167 -0.261 -3.989 1.00 0.00 H new ATOM 0 HD23 LEU A 13 10.496 -0.608 -3.484 1.00 0.00 H new ATOM 164 N GLY A 14 9.372 1.365 -4.362 1.00 0.00 N ATOM 165 CA GLY A 14 9.343 2.728 -3.861 1.00 0.00 C ATOM 166 C GLY A 14 8.103 3.471 -4.362 1.00 0.00 C ATOM 167 O GLY A 14 8.081 4.701 -4.394 1.00 0.00 O ATOM 0 H GLY A 14 9.530 0.652 -3.650 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.350 2.719 -2.771 1.00 0.00 H new ATOM 0 HA3 GLY A 14 10.241 3.256 -4.181 1.00 0.00 H new ATOM 171 N LYS A 15 7.100 2.694 -4.743 1.00 0.00 N ATOM 172 CA LYS A 15 5.860 3.262 -5.242 1.00 0.00 C ATOM 173 C LYS A 15 4.676 2.538 -4.596 1.00 0.00 C ATOM 174 O LYS A 15 4.771 1.357 -4.266 1.00 0.00 O ATOM 175 CB LYS A 15 5.835 3.237 -6.771 1.00 0.00 C ATOM 176 CG LYS A 15 4.524 2.643 -7.290 1.00 0.00 C ATOM 177 CD LYS A 15 4.240 3.105 -8.721 1.00 0.00 C ATOM 178 CE LYS A 15 3.764 1.938 -9.588 1.00 0.00 C ATOM 179 NZ LYS A 15 2.593 2.341 -10.399 1.00 0.00 N ATOM 0 H LYS A 15 7.121 1.675 -4.716 1.00 0.00 H new ATOM 0 HA LYS A 15 5.784 4.313 -4.963 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.957 4.249 -7.157 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.676 2.651 -7.142 1.00 0.00 H new ATOM 0 HG2 LYS A 15 4.577 1.555 -7.259 1.00 0.00 H new ATOM 0 HG3 LYS A 15 3.703 2.941 -6.638 1.00 0.00 H new ATOM 0 HD2 LYS A 15 3.482 3.888 -8.711 1.00 0.00 H new ATOM 0 HD3 LYS A 15 5.142 3.540 -9.153 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.572 1.610 -10.242 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.502 1.090 -8.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 1.757 1.805 -10.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.418 3.358 -10.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 2.781 2.143 -11.403 1.00 0.00 H new ATOM 193 N VAL A 16 3.588 3.276 -4.436 1.00 0.00 N ATOM 194 CA VAL A 16 2.387 2.719 -3.836 1.00 0.00 C ATOM 195 C VAL A 16 1.717 1.772 -4.832 1.00 0.00 C ATOM 196 O VAL A 16 1.581 2.099 -6.011 1.00 0.00 O ATOM 197 CB VAL A 16 1.464 3.847 -3.368 1.00 0.00 C ATOM 198 CG1 VAL A 16 0.085 3.304 -2.989 1.00 0.00 C ATOM 199 CG2 VAL A 16 2.089 4.620 -2.205 1.00 0.00 C ATOM 0 H VAL A 16 3.512 4.255 -4.711 1.00 0.00 H new ATOM 0 HA VAL A 16 2.638 2.135 -2.951 1.00 0.00 H new ATOM 0 HB VAL A 16 1.334 4.541 -4.199 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.552 4.125 -2.660 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.366 2.820 -3.855 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.189 2.579 -2.181 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.413 5.416 -1.892 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.263 3.942 -1.369 1.00 0.00 H new ATOM 0 HG23 VAL A 16 3.037 5.054 -2.524 1.00 0.00 H new ATOM 209 N VAL A 17 1.313 0.617 -4.323 1.00 0.00 N ATOM 210 CA VAL A 17 0.660 -0.380 -5.154 1.00 0.00 C ATOM 211 C VAL A 17 -0.591 -0.893 -4.438 1.00 0.00 C ATOM 212 O VAL A 17 -0.736 -0.716 -3.229 1.00 0.00 O ATOM 213 CB VAL A 17 1.646 -1.496 -5.507 1.00 0.00 C ATOM 214 CG1 VAL A 17 2.720 -0.992 -6.473 1.00 0.00 C ATOM 215 CG2 VAL A 17 2.278 -2.088 -4.244 1.00 0.00 C ATOM 0 H VAL A 17 1.425 0.350 -3.345 1.00 0.00 H new ATOM 0 HA VAL A 17 0.338 0.061 -6.097 1.00 0.00 H new ATOM 0 HB VAL A 17 1.091 -2.289 -6.007 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.408 -1.804 -6.708 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.248 -0.639 -7.390 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.270 -0.173 -6.010 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.975 -2.879 -4.522 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.813 -1.307 -3.704 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.497 -2.501 -3.605 1.00 0.00 H new ATOM 225 N SER A 18 -1.465 -1.518 -5.215 1.00 0.00 N ATOM 226 CA SER A 18 -2.699 -2.057 -4.671 1.00 0.00 C ATOM 227 C SER A 18 -2.578 -3.574 -4.505 1.00 0.00 C ATOM 228 O SER A 18 -2.309 -4.288 -5.469 1.00 0.00 O ATOM 229 CB SER A 18 -3.891 -1.714 -5.565 1.00 0.00 C ATOM 230 OG SER A 18 -3.591 -1.892 -6.947 1.00 0.00 O ATOM 0 H SER A 18 -1.342 -1.663 -6.217 1.00 0.00 H new ATOM 0 HA SER A 18 -2.870 -1.603 -3.695 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.740 -2.342 -5.294 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.190 -0.681 -5.389 1.00 0.00 H new ATOM 0 HG SER A 18 -2.792 -2.452 -7.039 1.00 0.00 H new ATOM 236 N VAL A 19 -2.782 -4.020 -3.274 1.00 0.00 N ATOM 237 CA VAL A 19 -2.701 -5.438 -2.969 1.00 0.00 C ATOM 238 C VAL A 19 -4.099 -6.055 -3.052 1.00 0.00 C ATOM 239 O VAL A 19 -5.034 -5.567 -2.421 1.00 0.00 O ATOM 240 CB VAL A 19 -2.037 -5.643 -1.605 1.00 0.00 C ATOM 241 CG1 VAL A 19 -2.371 -7.023 -1.035 1.00 0.00 C ATOM 242 CG2 VAL A 19 -0.523 -5.440 -1.698 1.00 0.00 C ATOM 0 H VAL A 19 -3.003 -3.424 -2.476 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.076 -5.950 -3.700 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.435 -4.893 -0.921 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.887 -7.143 -0.066 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.450 -7.116 -0.916 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -2.014 -7.795 -1.717 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.075 -5.591 -0.716 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.102 -6.157 -2.403 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.312 -4.427 -2.041 1.00 0.00 H new ATOM 252 N VAL A 20 -4.195 -7.120 -3.834 1.00 0.00 N ATOM 253 CA VAL A 20 -5.462 -7.809 -4.008 1.00 0.00 C ATOM 254 C VAL A 20 -5.571 -8.936 -2.979 1.00 0.00 C ATOM 255 O VAL A 20 -4.692 -9.793 -2.898 1.00 0.00 O ATOM 256 CB VAL A 20 -5.599 -8.300 -5.450 1.00 0.00 C ATOM 257 CG1 VAL A 20 -7.014 -8.814 -5.724 1.00 0.00 C ATOM 258 CG2 VAL A 20 -5.212 -7.202 -6.442 1.00 0.00 C ATOM 0 H VAL A 20 -3.416 -7.523 -4.354 1.00 0.00 H new ATOM 0 HA VAL A 20 -6.294 -7.127 -3.832 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.909 -9.133 -5.586 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.083 -9.157 -6.756 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.237 -9.642 -5.051 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.731 -8.010 -5.560 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.318 -7.577 -7.460 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -5.864 -6.340 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.177 -6.905 -6.271 1.00 0.00 H new ATOM 268 N SER A 21 -6.655 -8.900 -2.220 1.00 0.00 N ATOM 269 CA SER A 21 -6.889 -9.908 -1.200 1.00 0.00 C ATOM 270 C SER A 21 -7.304 -11.228 -1.854 1.00 0.00 C ATOM 271 O SER A 21 -8.232 -11.261 -2.660 1.00 0.00 O ATOM 272 CB SER A 21 -7.959 -9.449 -0.207 1.00 0.00 C ATOM 273 OG SER A 21 -7.945 -10.225 0.989 1.00 0.00 O ATOM 0 H SER A 21 -7.382 -8.188 -2.291 1.00 0.00 H new ATOM 0 HA SER A 21 -5.961 -10.058 -0.649 1.00 0.00 H new ATOM 0 HB2 SER A 21 -7.798 -8.400 0.040 1.00 0.00 H new ATOM 0 HB3 SER A 21 -8.941 -9.520 -0.674 1.00 0.00 H new ATOM 0 HG SER A 21 -8.525 -9.805 1.658 1.00 0.00 H new ATOM 279 N ALA A 22 -6.594 -12.283 -1.483 1.00 0.00 N ATOM 280 CA ALA A 22 -6.876 -13.602 -2.024 1.00 0.00 C ATOM 281 C ALA A 22 -8.332 -13.968 -1.729 1.00 0.00 C ATOM 282 O ALA A 22 -9.087 -14.307 -2.640 1.00 0.00 O ATOM 283 CB ALA A 22 -5.891 -14.616 -1.439 1.00 0.00 C ATOM 0 H ALA A 22 -5.824 -12.252 -0.815 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.746 -13.608 -3.106 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.103 -15.605 -1.845 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.873 -14.327 -1.700 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.994 -14.639 -0.354 1.00 0.00 H new ATOM 289 N THR A 23 -8.684 -13.886 -0.454 1.00 0.00 N ATOM 290 CA THR A 23 -10.036 -14.205 -0.030 1.00 0.00 C ATOM 291 C THR A 23 -10.987 -13.058 -0.375 1.00 0.00 C ATOM 292 O THR A 23 -12.191 -13.150 -0.133 1.00 0.00 O ATOM 293 CB THR A 23 -9.997 -14.532 1.465 1.00 0.00 C ATOM 294 OG1 THR A 23 -11.127 -15.378 1.664 1.00 0.00 O ATOM 295 CG2 THR A 23 -10.286 -13.311 2.340 1.00 0.00 C ATOM 0 H THR A 23 -8.056 -13.603 0.299 1.00 0.00 H new ATOM 0 HA THR A 23 -10.422 -15.076 -0.559 1.00 0.00 H new ATOM 0 HB THR A 23 -9.019 -14.938 1.722 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.885 -15.039 1.144 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.246 -13.599 3.391 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.541 -12.540 2.146 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.278 -12.923 2.108 1.00 0.00 H new ATOM 303 N GLU A 24 -10.414 -12.003 -0.935 1.00 0.00 N ATOM 304 CA GLU A 24 -11.196 -10.840 -1.317 1.00 0.00 C ATOM 305 C GLU A 24 -10.629 -10.215 -2.593 1.00 0.00 C ATOM 306 O GLU A 24 -10.021 -9.147 -2.548 1.00 0.00 O ATOM 307 CB GLU A 24 -11.246 -9.816 -0.180 1.00 0.00 C ATOM 308 CG GLU A 24 -12.648 -9.742 0.429 1.00 0.00 C ATOM 309 CD GLU A 24 -12.639 -10.209 1.886 1.00 0.00 C ATOM 310 OE1 GLU A 24 -12.234 -9.393 2.741 1.00 0.00 O ATOM 311 OE2 GLU A 24 -13.036 -11.372 2.110 1.00 0.00 O ATOM 0 H GLU A 24 -9.416 -11.929 -1.133 1.00 0.00 H new ATOM 0 HA GLU A 24 -12.218 -11.163 -1.517 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.525 -10.087 0.591 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.957 -8.835 -0.556 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -13.019 -8.718 0.374 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -13.333 -10.361 -0.151 1.00 0.00 H new ATOM 318 N ARG A 25 -10.850 -10.907 -3.701 1.00 0.00 N ATOM 319 CA ARG A 25 -10.368 -10.433 -4.987 1.00 0.00 C ATOM 320 C ARG A 25 -10.773 -8.972 -5.200 1.00 0.00 C ATOM 321 O ARG A 25 -10.135 -8.254 -5.968 1.00 0.00 O ATOM 322 CB ARG A 25 -10.927 -11.282 -6.131 1.00 0.00 C ATOM 323 CG ARG A 25 -10.441 -12.729 -6.028 1.00 0.00 C ATOM 324 CD ARG A 25 -9.330 -13.008 -7.041 1.00 0.00 C ATOM 325 NE ARG A 25 -9.119 -14.467 -7.172 1.00 0.00 N ATOM 326 CZ ARG A 25 -8.239 -15.026 -8.014 1.00 0.00 C ATOM 327 NH1 ARG A 25 -7.482 -14.252 -8.803 1.00 0.00 N ATOM 328 NH2 ARG A 25 -8.115 -16.360 -8.064 1.00 0.00 N ATOM 0 H ARG A 25 -11.356 -11.792 -3.735 1.00 0.00 H new ATOM 0 HA ARG A 25 -9.281 -10.516 -4.985 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -12.016 -11.258 -6.108 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -10.619 -10.858 -7.087 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -10.075 -12.923 -5.020 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -11.275 -13.409 -6.201 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -9.594 -12.582 -8.009 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -8.406 -12.526 -6.722 1.00 0.00 H new ATOM 0 HE ARG A 25 -9.678 -15.086 -6.585 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -7.575 -13.237 -8.763 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -6.812 -14.678 -9.444 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -8.690 -16.949 -7.461 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -7.445 -16.786 -8.705 1.00 0.00 H new ATOM 342 N THR A 26 -11.831 -8.578 -4.506 1.00 0.00 N ATOM 343 CA THR A 26 -12.329 -7.217 -4.610 1.00 0.00 C ATOM 344 C THR A 26 -11.529 -6.286 -3.696 1.00 0.00 C ATOM 345 O THR A 26 -10.773 -5.440 -4.173 1.00 0.00 O ATOM 346 CB THR A 26 -13.825 -7.235 -4.298 1.00 0.00 C ATOM 347 OG1 THR A 26 -14.441 -7.467 -5.561 1.00 0.00 O ATOM 348 CG2 THR A 26 -14.352 -5.863 -3.872 1.00 0.00 C ATOM 0 H THR A 26 -12.357 -9.177 -3.870 1.00 0.00 H new ATOM 0 HA THR A 26 -12.198 -6.824 -5.618 1.00 0.00 H new ATOM 0 HB THR A 26 -14.021 -7.960 -3.508 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.414 -7.495 -5.450 1.00 0.00 H new ATOM 0 HG21 THR A 26 -15.419 -5.932 -3.662 1.00 0.00 H new ATOM 0 HG22 THR A 26 -13.827 -5.534 -2.975 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.186 -5.144 -4.674 1.00 0.00 H new ATOM 356 N GLU A 27 -11.722 -6.472 -2.399 1.00 0.00 N ATOM 357 CA GLU A 27 -11.028 -5.661 -1.414 1.00 0.00 C ATOM 358 C GLU A 27 -9.533 -5.596 -1.736 1.00 0.00 C ATOM 359 O GLU A 27 -8.908 -6.622 -2.002 1.00 0.00 O ATOM 360 CB GLU A 27 -11.261 -6.194 0.000 1.00 0.00 C ATOM 361 CG GLU A 27 -11.963 -5.151 0.872 1.00 0.00 C ATOM 362 CD GLU A 27 -10.946 -4.241 1.564 1.00 0.00 C ATOM 363 OE1 GLU A 27 -10.129 -4.787 2.336 1.00 0.00 O ATOM 364 OE2 GLU A 27 -11.008 -3.020 1.304 1.00 0.00 O ATOM 0 H GLU A 27 -12.350 -7.174 -2.007 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.433 -4.650 -1.456 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.864 -7.101 -0.044 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.307 -6.467 0.451 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.635 -4.551 0.258 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.577 -5.651 1.621 1.00 0.00 H new ATOM 371 N TRP A 28 -9.004 -4.382 -1.702 1.00 0.00 N ATOM 372 CA TRP A 28 -7.596 -4.172 -1.988 1.00 0.00 C ATOM 373 C TRP A 28 -7.091 -3.053 -1.075 1.00 0.00 C ATOM 374 O TRP A 28 -7.830 -2.122 -0.759 1.00 0.00 O ATOM 375 CB TRP A 28 -7.374 -3.876 -3.473 1.00 0.00 C ATOM 376 CG TRP A 28 -7.841 -2.486 -3.907 1.00 0.00 C ATOM 377 CD1 TRP A 28 -9.003 -2.147 -4.480 1.00 0.00 C ATOM 378 CD2 TRP A 28 -7.102 -1.253 -3.778 1.00 0.00 C ATOM 379 NE1 TRP A 28 -9.068 -0.791 -4.730 1.00 0.00 N ATOM 380 CE2 TRP A 28 -7.875 -0.230 -4.289 1.00 0.00 C ATOM 381 CE3 TRP A 28 -5.823 -1.009 -3.247 1.00 0.00 C ATOM 382 CZ2 TRP A 28 -7.457 1.106 -4.320 1.00 0.00 C ATOM 383 CZ3 TRP A 28 -5.419 0.331 -3.286 1.00 0.00 C ATOM 384 CH2 TRP A 28 -6.185 1.372 -3.797 1.00 0.00 C ATOM 0 H TRP A 28 -9.526 -3.534 -1.481 1.00 0.00 H new ATOM 0 HA TRP A 28 -7.023 -5.076 -1.783 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -6.312 -3.978 -3.699 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -7.899 -4.626 -4.065 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -9.791 -2.847 -4.717 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -9.848 -0.293 -5.159 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -5.201 -1.793 -2.841 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -8.081 1.889 -4.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -4.443 0.573 -2.891 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -5.801 2.382 -3.791 1.00 0.00 H new ATOM 395 N TYR A 29 -5.833 -3.180 -0.675 1.00 0.00 N ATOM 396 CA TYR A 29 -5.221 -2.192 0.196 1.00 0.00 C ATOM 397 C TYR A 29 -3.886 -1.710 -0.375 1.00 0.00 C ATOM 398 O TYR A 29 -3.170 -2.475 -1.018 1.00 0.00 O ATOM 399 CB TYR A 29 -4.966 -2.902 1.527 1.00 0.00 C ATOM 400 CG TYR A 29 -3.541 -3.435 1.685 1.00 0.00 C ATOM 401 CD1 TYR A 29 -2.561 -2.635 2.236 1.00 0.00 C ATOM 402 CD2 TYR A 29 -3.235 -4.718 1.276 1.00 0.00 C ATOM 403 CE1 TYR A 29 -1.220 -3.137 2.385 1.00 0.00 C ATOM 404 CE2 TYR A 29 -1.893 -5.219 1.424 1.00 0.00 C ATOM 405 CZ TYR A 29 -0.953 -4.405 1.971 1.00 0.00 C ATOM 406 OH TYR A 29 0.315 -4.878 2.112 1.00 0.00 O ATOM 0 H TYR A 29 -5.222 -3.953 -0.939 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.869 -1.322 0.304 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.177 -2.210 2.342 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.666 -3.732 1.624 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -2.800 -1.632 2.556 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.002 -5.345 0.845 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.444 -2.521 2.815 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.639 -6.220 1.107 1.00 0.00 H new ATOM 0 HH TYR A 29 0.744 -4.441 2.878 1.00 0.00 H new ATOM 416 N PRO A 30 -3.584 -0.410 -0.113 1.00 0.00 N ATOM 417 CA PRO A 30 -2.347 0.182 -0.593 1.00 0.00 C ATOM 418 C PRO A 30 -1.152 -0.298 0.232 1.00 0.00 C ATOM 419 O PRO A 30 -1.266 -0.495 1.441 1.00 0.00 O ATOM 420 CB PRO A 30 -2.568 1.684 -0.499 1.00 0.00 C ATOM 421 CG PRO A 30 -3.733 1.874 0.459 1.00 0.00 C ATOM 422 CD PRO A 30 -4.408 0.526 0.646 1.00 0.00 C ATOM 0 HA PRO A 30 -2.111 -0.110 -1.616 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -1.674 2.188 -0.132 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.794 2.108 -1.478 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.381 2.261 1.416 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.439 2.603 0.061 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.454 0.249 1.699 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.433 0.542 0.275 1.00 0.00 H new ATOM 430 N ALA A 31 -0.032 -0.473 -0.454 1.00 0.00 N ATOM 431 CA ALA A 31 1.183 -0.927 0.200 1.00 0.00 C ATOM 432 C ALA A 31 2.392 -0.535 -0.651 1.00 0.00 C ATOM 433 O ALA A 31 2.361 -0.659 -1.874 1.00 0.00 O ATOM 434 CB ALA A 31 1.102 -2.436 0.438 1.00 0.00 C ATOM 0 H ALA A 31 0.059 -0.308 -1.456 1.00 0.00 H new ATOM 0 HA ALA A 31 1.296 -0.449 1.173 1.00 0.00 H new ATOM 0 HB1 ALA A 31 2.014 -2.776 0.929 1.00 0.00 H new ATOM 0 HB2 ALA A 31 0.244 -2.659 1.072 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.991 -2.949 -0.517 1.00 0.00 H new ATOM 440 N LEU A 32 3.429 -0.069 0.030 1.00 0.00 N ATOM 441 CA LEU A 32 4.647 0.341 -0.650 1.00 0.00 C ATOM 442 C LEU A 32 5.606 -0.848 -0.731 1.00 0.00 C ATOM 443 O LEU A 32 5.920 -1.468 0.285 1.00 0.00 O ATOM 444 CB LEU A 32 5.250 1.572 0.030 1.00 0.00 C ATOM 445 CG LEU A 32 6.443 2.215 -0.681 1.00 0.00 C ATOM 446 CD1 LEU A 32 6.071 2.636 -2.104 1.00 0.00 C ATOM 447 CD2 LEU A 32 7.004 3.381 0.134 1.00 0.00 C ATOM 0 H LEU A 32 3.451 0.034 1.045 1.00 0.00 H new ATOM 0 HA LEU A 32 4.429 0.645 -1.674 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.468 2.323 0.136 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.561 1.291 1.036 1.00 0.00 H new ATOM 0 HG LEU A 32 7.234 1.470 -0.762 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.936 3.090 -2.587 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.756 1.760 -2.672 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.255 3.358 -2.068 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.851 3.820 -0.394 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.230 4.136 0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.332 3.019 1.108 1.00 0.00 H new ATOM 459 N VAL A 33 6.045 -1.130 -1.949 1.00 0.00 N ATOM 460 CA VAL A 33 6.963 -2.234 -2.176 1.00 0.00 C ATOM 461 C VAL A 33 8.339 -1.872 -1.615 1.00 0.00 C ATOM 462 O VAL A 33 8.782 -0.730 -1.736 1.00 0.00 O ATOM 463 CB VAL A 33 6.998 -2.587 -3.665 1.00 0.00 C ATOM 464 CG1 VAL A 33 8.091 -3.617 -3.958 1.00 0.00 C ATOM 465 CG2 VAL A 33 5.633 -3.085 -4.142 1.00 0.00 C ATOM 0 H VAL A 33 5.782 -0.614 -2.789 1.00 0.00 H new ATOM 0 HA VAL A 33 6.624 -3.127 -1.651 1.00 0.00 H new ATOM 0 HB VAL A 33 7.236 -1.679 -4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.095 -3.851 -5.023 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.061 -3.210 -3.672 1.00 0.00 H new ATOM 0 HG13 VAL A 33 7.897 -4.526 -3.388 1.00 0.00 H new ATOM 0 HG21 VAL A 33 5.685 -3.329 -5.203 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.353 -3.975 -3.578 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.886 -2.306 -3.985 1.00 0.00 H new ATOM 475 N ILE A 34 8.977 -2.864 -1.012 1.00 0.00 N ATOM 476 CA ILE A 34 10.294 -2.664 -0.432 1.00 0.00 C ATOM 477 C ILE A 34 11.010 -4.012 -0.325 1.00 0.00 C ATOM 478 O ILE A 34 10.469 -5.040 -0.730 1.00 0.00 O ATOM 479 CB ILE A 34 10.186 -1.918 0.899 1.00 0.00 C ATOM 480 CG1 ILE A 34 9.220 -2.629 1.849 1.00 0.00 C ATOM 481 CG2 ILE A 34 9.797 -0.454 0.677 1.00 0.00 C ATOM 482 CD1 ILE A 34 9.412 -2.147 3.288 1.00 0.00 C ATOM 0 H ILE A 34 8.606 -3.809 -0.912 1.00 0.00 H new ATOM 0 HA ILE A 34 10.902 -2.030 -1.078 1.00 0.00 H new ATOM 0 HB ILE A 34 11.167 -1.923 1.374 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.193 -2.445 1.534 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.381 -3.706 1.798 1.00 0.00 H new ATOM 0 HG21 ILE A 34 9.727 0.054 1.639 1.00 0.00 H new ATOM 0 HG22 ILE A 34 10.554 0.034 0.063 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.833 -0.406 0.171 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.713 -2.668 3.943 1.00 0.00 H new ATOM 0 HD12 ILE A 34 10.433 -2.355 3.608 1.00 0.00 H new ATOM 0 HD13 ILE A 34 9.227 -1.074 3.340 1.00 0.00 H new ATOM 494 N SER A 35 12.216 -3.964 0.222 1.00 0.00 N ATOM 495 CA SER A 35 13.011 -5.169 0.388 1.00 0.00 C ATOM 496 C SER A 35 13.380 -5.353 1.861 1.00 0.00 C ATOM 497 O SER A 35 13.611 -4.379 2.574 1.00 0.00 O ATOM 498 CB SER A 35 14.274 -5.118 -0.473 1.00 0.00 C ATOM 499 OG SER A 35 14.912 -6.389 -0.562 1.00 0.00 O ATOM 0 H SER A 35 12.662 -3.110 0.556 1.00 0.00 H new ATOM 0 HA SER A 35 12.415 -6.020 0.060 1.00 0.00 H new ATOM 0 HB2 SER A 35 14.017 -4.771 -1.474 1.00 0.00 H new ATOM 0 HB3 SER A 35 14.970 -4.392 -0.053 1.00 0.00 H new ATOM 0 HG SER A 35 15.713 -6.314 -1.122 1.00 0.00 H new ATOM 505 N PRO A 36 13.425 -6.646 2.284 1.00 0.00 N ATOM 506 CA PRO A 36 13.762 -6.970 3.660 1.00 0.00 C ATOM 507 C PRO A 36 15.261 -6.799 3.913 1.00 0.00 C ATOM 508 O PRO A 36 16.025 -7.759 3.817 1.00 0.00 O ATOM 509 CB PRO A 36 13.287 -8.401 3.853 1.00 0.00 C ATOM 510 CG PRO A 36 13.126 -8.979 2.457 1.00 0.00 C ATOM 511 CD PRO A 36 13.157 -7.826 1.469 1.00 0.00 C ATOM 0 HA PRO A 36 13.284 -6.304 4.378 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.008 -8.977 4.433 1.00 0.00 H new ATOM 0 HB3 PRO A 36 12.344 -8.429 4.398 1.00 0.00 H new ATOM 0 HG2 PRO A 36 13.926 -9.687 2.242 1.00 0.00 H new ATOM 0 HG3 PRO A 36 12.187 -9.526 2.376 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.931 -7.971 0.716 1.00 0.00 H new ATOM 0 HD3 PRO A 36 12.209 -7.734 0.938 1.00 0.00 H new ATOM 519 N SER A 37 15.638 -5.569 4.230 1.00 0.00 N ATOM 520 CA SER A 37 17.033 -5.259 4.497 1.00 0.00 C ATOM 521 C SER A 37 17.271 -5.179 6.006 1.00 0.00 C ATOM 522 O SER A 37 18.138 -5.870 6.538 1.00 0.00 O ATOM 523 CB SER A 37 17.444 -3.949 3.824 1.00 0.00 C ATOM 524 OG SER A 37 18.809 -3.964 3.415 1.00 0.00 O ATOM 0 H SER A 37 15.002 -4.775 4.308 1.00 0.00 H new ATOM 0 HA SER A 37 17.647 -6.058 4.081 1.00 0.00 H new ATOM 0 HB2 SER A 37 16.808 -3.772 2.957 1.00 0.00 H new ATOM 0 HB3 SER A 37 17.281 -3.121 4.513 1.00 0.00 H new ATOM 0 HG SER A 37 19.032 -3.110 2.988 1.00 0.00 H new ATOM 530 N CYS A 38 16.488 -4.328 6.651 1.00 0.00 N ATOM 531 CA CYS A 38 16.604 -4.148 8.089 1.00 0.00 C ATOM 532 C CYS A 38 16.291 -5.485 8.767 1.00 0.00 C ATOM 533 O CYS A 38 16.993 -5.894 9.691 1.00 0.00 O ATOM 534 CB CYS A 38 15.694 -3.027 8.593 1.00 0.00 C ATOM 535 SG CYS A 38 16.630 -1.913 9.703 1.00 0.00 S ATOM 0 H CYS A 38 15.771 -3.755 6.206 1.00 0.00 H new ATOM 0 HA CYS A 38 17.620 -3.843 8.340 1.00 0.00 H new ATOM 0 HB2 CYS A 38 15.296 -2.463 7.749 1.00 0.00 H new ATOM 0 HB3 CYS A 38 14.841 -3.450 9.124 1.00 0.00 H new ATOM 0 HG CYS A 38 15.849 -0.963 10.124 1.00 0.00 H new ATOM 541 N ASN A 39 15.240 -6.126 8.281 1.00 0.00 N ATOM 542 CA ASN A 39 14.827 -7.407 8.828 1.00 0.00 C ATOM 543 C ASN A 39 15.832 -8.484 8.412 1.00 0.00 C ATOM 544 O ASN A 39 16.754 -8.213 7.645 1.00 0.00 O ATOM 545 CB ASN A 39 13.451 -7.816 8.298 1.00 0.00 C ATOM 546 CG ASN A 39 12.429 -6.697 8.506 1.00 0.00 C ATOM 547 OD1 ASN A 39 11.898 -6.499 9.587 1.00 0.00 O ATOM 548 ND2 ASN A 39 12.183 -5.977 7.415 1.00 0.00 N ATOM 0 H ASN A 39 14.661 -5.783 7.514 1.00 0.00 H new ATOM 0 HA ASN A 39 14.782 -7.310 9.913 1.00 0.00 H new ATOM 0 HB2 ASN A 39 13.522 -8.056 7.237 1.00 0.00 H new ATOM 0 HB3 ASN A 39 13.115 -8.719 8.807 1.00 0.00 H new ATOM 0 HD21 ASN A 39 11.516 -5.207 7.452 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.662 -6.195 6.541 1.00 0.00 H new ATOM 555 N ASP A 40 15.619 -9.681 8.937 1.00 0.00 N ATOM 556 CA ASP A 40 16.496 -10.799 8.630 1.00 0.00 C ATOM 557 C ASP A 40 15.703 -12.104 8.724 1.00 0.00 C ATOM 558 O ASP A 40 15.578 -12.831 7.740 1.00 0.00 O ATOM 559 CB ASP A 40 17.656 -10.878 9.624 1.00 0.00 C ATOM 560 CG ASP A 40 19.049 -10.742 9.003 1.00 0.00 C ATOM 561 OD1 ASP A 40 19.280 -9.700 8.351 1.00 0.00 O ATOM 562 OD2 ASP A 40 19.851 -11.681 9.195 1.00 0.00 O ATOM 0 H ASP A 40 14.853 -9.902 9.573 1.00 0.00 H new ATOM 0 HA ASP A 40 16.892 -10.651 7.625 1.00 0.00 H new ATOM 0 HB2 ASP A 40 17.529 -10.094 10.371 1.00 0.00 H new ATOM 0 HB3 ASP A 40 17.600 -11.831 10.150 1.00 0.00 H new ATOM 567 N ASP A 41 15.187 -12.360 9.917 1.00 0.00 N ATOM 568 CA ASP A 41 14.410 -13.565 10.152 1.00 0.00 C ATOM 569 C ASP A 41 13.245 -13.617 9.162 1.00 0.00 C ATOM 570 O ASP A 41 12.923 -14.679 8.633 1.00 0.00 O ATOM 571 CB ASP A 41 13.828 -13.578 11.567 1.00 0.00 C ATOM 572 CG ASP A 41 14.698 -14.268 12.619 1.00 0.00 C ATOM 573 OD1 ASP A 41 15.137 -15.403 12.335 1.00 0.00 O ATOM 574 OD2 ASP A 41 14.906 -13.645 13.682 1.00 0.00 O ATOM 0 H ASP A 41 15.292 -11.754 10.731 1.00 0.00 H new ATOM 0 HA ASP A 41 15.071 -14.422 10.026 1.00 0.00 H new ATOM 0 HB2 ASP A 41 13.653 -12.549 11.881 1.00 0.00 H new ATOM 0 HB3 ASP A 41 12.857 -14.073 11.539 1.00 0.00 H new ATOM 579 N ILE A 42 12.645 -12.456 8.942 1.00 0.00 N ATOM 580 CA ILE A 42 11.522 -12.356 8.025 1.00 0.00 C ATOM 581 C ILE A 42 11.978 -12.765 6.623 1.00 0.00 C ATOM 582 O ILE A 42 12.298 -11.913 5.796 1.00 0.00 O ATOM 583 CB ILE A 42 10.903 -10.959 8.086 1.00 0.00 C ATOM 584 CG1 ILE A 42 10.476 -10.612 9.514 1.00 0.00 C ATOM 585 CG2 ILE A 42 9.746 -10.828 7.094 1.00 0.00 C ATOM 586 CD1 ILE A 42 9.337 -11.521 9.982 1.00 0.00 C ATOM 0 H ILE A 42 12.915 -11.577 9.383 1.00 0.00 H new ATOM 0 HA ILE A 42 10.729 -13.044 8.317 1.00 0.00 H new ATOM 0 HB ILE A 42 11.663 -10.235 7.791 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.327 -10.714 10.187 1.00 0.00 H new ATOM 0 HG13 ILE A 42 10.157 -9.571 9.559 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.324 -9.825 7.158 1.00 0.00 H new ATOM 0 HG22 ILE A 42 10.112 -11.004 6.083 1.00 0.00 H new ATOM 0 HG23 ILE A 42 8.976 -11.562 7.334 1.00 0.00 H new ATOM 0 HD11 ILE A 42 9.053 -11.253 11.000 1.00 0.00 H new ATOM 0 HD12 ILE A 42 8.479 -11.398 9.321 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.667 -12.559 9.959 1.00 0.00 H new ATOM 598 N THR A 43 11.993 -14.071 6.397 1.00 0.00 N ATOM 599 CA THR A 43 12.403 -14.604 5.109 1.00 0.00 C ATOM 600 C THR A 43 11.254 -14.515 4.103 1.00 0.00 C ATOM 601 O THR A 43 10.189 -15.092 4.321 1.00 0.00 O ATOM 602 CB THR A 43 12.911 -16.031 5.328 1.00 0.00 C ATOM 603 OG1 THR A 43 14.275 -15.860 5.707 1.00 0.00 O ATOM 604 CG2 THR A 43 12.984 -16.832 4.026 1.00 0.00 C ATOM 0 H THR A 43 11.728 -14.776 7.085 1.00 0.00 H new ATOM 0 HA THR A 43 13.214 -14.017 4.679 1.00 0.00 H new ATOM 0 HB THR A 43 12.259 -16.544 6.034 1.00 0.00 H new ATOM 0 HG1 THR A 43 14.682 -16.737 5.870 1.00 0.00 H new ATOM 0 HG21 THR A 43 13.350 -17.837 4.237 1.00 0.00 H new ATOM 0 HG22 THR A 43 11.991 -16.894 3.581 1.00 0.00 H new ATOM 0 HG23 THR A 43 13.663 -16.337 3.332 1.00 0.00 H new ATOM 612 N VAL A 44 11.507 -13.788 3.026 1.00 0.00 N ATOM 613 CA VAL A 44 10.507 -13.617 1.986 1.00 0.00 C ATOM 614 C VAL A 44 10.807 -14.576 0.833 1.00 0.00 C ATOM 615 O VAL A 44 11.967 -14.857 0.539 1.00 0.00 O ATOM 616 CB VAL A 44 10.454 -12.152 1.547 1.00 0.00 C ATOM 617 CG1 VAL A 44 9.528 -11.974 0.343 1.00 0.00 C ATOM 618 CG2 VAL A 44 10.028 -11.248 2.706 1.00 0.00 C ATOM 0 H VAL A 44 12.391 -13.310 2.850 1.00 0.00 H new ATOM 0 HA VAL A 44 9.516 -13.865 2.365 1.00 0.00 H new ATOM 0 HB VAL A 44 11.458 -11.856 1.243 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.508 -10.924 0.051 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.894 -12.575 -0.489 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.521 -12.296 0.608 1.00 0.00 H new ATOM 0 HG21 VAL A 44 9.998 -10.212 2.368 1.00 0.00 H new ATOM 0 HG22 VAL A 44 9.039 -11.545 3.054 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.743 -11.342 3.523 1.00 0.00 H new ATOM 628 N LYS A 45 9.739 -15.053 0.209 1.00 0.00 N ATOM 629 CA LYS A 45 9.874 -15.974 -0.906 1.00 0.00 C ATOM 630 C LYS A 45 10.349 -15.208 -2.142 1.00 0.00 C ATOM 631 O LYS A 45 10.720 -14.039 -2.047 1.00 0.00 O ATOM 632 CB LYS A 45 8.570 -16.744 -1.125 1.00 0.00 C ATOM 633 CG LYS A 45 8.565 -18.052 -0.331 1.00 0.00 C ATOM 634 CD LYS A 45 8.488 -17.781 1.173 1.00 0.00 C ATOM 635 CE LYS A 45 8.670 -19.073 1.973 1.00 0.00 C ATOM 636 NZ LYS A 45 9.084 -18.769 3.361 1.00 0.00 N ATOM 0 H LYS A 45 8.777 -14.819 0.455 1.00 0.00 H new ATOM 0 HA LYS A 45 10.631 -16.727 -0.687 1.00 0.00 H new ATOM 0 HB2 LYS A 45 7.724 -16.127 -0.822 1.00 0.00 H new ATOM 0 HB3 LYS A 45 8.444 -16.958 -2.186 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.717 -18.664 -0.638 1.00 0.00 H new ATOM 0 HG3 LYS A 45 9.467 -18.621 -0.556 1.00 0.00 H new ATOM 0 HD2 LYS A 45 9.257 -17.062 1.456 1.00 0.00 H new ATOM 0 HD3 LYS A 45 7.526 -17.331 1.416 1.00 0.00 H new ATOM 0 HE2 LYS A 45 7.738 -19.637 1.981 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.420 -19.702 1.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.203 -19.656 3.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.985 -18.250 3.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.355 -18.187 3.821 1.00 0.00 H new ATOM 650 N LYS A 46 10.323 -15.897 -3.273 1.00 0.00 N ATOM 651 CA LYS A 46 10.748 -15.295 -4.526 1.00 0.00 C ATOM 652 C LYS A 46 9.519 -14.797 -5.289 1.00 0.00 C ATOM 653 O LYS A 46 9.632 -13.935 -6.159 1.00 0.00 O ATOM 654 CB LYS A 46 11.612 -16.273 -5.324 1.00 0.00 C ATOM 655 CG LYS A 46 10.749 -17.325 -6.022 1.00 0.00 C ATOM 656 CD LYS A 46 10.213 -16.799 -7.355 1.00 0.00 C ATOM 657 CE LYS A 46 10.029 -17.937 -8.360 1.00 0.00 C ATOM 658 NZ LYS A 46 11.295 -18.197 -9.084 1.00 0.00 N ATOM 0 H LYS A 46 10.014 -16.866 -3.348 1.00 0.00 H new ATOM 0 HA LYS A 46 11.381 -14.428 -4.337 1.00 0.00 H new ATOM 0 HB2 LYS A 46 12.196 -15.727 -6.065 1.00 0.00 H new ATOM 0 HB3 LYS A 46 12.322 -16.764 -4.658 1.00 0.00 H new ATOM 0 HG2 LYS A 46 11.336 -18.227 -6.193 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.917 -17.604 -5.376 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.261 -16.294 -7.194 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.902 -16.058 -7.761 1.00 0.00 H new ATOM 0 HE2 LYS A 46 9.707 -18.840 -7.841 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.243 -17.680 -9.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.154 -18.972 -9.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.586 -17.339 -9.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 12.036 -18.463 -8.404 1.00 0.00 H new ATOM 672 N ASP A 47 8.373 -15.362 -4.935 1.00 0.00 N ATOM 673 CA ASP A 47 7.125 -14.985 -5.577 1.00 0.00 C ATOM 674 C ASP A 47 6.452 -13.877 -4.764 1.00 0.00 C ATOM 675 O ASP A 47 5.603 -13.153 -5.279 1.00 0.00 O ATOM 676 CB ASP A 47 6.161 -16.173 -5.646 1.00 0.00 C ATOM 677 CG ASP A 47 6.042 -16.983 -4.354 1.00 0.00 C ATOM 678 OD1 ASP A 47 7.070 -17.573 -3.956 1.00 0.00 O ATOM 679 OD2 ASP A 47 4.925 -16.995 -3.793 1.00 0.00 O ATOM 0 H ASP A 47 8.283 -16.077 -4.213 1.00 0.00 H new ATOM 0 HA ASP A 47 7.354 -14.646 -6.587 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.172 -15.804 -5.919 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.485 -16.839 -6.446 1.00 0.00 H new ATOM 684 N GLN A 48 6.858 -13.781 -3.507 1.00 0.00 N ATOM 685 CA GLN A 48 6.306 -12.774 -2.616 1.00 0.00 C ATOM 686 C GLN A 48 7.303 -11.629 -2.427 1.00 0.00 C ATOM 687 O GLN A 48 8.487 -11.776 -2.728 1.00 0.00 O ATOM 688 CB GLN A 48 5.911 -13.387 -1.271 1.00 0.00 C ATOM 689 CG GLN A 48 4.713 -14.325 -1.427 1.00 0.00 C ATOM 690 CD GLN A 48 4.475 -15.127 -0.145 1.00 0.00 C ATOM 691 OE1 GLN A 48 4.586 -14.625 0.961 1.00 0.00 O ATOM 692 NE2 GLN A 48 4.142 -16.398 -0.357 1.00 0.00 N ATOM 0 H GLN A 48 7.563 -14.384 -3.084 1.00 0.00 H new ATOM 0 HA GLN A 48 5.402 -12.370 -3.072 1.00 0.00 H new ATOM 0 HB2 GLN A 48 6.756 -13.936 -0.856 1.00 0.00 H new ATOM 0 HB3 GLN A 48 5.667 -12.594 -0.564 1.00 0.00 H new ATOM 0 HG2 GLN A 48 3.822 -13.746 -1.669 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.886 -15.006 -2.260 1.00 0.00 H new ATOM 0 HE21 GLN A 48 4.067 -16.753 -1.310 1.00 0.00 H new ATOM 0 HE22 GLN A 48 3.962 -17.017 0.434 1.00 0.00 H new ATOM 701 N CYS A 49 6.789 -10.515 -1.927 1.00 0.00 N ATOM 702 CA CYS A 49 7.619 -9.347 -1.693 1.00 0.00 C ATOM 703 C CYS A 49 7.106 -8.635 -0.440 1.00 0.00 C ATOM 704 O CYS A 49 5.921 -8.713 -0.119 1.00 0.00 O ATOM 705 CB CYS A 49 7.643 -8.417 -2.908 1.00 0.00 C ATOM 706 SG CYS A 49 9.353 -7.847 -3.226 1.00 0.00 S ATOM 0 H CYS A 49 5.807 -10.397 -1.677 1.00 0.00 H new ATOM 0 HA CYS A 49 8.652 -9.658 -1.535 1.00 0.00 H new ATOM 0 HB2 CYS A 49 7.256 -8.939 -3.783 1.00 0.00 H new ATOM 0 HB3 CYS A 49 6.992 -7.560 -2.734 1.00 0.00 H new ATOM 0 HG CYS A 49 9.363 -7.060 -4.261 1.00 0.00 H new ATOM 712 N LEU A 50 8.022 -7.956 0.235 1.00 0.00 N ATOM 713 CA LEU A 50 7.676 -7.231 1.446 1.00 0.00 C ATOM 714 C LEU A 50 7.166 -5.838 1.073 1.00 0.00 C ATOM 715 O LEU A 50 7.874 -5.064 0.430 1.00 0.00 O ATOM 716 CB LEU A 50 8.859 -7.213 2.415 1.00 0.00 C ATOM 717 CG LEU A 50 8.584 -6.618 3.797 1.00 0.00 C ATOM 718 CD1 LEU A 50 7.584 -7.477 4.575 1.00 0.00 C ATOM 719 CD2 LEU A 50 9.886 -6.411 4.575 1.00 0.00 C ATOM 0 H LEU A 50 9.004 -7.893 -0.034 1.00 0.00 H new ATOM 0 HA LEU A 50 6.868 -7.736 1.975 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.212 -8.236 2.545 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.672 -6.651 1.955 1.00 0.00 H new ATOM 0 HG LEU A 50 8.130 -5.636 3.661 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.406 -7.032 5.554 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.645 -7.530 4.025 1.00 0.00 H new ATOM 0 HD13 LEU A 50 7.988 -8.481 4.701 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.662 -5.987 5.554 1.00 0.00 H new ATOM 0 HD22 LEU A 50 10.390 -7.369 4.702 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.534 -5.729 4.024 1.00 0.00 H new ATOM 731 N VAL A 51 5.940 -5.560 1.490 1.00 0.00 N ATOM 732 CA VAL A 51 5.326 -4.274 1.209 1.00 0.00 C ATOM 733 C VAL A 51 5.060 -3.541 2.525 1.00 0.00 C ATOM 734 O VAL A 51 5.014 -4.161 3.586 1.00 0.00 O ATOM 735 CB VAL A 51 4.063 -4.469 0.367 1.00 0.00 C ATOM 736 CG1 VAL A 51 4.306 -5.477 -0.759 1.00 0.00 C ATOM 737 CG2 VAL A 51 2.882 -4.897 1.240 1.00 0.00 C ATOM 0 H VAL A 51 5.354 -6.205 2.021 1.00 0.00 H new ATOM 0 HA VAL A 51 5.999 -3.651 0.621 1.00 0.00 H new ATOM 0 HB VAL A 51 3.813 -3.511 -0.088 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.393 -5.598 -1.343 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.105 -5.114 -1.406 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.593 -6.438 -0.332 1.00 0.00 H new ATOM 0 HG21 VAL A 51 1.998 -5.029 0.617 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.119 -5.838 1.737 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.687 -4.130 1.989 1.00 0.00 H new ATOM 747 N ARG A 52 4.890 -2.231 2.412 1.00 0.00 N ATOM 748 CA ARG A 52 4.629 -1.408 3.580 1.00 0.00 C ATOM 749 C ARG A 52 3.237 -0.781 3.488 1.00 0.00 C ATOM 750 O ARG A 52 2.992 0.074 2.639 1.00 0.00 O ATOM 751 CB ARG A 52 5.673 -0.297 3.715 1.00 0.00 C ATOM 752 CG ARG A 52 5.579 0.380 5.084 1.00 0.00 C ATOM 753 CD ARG A 52 6.834 0.110 5.916 1.00 0.00 C ATOM 754 NE ARG A 52 7.949 0.961 5.444 1.00 0.00 N ATOM 755 CZ ARG A 52 9.056 1.214 6.155 1.00 0.00 C ATOM 756 NH1 ARG A 52 9.203 0.681 7.376 1.00 0.00 N ATOM 757 NH2 ARG A 52 10.016 1.999 5.645 1.00 0.00 N ATOM 0 H ARG A 52 4.928 -1.720 1.530 1.00 0.00 H new ATOM 0 HA ARG A 52 4.684 -2.052 4.458 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.671 -0.713 3.579 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.526 0.443 2.928 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.448 1.454 4.954 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.700 0.014 5.615 1.00 0.00 H new ATOM 0 HD2 ARG A 52 6.633 0.311 6.968 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.111 -0.941 5.840 1.00 0.00 H new ATOM 0 HE ARG A 52 7.870 1.382 4.518 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.473 0.083 7.763 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.045 0.873 7.918 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.904 2.404 4.716 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.859 2.191 6.187 1.00 0.00 H new ATOM 771 N SER A 53 2.360 -1.232 4.373 1.00 0.00 N ATOM 772 CA SER A 53 0.998 -0.727 4.403 1.00 0.00 C ATOM 773 C SER A 53 1.003 0.771 4.716 1.00 0.00 C ATOM 774 O SER A 53 1.928 1.273 5.351 1.00 0.00 O ATOM 775 CB SER A 53 0.152 -1.481 5.430 1.00 0.00 C ATOM 776 OG SER A 53 -1.131 -0.887 5.605 1.00 0.00 O ATOM 0 H SER A 53 2.567 -1.942 5.075 1.00 0.00 H new ATOM 0 HA SER A 53 0.553 -0.886 3.421 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.032 -2.516 5.110 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.675 -1.501 6.386 1.00 0.00 H new ATOM 0 HG SER A 53 -1.641 -1.399 6.267 1.00 0.00 H new ATOM 782 N PHE A 54 -0.043 1.442 4.255 1.00 0.00 N ATOM 783 CA PHE A 54 -0.172 2.872 4.478 1.00 0.00 C ATOM 784 C PHE A 54 -1.333 3.176 5.426 1.00 0.00 C ATOM 785 O PHE A 54 -1.710 4.335 5.600 1.00 0.00 O ATOM 786 CB PHE A 54 -0.457 3.513 3.119 1.00 0.00 C ATOM 787 CG PHE A 54 0.794 3.758 2.272 1.00 0.00 C ATOM 788 CD1 PHE A 54 1.717 4.673 2.672 1.00 0.00 C ATOM 789 CD2 PHE A 54 0.982 3.061 1.119 1.00 0.00 C ATOM 790 CE1 PHE A 54 2.878 4.901 1.886 1.00 0.00 C ATOM 791 CE2 PHE A 54 2.143 3.288 0.333 1.00 0.00 C ATOM 792 CZ PHE A 54 3.067 4.203 0.733 1.00 0.00 C ATOM 0 H PHE A 54 -0.809 1.022 3.728 1.00 0.00 H new ATOM 0 HA PHE A 54 0.741 3.262 4.928 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.140 2.872 2.562 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.968 4.463 3.277 1.00 0.00 H new ATOM 0 HD1 PHE A 54 1.567 5.226 3.587 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.248 2.335 0.801 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.611 5.628 2.203 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.292 2.734 -0.582 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.950 4.375 0.136 1.00 0.00 H new ATOM 802 N ILE A 55 -1.869 2.118 6.014 1.00 0.00 N ATOM 803 CA ILE A 55 -2.980 2.257 6.940 1.00 0.00 C ATOM 804 C ILE A 55 -2.441 2.323 8.371 1.00 0.00 C ATOM 805 O ILE A 55 -2.588 3.340 9.046 1.00 0.00 O ATOM 806 CB ILE A 55 -4.004 1.143 6.719 1.00 0.00 C ATOM 807 CG1 ILE A 55 -4.602 1.217 5.313 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.085 1.168 7.803 1.00 0.00 C ATOM 809 CD1 ILE A 55 -5.388 -0.053 4.982 1.00 0.00 C ATOM 0 H ILE A 55 -1.554 1.159 5.867 1.00 0.00 H new ATOM 0 HA ILE A 55 -3.514 3.190 6.757 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.488 0.186 6.799 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -5.258 2.084 5.239 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.805 1.356 4.582 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -5.800 0.366 7.622 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.623 1.029 8.781 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -5.602 2.127 7.779 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -5.802 0.027 3.977 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -4.724 -0.916 5.033 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.199 -0.176 5.700 1.00 0.00 H new ATOM 821 N ASP A 56 -1.829 1.225 8.789 1.00 0.00 N ATOM 822 CA ASP A 56 -1.268 1.146 10.127 1.00 0.00 C ATOM 823 C ASP A 56 0.257 1.238 10.043 1.00 0.00 C ATOM 824 O ASP A 56 0.929 1.426 11.056 1.00 0.00 O ATOM 825 CB ASP A 56 -1.624 -0.183 10.796 1.00 0.00 C ATOM 826 CG ASP A 56 -1.207 -0.302 12.263 1.00 0.00 C ATOM 827 OD1 ASP A 56 0.002 -0.528 12.492 1.00 0.00 O ATOM 828 OD2 ASP A 56 -2.104 -0.164 13.122 1.00 0.00 O ATOM 0 H ASP A 56 -1.709 0.383 8.225 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.680 1.967 10.713 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.702 -0.329 10.728 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -1.156 -0.992 10.234 1.00 0.00 H new ATOM 833 N SER A 57 0.760 1.100 8.824 1.00 0.00 N ATOM 834 CA SER A 57 2.193 1.165 8.593 1.00 0.00 C ATOM 835 C SER A 57 2.867 -0.099 9.129 1.00 0.00 C ATOM 836 O SER A 57 3.844 -0.018 9.872 1.00 0.00 O ATOM 837 CB SER A 57 2.799 2.408 9.248 1.00 0.00 C ATOM 838 OG SER A 57 3.160 2.174 10.606 1.00 0.00 O ATOM 0 H SER A 57 0.200 0.943 7.986 1.00 0.00 H new ATOM 0 HA SER A 57 2.364 1.232 7.519 1.00 0.00 H new ATOM 0 HB2 SER A 57 3.680 2.720 8.687 1.00 0.00 H new ATOM 0 HB3 SER A 57 2.083 3.229 9.199 1.00 0.00 H new ATOM 0 HG SER A 57 2.353 2.002 11.134 1.00 0.00 H new ATOM 844 N LYS A 58 2.318 -1.238 8.731 1.00 0.00 N ATOM 845 CA LYS A 58 2.855 -2.517 9.162 1.00 0.00 C ATOM 846 C LYS A 58 3.569 -3.188 7.987 1.00 0.00 C ATOM 847 O LYS A 58 3.507 -2.700 6.859 1.00 0.00 O ATOM 848 CB LYS A 58 1.753 -3.377 9.785 1.00 0.00 C ATOM 849 CG LYS A 58 1.724 -3.214 11.306 1.00 0.00 C ATOM 850 CD LYS A 58 1.011 -4.393 11.971 1.00 0.00 C ATOM 851 CE LYS A 58 1.740 -4.828 13.243 1.00 0.00 C ATOM 852 NZ LYS A 58 1.398 -3.929 14.369 1.00 0.00 N ATOM 0 H LYS A 58 1.507 -1.301 8.115 1.00 0.00 H new ATOM 0 HA LYS A 58 3.598 -2.374 9.946 1.00 0.00 H new ATOM 0 HB2 LYS A 58 0.787 -3.095 9.367 1.00 0.00 H new ATOM 0 HB3 LYS A 58 1.917 -4.424 9.531 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.743 -3.139 11.687 1.00 0.00 H new ATOM 0 HG3 LYS A 58 1.217 -2.285 11.566 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -0.014 -4.113 12.213 1.00 0.00 H new ATOM 0 HD3 LYS A 58 0.957 -5.230 11.274 1.00 0.00 H new ATOM 0 HE2 LYS A 58 1.468 -5.853 13.493 1.00 0.00 H new ATOM 0 HE3 LYS A 58 2.817 -4.816 13.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 1.901 -4.238 15.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 1.680 -2.956 14.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.373 -3.961 14.540 1.00 0.00 H new ATOM 866 N PHE A 59 4.228 -4.296 8.291 1.00 0.00 N ATOM 867 CA PHE A 59 4.953 -5.039 7.274 1.00 0.00 C ATOM 868 C PHE A 59 4.193 -6.306 6.874 1.00 0.00 C ATOM 869 O PHE A 59 4.128 -7.263 7.644 1.00 0.00 O ATOM 870 CB PHE A 59 6.299 -5.436 7.882 1.00 0.00 C ATOM 871 CG PHE A 59 7.275 -4.270 8.045 1.00 0.00 C ATOM 872 CD1 PHE A 59 7.780 -3.647 6.947 1.00 0.00 C ATOM 873 CD2 PHE A 59 7.641 -3.857 9.288 1.00 0.00 C ATOM 874 CE1 PHE A 59 8.686 -2.564 7.098 1.00 0.00 C ATOM 875 CE2 PHE A 59 8.547 -2.775 9.440 1.00 0.00 C ATOM 876 CZ PHE A 59 9.052 -2.152 8.341 1.00 0.00 C ATOM 0 H PHE A 59 4.275 -4.698 9.227 1.00 0.00 H new ATOM 0 HA PHE A 59 5.076 -4.424 6.382 1.00 0.00 H new ATOM 0 HB2 PHE A 59 6.126 -5.891 8.857 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.760 -6.197 7.253 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.492 -3.976 5.959 1.00 0.00 H new ATOM 0 HD2 PHE A 59 7.242 -4.353 10.160 1.00 0.00 H new ATOM 0 HE1 PHE A 59 9.084 -2.068 6.225 1.00 0.00 H new ATOM 0 HE2 PHE A 59 8.835 -2.446 10.428 1.00 0.00 H new ATOM 0 HZ PHE A 59 9.743 -1.330 8.456 1.00 0.00 H new ATOM 886 N TYR A 60 3.638 -6.271 5.672 1.00 0.00 N ATOM 887 CA TYR A 60 2.886 -7.405 5.162 1.00 0.00 C ATOM 888 C TYR A 60 3.644 -8.102 4.031 1.00 0.00 C ATOM 889 O TYR A 60 4.440 -7.475 3.333 1.00 0.00 O ATOM 890 CB TYR A 60 1.581 -6.830 4.606 1.00 0.00 C ATOM 891 CG TYR A 60 0.633 -6.289 5.678 1.00 0.00 C ATOM 892 CD1 TYR A 60 -0.274 -7.134 6.285 1.00 0.00 C ATOM 893 CD2 TYR A 60 0.684 -4.959 6.037 1.00 0.00 C ATOM 894 CE1 TYR A 60 -1.167 -6.626 7.294 1.00 0.00 C ATOM 895 CE2 TYR A 60 -0.209 -4.450 7.046 1.00 0.00 C ATOM 896 CZ TYR A 60 -1.091 -5.309 7.624 1.00 0.00 C ATOM 897 OH TYR A 60 -1.934 -4.829 8.577 1.00 0.00 O ATOM 0 H TYR A 60 3.694 -5.475 5.036 1.00 0.00 H new ATOM 0 HA TYR A 60 2.718 -8.139 5.950 1.00 0.00 H new ATOM 0 HB2 TYR A 60 1.818 -6.028 3.907 1.00 0.00 H new ATOM 0 HB3 TYR A 60 1.067 -7.606 4.039 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -0.314 -8.176 6.003 1.00 0.00 H new ATOM 0 HD2 TYR A 60 1.394 -4.298 5.561 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -1.881 -7.276 7.778 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -0.179 -3.410 7.337 1.00 0.00 H new ATOM 0 HH TYR A 60 -1.766 -3.873 8.711 1.00 0.00 H new ATOM 907 N SER A 61 3.372 -9.390 3.884 1.00 0.00 N ATOM 908 CA SER A 61 4.019 -10.180 2.850 1.00 0.00 C ATOM 909 C SER A 61 2.969 -10.754 1.897 1.00 0.00 C ATOM 910 O SER A 61 2.336 -11.764 2.202 1.00 0.00 O ATOM 911 CB SER A 61 4.856 -11.306 3.460 1.00 0.00 C ATOM 912 OG SER A 61 4.358 -11.714 4.730 1.00 0.00 O ATOM 0 H SER A 61 2.712 -9.907 4.464 1.00 0.00 H new ATOM 0 HA SER A 61 4.690 -9.528 2.291 1.00 0.00 H new ATOM 0 HB2 SER A 61 4.864 -12.160 2.782 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.889 -10.974 3.565 1.00 0.00 H new ATOM 0 HG SER A 61 4.919 -12.435 5.085 1.00 0.00 H new ATOM 918 N ILE A 62 2.818 -10.088 0.762 1.00 0.00 N ATOM 919 CA ILE A 62 1.855 -10.520 -0.237 1.00 0.00 C ATOM 920 C ILE A 62 2.603 -11.036 -1.468 1.00 0.00 C ATOM 921 O ILE A 62 3.832 -11.013 -1.507 1.00 0.00 O ATOM 922 CB ILE A 62 0.863 -9.398 -0.546 1.00 0.00 C ATOM 923 CG1 ILE A 62 1.097 -8.192 0.366 1.00 0.00 C ATOM 924 CG2 ILE A 62 -0.578 -9.904 -0.467 1.00 0.00 C ATOM 925 CD1 ILE A 62 0.888 -8.566 1.835 1.00 0.00 C ATOM 0 H ILE A 62 3.346 -9.252 0.512 1.00 0.00 H new ATOM 0 HA ILE A 62 1.256 -11.347 0.144 1.00 0.00 H new ATOM 0 HB ILE A 62 1.032 -9.065 -1.570 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.110 -7.815 0.224 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.416 -7.387 0.092 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -1.263 -9.087 -0.691 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.722 -10.707 -1.190 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.777 -10.280 0.537 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.061 -7.691 2.461 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -0.133 -8.919 1.979 1.00 0.00 H new ATOM 0 HD13 ILE A 62 1.587 -9.355 2.113 1.00 0.00 H new ATOM 937 N ALA A 63 1.830 -11.488 -2.444 1.00 0.00 N ATOM 938 CA ALA A 63 2.403 -12.009 -3.674 1.00 0.00 C ATOM 939 C ALA A 63 2.313 -10.940 -4.766 1.00 0.00 C ATOM 940 O ALA A 63 1.276 -10.301 -4.930 1.00 0.00 O ATOM 941 CB ALA A 63 1.686 -13.302 -4.064 1.00 0.00 C ATOM 0 H ALA A 63 0.811 -11.504 -2.408 1.00 0.00 H new ATOM 0 HA ALA A 63 3.457 -12.250 -3.534 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.116 -13.692 -4.986 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.804 -14.038 -3.269 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.626 -13.099 -4.215 1.00 0.00 H new ATOM 947 N ARG A 64 3.416 -10.780 -5.484 1.00 0.00 N ATOM 948 CA ARG A 64 3.474 -9.800 -6.555 1.00 0.00 C ATOM 949 C ARG A 64 2.328 -10.024 -7.543 1.00 0.00 C ATOM 950 O ARG A 64 1.972 -9.123 -8.300 1.00 0.00 O ATOM 951 CB ARG A 64 4.807 -9.882 -7.303 1.00 0.00 C ATOM 952 CG ARG A 64 5.952 -9.340 -6.445 1.00 0.00 C ATOM 953 CD ARG A 64 6.130 -7.835 -6.657 1.00 0.00 C ATOM 954 NE ARG A 64 6.953 -7.588 -7.863 1.00 0.00 N ATOM 955 CZ ARG A 64 8.289 -7.680 -7.892 1.00 0.00 C ATOM 956 NH1 ARG A 64 8.962 -8.015 -6.782 1.00 0.00 N ATOM 957 NH2 ARG A 64 8.952 -7.439 -9.031 1.00 0.00 N ATOM 0 H ARG A 64 4.275 -11.312 -5.345 1.00 0.00 H new ATOM 0 HA ARG A 64 3.382 -8.811 -6.106 1.00 0.00 H new ATOM 0 HB2 ARG A 64 5.011 -10.917 -7.577 1.00 0.00 H new ATOM 0 HB3 ARG A 64 4.743 -9.314 -8.231 1.00 0.00 H new ATOM 0 HG2 ARG A 64 5.750 -9.541 -5.393 1.00 0.00 H new ATOM 0 HG3 ARG A 64 6.877 -9.858 -6.697 1.00 0.00 H new ATOM 0 HD2 ARG A 64 5.157 -7.357 -6.767 1.00 0.00 H new ATOM 0 HD3 ARG A 64 6.607 -7.390 -5.784 1.00 0.00 H new ATOM 0 HE ARG A 64 6.473 -7.332 -8.726 1.00 0.00 H new ATOM 0 HH11 ARG A 64 8.457 -8.200 -5.915 1.00 0.00 H new ATOM 0 HH12 ARG A 64 9.979 -8.085 -6.804 1.00 0.00 H new ATOM 0 HH21 ARG A 64 8.439 -7.186 -9.876 1.00 0.00 H new ATOM 0 HH22 ARG A 64 9.969 -7.509 -9.053 1.00 0.00 H new ATOM 971 N LYS A 65 1.781 -11.230 -7.502 1.00 0.00 N ATOM 972 CA LYS A 65 0.682 -11.585 -8.384 1.00 0.00 C ATOM 973 C LYS A 65 -0.604 -10.929 -7.878 1.00 0.00 C ATOM 974 O LYS A 65 -1.564 -10.774 -8.631 1.00 0.00 O ATOM 975 CB LYS A 65 0.582 -13.104 -8.532 1.00 0.00 C ATOM 976 CG LYS A 65 0.223 -13.762 -7.197 1.00 0.00 C ATOM 977 CD LYS A 65 -0.969 -14.707 -7.355 1.00 0.00 C ATOM 978 CE LYS A 65 -0.929 -15.819 -6.304 1.00 0.00 C ATOM 979 NZ LYS A 65 -1.675 -17.006 -6.777 1.00 0.00 N ATOM 0 H LYS A 65 2.079 -11.974 -6.871 1.00 0.00 H new ATOM 0 HA LYS A 65 0.861 -11.203 -9.389 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.173 -13.351 -9.278 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.530 -13.501 -8.894 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.082 -14.315 -6.817 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.012 -12.994 -6.460 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.898 -14.145 -7.260 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.961 -15.145 -8.353 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.105 -16.092 -6.094 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.360 -15.460 -5.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.638 -17.751 -6.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.666 -16.745 -6.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.246 -17.358 -7.657 1.00 0.00 H new ATOM 993 N ASP A 66 -0.582 -10.562 -6.605 1.00 0.00 N ATOM 994 CA ASP A 66 -1.734 -9.927 -5.989 1.00 0.00 C ATOM 995 C ASP A 66 -1.598 -8.408 -6.108 1.00 0.00 C ATOM 996 O ASP A 66 -2.577 -7.679 -5.951 1.00 0.00 O ATOM 997 CB ASP A 66 -1.828 -10.278 -4.503 1.00 0.00 C ATOM 998 CG ASP A 66 -1.513 -11.737 -4.163 1.00 0.00 C ATOM 999 OD1 ASP A 66 -1.790 -12.594 -5.029 1.00 0.00 O ATOM 1000 OD2 ASP A 66 -1.003 -11.961 -3.044 1.00 0.00 O ATOM 0 H ASP A 66 0.216 -10.693 -5.983 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.628 -10.283 -6.501 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -1.144 -9.635 -3.949 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -2.835 -10.048 -4.153 1.00 0.00 H new ATOM 1005 N ILE A 67 -0.376 -7.975 -6.382 1.00 0.00 N ATOM 1006 CA ILE A 67 -0.099 -6.555 -6.524 1.00 0.00 C ATOM 1007 C ILE A 67 -0.365 -6.130 -7.969 1.00 0.00 C ATOM 1008 O ILE A 67 -0.160 -6.910 -8.897 1.00 0.00 O ATOM 1009 CB ILE A 67 1.316 -6.234 -6.038 1.00 0.00 C ATOM 1010 CG1 ILE A 67 1.642 -7.001 -4.754 1.00 0.00 C ATOM 1011 CG2 ILE A 67 1.510 -4.726 -5.872 1.00 0.00 C ATOM 1012 CD1 ILE A 67 3.060 -6.685 -4.273 1.00 0.00 C ATOM 0 H ILE A 67 0.434 -8.582 -6.509 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.768 -5.971 -5.892 1.00 0.00 H new ATOM 0 HB ILE A 67 2.022 -6.566 -6.799 1.00 0.00 H new ATOM 0 HG12 ILE A 67 0.924 -6.739 -3.977 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.544 -8.072 -4.931 1.00 0.00 H new ATOM 0 HG21 ILE A 67 2.524 -4.526 -5.526 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.349 -4.231 -6.830 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.795 -4.345 -5.142 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.267 -7.242 -3.359 1.00 0.00 H new ATOM 0 HD12 ILE A 67 3.777 -6.970 -5.043 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.147 -5.617 -4.074 1.00 0.00 H new ATOM 1024 N LYS A 68 -0.817 -4.893 -8.114 1.00 0.00 N ATOM 1025 CA LYS A 68 -1.113 -4.353 -9.431 1.00 0.00 C ATOM 1026 C LYS A 68 -1.132 -2.825 -9.359 1.00 0.00 C ATOM 1027 O LYS A 68 -1.635 -2.252 -8.394 1.00 0.00 O ATOM 1028 CB LYS A 68 -2.406 -4.960 -9.980 1.00 0.00 C ATOM 1029 CG LYS A 68 -3.579 -4.701 -9.029 1.00 0.00 C ATOM 1030 CD LYS A 68 -4.444 -3.542 -9.531 1.00 0.00 C ATOM 1031 CE LYS A 68 -5.260 -3.958 -10.757 1.00 0.00 C ATOM 1032 NZ LYS A 68 -6.076 -2.824 -11.244 1.00 0.00 N ATOM 0 H LYS A 68 -0.986 -4.249 -7.341 1.00 0.00 H new ATOM 0 HA LYS A 68 -0.333 -4.628 -10.140 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -2.625 -4.534 -10.959 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -2.277 -6.033 -10.121 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.186 -5.602 -8.941 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -3.201 -4.473 -8.033 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -5.115 -3.214 -8.737 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -3.809 -2.692 -9.783 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -4.592 -4.299 -11.548 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.907 -4.797 -10.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.624 -3.123 -12.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -6.727 -2.517 -10.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -5.452 -2.034 -11.506 1.00 0.00 H new ATOM 1046 N GLU A 69 -0.576 -2.210 -10.392 1.00 0.00 N ATOM 1047 CA GLU A 69 -0.524 -0.759 -10.459 1.00 0.00 C ATOM 1048 C GLU A 69 -1.814 -0.154 -9.903 1.00 0.00 C ATOM 1049 O GLU A 69 -2.892 -0.722 -10.069 1.00 0.00 O ATOM 1050 CB GLU A 69 -0.269 -0.286 -11.891 1.00 0.00 C ATOM 1051 CG GLU A 69 1.230 -0.233 -12.193 1.00 0.00 C ATOM 1052 CD GLU A 69 1.481 -0.072 -13.694 1.00 0.00 C ATOM 1053 OE1 GLU A 69 0.923 -0.892 -14.454 1.00 0.00 O ATOM 1054 OE2 GLU A 69 2.226 0.868 -14.048 1.00 0.00 O ATOM 0 H GLU A 69 -0.158 -2.689 -11.189 1.00 0.00 H new ATOM 0 HA GLU A 69 0.308 -0.416 -9.844 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.761 -0.959 -12.593 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.708 0.701 -12.035 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.684 0.598 -11.653 1.00 0.00 H new ATOM 0 HG3 GLU A 69 1.709 -1.145 -11.836 1.00 0.00 H new ATOM 1061 N VAL A 70 -1.661 0.990 -9.251 1.00 0.00 N ATOM 1062 CA VAL A 70 -2.800 1.678 -8.669 1.00 0.00 C ATOM 1063 C VAL A 70 -2.605 3.188 -8.810 1.00 0.00 C ATOM 1064 O VAL A 70 -1.476 3.677 -8.782 1.00 0.00 O ATOM 1065 CB VAL A 70 -2.995 1.232 -7.217 1.00 0.00 C ATOM 1066 CG1 VAL A 70 -1.974 1.904 -6.297 1.00 0.00 C ATOM 1067 CG2 VAL A 70 -4.424 1.507 -6.746 1.00 0.00 C ATOM 0 H VAL A 70 -0.765 1.457 -9.113 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.716 1.418 -9.200 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.830 0.156 -7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -2.134 1.571 -5.272 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -0.966 1.635 -6.613 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.094 2.986 -6.350 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.535 1.181 -5.712 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.630 2.575 -6.814 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.126 0.961 -7.376 1.00 0.00 H new ATOM 1077 N ASP A 71 -3.722 3.885 -8.958 1.00 0.00 N ATOM 1078 CA ASP A 71 -3.688 5.331 -9.104 1.00 0.00 C ATOM 1079 C ASP A 71 -4.305 5.979 -7.862 1.00 0.00 C ATOM 1080 O ASP A 71 -5.495 6.285 -7.845 1.00 0.00 O ATOM 1081 CB ASP A 71 -4.496 5.781 -10.323 1.00 0.00 C ATOM 1082 CG ASP A 71 -4.948 4.652 -11.251 1.00 0.00 C ATOM 1083 OD1 ASP A 71 -4.088 4.171 -12.020 1.00 0.00 O ATOM 1084 OD2 ASP A 71 -6.143 4.296 -11.172 1.00 0.00 O ATOM 0 H ASP A 71 -4.656 3.476 -8.980 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.648 5.633 -9.229 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.377 6.321 -9.977 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.896 6.486 -10.898 1.00 0.00 H new ATOM 1089 N ILE A 72 -3.467 6.168 -6.854 1.00 0.00 N ATOM 1090 CA ILE A 72 -3.914 6.772 -5.612 1.00 0.00 C ATOM 1091 C ILE A 72 -4.060 8.283 -5.809 1.00 0.00 C ATOM 1092 O ILE A 72 -5.017 8.886 -5.326 1.00 0.00 O ATOM 1093 CB ILE A 72 -2.980 6.390 -4.462 1.00 0.00 C ATOM 1094 CG1 ILE A 72 -2.821 4.872 -4.367 1.00 0.00 C ATOM 1095 CG2 ILE A 72 -3.457 7.001 -3.142 1.00 0.00 C ATOM 1096 CD1 ILE A 72 -4.132 4.160 -4.710 1.00 0.00 C ATOM 0 H ILE A 72 -2.480 5.913 -6.873 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.896 6.389 -5.334 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.994 6.805 -4.670 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.035 4.542 -5.047 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.507 4.598 -3.360 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.776 6.714 -2.341 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.477 8.087 -3.230 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.459 6.637 -2.914 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.991 3.082 -4.635 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.909 4.474 -4.013 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -4.430 4.417 -5.726 1.00 0.00 H new ATOM 1108 N LEU A 73 -3.097 8.850 -6.520 1.00 0.00 N ATOM 1109 CA LEU A 73 -3.106 10.279 -6.788 1.00 0.00 C ATOM 1110 C LEU A 73 -4.210 10.597 -7.797 1.00 0.00 C ATOM 1111 O LEU A 73 -4.478 11.763 -8.082 1.00 0.00 O ATOM 1112 CB LEU A 73 -1.718 10.750 -7.226 1.00 0.00 C ATOM 1113 CG LEU A 73 -0.826 11.323 -6.122 1.00 0.00 C ATOM 1114 CD1 LEU A 73 0.376 12.061 -6.717 1.00 0.00 C ATOM 1115 CD2 LEU A 73 -1.630 12.211 -5.172 1.00 0.00 C ATOM 0 H LEU A 73 -2.305 8.346 -6.919 1.00 0.00 H new ATOM 0 HA LEU A 73 -3.334 10.836 -5.879 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.199 9.909 -7.686 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.840 11.510 -7.998 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.436 10.493 -5.533 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.994 12.459 -5.912 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.966 11.370 -7.319 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.026 12.881 -7.344 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -0.972 12.605 -4.398 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.068 13.038 -5.731 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.424 11.624 -4.710 1.00 0.00 H new ATOM 1127 N ASN A 74 -4.823 9.540 -8.309 1.00 0.00 N ATOM 1128 CA ASN A 74 -5.894 9.692 -9.281 1.00 0.00 C ATOM 1129 C ASN A 74 -7.237 9.436 -8.596 1.00 0.00 C ATOM 1130 O ASN A 74 -8.270 9.351 -9.259 1.00 0.00 O ATOM 1131 CB ASN A 74 -5.745 8.686 -10.424 1.00 0.00 C ATOM 1132 CG ASN A 74 -5.864 9.380 -11.783 1.00 0.00 C ATOM 1133 OD1 ASN A 74 -6.693 9.042 -12.612 1.00 0.00 O ATOM 1134 ND2 ASN A 74 -4.990 10.366 -11.964 1.00 0.00 N ATOM 0 H ASN A 74 -4.599 8.574 -8.069 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.846 10.704 -9.683 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -4.779 8.186 -10.350 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.510 7.915 -10.337 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -4.987 10.891 -12.839 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -4.323 10.597 -11.228 1.00 0.00 H new ATOM 1141 N LEU A 75 -7.182 9.321 -7.277 1.00 0.00 N ATOM 1142 CA LEU A 75 -8.382 9.077 -6.496 1.00 0.00 C ATOM 1143 C LEU A 75 -9.004 10.415 -6.093 1.00 0.00 C ATOM 1144 O LEU A 75 -8.312 11.431 -6.029 1.00 0.00 O ATOM 1145 CB LEU A 75 -8.073 8.160 -5.311 1.00 0.00 C ATOM 1146 CG LEU A 75 -7.879 6.679 -5.641 1.00 0.00 C ATOM 1147 CD1 LEU A 75 -7.373 5.907 -4.421 1.00 0.00 C ATOM 1148 CD2 LEU A 75 -9.164 6.072 -6.210 1.00 0.00 C ATOM 0 H LEU A 75 -6.324 9.392 -6.730 1.00 0.00 H new ATOM 0 HA LEU A 75 -9.124 8.548 -7.093 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -7.170 8.524 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -8.884 8.247 -4.588 1.00 0.00 H new ATOM 0 HG LEU A 75 -7.114 6.598 -6.413 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.244 4.857 -4.683 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.418 6.321 -4.099 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.097 5.992 -3.611 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -9.000 5.019 -6.436 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.966 6.165 -5.477 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -9.443 6.600 -7.122 1.00 0.00 H new ATOM 1160 N PRO A 76 -10.337 10.372 -5.823 1.00 0.00 N ATOM 1161 CA PRO A 76 -11.059 11.569 -5.428 1.00 0.00 C ATOM 1162 C PRO A 76 -10.744 11.946 -3.979 1.00 0.00 C ATOM 1163 O PRO A 76 -10.723 11.087 -3.101 1.00 0.00 O ATOM 1164 CB PRO A 76 -12.525 11.234 -5.648 1.00 0.00 C ATOM 1165 CG PRO A 76 -12.601 9.718 -5.715 1.00 0.00 C ATOM 1166 CD PRO A 76 -11.187 9.187 -5.889 1.00 0.00 C ATOM 0 HA PRO A 76 -10.772 12.445 -6.010 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -13.140 11.620 -4.835 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.895 11.685 -6.569 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -13.050 9.318 -4.806 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -13.232 9.404 -6.547 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.933 8.473 -5.106 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -11.072 8.670 -6.842 1.00 0.00 H new ATOM 1174 N GLU A 77 -10.505 13.234 -3.775 1.00 0.00 N ATOM 1175 CA GLU A 77 -10.191 13.735 -2.448 1.00 0.00 C ATOM 1176 C GLU A 77 -11.043 13.022 -1.396 1.00 0.00 C ATOM 1177 O GLU A 77 -10.619 12.864 -0.252 1.00 0.00 O ATOM 1178 CB GLU A 77 -10.385 15.251 -2.375 1.00 0.00 C ATOM 1179 CG GLU A 77 -9.057 15.963 -2.111 1.00 0.00 C ATOM 1180 CD GLU A 77 -9.234 17.098 -1.102 1.00 0.00 C ATOM 1181 OE1 GLU A 77 -9.179 16.794 0.110 1.00 0.00 O ATOM 1182 OE2 GLU A 77 -9.420 18.244 -1.563 1.00 0.00 O ATOM 0 H GLU A 77 -10.523 13.945 -4.506 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.142 13.525 -2.240 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -10.815 15.611 -3.310 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -11.095 15.492 -1.584 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.326 15.248 -1.734 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.662 16.361 -3.046 1.00 0.00 H new ATOM 1189 N SER A 78 -12.229 12.609 -1.820 1.00 0.00 N ATOM 1190 CA SER A 78 -13.143 11.916 -0.929 1.00 0.00 C ATOM 1191 C SER A 78 -12.463 10.678 -0.343 1.00 0.00 C ATOM 1192 O SER A 78 -12.340 10.550 0.875 1.00 0.00 O ATOM 1193 CB SER A 78 -14.429 11.521 -1.657 1.00 0.00 C ATOM 1194 OG SER A 78 -15.588 12.053 -1.021 1.00 0.00 O ATOM 0 H SER A 78 -12.578 12.741 -2.769 1.00 0.00 H new ATOM 0 HA SER A 78 -13.411 12.594 -0.119 1.00 0.00 H new ATOM 0 HB2 SER A 78 -14.386 11.875 -2.687 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.504 10.434 -1.697 1.00 0.00 H new ATOM 0 HG SER A 78 -16.388 11.780 -1.517 1.00 0.00 H new ATOM 1200 N GLU A 79 -12.041 9.795 -1.236 1.00 0.00 N ATOM 1201 CA GLU A 79 -11.378 8.569 -0.822 1.00 0.00 C ATOM 1202 C GLU A 79 -10.163 8.893 0.051 1.00 0.00 C ATOM 1203 O GLU A 79 -9.992 8.313 1.121 1.00 0.00 O ATOM 1204 CB GLU A 79 -10.973 7.729 -2.035 1.00 0.00 C ATOM 1205 CG GLU A 79 -12.206 7.208 -2.776 1.00 0.00 C ATOM 1206 CD GLU A 79 -13.235 6.639 -1.798 1.00 0.00 C ATOM 1207 OE1 GLU A 79 -12.838 5.756 -1.006 1.00 0.00 O ATOM 1208 OE2 GLU A 79 -14.396 7.097 -1.864 1.00 0.00 O ATOM 0 H GLU A 79 -12.145 9.904 -2.245 1.00 0.00 H new ATOM 0 HA GLU A 79 -12.080 7.980 -0.231 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.364 8.330 -2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.357 6.890 -1.712 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -12.656 8.016 -3.353 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -11.909 6.436 -3.486 1.00 0.00 H new ATOM 1215 N LEU A 80 -9.351 9.817 -0.440 1.00 0.00 N ATOM 1216 CA LEU A 80 -8.158 10.224 0.281 1.00 0.00 C ATOM 1217 C LEU A 80 -8.557 10.755 1.660 1.00 0.00 C ATOM 1218 O LEU A 80 -8.052 10.287 2.679 1.00 0.00 O ATOM 1219 CB LEU A 80 -7.343 11.218 -0.548 1.00 0.00 C ATOM 1220 CG LEU A 80 -7.046 10.805 -1.991 1.00 0.00 C ATOM 1221 CD1 LEU A 80 -6.317 11.920 -2.743 1.00 0.00 C ATOM 1222 CD2 LEU A 80 -6.274 9.485 -2.034 1.00 0.00 C ATOM 0 H LEU A 80 -9.496 10.296 -1.329 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.502 9.369 0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.876 12.169 -0.566 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -6.395 11.394 -0.039 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.995 10.641 -2.502 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -6.118 11.600 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.938 12.816 -2.757 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.374 12.140 -2.242 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.075 9.213 -3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.330 9.598 -1.501 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.866 8.702 -1.561 1.00 0.00 H new ATOM 1234 N SER A 81 -9.459 11.725 1.647 1.00 0.00 N ATOM 1235 CA SER A 81 -9.932 12.324 2.883 1.00 0.00 C ATOM 1236 C SER A 81 -10.395 11.233 3.850 1.00 0.00 C ATOM 1237 O SER A 81 -10.056 11.261 5.032 1.00 0.00 O ATOM 1238 CB SER A 81 -11.068 13.314 2.617 1.00 0.00 C ATOM 1239 OG SER A 81 -11.246 14.225 3.698 1.00 0.00 O ATOM 0 H SER A 81 -9.875 12.111 0.800 1.00 0.00 H new ATOM 0 HA SER A 81 -9.106 12.874 3.334 1.00 0.00 H new ATOM 0 HB2 SER A 81 -10.857 13.871 1.704 1.00 0.00 H new ATOM 0 HB3 SER A 81 -11.995 12.766 2.449 1.00 0.00 H new ATOM 0 HG SER A 81 -11.979 14.841 3.489 1.00 0.00 H new ATOM 1245 N THR A 82 -11.162 10.296 3.312 1.00 0.00 N ATOM 1246 CA THR A 82 -11.676 9.197 4.112 1.00 0.00 C ATOM 1247 C THR A 82 -10.615 8.105 4.261 1.00 0.00 C ATOM 1248 O THR A 82 -9.870 8.087 5.239 1.00 0.00 O ATOM 1249 CB THR A 82 -12.970 8.703 3.464 1.00 0.00 C ATOM 1250 OG1 THR A 82 -12.556 8.217 2.189 1.00 0.00 O ATOM 1251 CG2 THR A 82 -13.931 9.847 3.130 1.00 0.00 C ATOM 0 H THR A 82 -11.440 10.275 2.331 1.00 0.00 H new ATOM 0 HA THR A 82 -11.909 9.522 5.126 1.00 0.00 H new ATOM 0 HB THR A 82 -13.463 7.996 4.131 1.00 0.00 H new ATOM 0 HG1 THR A 82 -12.661 8.925 1.519 1.00 0.00 H new ATOM 0 HG21 THR A 82 -14.834 9.442 2.672 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.195 10.379 4.044 1.00 0.00 H new ATOM 0 HG23 THR A 82 -13.450 10.536 2.436 1.00 0.00 H new ATOM 1259 N LYS A 83 -10.581 7.220 3.275 1.00 0.00 N ATOM 1260 CA LYS A 83 -9.623 6.127 3.284 1.00 0.00 C ATOM 1261 C LYS A 83 -8.253 6.658 3.710 1.00 0.00 C ATOM 1262 O LYS A 83 -7.680 7.514 3.038 1.00 0.00 O ATOM 1263 CB LYS A 83 -9.613 5.413 1.930 1.00 0.00 C ATOM 1264 CG LYS A 83 -10.475 4.150 1.970 1.00 0.00 C ATOM 1265 CD LYS A 83 -11.960 4.494 1.847 1.00 0.00 C ATOM 1266 CE LYS A 83 -12.803 3.634 2.790 1.00 0.00 C ATOM 1267 NZ LYS A 83 -12.662 4.105 4.186 1.00 0.00 N ATOM 0 H LYS A 83 -11.201 7.238 2.465 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.913 5.372 4.015 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -9.984 6.086 1.157 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.590 5.151 1.661 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.185 3.482 1.159 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.298 3.615 2.903 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.113 5.548 2.077 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.288 4.341 0.819 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -13.850 3.675 2.490 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.491 2.592 2.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -13.352 3.614 4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -11.700 3.903 4.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -12.835 5.130 4.226 1.00 0.00 H new ATOM 1281 N PRO A 84 -7.755 6.113 4.852 1.00 0.00 N ATOM 1282 CA PRO A 84 -6.463 6.522 5.374 1.00 0.00 C ATOM 1283 C PRO A 84 -5.322 5.923 4.550 1.00 0.00 C ATOM 1284 O PRO A 84 -4.475 6.650 4.034 1.00 0.00 O ATOM 1285 CB PRO A 84 -6.459 6.056 6.821 1.00 0.00 C ATOM 1286 CG PRO A 84 -7.548 5.002 6.923 1.00 0.00 C ATOM 1287 CD PRO A 84 -8.406 5.096 5.672 1.00 0.00 C ATOM 0 HA PRO A 84 -6.308 7.599 5.315 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.489 5.642 7.095 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.655 6.887 7.499 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -7.110 4.008 7.012 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -8.154 5.164 7.815 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -8.454 4.139 5.152 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -9.430 5.379 5.915 1.00 0.00 H new ATOM 1295 N GLY A 85 -5.338 4.601 4.451 1.00 0.00 N ATOM 1296 CA GLY A 85 -4.315 3.895 3.698 1.00 0.00 C ATOM 1297 C GLY A 85 -4.032 4.596 2.368 1.00 0.00 C ATOM 1298 O GLY A 85 -2.876 4.749 1.977 1.00 0.00 O ATOM 0 H GLY A 85 -6.043 4.001 4.880 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.399 3.839 4.286 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.637 2.870 3.512 1.00 0.00 H new ATOM 1302 N LEU A 86 -5.107 5.004 1.710 1.00 0.00 N ATOM 1303 CA LEU A 86 -4.989 5.684 0.431 1.00 0.00 C ATOM 1304 C LEU A 86 -4.303 7.036 0.641 1.00 0.00 C ATOM 1305 O LEU A 86 -3.276 7.316 0.025 1.00 0.00 O ATOM 1306 CB LEU A 86 -6.355 5.786 -0.250 1.00 0.00 C ATOM 1307 CG LEU A 86 -7.119 4.472 -0.421 1.00 0.00 C ATOM 1308 CD1 LEU A 86 -8.537 4.724 -0.939 1.00 0.00 C ATOM 1309 CD2 LEU A 86 -6.347 3.500 -1.315 1.00 0.00 C ATOM 0 H LEU A 86 -6.064 4.877 2.039 1.00 0.00 H new ATOM 0 HA LEU A 86 -4.362 5.109 -0.251 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.976 6.472 0.326 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -6.216 6.233 -1.234 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.213 4.003 0.558 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.058 3.773 -1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.077 5.352 -0.230 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.488 5.227 -1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.913 2.574 -1.420 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.200 3.948 -2.298 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.378 3.284 -0.866 1.00 0.00 H new ATOM 1321 N GLN A 87 -4.900 7.838 1.509 1.00 0.00 N ATOM 1322 CA GLN A 87 -4.359 9.153 1.807 1.00 0.00 C ATOM 1323 C GLN A 87 -2.831 9.102 1.851 1.00 0.00 C ATOM 1324 O GLN A 87 -2.163 9.584 0.936 1.00 0.00 O ATOM 1325 CB GLN A 87 -4.928 9.696 3.120 1.00 0.00 C ATOM 1326 CG GLN A 87 -4.568 11.171 3.305 1.00 0.00 C ATOM 1327 CD GLN A 87 -5.826 12.022 3.496 1.00 0.00 C ATOM 1328 OE1 GLN A 87 -6.525 11.928 4.491 1.00 0.00 O ATOM 1329 NE2 GLN A 87 -6.072 12.856 2.489 1.00 0.00 N ATOM 0 H GLN A 87 -5.753 7.603 2.016 1.00 0.00 H new ATOM 0 HA GLN A 87 -4.657 9.835 1.011 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -6.012 9.579 3.127 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.539 9.115 3.957 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -3.913 11.284 4.169 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -4.013 11.525 2.436 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -5.445 12.884 1.685 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -6.888 13.468 2.521 1.00 0.00 H new ATOM 1338 N LYS A 88 -2.321 8.513 2.923 1.00 0.00 N ATOM 1339 CA LYS A 88 -0.884 8.394 3.098 1.00 0.00 C ATOM 1340 C LYS A 88 -0.241 8.013 1.762 1.00 0.00 C ATOM 1341 O LYS A 88 0.606 8.740 1.247 1.00 0.00 O ATOM 1342 CB LYS A 88 -0.561 7.420 4.234 1.00 0.00 C ATOM 1343 CG LYS A 88 -0.682 8.108 5.595 1.00 0.00 C ATOM 1344 CD LYS A 88 -1.823 7.504 6.416 1.00 0.00 C ATOM 1345 CE LYS A 88 -2.375 8.520 7.417 1.00 0.00 C ATOM 1346 NZ LYS A 88 -3.385 7.886 8.296 1.00 0.00 N ATOM 0 H LYS A 88 -2.877 8.113 3.679 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.457 9.351 3.397 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -1.239 6.568 4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 88 0.449 7.030 4.108 1.00 0.00 H new ATOM 0 HG2 LYS A 88 0.256 8.008 6.141 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.857 9.175 5.453 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -2.620 7.174 5.750 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -1.466 6.622 6.947 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -1.562 8.924 8.020 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.823 9.358 6.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -3.750 8.590 8.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.169 7.522 7.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -2.947 7.101 8.819 1.00 0.00 H new ATOM 1360 N ALA A 89 -0.671 6.874 1.239 1.00 0.00 N ATOM 1361 CA ALA A 89 -0.148 6.388 -0.027 1.00 0.00 C ATOM 1362 C ALA A 89 -0.020 7.559 -1.004 1.00 0.00 C ATOM 1363 O ALA A 89 1.027 7.744 -1.622 1.00 0.00 O ATOM 1364 CB ALA A 89 -1.056 5.278 -0.562 1.00 0.00 C ATOM 0 H ALA A 89 -1.375 6.274 1.668 1.00 0.00 H new ATOM 0 HA ALA A 89 0.846 5.960 0.107 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.664 4.913 -1.511 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -1.090 4.458 0.156 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.062 5.671 -0.712 1.00 0.00 H new ATOM 1370 N SER A 90 -1.100 8.319 -1.112 1.00 0.00 N ATOM 1371 CA SER A 90 -1.122 9.466 -2.003 1.00 0.00 C ATOM 1372 C SER A 90 -0.053 10.477 -1.581 1.00 0.00 C ATOM 1373 O SER A 90 0.719 10.953 -2.410 1.00 0.00 O ATOM 1374 CB SER A 90 -2.501 10.127 -2.017 1.00 0.00 C ATOM 1375 OG SER A 90 -3.291 9.691 -3.120 1.00 0.00 O ATOM 0 H SER A 90 -1.966 8.163 -0.597 1.00 0.00 H new ATOM 0 HA SER A 90 -0.906 9.118 -3.013 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.021 9.900 -1.086 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.384 11.210 -2.061 1.00 0.00 H new ATOM 0 HG SER A 90 -4.008 10.338 -3.285 1.00 0.00 H new ATOM 1381 N ILE A 91 -0.044 10.774 -0.289 1.00 0.00 N ATOM 1382 CA ILE A 91 0.917 11.720 0.254 1.00 0.00 C ATOM 1383 C ILE A 91 2.312 11.387 -0.280 1.00 0.00 C ATOM 1384 O ILE A 91 3.013 12.263 -0.783 1.00 0.00 O ATOM 1385 CB ILE A 91 0.834 11.750 1.781 1.00 0.00 C ATOM 1386 CG1 ILE A 91 -0.486 12.369 2.247 1.00 0.00 C ATOM 1387 CG2 ILE A 91 2.046 12.465 2.382 1.00 0.00 C ATOM 1388 CD1 ILE A 91 -0.411 12.773 3.721 1.00 0.00 C ATOM 0 H ILE A 91 -0.686 10.377 0.397 1.00 0.00 H new ATOM 0 HA ILE A 91 0.683 12.732 -0.075 1.00 0.00 H new ATOM 0 HB ILE A 91 0.853 10.722 2.144 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.717 13.243 1.638 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.298 11.656 2.102 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.962 12.472 3.469 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.958 11.942 2.092 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.083 13.490 2.014 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.361 13.210 4.027 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.204 11.893 4.329 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.386 13.504 3.858 1.00 0.00 H new ATOM 1400 N PHE A 92 2.671 10.118 -0.153 1.00 0.00 N ATOM 1401 CA PHE A 92 3.969 9.658 -0.617 1.00 0.00 C ATOM 1402 C PHE A 92 4.073 9.754 -2.140 1.00 0.00 C ATOM 1403 O PHE A 92 5.165 9.666 -2.699 1.00 0.00 O ATOM 1404 CB PHE A 92 4.100 8.192 -0.199 1.00 0.00 C ATOM 1405 CG PHE A 92 5.321 7.483 -0.790 1.00 0.00 C ATOM 1406 CD1 PHE A 92 6.556 7.706 -0.266 1.00 0.00 C ATOM 1407 CD2 PHE A 92 5.170 6.631 -1.839 1.00 0.00 C ATOM 1408 CE1 PHE A 92 7.688 7.049 -0.813 1.00 0.00 C ATOM 1409 CE2 PHE A 92 6.303 5.973 -2.387 1.00 0.00 C ATOM 1410 CZ PHE A 92 7.539 6.197 -1.862 1.00 0.00 C ATOM 0 H PHE A 92 2.086 9.394 0.264 1.00 0.00 H new ATOM 0 HA PHE A 92 4.758 10.275 -0.187 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.152 8.138 0.888 1.00 0.00 H new ATOM 0 HB3 PHE A 92 3.200 7.657 -0.502 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.675 8.383 0.567 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.189 6.455 -2.255 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.668 7.226 -0.396 1.00 0.00 H new ATOM 0 HE2 PHE A 92 6.184 5.295 -3.220 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.401 5.698 -2.279 1.00 0.00 H new ATOM 1420 N LEU A 93 2.920 9.931 -2.770 1.00 0.00 N ATOM 1421 CA LEU A 93 2.867 10.039 -4.218 1.00 0.00 C ATOM 1422 C LEU A 93 2.989 11.511 -4.620 1.00 0.00 C ATOM 1423 O LEU A 93 3.172 11.823 -5.796 1.00 0.00 O ATOM 1424 CB LEU A 93 1.610 9.356 -4.761 1.00 0.00 C ATOM 1425 CG LEU A 93 1.619 7.827 -4.745 1.00 0.00 C ATOM 1426 CD1 LEU A 93 0.703 7.262 -5.834 1.00 0.00 C ATOM 1427 CD2 LEU A 93 3.045 7.285 -4.859 1.00 0.00 C ATOM 0 H LEU A 93 2.016 10.002 -2.304 1.00 0.00 H new ATOM 0 HA LEU A 93 3.708 9.513 -4.670 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.754 9.701 -4.181 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.454 9.688 -5.787 1.00 0.00 H new ATOM 0 HG LEU A 93 1.224 7.494 -3.785 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.728 6.173 -5.801 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.317 7.607 -5.667 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.046 7.603 -6.811 1.00 0.00 H new ATOM 0 HD21 LEU A 93 3.022 6.195 -4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.491 7.627 -5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.640 7.646 -4.020 1.00 0.00 H new ATOM 1439 N LYS A 94 2.884 12.375 -3.621 1.00 0.00 N ATOM 1440 CA LYS A 94 2.981 13.805 -3.856 1.00 0.00 C ATOM 1441 C LYS A 94 4.232 14.349 -3.163 1.00 0.00 C ATOM 1442 O LYS A 94 4.949 15.176 -3.724 1.00 0.00 O ATOM 1443 CB LYS A 94 1.690 14.507 -3.433 1.00 0.00 C ATOM 1444 CG LYS A 94 0.740 13.531 -2.734 1.00 0.00 C ATOM 1445 CD LYS A 94 -0.455 14.270 -2.127 1.00 0.00 C ATOM 1446 CE LYS A 94 -1.002 15.318 -3.098 1.00 0.00 C ATOM 1447 NZ LYS A 94 -2.321 15.810 -2.640 1.00 0.00 N ATOM 0 H LYS A 94 2.733 12.112 -2.647 1.00 0.00 H new ATOM 0 HA LYS A 94 3.093 14.008 -4.921 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.924 15.335 -2.764 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.200 14.934 -4.308 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.388 12.787 -3.448 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.276 12.994 -1.951 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.240 13.556 -1.877 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.155 14.752 -1.197 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.303 16.151 -3.175 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.094 14.886 -4.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.678 16.521 -3.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.990 15.015 -2.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.223 16.241 -1.698 1.00 0.00 H new ATOM 1461 N THR A 95 4.456 13.861 -1.951 1.00 0.00 N ATOM 1462 CA THR A 95 5.609 14.287 -1.174 1.00 0.00 C ATOM 1463 C THR A 95 6.842 13.467 -1.557 1.00 0.00 C ATOM 1464 O THR A 95 7.956 13.990 -1.582 1.00 0.00 O ATOM 1465 CB THR A 95 5.245 14.182 0.308 1.00 0.00 C ATOM 1466 OG1 THR A 95 5.010 12.790 0.509 1.00 0.00 O ATOM 1467 CG2 THR A 95 3.899 14.835 0.628 1.00 0.00 C ATOM 0 H THR A 95 3.859 13.175 -1.488 1.00 0.00 H new ATOM 0 HA THR A 95 5.869 15.324 -1.387 1.00 0.00 H new ATOM 0 HB THR A 95 6.027 14.648 0.908 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.589 12.411 -0.290 1.00 0.00 H new ATOM 0 HG21 THR A 95 3.689 14.732 1.693 1.00 0.00 H new ATOM 0 HG22 THR A 95 3.936 15.892 0.366 1.00 0.00 H new ATOM 0 HG23 THR A 95 3.112 14.346 0.054 1.00 0.00 H new ATOM 1475 N ARG A 96 6.603 12.196 -1.846 1.00 0.00 N ATOM 1476 CA ARG A 96 7.681 11.299 -2.226 1.00 0.00 C ATOM 1477 C ARG A 96 8.694 11.175 -1.086 1.00 0.00 C ATOM 1478 O ARG A 96 9.896 11.076 -1.327 1.00 0.00 O ATOM 1479 CB ARG A 96 8.396 11.799 -3.483 1.00 0.00 C ATOM 1480 CG ARG A 96 7.389 12.235 -4.550 1.00 0.00 C ATOM 1481 CD ARG A 96 6.697 11.023 -5.177 1.00 0.00 C ATOM 1482 NE ARG A 96 7.564 10.425 -6.216 1.00 0.00 N ATOM 1483 CZ ARG A 96 7.180 9.444 -7.043 1.00 0.00 C ATOM 1484 NH1 ARG A 96 5.939 8.943 -6.957 1.00 0.00 N ATOM 1485 NH2 ARG A 96 8.034 8.963 -7.956 1.00 0.00 N ATOM 0 H ARG A 96 5.678 11.766 -1.825 1.00 0.00 H new ATOM 0 HA ARG A 96 7.243 10.323 -2.435 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.046 12.636 -3.227 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.034 11.010 -3.881 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.644 12.894 -4.104 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.899 12.808 -5.324 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.474 10.283 -4.408 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.745 11.324 -5.615 1.00 0.00 H new ATOM 0 HE ARG A 96 8.515 10.783 -6.308 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.288 9.309 -6.262 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.646 8.196 -7.587 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.978 9.344 -8.022 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.740 8.216 -8.585 1.00 0.00 H new ATOM 1499 N VAL A 97 8.171 11.183 0.131 1.00 0.00 N ATOM 1500 CA VAL A 97 9.016 11.072 1.308 1.00 0.00 C ATOM 1501 C VAL A 97 8.211 10.449 2.451 1.00 0.00 C ATOM 1502 O VAL A 97 7.354 11.104 3.041 1.00 0.00 O ATOM 1503 CB VAL A 97 9.599 12.440 1.665 1.00 0.00 C ATOM 1504 CG1 VAL A 97 8.490 13.431 2.028 1.00 0.00 C ATOM 1505 CG2 VAL A 97 10.620 12.323 2.798 1.00 0.00 C ATOM 0 H VAL A 97 7.173 11.265 0.328 1.00 0.00 H new ATOM 0 HA VAL A 97 9.863 10.415 1.110 1.00 0.00 H new ATOM 0 HB VAL A 97 10.117 12.823 0.785 1.00 0.00 H new ATOM 0 HG11 VAL A 97 8.932 14.396 2.278 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.816 13.549 1.180 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.932 13.055 2.885 1.00 0.00 H new ATOM 0 HG21 VAL A 97 11.019 13.310 3.032 1.00 0.00 H new ATOM 0 HG22 VAL A 97 10.136 11.908 3.682 1.00 0.00 H new ATOM 0 HG23 VAL A 97 11.434 11.667 2.488 1.00 0.00 H new ATOM 1515 N VAL A 98 8.516 9.189 2.728 1.00 0.00 N ATOM 1516 CA VAL A 98 7.831 8.470 3.789 1.00 0.00 C ATOM 1517 C VAL A 98 8.105 9.161 5.127 1.00 0.00 C ATOM 1518 O VAL A 98 9.033 9.961 5.238 1.00 0.00 O ATOM 1519 CB VAL A 98 8.251 6.998 3.780 1.00 0.00 C ATOM 1520 CG1 VAL A 98 7.372 6.184 2.829 1.00 0.00 C ATOM 1521 CG2 VAL A 98 9.731 6.854 3.420 1.00 0.00 C ATOM 0 H VAL A 98 9.228 8.648 2.236 1.00 0.00 H new ATOM 0 HA VAL A 98 6.753 8.488 3.628 1.00 0.00 H new ATOM 0 HB VAL A 98 8.111 6.602 4.786 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.691 5.142 2.841 1.00 0.00 H new ATOM 0 HG12 VAL A 98 6.332 6.249 3.149 1.00 0.00 H new ATOM 0 HG13 VAL A 98 7.466 6.580 1.818 1.00 0.00 H new ATOM 0 HG21 VAL A 98 10.005 5.799 3.420 1.00 0.00 H new ATOM 0 HG22 VAL A 98 9.907 7.274 2.430 1.00 0.00 H new ATOM 0 HG23 VAL A 98 10.337 7.386 4.153 1.00 0.00 H new ATOM 1531 N PRO A 99 7.259 8.819 6.134 1.00 0.00 N ATOM 1532 CA PRO A 99 7.399 9.398 7.460 1.00 0.00 C ATOM 1533 C PRO A 99 8.587 8.783 8.203 1.00 0.00 C ATOM 1534 O PRO A 99 8.977 7.649 7.927 1.00 0.00 O ATOM 1535 CB PRO A 99 6.070 9.136 8.148 1.00 0.00 C ATOM 1536 CG PRO A 99 5.403 8.022 7.357 1.00 0.00 C ATOM 1537 CD PRO A 99 6.147 7.876 6.039 1.00 0.00 C ATOM 0 HA PRO A 99 7.613 10.466 7.431 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.219 8.842 9.187 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.451 10.033 8.157 1.00 0.00 H new ATOM 0 HG2 PRO A 99 5.431 7.087 7.917 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.353 8.256 7.179 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.504 6.856 5.897 1.00 0.00 H new ATOM 0 HD3 PRO A 99 5.502 8.109 5.192 1.00 0.00 H new ATOM 1545 N ASP A 100 9.129 9.558 9.130 1.00 0.00 N ATOM 1546 CA ASP A 100 10.265 9.104 9.915 1.00 0.00 C ATOM 1547 C ASP A 100 10.017 7.667 10.379 1.00 0.00 C ATOM 1548 O ASP A 100 10.900 6.817 10.279 1.00 0.00 O ATOM 1549 CB ASP A 100 10.460 9.975 11.157 1.00 0.00 C ATOM 1550 CG ASP A 100 11.792 10.725 11.219 1.00 0.00 C ATOM 1551 OD1 ASP A 100 12.197 11.250 10.159 1.00 0.00 O ATOM 1552 OD2 ASP A 100 12.374 10.757 12.324 1.00 0.00 O ATOM 0 H ASP A 100 8.803 10.498 9.356 1.00 0.00 H new ATOM 0 HA ASP A 100 11.154 9.166 9.288 1.00 0.00 H new ATOM 0 HB2 ASP A 100 9.649 10.702 11.204 1.00 0.00 H new ATOM 0 HB3 ASP A 100 10.374 9.344 12.042 1.00 0.00 H new ATOM 1557 N ASN A 101 8.810 7.440 10.878 1.00 0.00 N ATOM 1558 CA ASN A 101 8.435 6.121 11.357 1.00 0.00 C ATOM 1559 C ASN A 101 8.939 5.062 10.374 1.00 0.00 C ATOM 1560 O ASN A 101 9.218 3.930 10.765 1.00 0.00 O ATOM 1561 CB ASN A 101 6.914 5.984 11.459 1.00 0.00 C ATOM 1562 CG ASN A 101 6.428 6.314 12.872 1.00 0.00 C ATOM 1563 OD1 ASN A 101 7.190 6.689 13.747 1.00 0.00 O ATOM 1564 ND2 ASN A 101 5.119 6.154 13.045 1.00 0.00 N ATOM 0 H ASN A 101 8.080 8.147 10.961 1.00 0.00 H new ATOM 0 HA ASN A 101 8.878 5.983 12.344 1.00 0.00 H new ATOM 0 HB2 ASN A 101 6.436 6.651 10.741 1.00 0.00 H new ATOM 0 HB3 ASN A 101 6.618 4.968 11.197 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.697 6.349 13.953 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.537 5.837 12.270 1.00 0.00 H new ATOM 1571 N TRP A 102 9.042 5.469 9.117 1.00 0.00 N ATOM 1572 CA TRP A 102 9.508 4.570 8.075 1.00 0.00 C ATOM 1573 C TRP A 102 11.022 4.742 7.945 1.00 0.00 C ATOM 1574 O TRP A 102 11.778 3.792 8.148 1.00 0.00 O ATOM 1575 CB TRP A 102 8.763 4.820 6.761 1.00 0.00 C ATOM 1576 CG TRP A 102 7.252 4.599 6.852 1.00 0.00 C ATOM 1577 CD1 TRP A 102 6.455 4.768 7.916 1.00 0.00 C ATOM 1578 CD2 TRP A 102 6.383 4.157 5.787 1.00 0.00 C ATOM 1579 NE1 TRP A 102 5.142 4.470 7.616 1.00 0.00 N ATOM 1580 CE2 TRP A 102 5.096 4.087 6.280 1.00 0.00 C ATOM 1581 CE3 TRP A 102 6.675 3.829 4.452 1.00 0.00 C ATOM 1582 CZ2 TRP A 102 3.999 3.690 5.506 1.00 0.00 C ATOM 1583 CZ3 TRP A 102 5.567 3.435 3.690 1.00 0.00 C ATOM 1584 CH2 TRP A 102 4.265 3.358 4.173 1.00 0.00 C ATOM 0 H TRP A 102 8.811 6.409 8.797 1.00 0.00 H new ATOM 0 HA TRP A 102 9.296 3.533 8.337 1.00 0.00 H new ATOM 0 HB2 TRP A 102 8.951 5.844 6.437 1.00 0.00 H new ATOM 0 HB3 TRP A 102 9.171 4.163 5.993 1.00 0.00 H new ATOM 0 HD1 TRP A 102 6.798 5.096 8.886 1.00 0.00 H new ATOM 0 HE1 TRP A 102 4.350 4.521 8.257 1.00 0.00 H new ATOM 0 HE3 TRP A 102 7.674 3.877 4.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 3.001 3.643 5.916 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 5.736 3.173 2.656 1.00 0.00 H new ATOM 0 HH2 TRP A 102 3.463 3.043 3.522 1.00 0.00 H new ATOM 1595 N LYS A 103 11.422 5.960 7.609 1.00 0.00 N ATOM 1596 CA LYS A 103 12.833 6.268 7.450 1.00 0.00 C ATOM 1597 C LYS A 103 13.431 5.358 6.375 1.00 0.00 C ATOM 1598 O LYS A 103 14.213 4.459 6.683 1.00 0.00 O ATOM 1599 CB LYS A 103 13.554 6.186 8.797 1.00 0.00 C ATOM 1600 CG LYS A 103 14.962 6.776 8.701 1.00 0.00 C ATOM 1601 CD LYS A 103 16.006 5.792 9.236 1.00 0.00 C ATOM 1602 CE LYS A 103 17.424 6.293 8.956 1.00 0.00 C ATOM 1603 NZ LYS A 103 18.423 5.382 9.559 1.00 0.00 N ATOM 0 H LYS A 103 10.793 6.745 7.442 1.00 0.00 H new ATOM 0 HA LYS A 103 12.963 7.294 7.107 1.00 0.00 H new ATOM 0 HB2 LYS A 103 12.982 6.723 9.553 1.00 0.00 H new ATOM 0 HB3 LYS A 103 13.612 5.147 9.120 1.00 0.00 H new ATOM 0 HG2 LYS A 103 15.187 7.022 7.663 1.00 0.00 H new ATOM 0 HG3 LYS A 103 15.010 7.706 9.267 1.00 0.00 H new ATOM 0 HD2 LYS A 103 15.869 5.658 10.309 1.00 0.00 H new ATOM 0 HD3 LYS A 103 15.863 4.816 8.772 1.00 0.00 H new ATOM 0 HE2 LYS A 103 17.587 6.360 7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 103 17.548 7.298 9.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 19.380 5.736 9.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 18.277 5.339 10.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 18.315 4.430 9.153 1.00 0.00 H new ATOM 1617 N MET A 104 13.041 5.622 5.137 1.00 0.00 N ATOM 1618 CA MET A 104 13.529 4.837 4.015 1.00 0.00 C ATOM 1619 C MET A 104 14.875 5.369 3.519 1.00 0.00 C ATOM 1620 O MET A 104 15.261 6.491 3.844 1.00 0.00 O ATOM 1621 CB MET A 104 12.509 4.887 2.876 1.00 0.00 C ATOM 1622 CG MET A 104 11.412 3.838 3.075 1.00 0.00 C ATOM 1623 SD MET A 104 11.807 2.360 2.157 1.00 0.00 S ATOM 1624 CE MET A 104 11.465 1.123 3.398 1.00 0.00 C ATOM 0 H MET A 104 12.393 6.368 4.886 1.00 0.00 H new ATOM 0 HA MET A 104 13.666 3.808 4.347 1.00 0.00 H new ATOM 0 HB2 MET A 104 12.063 5.880 2.826 1.00 0.00 H new ATOM 0 HB3 MET A 104 13.012 4.716 1.925 1.00 0.00 H new ATOM 0 HG2 MET A 104 11.311 3.602 4.134 1.00 0.00 H new ATOM 0 HG3 MET A 104 10.453 4.236 2.744 1.00 0.00 H new ATOM 0 HE1 MET A 104 11.919 0.177 3.103 1.00 0.00 H new ATOM 0 HE2 MET A 104 11.880 1.442 4.354 1.00 0.00 H new ATOM 0 HE3 MET A 104 10.387 0.993 3.495 1.00 0.00 H new ATOM 1634 N ASP A 105 15.552 4.538 2.741 1.00 0.00 N ATOM 1635 CA ASP A 105 16.848 4.910 2.197 1.00 0.00 C ATOM 1636 C ASP A 105 17.418 3.735 1.400 1.00 0.00 C ATOM 1637 O ASP A 105 18.552 3.319 1.629 1.00 0.00 O ATOM 1638 CB ASP A 105 17.837 5.250 3.314 1.00 0.00 C ATOM 1639 CG ASP A 105 18.210 4.080 4.225 1.00 0.00 C ATOM 1640 OD1 ASP A 105 17.390 3.771 5.117 1.00 0.00 O ATOM 1641 OD2 ASP A 105 19.306 3.518 4.009 1.00 0.00 O ATOM 0 H ASP A 105 15.228 3.608 2.474 1.00 0.00 H new ATOM 0 HA ASP A 105 16.709 5.784 1.561 1.00 0.00 H new ATOM 0 HB2 ASP A 105 18.748 5.646 2.864 1.00 0.00 H new ATOM 0 HB3 ASP A 105 17.412 6.046 3.925 1.00 0.00 H new ATOM 1646 N ILE A 106 16.606 3.235 0.480 1.00 0.00 N ATOM 1647 CA ILE A 106 17.015 2.117 -0.352 1.00 0.00 C ATOM 1648 C ILE A 106 17.210 2.601 -1.789 1.00 0.00 C ATOM 1649 O ILE A 106 17.945 1.986 -2.561 1.00 0.00 O ATOM 1650 CB ILE A 106 16.023 0.960 -0.221 1.00 0.00 C ATOM 1651 CG1 ILE A 106 16.173 -0.025 -1.381 1.00 0.00 C ATOM 1652 CG2 ILE A 106 14.590 1.480 -0.091 1.00 0.00 C ATOM 1653 CD1 ILE A 106 15.932 -1.462 -0.916 1.00 0.00 C ATOM 0 H ILE A 106 15.666 3.584 0.293 1.00 0.00 H new ATOM 0 HA ILE A 106 17.974 1.723 -0.016 1.00 0.00 H new ATOM 0 HB ILE A 106 16.252 0.415 0.695 1.00 0.00 H new ATOM 0 HG12 ILE A 106 15.466 0.228 -2.171 1.00 0.00 H new ATOM 0 HG13 ILE A 106 17.172 0.060 -1.808 1.00 0.00 H new ATOM 0 HG21 ILE A 106 13.904 0.638 0.001 1.00 0.00 H new ATOM 0 HG22 ILE A 106 14.511 2.111 0.795 1.00 0.00 H new ATOM 0 HG23 ILE A 106 14.333 2.063 -0.976 1.00 0.00 H new ATOM 0 HD11 ILE A 106 16.045 -2.142 -1.761 1.00 0.00 H new ATOM 0 HD12 ILE A 106 16.656 -1.721 -0.143 1.00 0.00 H new ATOM 0 HD13 ILE A 106 14.923 -1.549 -0.512 1.00 0.00 H new ATOM 1665 N SER A 107 16.539 3.699 -2.106 1.00 0.00 N ATOM 1666 CA SER A 107 16.630 4.272 -3.438 1.00 0.00 C ATOM 1667 C SER A 107 18.078 4.662 -3.742 1.00 0.00 C ATOM 1668 O SER A 107 18.553 4.473 -4.861 1.00 0.00 O ATOM 1669 CB SER A 107 15.712 5.488 -3.577 1.00 0.00 C ATOM 1670 OG SER A 107 15.311 5.703 -4.928 1.00 0.00 O ATOM 0 H SER A 107 15.931 4.206 -1.464 1.00 0.00 H new ATOM 0 HA SER A 107 16.305 3.520 -4.157 1.00 0.00 H new ATOM 0 HB2 SER A 107 14.828 5.348 -2.954 1.00 0.00 H new ATOM 0 HB3 SER A 107 16.226 6.375 -3.206 1.00 0.00 H new ATOM 0 HG SER A 107 14.725 6.487 -4.974 1.00 0.00 H new ATOM 1676 N GLU A 108 18.738 5.200 -2.727 1.00 0.00 N ATOM 1677 CA GLU A 108 20.122 5.618 -2.873 1.00 0.00 C ATOM 1678 C GLU A 108 21.053 4.406 -2.804 1.00 0.00 C ATOM 1679 O GLU A 108 22.228 4.499 -3.156 1.00 0.00 O ATOM 1680 CB GLU A 108 20.494 6.657 -1.814 1.00 0.00 C ATOM 1681 CG GLU A 108 20.385 6.070 -0.406 1.00 0.00 C ATOM 1682 CD GLU A 108 21.002 7.010 0.631 1.00 0.00 C ATOM 1683 OE1 GLU A 108 22.225 7.245 0.527 1.00 0.00 O ATOM 1684 OE2 GLU A 108 20.236 7.472 1.504 1.00 0.00 O ATOM 0 H GLU A 108 18.340 5.356 -1.801 1.00 0.00 H new ATOM 0 HA GLU A 108 20.239 6.085 -3.851 1.00 0.00 H new ATOM 0 HB2 GLU A 108 21.511 7.009 -1.987 1.00 0.00 H new ATOM 0 HB3 GLU A 108 19.837 7.523 -1.903 1.00 0.00 H new ATOM 0 HG2 GLU A 108 19.337 5.892 -0.163 1.00 0.00 H new ATOM 0 HG3 GLU A 108 20.889 5.104 -0.371 1.00 0.00 H new ATOM 1691 N ILE A 109 20.493 3.295 -2.347 1.00 0.00 N ATOM 1692 CA ILE A 109 21.259 2.067 -2.225 1.00 0.00 C ATOM 1693 C ILE A 109 21.374 1.406 -3.600 1.00 0.00 C ATOM 1694 O ILE A 109 22.183 0.498 -3.792 1.00 0.00 O ATOM 1695 CB ILE A 109 20.648 1.158 -1.156 1.00 0.00 C ATOM 1696 CG1 ILE A 109 20.902 1.714 0.246 1.00 0.00 C ATOM 1697 CG2 ILE A 109 21.155 -0.279 -1.303 1.00 0.00 C ATOM 1698 CD1 ILE A 109 20.377 0.758 1.319 1.00 0.00 C ATOM 0 H ILE A 109 19.518 3.220 -2.057 1.00 0.00 H new ATOM 0 HA ILE A 109 22.273 2.282 -1.887 1.00 0.00 H new ATOM 0 HB ILE A 109 19.568 1.135 -1.303 1.00 0.00 H new ATOM 0 HG12 ILE A 109 21.970 1.875 0.389 1.00 0.00 H new ATOM 0 HG13 ILE A 109 20.417 2.684 0.350 1.00 0.00 H new ATOM 0 HG21 ILE A 109 20.706 -0.904 -0.531 1.00 0.00 H new ATOM 0 HG22 ILE A 109 20.881 -0.663 -2.286 1.00 0.00 H new ATOM 0 HG23 ILE A 109 22.240 -0.295 -1.197 1.00 0.00 H new ATOM 0 HD11 ILE A 109 20.570 1.178 2.306 1.00 0.00 H new ATOM 0 HD12 ILE A 109 19.304 0.618 1.188 1.00 0.00 H new ATOM 0 HD13 ILE A 109 20.882 -0.204 1.228 1.00 0.00 H new ATOM 1710 N LEU A 110 20.555 1.887 -4.524 1.00 0.00 N ATOM 1711 CA LEU A 110 20.556 1.354 -5.876 1.00 0.00 C ATOM 1712 C LEU A 110 21.121 2.406 -6.834 1.00 0.00 C ATOM 1713 O LEU A 110 22.181 2.206 -7.426 1.00 0.00 O ATOM 1714 CB LEU A 110 19.158 0.862 -6.258 1.00 0.00 C ATOM 1715 CG LEU A 110 18.672 -0.399 -5.543 1.00 0.00 C ATOM 1716 CD1 LEU A 110 17.182 -0.300 -5.208 1.00 0.00 C ATOM 1717 CD2 LEU A 110 18.994 -1.652 -6.359 1.00 0.00 C ATOM 0 H LEU A 110 19.886 2.640 -4.363 1.00 0.00 H new ATOM 0 HA LEU A 110 21.206 0.481 -5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 110 18.446 1.664 -6.062 1.00 0.00 H new ATOM 0 HB3 LEU A 110 19.141 0.676 -7.332 1.00 0.00 H new ATOM 0 HG LEU A 110 19.210 -0.484 -4.599 1.00 0.00 H new ATOM 0 HD11 LEU A 110 16.862 -1.210 -4.700 1.00 0.00 H new ATOM 0 HD12 LEU A 110 17.012 0.558 -4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 110 16.610 -0.177 -6.128 1.00 0.00 H new ATOM 0 HD21 LEU A 110 18.637 -2.534 -5.827 1.00 0.00 H new ATOM 0 HD22 LEU A 110 18.502 -1.590 -7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 110 20.072 -1.726 -6.502 1.00 0.00 H new ATOM 1729 N GLU A 111 20.389 3.503 -6.955 1.00 0.00 N ATOM 1730 CA GLU A 111 20.805 4.586 -7.830 1.00 0.00 C ATOM 1731 C GLU A 111 20.636 4.179 -9.296 1.00 0.00 C ATOM 1732 O GLU A 111 19.802 4.738 -10.006 1.00 0.00 O ATOM 1733 CB GLU A 111 22.247 5.003 -7.540 1.00 0.00 C ATOM 1734 CG GLU A 111 22.302 6.414 -6.951 1.00 0.00 C ATOM 1735 CD GLU A 111 23.525 7.177 -7.467 1.00 0.00 C ATOM 1736 OE1 GLU A 111 23.619 7.329 -8.704 1.00 0.00 O ATOM 1737 OE2 GLU A 111 24.338 7.589 -6.612 1.00 0.00 O ATOM 0 H GLU A 111 19.511 3.666 -6.462 1.00 0.00 H new ATOM 0 HA GLU A 111 20.167 5.448 -7.636 1.00 0.00 H new ATOM 0 HB2 GLU A 111 22.701 4.297 -6.845 1.00 0.00 H new ATOM 0 HB3 GLU A 111 22.832 4.966 -8.459 1.00 0.00 H new ATOM 0 HG2 GLU A 111 21.394 6.957 -7.212 1.00 0.00 H new ATOM 0 HG3 GLU A 111 22.337 6.357 -5.863 1.00 0.00 H new ATOM 1744 N SER A 112 21.440 3.208 -9.703 1.00 0.00 N ATOM 1745 CA SER A 112 21.390 2.720 -11.070 1.00 0.00 C ATOM 1746 C SER A 112 22.282 1.486 -11.219 1.00 0.00 C ATOM 1747 O SER A 112 23.372 1.569 -11.783 1.00 0.00 O ATOM 1748 CB SER A 112 21.818 3.806 -12.059 1.00 0.00 C ATOM 1749 OG SER A 112 21.441 3.490 -13.397 1.00 0.00 O ATOM 0 H SER A 112 22.130 2.746 -9.110 1.00 0.00 H new ATOM 0 HA SER A 112 20.360 2.445 -11.297 1.00 0.00 H new ATOM 0 HB2 SER A 112 21.368 4.756 -11.771 1.00 0.00 H new ATOM 0 HB3 SER A 112 22.899 3.937 -12.008 1.00 0.00 H new ATOM 0 HG SER A 112 21.731 4.209 -13.997 1.00 0.00 H new ATOM 1755 N GLY A 113 21.786 0.372 -10.701 1.00 0.00 N ATOM 1756 CA GLY A 113 22.527 -0.878 -10.770 1.00 0.00 C ATOM 1757 C GLY A 113 21.887 -1.941 -9.874 1.00 0.00 C ATOM 1758 O GLY A 113 21.166 -1.615 -8.933 1.00 0.00 O ATOM 0 H GLY A 113 20.882 0.308 -10.233 1.00 0.00 H new ATOM 0 HA2 GLY A 113 22.554 -1.233 -11.800 1.00 0.00 H new ATOM 0 HA3 GLY A 113 23.559 -0.711 -10.463 1.00 0.00 H new ATOM 1762 N PRO A 114 22.185 -3.226 -10.207 1.00 0.00 N ATOM 1763 CA PRO A 114 21.648 -4.340 -9.443 1.00 0.00 C ATOM 1764 C PRO A 114 22.370 -4.484 -8.102 1.00 0.00 C ATOM 1765 O PRO A 114 23.368 -3.809 -7.855 1.00 0.00 O ATOM 1766 CB PRO A 114 21.820 -5.553 -10.344 1.00 0.00 C ATOM 1767 CG PRO A 114 22.862 -5.160 -11.378 1.00 0.00 C ATOM 1768 CD PRO A 114 23.036 -3.650 -11.313 1.00 0.00 C ATOM 0 HA PRO A 114 20.600 -4.202 -9.178 1.00 0.00 H new ATOM 0 HB2 PRO A 114 22.146 -6.421 -9.772 1.00 0.00 H new ATOM 0 HB3 PRO A 114 20.878 -5.821 -10.822 1.00 0.00 H new ATOM 0 HG2 PRO A 114 23.808 -5.662 -11.177 1.00 0.00 H new ATOM 0 HG3 PRO A 114 22.545 -5.465 -12.375 1.00 0.00 H new ATOM 0 HD2 PRO A 114 24.077 -3.379 -11.138 1.00 0.00 H new ATOM 0 HD3 PRO A 114 22.736 -3.176 -12.248 1.00 0.00 H new ATOM 1776 N SER A 115 21.837 -5.369 -7.272 1.00 0.00 N ATOM 1777 CA SER A 115 22.418 -5.609 -5.962 1.00 0.00 C ATOM 1778 C SER A 115 22.637 -7.109 -5.755 1.00 0.00 C ATOM 1779 O SER A 115 21.759 -7.804 -5.244 1.00 0.00 O ATOM 1780 CB SER A 115 21.528 -5.045 -4.853 1.00 0.00 C ATOM 1781 OG SER A 115 22.233 -4.906 -3.622 1.00 0.00 O ATOM 0 H SER A 115 21.010 -5.928 -7.481 1.00 0.00 H new ATOM 0 HA SER A 115 23.379 -5.097 -5.915 1.00 0.00 H new ATOM 0 HB2 SER A 115 21.138 -4.074 -5.159 1.00 0.00 H new ATOM 0 HB3 SER A 115 20.670 -5.701 -4.707 1.00 0.00 H new ATOM 0 HG SER A 115 21.631 -4.542 -2.940 1.00 0.00 H new ATOM 1787 N SER A 116 23.813 -7.565 -6.161 1.00 0.00 N ATOM 1788 CA SER A 116 24.159 -8.970 -6.027 1.00 0.00 C ATOM 1789 C SER A 116 23.212 -9.825 -6.872 1.00 0.00 C ATOM 1790 O SER A 116 22.152 -10.235 -6.402 1.00 0.00 O ATOM 1791 CB SER A 116 24.108 -9.412 -4.563 1.00 0.00 C ATOM 1792 OG SER A 116 25.004 -8.662 -3.747 1.00 0.00 O ATOM 0 H SER A 116 24.539 -6.986 -6.583 1.00 0.00 H new ATOM 0 HA SER A 116 25.179 -9.107 -6.385 1.00 0.00 H new ATOM 0 HB2 SER A 116 23.092 -9.298 -4.185 1.00 0.00 H new ATOM 0 HB3 SER A 116 24.356 -10.471 -4.495 1.00 0.00 H new ATOM 0 HG SER A 116 24.940 -8.973 -2.820 1.00 0.00 H new ATOM 1798 N GLY A 117 23.629 -10.068 -8.106 1.00 0.00 N ATOM 1799 CA GLY A 117 22.832 -10.867 -9.021 1.00 0.00 C ATOM 1800 C GLY A 117 23.690 -11.931 -9.709 1.00 0.00 C ATOM 1801 O GLY A 117 24.065 -12.926 -9.091 1.00 0.00 O ATOM 0 H GLY A 117 24.508 -9.726 -8.493 1.00 0.00 H new ATOM 0 HA2 GLY A 117 22.018 -11.347 -8.477 1.00 0.00 H new ATOM 0 HA3 GLY A 117 22.376 -10.221 -9.771 1.00 0.00 H new TER 1805 GLY A 117