USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1081 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 77 HIS : no HE2:sc= -1.56! K(o=-0.66!,f=-1.9) USER MOD Set 1.2: B 155 THR OG1 : rot -83:sc= 0.905 USER MOD Set 1.3: B 159 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 79 GLN : amide:sc= 0.887 K(o=2.1,f=-6!) USER MOD Set 2.2: A 82 LYS NZ :NH3+ 131:sc= 1.21 (180deg=0) USER MOD Set 3.1: A 23 SER OG : rot 180:sc= 0.243 USER MOD Set 3.2: A 24 SER OG : rot 180:sc= 0.0742 USER MOD Single : A 1 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0492) USER MOD Single : A 5 THR OG1 : rot -50:sc= 0.286 USER MOD Single : A 7 ASN :FLIP amide:sc=-0.00262 F(o=-1.2,f=-0.0026) USER MOD Single : A 9 SER OG : rot -25:sc= 0.0366 USER MOD Single : A -1 MET CE :methyl -157:sc= -0.622 (180deg=-1.09) USER MOD Single : A -3 GLY N :NH3+ -133:sc= 0.0637 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0431) USER MOD Single : A 17 HIS : no HE2:sc= 1.08 K(o=1.1,f=-3.4!) USER MOD Single : A 18 THR OG1 : rot -150:sc= -0.193 USER MOD Single : A 19 LYS NZ :NH3+ 162:sc= -0.0428 (180deg=-0.314) USER MOD Single : A 22 LYS NZ :NH3+ -165:sc= -5.6! (180deg=-5.71!) USER MOD Single : A 30 THR OG1 : rot 99:sc= -1.86! USER MOD Single : A 42 GLN : amide:sc= -1.84! C(o=-1.8!,f=-2.8!) USER MOD Single : A 44 LYS NZ :NH3+ -177:sc= 1.19 (180deg=0.947) USER MOD Single : A 45 SER OG : rot -11:sc= 1.04 USER MOD Single : A 57 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0587) USER MOD Single : A 58 MET CE :methyl -165:sc= -0.725 (180deg=-1.27) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0.223 USER MOD Single : A 66 SER OG : rot -4:sc= 0.212 USER MOD Single : A 68 ASN : amide:sc= -1.31 K(o=-1.3,f=-9.9!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 CYS SG : rot -50:sc= -0.75 USER MOD Single : A 75 HIS : no HE2:sc= -2.17 K(o=-2.2,f=-5.4!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -0.765 K(o=-0.77,f=-1.4) USER MOD Single : A 86 SER OG : rot -39:sc= 0.244 USER MOD Single : A 92 SER OG : rot 160:sc= -1.97! USER MOD Single : A 98 CYS SG : rot -34:sc= -0.416 USER MOD Single : A 101 TYR OH : rot -75:sc= 0.0325 USER MOD Single : A 111 ASN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.00162 USER MOD Single : A 113 SER OG : rot -80:sc= 1.44 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 152 SER OG : rot 180:sc= 0 USER MOD Single : B 153 SER OG : rot 180:sc= 0 USER MOD Single : B 160 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 112.201 10.460 -21.326 1.00 0.00 N ATOM 2 CA GLY A -3 112.839 11.746 -21.556 1.00 0.00 C ATOM 3 C GLY A -3 114.216 11.779 -20.984 1.00 0.00 C ATOM 4 O GLY A -3 114.865 10.733 -20.846 1.00 0.00 O ATOM 0 H1 GLY A -3 111.764 10.126 -22.209 1.00 0.00 H new ATOM 0 H2 GLY A -3 112.913 9.771 -21.010 1.00 0.00 H new ATOM 0 H3 GLY A -3 111.469 10.562 -20.595 1.00 0.00 H new ATOM 0 HA2 GLY A -3 112.883 11.946 -22.627 1.00 0.00 H new ATOM 0 HA3 GLY A -3 112.238 12.538 -21.108 1.00 0.00 H new ATOM 10 N ALA A -2 114.660 12.957 -20.615 1.00 0.00 N ATOM 11 CA ALA A -2 115.975 13.163 -20.049 1.00 0.00 C ATOM 12 C ALA A -2 115.979 12.842 -18.559 1.00 0.00 C ATOM 13 O ALA A -2 116.307 13.676 -17.725 1.00 0.00 O ATOM 14 CB ALA A -2 116.426 14.598 -20.293 1.00 0.00 C ATOM 0 H ALA A -2 114.111 13.813 -20.700 1.00 0.00 H new ATOM 0 HA ALA A -2 116.676 12.487 -20.538 1.00 0.00 H new ATOM 0 HB1 ALA A -2 117.417 14.746 -19.864 1.00 0.00 H new ATOM 0 HB2 ALA A -2 116.462 14.791 -21.365 1.00 0.00 H new ATOM 0 HB3 ALA A -2 115.722 15.285 -19.825 1.00 0.00 H new ATOM 20 N MET A -1 115.612 11.630 -18.234 1.00 0.00 N ATOM 21 CA MET A -1 115.565 11.198 -16.862 1.00 0.00 C ATOM 22 C MET A -1 116.529 10.078 -16.608 1.00 0.00 C ATOM 23 O MET A -1 116.186 9.051 -16.036 1.00 0.00 O ATOM 24 CB MET A -1 114.146 10.835 -16.408 1.00 0.00 C ATOM 25 CG MET A -1 113.261 12.043 -16.152 1.00 0.00 C ATOM 26 SD MET A -1 113.945 13.139 -14.882 1.00 0.00 S ATOM 27 CE MET A -1 113.995 12.040 -13.459 1.00 0.00 C ATOM 0 H MET A -1 115.338 10.917 -18.910 1.00 0.00 H new ATOM 0 HA MET A -1 115.876 12.048 -16.255 1.00 0.00 H new ATOM 0 HB2 MET A -1 113.680 10.208 -17.168 1.00 0.00 H new ATOM 0 HB3 MET A -1 114.206 10.240 -15.497 1.00 0.00 H new ATOM 0 HG2 MET A -1 113.134 12.601 -17.080 1.00 0.00 H new ATOM 0 HG3 MET A -1 112.271 11.707 -15.844 1.00 0.00 H new ATOM 0 HE1 MET A -1 113.993 12.631 -12.543 1.00 0.00 H new ATOM 0 HE2 MET A -1 113.122 11.387 -13.472 1.00 0.00 H new ATOM 0 HE3 MET A -1 114.901 11.435 -13.498 1.00 0.00 H new ATOM 37 N GLY A 0 117.755 10.283 -17.024 1.00 0.00 N ATOM 38 CA GLY A 0 118.803 9.315 -16.775 1.00 0.00 C ATOM 39 C GLY A 0 119.480 9.588 -15.447 1.00 0.00 C ATOM 40 O GLY A 0 120.647 9.274 -15.249 1.00 0.00 O ATOM 0 H GLY A 0 118.055 11.112 -17.538 1.00 0.00 H new ATOM 0 HA2 GLY A 0 118.383 8.309 -16.775 1.00 0.00 H new ATOM 0 HA3 GLY A 0 119.539 9.353 -17.578 1.00 0.00 H new ATOM 44 N LYS A 1 118.733 10.193 -14.560 1.00 0.00 N ATOM 45 CA LYS A 1 119.163 10.559 -13.239 1.00 0.00 C ATOM 46 C LYS A 1 118.128 10.004 -12.296 1.00 0.00 C ATOM 47 O LYS A 1 116.964 9.858 -12.691 1.00 0.00 O ATOM 48 CB LYS A 1 119.204 12.103 -13.054 1.00 0.00 C ATOM 49 CG LYS A 1 120.273 12.874 -13.841 1.00 0.00 C ATOM 50 CD LYS A 1 119.995 12.969 -15.345 1.00 0.00 C ATOM 51 CE LYS A 1 118.702 13.726 -15.666 1.00 0.00 C ATOM 52 NZ LYS A 1 118.725 15.128 -15.204 1.00 0.00 N ATOM 0 H LYS A 1 117.766 10.455 -14.749 1.00 0.00 H new ATOM 0 HA LYS A 1 120.166 10.173 -13.057 1.00 0.00 H new ATOM 0 HB2 LYS A 1 118.228 12.503 -13.329 1.00 0.00 H new ATOM 0 HB3 LYS A 1 119.347 12.313 -11.994 1.00 0.00 H new ATOM 0 HG2 LYS A 1 120.353 13.881 -13.433 1.00 0.00 H new ATOM 0 HG3 LYS A 1 121.239 12.391 -13.691 1.00 0.00 H new ATOM 0 HD2 LYS A 1 120.832 13.467 -15.833 1.00 0.00 H new ATOM 0 HD3 LYS A 1 119.935 11.964 -15.762 1.00 0.00 H new ATOM 0 HE2 LYS A 1 118.534 13.707 -16.743 1.00 0.00 H new ATOM 0 HE3 LYS A 1 117.861 13.210 -15.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 117.862 15.613 -15.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 118.772 15.151 -14.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 119.558 15.610 -15.599 1.00 0.00 H new ATOM 66 N PRO A 2 118.517 9.662 -11.063 1.00 0.00 N ATOM 67 CA PRO A 2 117.580 9.160 -10.084 1.00 0.00 C ATOM 68 C PRO A 2 116.636 10.265 -9.656 1.00 0.00 C ATOM 69 O PRO A 2 117.045 11.425 -9.460 1.00 0.00 O ATOM 70 CB PRO A 2 118.444 8.683 -8.921 1.00 0.00 C ATOM 71 CG PRO A 2 119.745 9.386 -9.078 1.00 0.00 C ATOM 72 CD PRO A 2 119.892 9.751 -10.532 1.00 0.00 C ATOM 0 HA PRO A 2 116.956 8.355 -10.471 1.00 0.00 H new ATOM 0 HB2 PRO A 2 117.981 8.923 -7.964 1.00 0.00 H new ATOM 0 HB3 PRO A 2 118.577 7.601 -8.948 1.00 0.00 H new ATOM 0 HG2 PRO A 2 119.776 10.279 -8.454 1.00 0.00 H new ATOM 0 HG3 PRO A 2 120.567 8.746 -8.759 1.00 0.00 H new ATOM 0 HD2 PRO A 2 120.302 10.754 -10.652 1.00 0.00 H new ATOM 0 HD3 PRO A 2 120.565 9.067 -11.049 1.00 0.00 H new ATOM 80 N PHE A 3 115.411 9.919 -9.530 1.00 0.00 N ATOM 81 CA PHE A 3 114.365 10.840 -9.247 1.00 0.00 C ATOM 82 C PHE A 3 114.003 10.821 -7.780 1.00 0.00 C ATOM 83 O PHE A 3 114.190 9.806 -7.089 1.00 0.00 O ATOM 84 CB PHE A 3 113.158 10.553 -10.153 1.00 0.00 C ATOM 85 CG PHE A 3 112.811 9.103 -10.264 1.00 0.00 C ATOM 86 CD1 PHE A 3 112.046 8.507 -9.311 1.00 0.00 C ATOM 87 CD2 PHE A 3 113.269 8.342 -11.327 1.00 0.00 C ATOM 88 CE1 PHE A 3 111.723 7.183 -9.389 1.00 0.00 C ATOM 89 CE2 PHE A 3 112.953 7.004 -11.419 1.00 0.00 C ATOM 90 CZ PHE A 3 112.174 6.421 -10.446 1.00 0.00 C ATOM 0 H PHE A 3 115.092 8.955 -9.623 1.00 0.00 H new ATOM 0 HA PHE A 3 114.711 11.851 -9.464 1.00 0.00 H new ATOM 0 HB2 PHE A 3 112.293 11.095 -9.770 1.00 0.00 H new ATOM 0 HB3 PHE A 3 113.364 10.944 -11.149 1.00 0.00 H new ATOM 0 HD1 PHE A 3 111.687 9.092 -8.477 1.00 0.00 H new ATOM 0 HD2 PHE A 3 113.879 8.802 -12.090 1.00 0.00 H new ATOM 0 HE1 PHE A 3 111.113 6.731 -8.621 1.00 0.00 H new ATOM 0 HE2 PHE A 3 113.315 6.416 -12.250 1.00 0.00 H new ATOM 0 HZ PHE A 3 111.918 5.374 -10.510 1.00 0.00 H new ATOM 100 N PHE A 4 113.603 11.953 -7.304 1.00 0.00 N ATOM 101 CA PHE A 4 113.181 12.130 -5.946 1.00 0.00 C ATOM 102 C PHE A 4 112.111 13.184 -5.848 1.00 0.00 C ATOM 103 O PHE A 4 112.245 14.287 -6.401 1.00 0.00 O ATOM 104 CB PHE A 4 114.343 12.528 -5.001 1.00 0.00 C ATOM 105 CG PHE A 4 113.861 12.992 -3.629 1.00 0.00 C ATOM 106 CD1 PHE A 4 113.536 14.330 -3.419 1.00 0.00 C ATOM 107 CD2 PHE A 4 113.665 12.103 -2.595 1.00 0.00 C ATOM 108 CE1 PHE A 4 113.034 14.764 -2.231 1.00 0.00 C ATOM 109 CE2 PHE A 4 113.169 12.539 -1.378 1.00 0.00 C ATOM 110 CZ PHE A 4 112.849 13.871 -1.199 1.00 0.00 C ATOM 0 H PHE A 4 113.558 12.807 -7.861 1.00 0.00 H new ATOM 0 HA PHE A 4 112.794 11.162 -5.629 1.00 0.00 H new ATOM 0 HB2 PHE A 4 115.011 11.676 -4.877 1.00 0.00 H new ATOM 0 HB3 PHE A 4 114.925 13.325 -5.465 1.00 0.00 H new ATOM 0 HD1 PHE A 4 113.686 15.040 -4.219 1.00 0.00 H new ATOM 0 HD2 PHE A 4 113.900 11.058 -2.735 1.00 0.00 H new ATOM 0 HE1 PHE A 4 112.781 15.806 -2.098 1.00 0.00 H new ATOM 0 HE2 PHE A 4 113.032 11.837 -0.568 1.00 0.00 H new ATOM 0 HZ PHE A 4 112.455 14.211 -0.253 1.00 0.00 H new ATOM 120 N THR A 5 111.076 12.829 -5.167 1.00 0.00 N ATOM 121 CA THR A 5 110.082 13.735 -4.695 1.00 0.00 C ATOM 122 C THR A 5 109.192 13.014 -3.697 1.00 0.00 C ATOM 123 O THR A 5 107.989 13.282 -3.568 1.00 0.00 O ATOM 124 CB THR A 5 109.315 14.451 -5.841 1.00 0.00 C ATOM 125 OG1 THR A 5 108.443 15.478 -5.327 1.00 0.00 O ATOM 126 CG2 THR A 5 108.534 13.471 -6.705 1.00 0.00 C ATOM 0 H THR A 5 110.890 11.859 -4.912 1.00 0.00 H new ATOM 0 HA THR A 5 110.567 14.559 -4.172 1.00 0.00 H new ATOM 0 HB THR A 5 110.066 14.923 -6.474 1.00 0.00 H new ATOM 0 HG1 THR A 5 107.890 15.108 -4.608 1.00 0.00 H new ATOM 0 HG21 THR A 5 108.014 14.015 -7.493 1.00 0.00 H new ATOM 0 HG22 THR A 5 109.221 12.753 -7.153 1.00 0.00 H new ATOM 0 HG23 THR A 5 107.807 12.942 -6.089 1.00 0.00 H new ATOM 134 N ARG A 6 109.851 12.083 -2.957 1.00 0.00 N ATOM 135 CA ARG A 6 109.265 11.252 -1.909 1.00 0.00 C ATOM 136 C ARG A 6 107.954 10.655 -2.314 1.00 0.00 C ATOM 137 O ARG A 6 106.949 10.656 -1.604 1.00 0.00 O ATOM 138 CB ARG A 6 109.276 11.962 -0.572 1.00 0.00 C ATOM 139 CG ARG A 6 108.595 13.300 -0.534 1.00 0.00 C ATOM 140 CD ARG A 6 107.148 13.203 -0.129 1.00 0.00 C ATOM 141 NE ARG A 6 106.989 12.815 1.284 1.00 0.00 N ATOM 142 CZ ARG A 6 106.261 11.784 1.741 1.00 0.00 C ATOM 143 NH1 ARG A 6 105.797 10.867 0.909 1.00 0.00 N ATOM 144 NH2 ARG A 6 106.051 11.649 3.037 1.00 0.00 N ATOM 0 H ARG A 6 110.844 11.895 -3.092 1.00 0.00 H new ATOM 0 HA ARG A 6 109.903 10.380 -1.765 1.00 0.00 H new ATOM 0 HB2 ARG A 6 108.803 11.314 0.166 1.00 0.00 H new ATOM 0 HB3 ARG A 6 110.312 12.095 -0.261 1.00 0.00 H new ATOM 0 HG2 ARG A 6 109.121 13.951 0.164 1.00 0.00 H new ATOM 0 HG3 ARG A 6 108.663 13.766 -1.517 1.00 0.00 H new ATOM 0 HD2 ARG A 6 106.660 14.163 -0.297 1.00 0.00 H new ATOM 0 HD3 ARG A 6 106.643 12.474 -0.763 1.00 0.00 H new ATOM 0 HE ARG A 6 107.477 13.382 1.978 1.00 0.00 H new ATOM 0 HH11 ARG A 6 105.991 10.939 -0.090 1.00 0.00 H new ATOM 0 HH12 ARG A 6 105.245 10.087 1.266 1.00 0.00 H new ATOM 0 HH21 ARG A 6 106.442 12.328 3.690 1.00 0.00 H new ATOM 0 HH22 ARG A 6 105.498 10.866 3.385 1.00 0.00 H new ATOM 158 N ASN A 7 107.956 10.219 -3.477 1.00 0.00 N ATOM 159 CA ASN A 7 106.797 9.572 -4.048 1.00 0.00 C ATOM 160 C ASN A 7 107.005 8.106 -4.383 1.00 0.00 C ATOM 161 O ASN A 7 107.771 7.760 -5.262 1.00 0.00 O ATOM 162 CB ASN A 7 106.327 10.326 -5.293 1.00 0.00 C ATOM 163 CG ASN A 7 105.312 11.414 -5.004 1.00 0.00 C ATOM 164 OD1 ASN A 7 105.315 11.929 -3.805 1.00 0.00 O flip ATOM 165 ND2 ASN A 7 104.501 11.765 -5.865 1.00 0.00 N flip ATOM 0 H ASN A 7 108.756 10.281 -4.107 1.00 0.00 H new ATOM 0 HA ASN A 7 106.031 9.602 -3.273 1.00 0.00 H new ATOM 0 HB2 ASN A 7 107.192 10.771 -5.785 1.00 0.00 H new ATOM 0 HB3 ASN A 7 105.892 9.614 -5.995 1.00 0.00 H new ATOM 0 HD21 ASN A 7 104.527 11.342 -6.793 1.00 0.00 H new ATOM 0 HD22 ASN A 7 103.805 12.479 -5.649 1.00 0.00 H new ATOM 172 N PRO A 8 106.298 7.183 -3.688 1.00 0.00 N ATOM 173 CA PRO A 8 106.253 5.790 -4.109 1.00 0.00 C ATOM 174 C PRO A 8 105.752 5.705 -5.500 1.00 0.00 C ATOM 175 O PRO A 8 106.082 4.807 -6.255 1.00 0.00 O ATOM 176 CB PRO A 8 105.159 5.187 -3.293 1.00 0.00 C ATOM 177 CG PRO A 8 104.695 6.191 -2.316 1.00 0.00 C ATOM 178 CD PRO A 8 105.588 7.380 -2.408 1.00 0.00 C ATOM 0 HA PRO A 8 107.233 5.323 -4.012 1.00 0.00 H new ATOM 0 HB2 PRO A 8 104.336 4.875 -3.935 1.00 0.00 H new ATOM 0 HB3 PRO A 8 105.518 4.295 -2.779 1.00 0.00 H new ATOM 0 HG2 PRO A 8 103.663 6.474 -2.523 1.00 0.00 H new ATOM 0 HG3 PRO A 8 104.716 5.778 -1.308 1.00 0.00 H new ATOM 0 HD2 PRO A 8 105.019 8.310 -2.404 1.00 0.00 H new ATOM 0 HD3 PRO A 8 106.281 7.427 -1.568 1.00 0.00 H new ATOM 186 N SER A 9 104.922 6.646 -5.816 1.00 0.00 N ATOM 187 CA SER A 9 104.303 6.658 -7.029 1.00 0.00 C ATOM 188 C SER A 9 105.248 7.210 -8.150 1.00 0.00 C ATOM 189 O SER A 9 104.942 7.080 -9.341 1.00 0.00 O ATOM 190 CB SER A 9 103.014 7.436 -6.922 1.00 0.00 C ATOM 191 OG SER A 9 102.175 7.247 -8.059 1.00 0.00 O ATOM 0 H SER A 9 104.675 7.424 -5.204 1.00 0.00 H new ATOM 0 HA SER A 9 104.061 5.636 -7.322 1.00 0.00 H new ATOM 0 HB2 SER A 9 102.480 7.129 -6.023 1.00 0.00 H new ATOM 0 HB3 SER A 9 103.240 8.497 -6.811 1.00 0.00 H new ATOM 0 HG SER A 9 102.724 7.004 -8.834 1.00 0.00 H new ATOM 197 N GLU A 10 106.388 7.839 -7.775 1.00 0.00 N ATOM 198 CA GLU A 10 107.357 8.286 -8.788 1.00 0.00 C ATOM 199 C GLU A 10 108.181 7.075 -9.157 1.00 0.00 C ATOM 200 O GLU A 10 108.625 6.907 -10.301 1.00 0.00 O ATOM 201 CB GLU A 10 108.277 9.444 -8.288 1.00 0.00 C ATOM 202 CG GLU A 10 109.322 9.050 -7.250 1.00 0.00 C ATOM 203 CD GLU A 10 110.048 10.209 -6.675 1.00 0.00 C ATOM 204 OE1 GLU A 10 110.675 10.950 -7.440 1.00 0.00 O ATOM 205 OE2 GLU A 10 109.965 10.420 -5.429 1.00 0.00 O ATOM 0 H GLU A 10 106.648 8.041 -6.810 1.00 0.00 H new ATOM 0 HA GLU A 10 106.823 8.694 -9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 10 108.789 9.875 -9.148 1.00 0.00 H new ATOM 0 HB3 GLU A 10 107.648 10.228 -7.866 1.00 0.00 H new ATOM 0 HG2 GLU A 10 108.834 8.501 -6.445 1.00 0.00 H new ATOM 0 HG3 GLU A 10 110.041 8.372 -7.709 1.00 0.00 H new ATOM 212 N LEU A 11 108.353 6.220 -8.152 1.00 0.00 N ATOM 213 CA LEU A 11 109.017 4.966 -8.280 1.00 0.00 C ATOM 214 C LEU A 11 108.272 4.087 -9.258 1.00 0.00 C ATOM 215 O LEU A 11 107.044 4.134 -9.380 1.00 0.00 O ATOM 216 CB LEU A 11 109.150 4.324 -6.899 1.00 0.00 C ATOM 217 CG LEU A 11 110.107 5.059 -5.945 1.00 0.00 C ATOM 218 CD1 LEU A 11 109.948 4.570 -4.527 1.00 0.00 C ATOM 219 CD2 LEU A 11 111.544 4.863 -6.394 1.00 0.00 C ATOM 0 H LEU A 11 108.017 6.404 -7.207 1.00 0.00 H new ATOM 0 HA LEU A 11 110.022 5.106 -8.679 1.00 0.00 H new ATOM 0 HB2 LEU A 11 108.163 4.276 -6.438 1.00 0.00 H new ATOM 0 HB3 LEU A 11 109.496 3.297 -7.021 1.00 0.00 H new ATOM 0 HG LEU A 11 109.858 6.120 -5.973 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.638 5.108 -3.877 1.00 0.00 H new ATOM 0 HD12 LEU A 11 108.925 4.745 -4.194 1.00 0.00 H new ATOM 0 HD13 LEU A 11 110.166 3.503 -4.483 1.00 0.00 H new ATOM 0 HD21 LEU A 11 112.213 5.387 -5.712 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.784 3.800 -6.392 1.00 0.00 H new ATOM 0 HD23 LEU A 11 111.668 5.261 -7.401 1.00 0.00 H new ATOM 231 N LYS A 12 109.037 3.360 -9.989 1.00 0.00 N ATOM 232 CA LYS A 12 108.555 2.519 -11.059 1.00 0.00 C ATOM 233 C LYS A 12 108.090 1.151 -10.561 1.00 0.00 C ATOM 234 O LYS A 12 108.144 0.861 -9.356 1.00 0.00 O ATOM 235 CB LYS A 12 109.646 2.371 -12.111 1.00 0.00 C ATOM 236 CG LYS A 12 110.912 1.816 -11.532 1.00 0.00 C ATOM 237 CD LYS A 12 111.970 1.515 -12.579 1.00 0.00 C ATOM 238 CE LYS A 12 112.451 2.787 -13.284 1.00 0.00 C ATOM 239 NZ LYS A 12 113.591 2.527 -14.191 1.00 0.00 N ATOM 0 H LYS A 12 110.049 3.323 -9.867 1.00 0.00 H new ATOM 0 HA LYS A 12 107.681 2.999 -11.500 1.00 0.00 H new ATOM 0 HB2 LYS A 12 109.294 1.716 -12.908 1.00 0.00 H new ATOM 0 HB3 LYS A 12 109.849 3.342 -12.562 1.00 0.00 H new ATOM 0 HG2 LYS A 12 111.316 2.527 -10.811 1.00 0.00 H new ATOM 0 HG3 LYS A 12 110.683 0.902 -10.984 1.00 0.00 H new ATOM 0 HD2 LYS A 12 112.818 1.019 -12.107 1.00 0.00 H new ATOM 0 HD3 LYS A 12 111.565 0.822 -13.316 1.00 0.00 H new ATOM 0 HE2 LYS A 12 111.627 3.218 -13.853 1.00 0.00 H new ATOM 0 HE3 LYS A 12 112.744 3.525 -12.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 113.883 3.416 -14.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 114.387 2.140 -13.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 113.305 1.843 -14.920 1.00 0.00 H new ATOM 253 N GLY A 13 107.651 0.333 -11.499 1.00 0.00 N ATOM 254 CA GLY A 13 107.164 -0.982 -11.209 1.00 0.00 C ATOM 255 C GLY A 13 105.779 -0.975 -10.617 1.00 0.00 C ATOM 256 O GLY A 13 104.853 -0.351 -11.151 1.00 0.00 O ATOM 0 H GLY A 13 107.626 0.575 -12.490 1.00 0.00 H new ATOM 0 HA2 GLY A 13 107.159 -1.573 -12.125 1.00 0.00 H new ATOM 0 HA3 GLY A 13 107.848 -1.473 -10.516 1.00 0.00 H new ATOM 260 N LYS A 14 105.652 -1.643 -9.525 1.00 0.00 N ATOM 261 CA LYS A 14 104.400 -1.824 -8.835 1.00 0.00 C ATOM 262 C LYS A 14 104.523 -1.429 -7.394 1.00 0.00 C ATOM 263 O LYS A 14 105.590 -1.544 -6.792 1.00 0.00 O ATOM 264 CB LYS A 14 103.964 -3.265 -8.980 1.00 0.00 C ATOM 265 CG LYS A 14 105.042 -4.251 -8.617 1.00 0.00 C ATOM 266 CD LYS A 14 104.993 -5.457 -9.509 1.00 0.00 C ATOM 267 CE LYS A 14 103.727 -6.298 -9.312 1.00 0.00 C ATOM 268 NZ LYS A 14 103.676 -6.952 -7.976 1.00 0.00 N ATOM 0 H LYS A 14 106.438 -2.099 -9.062 1.00 0.00 H new ATOM 0 HA LYS A 14 103.641 -1.179 -9.278 1.00 0.00 H new ATOM 0 HB2 LYS A 14 103.093 -3.440 -8.348 1.00 0.00 H new ATOM 0 HB3 LYS A 14 103.651 -3.441 -10.009 1.00 0.00 H new ATOM 0 HG2 LYS A 14 106.018 -3.774 -8.699 1.00 0.00 H new ATOM 0 HG3 LYS A 14 104.923 -4.558 -7.578 1.00 0.00 H new ATOM 0 HD2 LYS A 14 105.050 -5.135 -10.549 1.00 0.00 H new ATOM 0 HD3 LYS A 14 105.868 -6.078 -9.319 1.00 0.00 H new ATOM 0 HE2 LYS A 14 102.850 -5.662 -9.435 1.00 0.00 H new ATOM 0 HE3 LYS A 14 103.678 -7.062 -10.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 102.854 -7.587 -7.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 104.546 -7.501 -7.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 103.592 -6.225 -7.237 1.00 0.00 H new ATOM 282 N PHE A 15 103.441 -1.009 -6.850 1.00 0.00 N ATOM 283 CA PHE A 15 103.385 -0.476 -5.545 1.00 0.00 C ATOM 284 C PHE A 15 102.584 -1.440 -4.678 1.00 0.00 C ATOM 285 O PHE A 15 101.422 -1.726 -4.969 1.00 0.00 O ATOM 286 CB PHE A 15 102.697 0.887 -5.664 1.00 0.00 C ATOM 287 CG PHE A 15 102.663 1.744 -4.434 1.00 0.00 C ATOM 288 CD1 PHE A 15 103.338 1.381 -3.291 1.00 0.00 C ATOM 289 CD2 PHE A 15 101.965 2.935 -4.445 1.00 0.00 C ATOM 290 CE1 PHE A 15 103.318 2.175 -2.180 1.00 0.00 C ATOM 291 CE2 PHE A 15 101.941 3.749 -3.333 1.00 0.00 C ATOM 292 CZ PHE A 15 102.619 3.365 -2.192 1.00 0.00 C ATOM 0 H PHE A 15 102.537 -1.029 -7.322 1.00 0.00 H new ATOM 0 HA PHE A 15 104.367 -0.350 -5.089 1.00 0.00 H new ATOM 0 HB2 PHE A 15 103.194 1.449 -6.454 1.00 0.00 H new ATOM 0 HB3 PHE A 15 101.670 0.720 -5.989 1.00 0.00 H new ATOM 0 HD1 PHE A 15 103.892 0.454 -3.272 1.00 0.00 H new ATOM 0 HD2 PHE A 15 101.431 3.232 -5.336 1.00 0.00 H new ATOM 0 HE1 PHE A 15 103.850 1.871 -1.291 1.00 0.00 H new ATOM 0 HE2 PHE A 15 101.396 4.681 -3.353 1.00 0.00 H new ATOM 0 HZ PHE A 15 102.602 3.993 -1.314 1.00 0.00 H new ATOM 302 N ILE A 16 103.214 -1.959 -3.655 1.00 0.00 N ATOM 303 CA ILE A 16 102.611 -2.920 -2.773 1.00 0.00 C ATOM 304 C ILE A 16 102.936 -2.648 -1.353 1.00 0.00 C ATOM 305 O ILE A 16 103.930 -2.023 -1.034 1.00 0.00 O ATOM 306 CB ILE A 16 102.935 -4.412 -3.073 1.00 0.00 C ATOM 307 CG1 ILE A 16 104.456 -4.720 -3.239 1.00 0.00 C ATOM 308 CG2 ILE A 16 102.108 -4.939 -4.210 1.00 0.00 C ATOM 309 CD1 ILE A 16 105.104 -4.219 -4.536 1.00 0.00 C ATOM 0 H ILE A 16 104.175 -1.721 -3.409 1.00 0.00 H new ATOM 0 HA ILE A 16 101.546 -2.786 -2.964 1.00 0.00 H new ATOM 0 HB ILE A 16 102.647 -4.961 -2.176 1.00 0.00 H new ATOM 0 HG12 ILE A 16 104.990 -4.281 -2.396 1.00 0.00 H new ATOM 0 HG13 ILE A 16 104.597 -5.799 -3.179 1.00 0.00 H new ATOM 0 HG21 ILE A 16 102.362 -5.984 -4.391 1.00 0.00 H new ATOM 0 HG22 ILE A 16 101.051 -4.861 -3.958 1.00 0.00 H new ATOM 0 HG23 ILE A 16 102.311 -4.356 -5.108 1.00 0.00 H new ATOM 0 HD11 ILE A 16 106.160 -4.489 -4.543 1.00 0.00 H new ATOM 0 HD12 ILE A 16 104.607 -4.677 -5.391 1.00 0.00 H new ATOM 0 HD13 ILE A 16 105.006 -3.135 -4.597 1.00 0.00 H new ATOM 321 N HIS A 17 102.068 -3.062 -0.518 1.00 0.00 N ATOM 322 CA HIS A 17 102.243 -2.918 0.876 1.00 0.00 C ATOM 323 C HIS A 17 101.880 -4.194 1.617 1.00 0.00 C ATOM 324 O HIS A 17 100.705 -4.570 1.725 1.00 0.00 O ATOM 325 CB HIS A 17 101.567 -1.644 1.398 1.00 0.00 C ATOM 326 CG HIS A 17 100.187 -1.364 0.883 1.00 0.00 C ATOM 327 ND1 HIS A 17 99.848 -0.166 0.329 1.00 0.00 N ATOM 328 CD2 HIS A 17 99.072 -2.126 0.841 1.00 0.00 C ATOM 329 CE1 HIS A 17 98.575 -0.214 -0.033 1.00 0.00 C ATOM 330 NE2 HIS A 17 98.049 -1.391 0.253 1.00 0.00 N ATOM 0 H HIS A 17 101.197 -3.520 -0.786 1.00 0.00 H new ATOM 0 HA HIS A 17 103.303 -2.772 1.086 1.00 0.00 H new ATOM 0 HB2 HIS A 17 101.521 -1.703 2.485 1.00 0.00 H new ATOM 0 HB3 HIS A 17 102.203 -0.794 1.151 1.00 0.00 H new ATOM 0 HD1 HIS A 17 100.470 0.634 0.213 1.00 0.00 H new ATOM 0 HD2 HIS A 17 98.989 -3.140 1.205 1.00 0.00 H new ATOM 0 HE1 HIS A 17 98.039 0.600 -0.499 1.00 0.00 H new ATOM 338 N THR A 18 102.886 -4.890 2.058 1.00 0.00 N ATOM 339 CA THR A 18 102.703 -6.151 2.738 1.00 0.00 C ATOM 340 C THR A 18 103.189 -6.048 4.188 1.00 0.00 C ATOM 341 O THR A 18 104.181 -5.388 4.475 1.00 0.00 O ATOM 342 CB THR A 18 103.435 -7.311 1.974 1.00 0.00 C ATOM 343 OG1 THR A 18 103.176 -8.588 2.588 1.00 0.00 O ATOM 344 CG2 THR A 18 104.943 -7.082 1.892 1.00 0.00 C ATOM 0 H THR A 18 103.860 -4.604 1.959 1.00 0.00 H new ATOM 0 HA THR A 18 101.639 -6.387 2.751 1.00 0.00 H new ATOM 0 HB THR A 18 103.033 -7.314 0.961 1.00 0.00 H new ATOM 0 HG1 THR A 18 103.943 -9.181 2.446 1.00 0.00 H new ATOM 0 HG21 THR A 18 105.408 -7.909 1.355 1.00 0.00 H new ATOM 0 HG22 THR A 18 105.141 -6.149 1.364 1.00 0.00 H new ATOM 0 HG23 THR A 18 105.357 -7.024 2.898 1.00 0.00 H new ATOM 352 N LYS A 19 102.458 -6.655 5.087 1.00 0.00 N ATOM 353 CA LYS A 19 102.808 -6.669 6.491 1.00 0.00 C ATOM 354 C LYS A 19 103.980 -7.625 6.703 1.00 0.00 C ATOM 355 O LYS A 19 103.958 -8.751 6.209 1.00 0.00 O ATOM 356 CB LYS A 19 101.549 -7.079 7.332 1.00 0.00 C ATOM 357 CG LYS A 19 101.699 -7.261 8.883 1.00 0.00 C ATOM 358 CD LYS A 19 102.438 -8.565 9.267 1.00 0.00 C ATOM 359 CE LYS A 19 102.178 -8.998 10.705 1.00 0.00 C ATOM 360 NZ LYS A 19 100.766 -9.355 10.944 1.00 0.00 N ATOM 0 H LYS A 19 101.598 -7.157 4.868 1.00 0.00 H new ATOM 0 HA LYS A 19 103.120 -5.679 6.824 1.00 0.00 H new ATOM 0 HB2 LYS A 19 100.780 -6.326 7.162 1.00 0.00 H new ATOM 0 HB3 LYS A 19 101.172 -8.017 6.925 1.00 0.00 H new ATOM 0 HG2 LYS A 19 102.240 -6.408 9.293 1.00 0.00 H new ATOM 0 HG3 LYS A 19 100.710 -7.261 9.341 1.00 0.00 H new ATOM 0 HD2 LYS A 19 102.129 -9.363 8.592 1.00 0.00 H new ATOM 0 HD3 LYS A 19 103.509 -8.424 9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 19 102.810 -9.853 10.943 1.00 0.00 H new ATOM 0 HE3 LYS A 19 102.464 -8.192 11.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 100.693 -9.919 11.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 100.201 -8.488 11.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 100.408 -9.910 10.141 1.00 0.00 H new ATOM 374 N LEU A 20 104.992 -7.185 7.418 1.00 0.00 N ATOM 375 CA LEU A 20 106.106 -8.041 7.708 1.00 0.00 C ATOM 376 C LEU A 20 106.175 -8.232 9.193 1.00 0.00 C ATOM 377 O LEU A 20 106.265 -7.256 9.960 1.00 0.00 O ATOM 378 CB LEU A 20 107.428 -7.493 7.136 1.00 0.00 C ATOM 379 CG LEU A 20 108.197 -8.445 6.197 1.00 0.00 C ATOM 380 CD1 LEU A 20 107.306 -9.014 5.105 1.00 0.00 C ATOM 381 CD2 LEU A 20 109.344 -7.717 5.568 1.00 0.00 C ATOM 0 H LEU A 20 105.061 -6.244 7.805 1.00 0.00 H new ATOM 0 HA LEU A 20 105.957 -9.004 7.220 1.00 0.00 H new ATOM 0 HB2 LEU A 20 107.214 -6.572 6.593 1.00 0.00 H new ATOM 0 HB3 LEU A 20 108.080 -7.228 7.968 1.00 0.00 H new ATOM 0 HG LEU A 20 108.560 -9.276 6.801 1.00 0.00 H new ATOM 0 HD11 LEU A 20 107.890 -9.678 4.468 1.00 0.00 H new ATOM 0 HD12 LEU A 20 106.487 -9.573 5.558 1.00 0.00 H new ATOM 0 HD13 LEU A 20 106.901 -8.199 4.505 1.00 0.00 H new ATOM 0 HD21 LEU A 20 109.885 -8.393 4.906 1.00 0.00 H new ATOM 0 HD22 LEU A 20 108.967 -6.871 4.994 1.00 0.00 H new ATOM 0 HD23 LEU A 20 110.017 -7.357 6.346 1.00 0.00 H new ATOM 393 N ARG A 21 106.102 -9.449 9.608 1.00 0.00 N ATOM 394 CA ARG A 21 106.075 -9.786 10.986 1.00 0.00 C ATOM 395 C ARG A 21 107.502 -9.817 11.531 1.00 0.00 C ATOM 396 O ARG A 21 108.325 -10.561 11.070 1.00 0.00 O ATOM 397 CB ARG A 21 105.390 -11.136 11.179 1.00 0.00 C ATOM 398 CG ARG A 21 105.117 -11.485 12.624 1.00 0.00 C ATOM 399 CD ARG A 21 104.477 -12.850 12.739 1.00 0.00 C ATOM 400 NE ARG A 21 104.267 -13.237 14.139 1.00 0.00 N ATOM 401 CZ ARG A 21 104.051 -14.489 14.560 1.00 0.00 C ATOM 402 NH1 ARG A 21 103.813 -15.465 13.682 1.00 0.00 N ATOM 403 NH2 ARG A 21 104.014 -14.745 15.855 1.00 0.00 N ATOM 0 H ARG A 21 106.059 -10.254 8.984 1.00 0.00 H new ATOM 0 HA ARG A 21 105.508 -9.035 11.535 1.00 0.00 H new ATOM 0 HB2 ARG A 21 104.447 -11.135 10.632 1.00 0.00 H new ATOM 0 HB3 ARG A 21 106.013 -11.915 10.739 1.00 0.00 H new ATOM 0 HG2 ARG A 21 106.049 -11.468 13.189 1.00 0.00 H new ATOM 0 HG3 ARG A 21 104.462 -10.734 13.066 1.00 0.00 H new ATOM 0 HD2 ARG A 21 103.521 -12.849 12.215 1.00 0.00 H new ATOM 0 HD3 ARG A 21 105.109 -13.590 12.248 1.00 0.00 H new ATOM 0 HE ARG A 21 104.287 -12.498 14.842 1.00 0.00 H new ATOM 0 HH11 ARG A 21 103.795 -15.259 12.683 1.00 0.00 H new ATOM 0 HH12 ARG A 21 103.649 -16.417 14.010 1.00 0.00 H new ATOM 0 HH21 ARG A 21 104.150 -13.991 16.528 1.00 0.00 H new ATOM 0 HH22 ARG A 21 103.850 -15.697 16.182 1.00 0.00 H new ATOM 417 N LYS A 22 107.786 -8.907 12.430 1.00 0.00 N ATOM 418 CA LYS A 22 109.050 -8.780 13.110 1.00 0.00 C ATOM 419 C LYS A 22 109.534 -10.054 13.653 1.00 0.00 C ATOM 420 O LYS A 22 108.948 -10.584 14.629 1.00 0.00 O ATOM 421 CB LYS A 22 108.929 -7.815 14.237 1.00 0.00 C ATOM 422 CG LYS A 22 108.957 -6.356 13.889 1.00 0.00 C ATOM 423 CD LYS A 22 107.876 -5.866 12.981 1.00 0.00 C ATOM 424 CE LYS A 22 108.325 -5.678 11.573 1.00 0.00 C ATOM 425 NZ LYS A 22 108.989 -6.845 10.984 1.00 0.00 N ATOM 0 H LYS A 22 107.109 -8.201 12.721 1.00 0.00 H new ATOM 0 HA LYS A 22 109.764 -8.430 12.365 1.00 0.00 H new ATOM 0 HB2 LYS A 22 107.995 -8.021 14.761 1.00 0.00 H new ATOM 0 HB3 LYS A 22 109.739 -8.011 14.940 1.00 0.00 H new ATOM 0 HG2 LYS A 22 108.910 -5.783 14.815 1.00 0.00 H new ATOM 0 HG3 LYS A 22 109.918 -6.134 13.426 1.00 0.00 H new ATOM 0 HD2 LYS A 22 107.048 -6.575 12.999 1.00 0.00 H new ATOM 0 HD3 LYS A 22 107.493 -4.919 13.362 1.00 0.00 H new ATOM 0 HE2 LYS A 22 107.461 -5.421 10.961 1.00 0.00 H new ATOM 0 HE3 LYS A 22 109.008 -4.829 11.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 109.488 -6.560 10.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 109.672 -7.236 11.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 108.279 -7.568 10.752 1.00 0.00 H new ATOM 439 N SER A 23 110.605 -10.499 13.032 1.00 0.00 N ATOM 440 CA SER A 23 111.304 -11.693 13.343 1.00 0.00 C ATOM 441 C SER A 23 112.360 -11.342 14.424 1.00 0.00 C ATOM 442 O SER A 23 112.092 -10.486 15.280 1.00 0.00 O ATOM 443 CB SER A 23 111.945 -12.205 12.020 1.00 0.00 C ATOM 444 OG SER A 23 112.548 -13.475 12.158 1.00 0.00 O ATOM 0 H SER A 23 111.024 -9.994 12.251 1.00 0.00 H new ATOM 0 HA SER A 23 110.665 -12.481 13.740 1.00 0.00 H new ATOM 0 HB2 SER A 23 111.179 -12.254 11.246 1.00 0.00 H new ATOM 0 HB3 SER A 23 112.693 -11.488 11.683 1.00 0.00 H new ATOM 0 HG SER A 23 112.933 -13.749 11.299 1.00 0.00 H new ATOM 450 N SER A 24 113.515 -11.957 14.384 1.00 0.00 N ATOM 451 CA SER A 24 114.580 -11.732 15.350 1.00 0.00 C ATOM 452 C SER A 24 115.130 -10.266 15.349 1.00 0.00 C ATOM 453 O SER A 24 116.094 -9.929 14.653 1.00 0.00 O ATOM 454 CB SER A 24 115.667 -12.764 15.103 1.00 0.00 C ATOM 455 OG SER A 24 115.888 -12.915 13.708 1.00 0.00 O ATOM 0 H SER A 24 113.754 -12.643 13.668 1.00 0.00 H new ATOM 0 HA SER A 24 114.173 -11.856 16.354 1.00 0.00 H new ATOM 0 HB2 SER A 24 116.590 -12.456 15.594 1.00 0.00 H new ATOM 0 HB3 SER A 24 115.377 -13.720 15.539 1.00 0.00 H new ATOM 0 HG SER A 24 116.591 -13.581 13.558 1.00 0.00 H new ATOM 461 N ARG A 25 114.424 -9.405 16.096 1.00 0.00 N ATOM 462 CA ARG A 25 114.745 -7.988 16.335 1.00 0.00 C ATOM 463 C ARG A 25 114.792 -7.193 15.060 1.00 0.00 C ATOM 464 O ARG A 25 115.528 -6.212 14.955 1.00 0.00 O ATOM 465 CB ARG A 25 116.032 -7.734 17.153 1.00 0.00 C ATOM 466 CG ARG A 25 116.024 -8.225 18.586 1.00 0.00 C ATOM 467 CD ARG A 25 116.645 -9.594 18.695 1.00 0.00 C ATOM 468 NE ARG A 25 116.725 -10.056 20.074 1.00 0.00 N ATOM 469 CZ ARG A 25 117.136 -11.273 20.454 1.00 0.00 C ATOM 470 NH1 ARG A 25 117.596 -12.142 19.553 1.00 0.00 N ATOM 471 NH2 ARG A 25 117.114 -11.604 21.738 1.00 0.00 N ATOM 0 H ARG A 25 113.570 -9.691 16.575 1.00 0.00 H new ATOM 0 HA ARG A 25 113.916 -7.642 16.953 1.00 0.00 H new ATOM 0 HB2 ARG A 25 116.866 -8.206 16.634 1.00 0.00 H new ATOM 0 HB3 ARG A 25 116.227 -6.662 17.160 1.00 0.00 H new ATOM 0 HG2 ARG A 25 116.570 -7.524 19.217 1.00 0.00 H new ATOM 0 HG3 ARG A 25 115.000 -8.257 18.957 1.00 0.00 H new ATOM 0 HD2 ARG A 25 116.060 -10.304 18.110 1.00 0.00 H new ATOM 0 HD3 ARG A 25 117.645 -9.572 18.263 1.00 0.00 H new ATOM 0 HE ARG A 25 116.447 -9.403 20.806 1.00 0.00 H new ATOM 0 HH11 ARG A 25 117.636 -11.882 18.568 1.00 0.00 H new ATOM 0 HH12 ARG A 25 117.907 -13.067 19.849 1.00 0.00 H new ATOM 0 HH21 ARG A 25 116.785 -10.933 22.432 1.00 0.00 H new ATOM 0 HH22 ARG A 25 117.426 -12.530 22.031 1.00 0.00 H new ATOM 485 N GLY A 26 114.024 -7.598 14.100 1.00 0.00 N ATOM 486 CA GLY A 26 114.030 -6.896 12.875 1.00 0.00 C ATOM 487 C GLY A 26 113.287 -7.589 11.805 1.00 0.00 C ATOM 488 O GLY A 26 112.060 -7.912 11.935 1.00 0.00 O ATOM 0 H GLY A 26 113.396 -8.400 14.146 1.00 0.00 H new ATOM 0 HA2 GLY A 26 113.597 -5.908 13.028 1.00 0.00 H new ATOM 0 HA3 GLY A 26 115.061 -6.746 12.554 1.00 0.00 H new ATOM 492 N PHE A 27 113.980 -7.829 10.763 1.00 0.00 N ATOM 493 CA PHE A 27 113.435 -8.349 9.592 1.00 0.00 C ATOM 494 C PHE A 27 114.246 -9.535 9.082 1.00 0.00 C ATOM 495 O PHE A 27 114.025 -10.659 9.525 1.00 0.00 O ATOM 496 CB PHE A 27 113.418 -7.233 8.567 1.00 0.00 C ATOM 497 CG PHE A 27 112.458 -6.171 8.835 1.00 0.00 C ATOM 498 CD1 PHE A 27 111.123 -6.335 8.592 1.00 0.00 C ATOM 499 CD2 PHE A 27 112.898 -4.996 9.377 1.00 0.00 C ATOM 500 CE1 PHE A 27 110.252 -5.331 8.886 1.00 0.00 C ATOM 501 CE2 PHE A 27 112.037 -4.014 9.685 1.00 0.00 C ATOM 502 CZ PHE A 27 110.713 -4.172 9.441 1.00 0.00 C ATOM 0 H PHE A 27 114.984 -7.659 10.708 1.00 0.00 H new ATOM 0 HA PHE A 27 112.426 -8.716 9.780 1.00 0.00 H new ATOM 0 HB2 PHE A 27 114.415 -6.796 8.510 1.00 0.00 H new ATOM 0 HB3 PHE A 27 113.201 -7.661 7.588 1.00 0.00 H new ATOM 0 HD1 PHE A 27 110.760 -7.259 8.168 1.00 0.00 H new ATOM 0 HD2 PHE A 27 113.953 -4.856 9.560 1.00 0.00 H new ATOM 0 HE1 PHE A 27 109.199 -5.451 8.681 1.00 0.00 H new ATOM 0 HE2 PHE A 27 112.399 -3.098 10.127 1.00 0.00 H new ATOM 0 HZ PHE A 27 110.021 -3.379 9.686 1.00 0.00 H new ATOM 512 N GLY A 28 115.213 -9.280 8.252 1.00 0.00 N ATOM 513 CA GLY A 28 115.871 -10.346 7.539 1.00 0.00 C ATOM 514 C GLY A 28 115.913 -10.087 6.032 1.00 0.00 C ATOM 515 O GLY A 28 115.406 -10.876 5.233 1.00 0.00 O ATOM 0 H GLY A 28 115.567 -8.345 8.049 1.00 0.00 H new ATOM 0 HA2 GLY A 28 116.887 -10.461 7.916 1.00 0.00 H new ATOM 0 HA3 GLY A 28 115.352 -11.285 7.731 1.00 0.00 H new ATOM 519 N PHE A 29 116.446 -8.957 5.664 1.00 0.00 N ATOM 520 CA PHE A 29 116.734 -8.604 4.289 1.00 0.00 C ATOM 521 C PHE A 29 117.732 -7.470 4.292 1.00 0.00 C ATOM 522 O PHE A 29 117.700 -6.627 5.168 1.00 0.00 O ATOM 523 CB PHE A 29 115.465 -8.306 3.435 1.00 0.00 C ATOM 524 CG PHE A 29 114.513 -7.294 3.972 1.00 0.00 C ATOM 525 CD1 PHE A 29 113.496 -7.672 4.812 1.00 0.00 C ATOM 526 CD2 PHE A 29 114.618 -5.978 3.612 1.00 0.00 C ATOM 527 CE1 PHE A 29 112.603 -6.748 5.290 1.00 0.00 C ATOM 528 CE2 PHE A 29 113.720 -5.038 4.082 1.00 0.00 C ATOM 529 CZ PHE A 29 112.710 -5.425 4.925 1.00 0.00 C ATOM 0 H PHE A 29 116.703 -8.227 6.329 1.00 0.00 H new ATOM 0 HA PHE A 29 117.171 -9.469 3.790 1.00 0.00 H new ATOM 0 HB2 PHE A 29 115.790 -7.976 2.448 1.00 0.00 H new ATOM 0 HB3 PHE A 29 114.923 -9.241 3.296 1.00 0.00 H new ATOM 0 HD1 PHE A 29 113.398 -8.708 5.100 1.00 0.00 H new ATOM 0 HD2 PHE A 29 115.414 -5.669 2.951 1.00 0.00 H new ATOM 0 HE1 PHE A 29 111.812 -7.060 5.956 1.00 0.00 H new ATOM 0 HE2 PHE A 29 113.813 -4.003 3.787 1.00 0.00 H new ATOM 0 HZ PHE A 29 112.005 -4.698 5.299 1.00 0.00 H new ATOM 539 N THR A 30 118.638 -7.454 3.383 1.00 0.00 N ATOM 540 CA THR A 30 119.602 -6.413 3.373 1.00 0.00 C ATOM 541 C THR A 30 119.291 -5.452 2.260 1.00 0.00 C ATOM 542 O THR A 30 118.928 -5.856 1.132 1.00 0.00 O ATOM 543 CB THR A 30 121.037 -6.965 3.307 1.00 0.00 C ATOM 544 OG1 THR A 30 121.144 -7.915 2.240 1.00 0.00 O ATOM 545 CG2 THR A 30 121.392 -7.642 4.630 1.00 0.00 C ATOM 0 H THR A 30 118.733 -8.146 2.639 1.00 0.00 H new ATOM 0 HA THR A 30 119.546 -5.864 4.313 1.00 0.00 H new ATOM 0 HB THR A 30 121.727 -6.141 3.126 1.00 0.00 H new ATOM 0 HG1 THR A 30 121.538 -7.481 1.454 1.00 0.00 H new ATOM 0 HG21 THR A 30 122.409 -8.031 4.578 1.00 0.00 H new ATOM 0 HG22 THR A 30 121.322 -6.916 5.440 1.00 0.00 H new ATOM 0 HG23 THR A 30 120.699 -8.462 4.817 1.00 0.00 H new ATOM 553 N VAL A 31 119.379 -4.200 2.563 1.00 0.00 N ATOM 554 CA VAL A 31 118.950 -3.187 1.656 1.00 0.00 C ATOM 555 C VAL A 31 120.069 -2.179 1.403 1.00 0.00 C ATOM 556 O VAL A 31 121.020 -2.107 2.181 1.00 0.00 O ATOM 557 CB VAL A 31 117.692 -2.455 2.236 1.00 0.00 C ATOM 558 CG1 VAL A 31 116.610 -3.425 2.593 1.00 0.00 C ATOM 559 CG2 VAL A 31 118.031 -1.660 3.434 1.00 0.00 C ATOM 0 H VAL A 31 119.750 -3.849 3.446 1.00 0.00 H new ATOM 0 HA VAL A 31 118.690 -3.657 0.708 1.00 0.00 H new ATOM 0 HB VAL A 31 117.335 -1.788 1.451 1.00 0.00 H new ATOM 0 HG11 VAL A 31 115.753 -2.883 2.992 1.00 0.00 H new ATOM 0 HG12 VAL A 31 116.308 -3.977 1.703 1.00 0.00 H new ATOM 0 HG13 VAL A 31 116.980 -4.123 3.344 1.00 0.00 H new ATOM 0 HG21 VAL A 31 117.134 -1.166 3.809 1.00 0.00 H new ATOM 0 HG22 VAL A 31 118.433 -2.317 4.205 1.00 0.00 H new ATOM 0 HG23 VAL A 31 118.776 -0.909 3.173 1.00 0.00 H new ATOM 569 N VAL A 32 119.966 -1.446 0.308 1.00 0.00 N ATOM 570 CA VAL A 32 120.875 -0.385 -0.001 1.00 0.00 C ATOM 571 C VAL A 32 120.153 0.912 -0.217 1.00 0.00 C ATOM 572 O VAL A 32 119.154 0.981 -0.906 1.00 0.00 O ATOM 573 CB VAL A 32 121.841 -0.672 -1.185 1.00 0.00 C ATOM 574 CG1 VAL A 32 122.793 -1.773 -0.828 1.00 0.00 C ATOM 575 CG2 VAL A 32 121.089 -1.021 -2.458 1.00 0.00 C ATOM 0 H VAL A 32 119.236 -1.582 -0.392 1.00 0.00 H new ATOM 0 HA VAL A 32 121.509 -0.306 0.882 1.00 0.00 H new ATOM 0 HB VAL A 32 122.405 0.242 -1.375 1.00 0.00 H new ATOM 0 HG11 VAL A 32 123.462 -1.962 -1.667 1.00 0.00 H new ATOM 0 HG12 VAL A 32 123.378 -1.480 0.044 1.00 0.00 H new ATOM 0 HG13 VAL A 32 122.232 -2.679 -0.600 1.00 0.00 H new ATOM 0 HG21 VAL A 32 121.801 -1.214 -3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 32 120.482 -1.911 -2.290 1.00 0.00 H new ATOM 0 HG23 VAL A 32 120.443 -0.189 -2.739 1.00 0.00 H new ATOM 585 N GLY A 33 120.656 1.915 0.405 1.00 0.00 N ATOM 586 CA GLY A 33 120.152 3.223 0.256 1.00 0.00 C ATOM 587 C GLY A 33 119.892 3.877 1.572 1.00 0.00 C ATOM 588 O GLY A 33 120.716 3.756 2.541 1.00 0.00 O ATOM 0 H GLY A 33 121.447 1.844 1.045 1.00 0.00 H new ATOM 0 HA2 GLY A 33 120.863 3.823 -0.312 1.00 0.00 H new ATOM 0 HA3 GLY A 33 119.228 3.192 -0.322 1.00 0.00 H new ATOM 592 N GLY A 34 118.774 4.586 1.586 1.00 0.00 N ATOM 593 CA GLY A 34 118.251 5.328 2.725 1.00 0.00 C ATOM 594 C GLY A 34 119.295 6.074 3.386 1.00 0.00 C ATOM 595 O GLY A 34 119.461 6.014 4.556 1.00 0.00 O ATOM 0 H GLY A 34 118.176 4.664 0.763 1.00 0.00 H new ATOM 0 HA2 GLY A 34 117.469 6.010 2.390 1.00 0.00 H new ATOM 0 HA3 GLY A 34 117.791 4.638 3.432 1.00 0.00 H new ATOM 599 N ASP A 35 120.017 6.750 2.619 1.00 0.00 N ATOM 600 CA ASP A 35 121.137 7.444 3.095 1.00 0.00 C ATOM 601 C ASP A 35 120.741 8.788 3.521 1.00 0.00 C ATOM 602 O ASP A 35 121.264 9.320 4.520 1.00 0.00 O ATOM 603 CB ASP A 35 122.171 7.482 1.995 1.00 0.00 C ATOM 604 CG ASP A 35 123.476 8.163 2.404 1.00 0.00 C ATOM 605 OD1 ASP A 35 124.101 7.766 3.407 1.00 0.00 O ATOM 606 OD2 ASP A 35 123.937 9.061 1.695 1.00 0.00 O ATOM 0 H ASP A 35 119.853 6.847 1.617 1.00 0.00 H new ATOM 0 HA ASP A 35 121.567 6.944 3.963 1.00 0.00 H new ATOM 0 HB2 ASP A 35 122.388 6.462 1.676 1.00 0.00 H new ATOM 0 HB3 ASP A 35 121.754 8.003 1.134 1.00 0.00 H new ATOM 611 N GLU A 36 119.761 9.320 2.837 1.00 0.00 N ATOM 612 CA GLU A 36 119.427 10.684 3.009 1.00 0.00 C ATOM 613 C GLU A 36 118.042 10.911 2.559 1.00 0.00 C ATOM 614 O GLU A 36 117.454 10.055 1.916 1.00 0.00 O ATOM 615 CB GLU A 36 120.469 11.509 2.244 1.00 0.00 C ATOM 616 CG GLU A 36 120.840 10.907 0.925 1.00 0.00 C ATOM 617 CD GLU A 36 121.962 11.631 0.255 1.00 0.00 C ATOM 618 OE1 GLU A 36 122.514 12.606 0.842 1.00 0.00 O ATOM 619 OE2 GLU A 36 122.338 11.241 -0.857 1.00 0.00 O ATOM 0 H GLU A 36 119.188 8.818 2.159 1.00 0.00 H new ATOM 0 HA GLU A 36 119.454 10.991 4.054 1.00 0.00 H new ATOM 0 HB2 GLU A 36 120.080 12.514 2.081 1.00 0.00 H new ATOM 0 HB3 GLU A 36 121.365 11.609 2.856 1.00 0.00 H new ATOM 0 HG2 GLU A 36 121.123 9.865 1.073 1.00 0.00 H new ATOM 0 HG3 GLU A 36 119.968 10.911 0.271 1.00 0.00 H new ATOM 626 N PRO A 37 117.484 12.066 2.872 1.00 0.00 N ATOM 627 CA PRO A 37 116.126 12.448 2.512 1.00 0.00 C ATOM 628 C PRO A 37 116.075 12.858 1.061 1.00 0.00 C ATOM 629 O PRO A 37 115.550 13.909 0.683 1.00 0.00 O ATOM 630 CB PRO A 37 115.882 13.639 3.408 1.00 0.00 C ATOM 631 CG PRO A 37 116.965 13.608 4.404 1.00 0.00 C ATOM 632 CD PRO A 37 118.107 13.138 3.611 1.00 0.00 C ATOM 0 HA PRO A 37 115.391 11.652 2.633 1.00 0.00 H new ATOM 0 HB2 PRO A 37 115.898 14.568 2.839 1.00 0.00 H new ATOM 0 HB3 PRO A 37 114.905 13.576 3.888 1.00 0.00 H new ATOM 0 HG2 PRO A 37 117.148 14.592 4.837 1.00 0.00 H new ATOM 0 HG3 PRO A 37 116.739 12.934 5.230 1.00 0.00 H new ATOM 0 HD2 PRO A 37 118.508 13.914 2.959 1.00 0.00 H new ATOM 0 HD3 PRO A 37 118.930 12.789 4.234 1.00 0.00 H new ATOM 640 N ASP A 38 116.602 11.988 0.297 1.00 0.00 N ATOM 641 CA ASP A 38 116.863 12.129 -1.097 1.00 0.00 C ATOM 642 C ASP A 38 117.088 10.737 -1.685 1.00 0.00 C ATOM 643 O ASP A 38 116.601 10.421 -2.769 1.00 0.00 O ATOM 644 CB ASP A 38 118.115 12.994 -1.276 1.00 0.00 C ATOM 645 CG ASP A 38 118.550 13.122 -2.721 1.00 0.00 C ATOM 646 OD1 ASP A 38 119.343 12.283 -3.212 1.00 0.00 O ATOM 647 OD2 ASP A 38 118.107 14.072 -3.402 1.00 0.00 O ATOM 0 H ASP A 38 116.891 11.076 0.650 1.00 0.00 H new ATOM 0 HA ASP A 38 116.026 12.606 -1.607 1.00 0.00 H new ATOM 0 HB2 ASP A 38 117.923 13.988 -0.872 1.00 0.00 H new ATOM 0 HB3 ASP A 38 118.931 12.565 -0.694 1.00 0.00 H new ATOM 652 N GLU A 39 117.793 9.890 -0.931 1.00 0.00 N ATOM 653 CA GLU A 39 118.054 8.520 -1.346 1.00 0.00 C ATOM 654 C GLU A 39 117.291 7.578 -0.430 1.00 0.00 C ATOM 655 O GLU A 39 117.548 7.573 0.815 1.00 0.00 O ATOM 656 CB GLU A 39 119.561 8.180 -1.322 1.00 0.00 C ATOM 657 CG GLU A 39 119.879 6.779 -1.863 1.00 0.00 C ATOM 658 CD GLU A 39 121.352 6.432 -1.836 1.00 0.00 C ATOM 659 OE1 GLU A 39 122.155 7.146 -2.466 1.00 0.00 O ATOM 660 OE2 GLU A 39 121.732 5.409 -1.236 1.00 0.00 O ATOM 0 H GLU A 39 118.193 10.136 -0.026 1.00 0.00 H new ATOM 0 HA GLU A 39 117.719 8.404 -2.377 1.00 0.00 H new ATOM 0 HB2 GLU A 39 120.102 8.920 -1.911 1.00 0.00 H new ATOM 0 HB3 GLU A 39 119.927 8.258 -0.298 1.00 0.00 H new ATOM 0 HG2 GLU A 39 119.331 6.041 -1.277 1.00 0.00 H new ATOM 0 HG3 GLU A 39 119.517 6.705 -2.888 1.00 0.00 H new ATOM 667 N PHE A 40 116.395 6.789 -1.082 1.00 0.00 N ATOM 668 CA PHE A 40 115.423 5.801 -0.496 1.00 0.00 C ATOM 669 C PHE A 40 116.121 4.465 -0.302 1.00 0.00 C ATOM 670 O PHE A 40 117.232 4.275 -0.811 1.00 0.00 O ATOM 671 CB PHE A 40 114.248 5.540 -1.465 1.00 0.00 C ATOM 672 CG PHE A 40 113.624 6.737 -2.139 1.00 0.00 C ATOM 673 CD1 PHE A 40 113.223 7.847 -1.420 1.00 0.00 C ATOM 674 CD2 PHE A 40 113.436 6.729 -3.517 1.00 0.00 C ATOM 675 CE1 PHE A 40 112.642 8.930 -2.062 1.00 0.00 C ATOM 676 CE2 PHE A 40 112.855 7.806 -4.163 1.00 0.00 C ATOM 677 CZ PHE A 40 112.456 8.907 -3.437 1.00 0.00 C ATOM 0 H PHE A 40 116.320 6.822 -2.099 1.00 0.00 H new ATOM 0 HA PHE A 40 115.058 6.215 0.444 1.00 0.00 H new ATOM 0 HB2 PHE A 40 114.597 4.860 -2.242 1.00 0.00 H new ATOM 0 HB3 PHE A 40 113.466 5.019 -0.913 1.00 0.00 H new ATOM 0 HD1 PHE A 40 113.363 7.871 -0.349 1.00 0.00 H new ATOM 0 HD2 PHE A 40 113.748 5.869 -4.091 1.00 0.00 H new ATOM 0 HE1 PHE A 40 112.334 9.793 -1.491 1.00 0.00 H new ATOM 0 HE2 PHE A 40 112.715 7.784 -5.234 1.00 0.00 H new ATOM 0 HZ PHE A 40 112.000 9.749 -3.936 1.00 0.00 H new ATOM 687 N LEU A 41 115.520 3.541 0.474 1.00 0.00 N ATOM 688 CA LEU A 41 116.191 2.261 0.669 1.00 0.00 C ATOM 689 C LEU A 41 115.654 1.266 -0.334 1.00 0.00 C ATOM 690 O LEU A 41 114.534 1.374 -0.734 1.00 0.00 O ATOM 691 CB LEU A 41 116.098 1.677 2.088 1.00 0.00 C ATOM 692 CG LEU A 41 116.578 2.503 3.264 1.00 0.00 C ATOM 693 CD1 LEU A 41 115.554 3.580 3.684 1.00 0.00 C ATOM 694 CD2 LEU A 41 116.927 1.592 4.415 1.00 0.00 C ATOM 0 H LEU A 41 114.623 3.653 0.947 1.00 0.00 H new ATOM 0 HA LEU A 41 117.253 2.456 0.517 1.00 0.00 H new ATOM 0 HB2 LEU A 41 115.053 1.424 2.270 1.00 0.00 H new ATOM 0 HB3 LEU A 41 116.658 0.742 2.094 1.00 0.00 H new ATOM 0 HG LEU A 41 117.473 3.043 2.955 1.00 0.00 H new ATOM 0 HD11 LEU A 41 115.946 4.144 4.530 1.00 0.00 H new ATOM 0 HD12 LEU A 41 115.374 4.257 2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 41 114.618 3.100 3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 41 117.272 2.189 5.260 1.00 0.00 H new ATOM 0 HD22 LEU A 41 116.045 1.023 4.709 1.00 0.00 H new ATOM 0 HD23 LEU A 41 117.716 0.905 4.109 1.00 0.00 H new ATOM 706 N GLN A 42 116.472 0.377 -0.796 1.00 0.00 N ATOM 707 CA GLN A 42 116.083 -0.615 -1.775 1.00 0.00 C ATOM 708 C GLN A 42 116.560 -1.973 -1.301 1.00 0.00 C ATOM 709 O GLN A 42 117.516 -2.038 -0.631 1.00 0.00 O ATOM 710 CB GLN A 42 116.741 -0.219 -3.086 1.00 0.00 C ATOM 711 CG GLN A 42 116.550 -1.166 -4.266 1.00 0.00 C ATOM 712 CD GLN A 42 117.750 -2.057 -4.533 1.00 0.00 C ATOM 713 OE1 GLN A 42 118.489 -2.411 -3.639 1.00 0.00 O ATOM 714 NE2 GLN A 42 117.951 -2.419 -5.767 1.00 0.00 N ATOM 0 H GLN A 42 117.448 0.309 -0.506 1.00 0.00 H new ATOM 0 HA GLN A 42 115.003 -0.668 -1.909 1.00 0.00 H new ATOM 0 HB2 GLN A 42 116.362 0.762 -3.373 1.00 0.00 H new ATOM 0 HB3 GLN A 42 117.811 -0.108 -2.909 1.00 0.00 H new ATOM 0 HG2 GLN A 42 115.677 -1.792 -4.080 1.00 0.00 H new ATOM 0 HG3 GLN A 42 116.337 -0.580 -5.160 1.00 0.00 H new ATOM 0 HE21 GLN A 42 117.314 -2.107 -6.500 1.00 0.00 H new ATOM 0 HE22 GLN A 42 118.745 -3.015 -6.001 1.00 0.00 H new ATOM 723 N ILE A 43 115.898 -3.032 -1.664 1.00 0.00 N ATOM 724 CA ILE A 43 116.286 -4.370 -1.159 1.00 0.00 C ATOM 725 C ILE A 43 117.284 -4.992 -2.111 1.00 0.00 C ATOM 726 O ILE A 43 116.953 -5.203 -3.284 1.00 0.00 O ATOM 727 CB ILE A 43 115.102 -5.376 -1.104 1.00 0.00 C ATOM 728 CG1 ILE A 43 113.812 -4.728 -0.627 1.00 0.00 C ATOM 729 CG2 ILE A 43 115.453 -6.604 -0.243 1.00 0.00 C ATOM 730 CD1 ILE A 43 113.899 -4.035 0.684 1.00 0.00 C ATOM 0 H ILE A 43 115.097 -3.026 -2.295 1.00 0.00 H new ATOM 0 HA ILE A 43 116.677 -4.203 -0.155 1.00 0.00 H new ATOM 0 HB ILE A 43 114.930 -5.713 -2.126 1.00 0.00 H new ATOM 0 HG12 ILE A 43 113.486 -4.009 -1.379 1.00 0.00 H new ATOM 0 HG13 ILE A 43 113.041 -5.495 -0.564 1.00 0.00 H new ATOM 0 HG21 ILE A 43 114.605 -7.289 -0.224 1.00 0.00 H new ATOM 0 HG22 ILE A 43 116.320 -7.111 -0.668 1.00 0.00 H new ATOM 0 HG23 ILE A 43 115.683 -6.282 0.773 1.00 0.00 H new ATOM 0 HD11 ILE A 43 112.928 -3.607 0.934 1.00 0.00 H new ATOM 0 HD12 ILE A 43 114.190 -4.749 1.454 1.00 0.00 H new ATOM 0 HD13 ILE A 43 114.642 -3.240 0.627 1.00 0.00 H new ATOM 742 N LYS A 44 118.456 -5.343 -1.620 1.00 0.00 N ATOM 743 CA LYS A 44 119.446 -5.932 -2.495 1.00 0.00 C ATOM 744 C LYS A 44 119.590 -7.409 -2.259 1.00 0.00 C ATOM 745 O LYS A 44 120.158 -8.113 -3.092 1.00 0.00 O ATOM 746 CB LYS A 44 120.820 -5.277 -2.413 1.00 0.00 C ATOM 747 CG LYS A 44 121.594 -5.586 -1.138 1.00 0.00 C ATOM 748 CD LYS A 44 123.054 -5.205 -1.281 1.00 0.00 C ATOM 749 CE LYS A 44 123.864 -5.655 -0.082 1.00 0.00 C ATOM 750 NZ LYS A 44 125.264 -5.202 -0.166 1.00 0.00 N ATOM 0 H LYS A 44 118.740 -5.234 -0.646 1.00 0.00 H new ATOM 0 HA LYS A 44 119.061 -5.752 -3.499 1.00 0.00 H new ATOM 0 HB2 LYS A 44 121.413 -5.598 -3.269 1.00 0.00 H new ATOM 0 HB3 LYS A 44 120.699 -4.197 -2.496 1.00 0.00 H new ATOM 0 HG2 LYS A 44 121.154 -5.044 -0.301 1.00 0.00 H new ATOM 0 HG3 LYS A 44 121.513 -6.648 -0.908 1.00 0.00 H new ATOM 0 HD2 LYS A 44 123.462 -5.654 -2.187 1.00 0.00 H new ATOM 0 HD3 LYS A 44 123.140 -4.124 -1.395 1.00 0.00 H new ATOM 0 HE2 LYS A 44 123.410 -5.266 0.830 1.00 0.00 H new ATOM 0 HE3 LYS A 44 123.837 -6.742 -0.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 125.798 -5.572 0.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 125.690 -5.551 -1.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 125.294 -4.162 -0.155 1.00 0.00 H new ATOM 764 N SER A 45 119.132 -7.887 -1.125 1.00 0.00 N ATOM 765 CA SER A 45 119.183 -9.297 -0.839 1.00 0.00 C ATOM 766 C SER A 45 118.142 -9.688 0.180 1.00 0.00 C ATOM 767 O SER A 45 118.030 -9.077 1.232 1.00 0.00 O ATOM 768 CB SER A 45 120.572 -9.706 -0.325 1.00 0.00 C ATOM 769 OG SER A 45 121.588 -9.465 -1.298 1.00 0.00 O ATOM 0 H SER A 45 118.720 -7.317 -0.386 1.00 0.00 H new ATOM 0 HA SER A 45 118.978 -9.820 -1.773 1.00 0.00 H new ATOM 0 HB2 SER A 45 120.801 -9.151 0.585 1.00 0.00 H new ATOM 0 HB3 SER A 45 120.565 -10.763 -0.061 1.00 0.00 H new ATOM 0 HG SER A 45 121.172 -9.259 -2.161 1.00 0.00 H new ATOM 775 N LEU A 46 117.373 -10.668 -0.155 1.00 0.00 N ATOM 776 CA LEU A 46 116.488 -11.285 0.727 1.00 0.00 C ATOM 777 C LEU A 46 117.299 -12.159 1.650 1.00 0.00 C ATOM 778 O LEU A 46 118.047 -13.028 1.198 1.00 0.00 O ATOM 779 CB LEU A 46 115.502 -12.126 -0.078 1.00 0.00 C ATOM 780 CG LEU A 46 114.644 -13.098 0.704 1.00 0.00 C ATOM 781 CD1 LEU A 46 113.863 -12.372 1.753 1.00 0.00 C ATOM 782 CD2 LEU A 46 113.719 -13.836 -0.227 1.00 0.00 C ATOM 0 H LEU A 46 117.356 -11.065 -1.094 1.00 0.00 H new ATOM 0 HA LEU A 46 115.928 -10.554 1.310 1.00 0.00 H new ATOM 0 HB2 LEU A 46 114.842 -11.450 -0.622 1.00 0.00 H new ATOM 0 HB3 LEU A 46 116.064 -12.690 -0.823 1.00 0.00 H new ATOM 0 HG LEU A 46 115.292 -13.823 1.197 1.00 0.00 H new ATOM 0 HD11 LEU A 46 113.250 -13.083 2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 46 114.549 -11.873 2.437 1.00 0.00 H new ATOM 0 HD13 LEU A 46 113.219 -11.631 1.280 1.00 0.00 H new ATOM 0 HD21 LEU A 46 113.106 -14.533 0.345 1.00 0.00 H new ATOM 0 HD22 LEU A 46 113.074 -13.123 -0.740 1.00 0.00 H new ATOM 0 HD23 LEU A 46 114.306 -14.388 -0.961 1.00 0.00 H new ATOM 794 N VAL A 47 117.211 -11.913 2.902 1.00 0.00 N ATOM 795 CA VAL A 47 117.895 -12.714 3.841 1.00 0.00 C ATOM 796 C VAL A 47 116.954 -13.804 4.297 1.00 0.00 C ATOM 797 O VAL A 47 115.821 -13.549 4.748 1.00 0.00 O ATOM 798 CB VAL A 47 118.422 -11.887 5.036 1.00 0.00 C ATOM 799 CG1 VAL A 47 119.062 -12.777 6.060 1.00 0.00 C ATOM 800 CG2 VAL A 47 119.423 -10.844 4.575 1.00 0.00 C ATOM 0 H VAL A 47 116.664 -11.152 3.304 1.00 0.00 H new ATOM 0 HA VAL A 47 118.776 -13.152 3.371 1.00 0.00 H new ATOM 0 HB VAL A 47 117.568 -11.382 5.488 1.00 0.00 H new ATOM 0 HG11 VAL A 47 119.425 -12.173 6.891 1.00 0.00 H new ATOM 0 HG12 VAL A 47 118.329 -13.495 6.427 1.00 0.00 H new ATOM 0 HG13 VAL A 47 119.898 -13.311 5.607 1.00 0.00 H new ATOM 0 HG21 VAL A 47 119.778 -10.276 5.435 1.00 0.00 H new ATOM 0 HG22 VAL A 47 120.267 -11.338 4.092 1.00 0.00 H new ATOM 0 HG23 VAL A 47 118.944 -10.168 3.866 1.00 0.00 H new ATOM 810 N LEU A 48 117.378 -15.007 4.133 1.00 0.00 N ATOM 811 CA LEU A 48 116.565 -16.112 4.489 1.00 0.00 C ATOM 812 C LEU A 48 116.440 -16.187 5.974 1.00 0.00 C ATOM 813 O LEU A 48 117.355 -15.740 6.697 1.00 0.00 O ATOM 814 CB LEU A 48 117.092 -17.374 3.865 1.00 0.00 C ATOM 815 CG LEU A 48 117.185 -17.317 2.331 1.00 0.00 C ATOM 816 CD1 LEU A 48 117.711 -18.618 1.766 1.00 0.00 C ATOM 817 CD2 LEU A 48 115.829 -16.951 1.704 1.00 0.00 C ATOM 0 H LEU A 48 118.292 -15.251 3.751 1.00 0.00 H new ATOM 0 HA LEU A 48 115.557 -15.980 4.095 1.00 0.00 H new ATOM 0 HB2 LEU A 48 118.081 -17.584 4.272 1.00 0.00 H new ATOM 0 HB3 LEU A 48 116.447 -18.206 4.150 1.00 0.00 H new ATOM 0 HG LEU A 48 117.894 -16.531 2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 48 117.766 -18.547 0.680 1.00 0.00 H new ATOM 0 HD12 LEU A 48 118.705 -18.813 2.167 1.00 0.00 H new ATOM 0 HD13 LEU A 48 117.042 -19.432 2.043 1.00 0.00 H new ATOM 0 HD21 LEU A 48 115.927 -16.919 0.619 1.00 0.00 H new ATOM 0 HD22 LEU A 48 115.087 -17.700 1.979 1.00 0.00 H new ATOM 0 HD23 LEU A 48 115.511 -15.974 2.069 1.00 0.00 H new ATOM 829 N ASP A 49 115.289 -16.689 6.421 1.00 0.00 N ATOM 830 CA ASP A 49 114.889 -16.736 7.833 1.00 0.00 C ATOM 831 C ASP A 49 114.336 -15.354 8.267 1.00 0.00 C ATOM 832 O ASP A 49 113.990 -15.116 9.423 1.00 0.00 O ATOM 833 CB ASP A 49 116.035 -17.262 8.718 1.00 0.00 C ATOM 834 CG ASP A 49 115.644 -17.588 10.138 1.00 0.00 C ATOM 835 OD1 ASP A 49 115.069 -18.689 10.373 1.00 0.00 O ATOM 836 OD2 ASP A 49 115.948 -16.801 11.052 1.00 0.00 O ATOM 0 H ASP A 49 114.588 -17.086 5.796 1.00 0.00 H new ATOM 0 HA ASP A 49 114.078 -17.452 7.965 1.00 0.00 H new ATOM 0 HB2 ASP A 49 116.449 -18.158 8.256 1.00 0.00 H new ATOM 0 HB3 ASP A 49 116.830 -16.517 8.738 1.00 0.00 H new ATOM 841 N GLY A 50 114.240 -14.456 7.283 1.00 0.00 N ATOM 842 CA GLY A 50 113.619 -13.160 7.457 1.00 0.00 C ATOM 843 C GLY A 50 112.152 -13.235 7.157 1.00 0.00 C ATOM 844 O GLY A 50 111.767 -14.126 6.437 1.00 0.00 O ATOM 0 H GLY A 50 114.596 -14.618 6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 50 113.770 -12.813 8.479 1.00 0.00 H new ATOM 0 HA3 GLY A 50 114.094 -12.432 6.799 1.00 0.00 H new ATOM 848 N PRO A 51 111.296 -12.250 7.535 1.00 0.00 N ATOM 849 CA PRO A 51 109.869 -12.424 7.408 1.00 0.00 C ATOM 850 C PRO A 51 109.454 -12.358 5.951 1.00 0.00 C ATOM 851 O PRO A 51 108.486 -12.927 5.555 1.00 0.00 O ATOM 852 CB PRO A 51 109.264 -11.314 8.273 1.00 0.00 C ATOM 853 CG PRO A 51 110.374 -10.361 8.590 1.00 0.00 C ATOM 854 CD PRO A 51 111.608 -10.855 7.871 1.00 0.00 C ATOM 0 HA PRO A 51 109.518 -13.399 7.746 1.00 0.00 H new ATOM 0 HB2 PRO A 51 108.458 -10.806 7.743 1.00 0.00 H new ATOM 0 HB3 PRO A 51 108.835 -11.726 9.186 1.00 0.00 H new ATOM 0 HG2 PRO A 51 110.119 -9.352 8.266 1.00 0.00 H new ATOM 0 HG3 PRO A 51 110.547 -10.317 9.665 1.00 0.00 H new ATOM 0 HD2 PRO A 51 111.810 -10.266 6.977 1.00 0.00 H new ATOM 0 HD3 PRO A 51 112.492 -10.786 8.505 1.00 0.00 H new ATOM 862 N ALA A 52 110.251 -11.670 5.165 1.00 0.00 N ATOM 863 CA ALA A 52 110.049 -11.565 3.745 1.00 0.00 C ATOM 864 C ALA A 52 110.266 -12.932 3.099 1.00 0.00 C ATOM 865 O ALA A 52 109.523 -13.354 2.223 1.00 0.00 O ATOM 866 CB ALA A 52 111.033 -10.562 3.184 1.00 0.00 C ATOM 0 H ALA A 52 111.068 -11.162 5.503 1.00 0.00 H new ATOM 0 HA ALA A 52 109.033 -11.233 3.534 1.00 0.00 H new ATOM 0 HB1 ALA A 52 110.889 -10.474 2.107 1.00 0.00 H new ATOM 0 HB2 ALA A 52 110.870 -9.591 3.652 1.00 0.00 H new ATOM 0 HB3 ALA A 52 112.050 -10.897 3.388 1.00 0.00 H new ATOM 872 N ALA A 53 111.273 -13.627 3.585 1.00 0.00 N ATOM 873 CA ALA A 53 111.616 -14.947 3.106 1.00 0.00 C ATOM 874 C ALA A 53 110.514 -15.896 3.446 1.00 0.00 C ATOM 875 O ALA A 53 109.987 -16.621 2.610 1.00 0.00 O ATOM 876 CB ALA A 53 112.901 -15.414 3.794 1.00 0.00 C ATOM 0 H ALA A 53 111.881 -13.287 4.330 1.00 0.00 H new ATOM 0 HA ALA A 53 111.761 -14.918 2.026 1.00 0.00 H new ATOM 0 HB1 ALA A 53 113.164 -16.409 3.436 1.00 0.00 H new ATOM 0 HB2 ALA A 53 113.710 -14.720 3.564 1.00 0.00 H new ATOM 0 HB3 ALA A 53 112.746 -15.445 4.872 1.00 0.00 H new ATOM 882 N LEU A 54 110.159 -15.817 4.665 1.00 0.00 N ATOM 883 CA LEU A 54 109.264 -16.683 5.305 1.00 0.00 C ATOM 884 C LEU A 54 107.828 -16.531 4.913 1.00 0.00 C ATOM 885 O LEU A 54 107.167 -17.507 4.575 1.00 0.00 O ATOM 886 CB LEU A 54 109.478 -16.483 6.707 1.00 0.00 C ATOM 887 CG LEU A 54 110.929 -16.746 7.070 1.00 0.00 C ATOM 888 CD1 LEU A 54 111.025 -16.586 8.437 1.00 0.00 C ATOM 889 CD2 LEU A 54 111.405 -18.140 6.656 1.00 0.00 C ATOM 0 H LEU A 54 110.514 -15.090 5.286 1.00 0.00 H new ATOM 0 HA LEU A 54 109.468 -17.708 4.995 1.00 0.00 H new ATOM 0 HB2 LEU A 54 109.209 -15.462 6.979 1.00 0.00 H new ATOM 0 HB3 LEU A 54 108.829 -17.147 7.278 1.00 0.00 H new ATOM 0 HG LEU A 54 111.572 -16.050 6.531 1.00 0.00 H new ATOM 0 HD11 LEU A 54 112.053 -16.765 8.753 1.00 0.00 H new ATOM 0 HD12 LEU A 54 110.734 -15.571 8.706 1.00 0.00 H new ATOM 0 HD13 LEU A 54 110.364 -17.296 8.934 1.00 0.00 H new ATOM 0 HD21 LEU A 54 112.449 -18.268 6.942 1.00 0.00 H new ATOM 0 HD22 LEU A 54 110.797 -18.895 7.154 1.00 0.00 H new ATOM 0 HD23 LEU A 54 111.309 -18.252 5.576 1.00 0.00 H new ATOM 901 N ASP A 55 107.346 -15.322 4.940 1.00 0.00 N ATOM 902 CA ASP A 55 105.968 -15.027 4.570 1.00 0.00 C ATOM 903 C ASP A 55 105.861 -15.080 3.081 1.00 0.00 C ATOM 904 O ASP A 55 104.802 -15.379 2.514 1.00 0.00 O ATOM 905 CB ASP A 55 105.582 -13.623 5.030 1.00 0.00 C ATOM 906 CG ASP A 55 104.090 -13.346 5.000 1.00 0.00 C ATOM 907 OD1 ASP A 55 103.344 -13.945 5.819 1.00 0.00 O ATOM 908 OD2 ASP A 55 103.651 -12.471 4.214 1.00 0.00 O ATOM 0 H ASP A 55 107.888 -14.504 5.218 1.00 0.00 H new ATOM 0 HA ASP A 55 105.306 -15.753 5.041 1.00 0.00 H new ATOM 0 HB2 ASP A 55 105.948 -13.472 6.046 1.00 0.00 H new ATOM 0 HB3 ASP A 55 106.088 -12.894 4.398 1.00 0.00 H new ATOM 913 N GLY A 56 106.994 -14.860 2.447 1.00 0.00 N ATOM 914 CA GLY A 56 107.035 -14.796 1.014 1.00 0.00 C ATOM 915 C GLY A 56 106.564 -13.442 0.514 1.00 0.00 C ATOM 916 O GLY A 56 106.564 -12.460 1.280 1.00 0.00 O ATOM 0 H GLY A 56 107.894 -14.724 2.907 1.00 0.00 H new ATOM 0 HA2 GLY A 56 108.052 -14.982 0.667 1.00 0.00 H new ATOM 0 HA3 GLY A 56 106.407 -15.581 0.594 1.00 0.00 H new ATOM 920 N LYS A 57 106.183 -13.390 -0.759 1.00 0.00 N ATOM 921 CA LYS A 57 105.652 -12.193 -1.445 1.00 0.00 C ATOM 922 C LYS A 57 106.724 -11.111 -1.663 1.00 0.00 C ATOM 923 O LYS A 57 107.034 -10.772 -2.797 1.00 0.00 O ATOM 924 CB LYS A 57 104.411 -11.614 -0.719 1.00 0.00 C ATOM 925 CG LYS A 57 103.744 -10.434 -1.427 1.00 0.00 C ATOM 926 CD LYS A 57 102.605 -9.875 -0.588 1.00 0.00 C ATOM 927 CE LYS A 57 101.885 -8.722 -1.278 1.00 0.00 C ATOM 928 NZ LYS A 57 101.153 -9.158 -2.479 1.00 0.00 N ATOM 0 H LYS A 57 106.233 -14.204 -1.372 1.00 0.00 H new ATOM 0 HA LYS A 57 105.333 -12.527 -2.433 1.00 0.00 H new ATOM 0 HB2 LYS A 57 103.675 -12.409 -0.597 1.00 0.00 H new ATOM 0 HB3 LYS A 57 104.708 -11.298 0.281 1.00 0.00 H new ATOM 0 HG2 LYS A 57 104.481 -9.653 -1.615 1.00 0.00 H new ATOM 0 HG3 LYS A 57 103.364 -10.754 -2.397 1.00 0.00 H new ATOM 0 HD2 LYS A 57 101.891 -10.670 -0.375 1.00 0.00 H new ATOM 0 HD3 LYS A 57 102.997 -9.533 0.370 1.00 0.00 H new ATOM 0 HE2 LYS A 57 101.188 -8.261 -0.578 1.00 0.00 H new ATOM 0 HE3 LYS A 57 102.611 -7.957 -1.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 100.585 -8.367 -2.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 101.830 -9.464 -3.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 100.526 -9.951 -2.235 1.00 0.00 H new ATOM 942 N MET A 58 107.283 -10.605 -0.586 1.00 0.00 N ATOM 943 CA MET A 58 108.288 -9.545 -0.629 1.00 0.00 C ATOM 944 C MET A 58 109.625 -10.159 -1.024 1.00 0.00 C ATOM 945 O MET A 58 109.981 -11.250 -0.539 1.00 0.00 O ATOM 946 CB MET A 58 108.322 -8.830 0.737 1.00 0.00 C ATOM 947 CG MET A 58 109.276 -7.670 0.868 1.00 0.00 C ATOM 948 SD MET A 58 110.996 -8.132 1.029 1.00 0.00 S ATOM 949 CE MET A 58 111.659 -6.549 1.403 1.00 0.00 C ATOM 0 H MET A 58 107.056 -10.916 0.359 1.00 0.00 H new ATOM 0 HA MET A 58 108.047 -8.788 -1.376 1.00 0.00 H new ATOM 0 HB2 MET A 58 107.317 -8.471 0.959 1.00 0.00 H new ATOM 0 HB3 MET A 58 108.574 -9.566 1.501 1.00 0.00 H new ATOM 0 HG2 MET A 58 109.167 -7.027 -0.005 1.00 0.00 H new ATOM 0 HG3 MET A 58 108.990 -7.078 1.737 1.00 0.00 H new ATOM 0 HE1 MET A 58 112.742 -6.570 1.279 1.00 0.00 H new ATOM 0 HE2 MET A 58 111.231 -5.807 0.729 1.00 0.00 H new ATOM 0 HE3 MET A 58 111.416 -6.287 2.433 1.00 0.00 H new ATOM 959 N GLU A 59 110.343 -9.497 -1.920 1.00 0.00 N ATOM 960 CA GLU A 59 111.528 -10.075 -2.525 1.00 0.00 C ATOM 961 C GLU A 59 112.573 -9.012 -2.803 1.00 0.00 C ATOM 962 O GLU A 59 112.300 -7.810 -2.719 1.00 0.00 O ATOM 963 CB GLU A 59 111.158 -10.750 -3.862 1.00 0.00 C ATOM 964 CG GLU A 59 110.081 -11.817 -3.758 1.00 0.00 C ATOM 965 CD GLU A 59 109.793 -12.499 -5.052 1.00 0.00 C ATOM 966 OE1 GLU A 59 108.904 -12.044 -5.797 1.00 0.00 O ATOM 967 OE2 GLU A 59 110.428 -13.549 -5.335 1.00 0.00 O ATOM 0 H GLU A 59 110.122 -8.555 -2.243 1.00 0.00 H new ATOM 0 HA GLU A 59 111.934 -10.806 -1.826 1.00 0.00 H new ATOM 0 HB2 GLU A 59 110.824 -9.983 -4.560 1.00 0.00 H new ATOM 0 HB3 GLU A 59 112.056 -11.199 -4.287 1.00 0.00 H new ATOM 0 HG2 GLU A 59 110.388 -12.562 -3.024 1.00 0.00 H new ATOM 0 HG3 GLU A 59 109.164 -11.361 -3.385 1.00 0.00 H new ATOM 974 N THR A 60 113.779 -9.466 -3.102 1.00 0.00 N ATOM 975 CA THR A 60 114.844 -8.621 -3.524 1.00 0.00 C ATOM 976 C THR A 60 114.397 -7.872 -4.789 1.00 0.00 C ATOM 977 O THR A 60 113.927 -8.496 -5.755 1.00 0.00 O ATOM 978 CB THR A 60 116.027 -9.500 -3.887 1.00 0.00 C ATOM 979 OG1 THR A 60 116.271 -10.448 -2.842 1.00 0.00 O ATOM 980 CG2 THR A 60 117.236 -8.674 -4.072 1.00 0.00 C ATOM 0 H THR A 60 114.033 -10.453 -3.052 1.00 0.00 H new ATOM 0 HA THR A 60 115.111 -7.916 -2.736 1.00 0.00 H new ATOM 0 HB THR A 60 115.796 -10.024 -4.814 1.00 0.00 H new ATOM 0 HG1 THR A 60 117.035 -11.013 -3.084 1.00 0.00 H new ATOM 0 HG21 THR A 60 118.078 -9.315 -4.332 1.00 0.00 H new ATOM 0 HG22 THR A 60 117.066 -7.955 -4.873 1.00 0.00 H new ATOM 0 HG23 THR A 60 117.458 -8.141 -3.147 1.00 0.00 H new ATOM 988 N GLY A 61 114.527 -6.573 -4.785 1.00 0.00 N ATOM 989 CA GLY A 61 114.082 -5.806 -5.911 1.00 0.00 C ATOM 990 C GLY A 61 113.012 -4.820 -5.520 1.00 0.00 C ATOM 991 O GLY A 61 112.630 -3.943 -6.314 1.00 0.00 O ATOM 0 H GLY A 61 114.933 -6.030 -4.023 1.00 0.00 H new ATOM 0 HA2 GLY A 61 114.927 -5.273 -6.347 1.00 0.00 H new ATOM 0 HA3 GLY A 61 113.697 -6.476 -6.680 1.00 0.00 H new ATOM 995 N ASP A 62 112.472 -5.002 -4.318 1.00 0.00 N ATOM 996 CA ASP A 62 111.537 -4.035 -3.747 1.00 0.00 C ATOM 997 C ASP A 62 112.308 -2.828 -3.267 1.00 0.00 C ATOM 998 O ASP A 62 113.532 -2.882 -3.102 1.00 0.00 O ATOM 999 CB ASP A 62 110.734 -4.600 -2.547 1.00 0.00 C ATOM 1000 CG ASP A 62 109.581 -5.522 -2.904 1.00 0.00 C ATOM 1001 OD1 ASP A 62 108.706 -5.113 -3.683 1.00 0.00 O ATOM 1002 OD2 ASP A 62 109.528 -6.685 -2.418 1.00 0.00 O ATOM 0 H ASP A 62 112.664 -5.807 -3.722 1.00 0.00 H new ATOM 0 HA ASP A 62 110.827 -3.780 -4.534 1.00 0.00 H new ATOM 0 HB2 ASP A 62 111.421 -5.142 -1.896 1.00 0.00 H new ATOM 0 HB3 ASP A 62 110.341 -3.763 -1.970 1.00 0.00 H new ATOM 1007 N VAL A 63 111.636 -1.742 -3.078 1.00 0.00 N ATOM 1008 CA VAL A 63 112.261 -0.575 -2.521 1.00 0.00 C ATOM 1009 C VAL A 63 111.506 -0.159 -1.282 1.00 0.00 C ATOM 1010 O VAL A 63 110.286 -0.115 -1.285 1.00 0.00 O ATOM 1011 CB VAL A 63 112.378 0.626 -3.525 1.00 0.00 C ATOM 1012 CG1 VAL A 63 113.012 0.204 -4.812 1.00 0.00 C ATOM 1013 CG2 VAL A 63 111.053 1.260 -3.821 1.00 0.00 C ATOM 0 H VAL A 63 110.647 -1.632 -3.301 1.00 0.00 H new ATOM 0 HA VAL A 63 113.287 -0.847 -2.275 1.00 0.00 H new ATOM 0 HB VAL A 63 113.010 1.364 -3.030 1.00 0.00 H new ATOM 0 HG11 VAL A 63 113.077 1.060 -5.483 1.00 0.00 H new ATOM 0 HG12 VAL A 63 114.013 -0.180 -4.616 1.00 0.00 H new ATOM 0 HG13 VAL A 63 112.409 -0.576 -5.276 1.00 0.00 H new ATOM 0 HG21 VAL A 63 111.192 2.085 -4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 63 110.386 0.519 -4.262 1.00 0.00 H new ATOM 0 HG23 VAL A 63 110.616 1.638 -2.897 1.00 0.00 H new ATOM 1023 N ILE A 64 112.216 0.127 -0.247 1.00 0.00 N ATOM 1024 CA ILE A 64 111.628 0.520 0.983 1.00 0.00 C ATOM 1025 C ILE A 64 111.271 1.991 0.908 1.00 0.00 C ATOM 1026 O ILE A 64 112.196 2.907 0.867 1.00 0.00 O ATOM 1027 CB ILE A 64 112.543 0.262 2.193 1.00 0.00 C ATOM 1028 CG1 ILE A 64 112.848 -1.223 2.343 1.00 0.00 C ATOM 1029 CG2 ILE A 64 111.953 0.835 3.490 1.00 0.00 C ATOM 1030 CD1 ILE A 64 111.637 -2.082 2.669 1.00 0.00 C ATOM 0 H ILE A 64 113.235 0.094 -0.232 1.00 0.00 H new ATOM 0 HA ILE A 64 110.735 -0.087 1.133 1.00 0.00 H new ATOM 0 HB ILE A 64 113.481 0.785 2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 64 113.297 -1.585 1.418 1.00 0.00 H new ATOM 0 HG13 ILE A 64 113.592 -1.351 3.129 1.00 0.00 H new ATOM 0 HG21 ILE A 64 112.630 0.631 4.319 1.00 0.00 H new ATOM 0 HG22 ILE A 64 111.822 1.912 3.385 1.00 0.00 H new ATOM 0 HG23 ILE A 64 110.987 0.369 3.687 1.00 0.00 H new ATOM 0 HD11 ILE A 64 111.944 -3.124 2.758 1.00 0.00 H new ATOM 0 HD12 ILE A 64 111.199 -1.751 3.610 1.00 0.00 H new ATOM 0 HD13 ILE A 64 110.899 -1.988 1.872 1.00 0.00 H new ATOM 1042 N VAL A 65 109.960 2.196 0.847 1.00 0.00 N ATOM 1043 CA VAL A 65 109.329 3.473 0.751 1.00 0.00 C ATOM 1044 C VAL A 65 108.916 3.950 2.143 1.00 0.00 C ATOM 1045 O VAL A 65 109.300 5.006 2.567 1.00 0.00 O ATOM 1046 CB VAL A 65 108.066 3.381 -0.177 1.00 0.00 C ATOM 1047 CG1 VAL A 65 107.331 4.707 -0.300 1.00 0.00 C ATOM 1048 CG2 VAL A 65 108.449 2.869 -1.550 1.00 0.00 C ATOM 0 H VAL A 65 109.290 1.427 0.865 1.00 0.00 H new ATOM 0 HA VAL A 65 110.033 4.186 0.321 1.00 0.00 H new ATOM 0 HB VAL A 65 107.382 2.676 0.295 1.00 0.00 H new ATOM 0 HG11 VAL A 65 106.467 4.585 -0.953 1.00 0.00 H new ATOM 0 HG12 VAL A 65 106.998 5.031 0.686 1.00 0.00 H new ATOM 0 HG13 VAL A 65 108.001 5.457 -0.721 1.00 0.00 H new ATOM 0 HG21 VAL A 65 107.560 2.812 -2.178 1.00 0.00 H new ATOM 0 HG22 VAL A 65 109.171 3.548 -2.003 1.00 0.00 H new ATOM 0 HG23 VAL A 65 108.892 1.877 -1.458 1.00 0.00 H new ATOM 1058 N SER A 66 108.135 3.169 2.852 1.00 0.00 N ATOM 1059 CA SER A 66 107.667 3.561 4.183 1.00 0.00 C ATOM 1060 C SER A 66 107.300 2.320 4.996 1.00 0.00 C ATOM 1061 O SER A 66 107.314 1.208 4.466 1.00 0.00 O ATOM 1062 CB SER A 66 106.453 4.512 4.071 1.00 0.00 C ATOM 1063 OG SER A 66 106.772 5.689 3.327 1.00 0.00 O ATOM 0 H SER A 66 107.804 2.256 2.539 1.00 0.00 H new ATOM 0 HA SER A 66 108.471 4.090 4.695 1.00 0.00 H new ATOM 0 HB2 SER A 66 105.625 3.991 3.590 1.00 0.00 H new ATOM 0 HB3 SER A 66 106.117 4.792 5.069 1.00 0.00 H new ATOM 0 HG SER A 66 107.723 5.679 3.091 1.00 0.00 H new ATOM 1069 N VAL A 67 106.991 2.500 6.264 1.00 0.00 N ATOM 1070 CA VAL A 67 106.604 1.400 7.104 1.00 0.00 C ATOM 1071 C VAL A 67 105.553 1.881 8.116 1.00 0.00 C ATOM 1072 O VAL A 67 105.812 2.802 8.871 1.00 0.00 O ATOM 1073 CB VAL A 67 107.845 0.729 7.782 1.00 0.00 C ATOM 1074 CG1 VAL A 67 108.552 1.613 8.780 1.00 0.00 C ATOM 1075 CG2 VAL A 67 107.468 -0.555 8.404 1.00 0.00 C ATOM 0 H VAL A 67 107.003 3.406 6.732 1.00 0.00 H new ATOM 0 HA VAL A 67 106.150 0.619 6.494 1.00 0.00 H new ATOM 0 HB VAL A 67 108.561 0.551 6.980 1.00 0.00 H new ATOM 0 HG11 VAL A 67 109.400 1.076 9.205 1.00 0.00 H new ATOM 0 HG12 VAL A 67 108.907 2.514 8.280 1.00 0.00 H new ATOM 0 HG13 VAL A 67 107.860 1.888 9.576 1.00 0.00 H new ATOM 0 HG21 VAL A 67 108.345 -1.005 8.870 1.00 0.00 H new ATOM 0 HG22 VAL A 67 106.704 -0.382 9.161 1.00 0.00 H new ATOM 0 HG23 VAL A 67 107.077 -1.228 7.641 1.00 0.00 H new ATOM 1085 N ASN A 68 104.366 1.244 8.070 1.00 0.00 N ATOM 1086 CA ASN A 68 103.131 1.613 8.819 1.00 0.00 C ATOM 1087 C ASN A 68 103.118 3.034 9.399 1.00 0.00 C ATOM 1088 O ASN A 68 103.519 3.259 10.546 1.00 0.00 O ATOM 1089 CB ASN A 68 102.696 0.532 9.837 1.00 0.00 C ATOM 1090 CG ASN A 68 103.734 0.178 10.861 1.00 0.00 C ATOM 1091 OD1 ASN A 68 104.572 -0.634 10.604 1.00 0.00 O ATOM 1092 ND2 ASN A 68 103.659 0.723 12.030 1.00 0.00 N ATOM 0 H ASN A 68 104.228 0.420 7.485 1.00 0.00 H new ATOM 0 HA ASN A 68 102.357 1.642 8.052 1.00 0.00 H new ATOM 0 HB2 ASN A 68 101.800 0.878 10.353 1.00 0.00 H new ATOM 0 HB3 ASN A 68 102.421 -0.371 9.292 1.00 0.00 H new ATOM 0 HD21 ASN A 68 104.324 0.462 12.758 1.00 0.00 H new ATOM 0 HD22 ASN A 68 102.934 1.414 12.225 1.00 0.00 H new ATOM 1099 N ASP A 69 102.723 3.995 8.552 1.00 0.00 N ATOM 1100 CA ASP A 69 102.616 5.448 8.881 1.00 0.00 C ATOM 1101 C ASP A 69 103.980 6.148 8.967 1.00 0.00 C ATOM 1102 O ASP A 69 104.123 7.293 8.546 1.00 0.00 O ATOM 1103 CB ASP A 69 101.779 5.711 10.151 1.00 0.00 C ATOM 1104 CG ASP A 69 101.637 7.185 10.469 1.00 0.00 C ATOM 1105 OD1 ASP A 69 102.505 7.746 11.175 1.00 0.00 O ATOM 1106 OD2 ASP A 69 100.640 7.807 10.036 1.00 0.00 O ATOM 0 H ASP A 69 102.459 3.791 7.588 1.00 0.00 H new ATOM 0 HA ASP A 69 102.082 5.891 8.040 1.00 0.00 H new ATOM 0 HB2 ASP A 69 100.788 5.275 10.024 1.00 0.00 H new ATOM 0 HB3 ASP A 69 102.244 5.205 10.997 1.00 0.00 H new ATOM 1111 N THR A 70 104.963 5.460 9.493 1.00 0.00 N ATOM 1112 CA THR A 70 106.293 5.992 9.621 1.00 0.00 C ATOM 1113 C THR A 70 106.913 6.204 8.237 1.00 0.00 C ATOM 1114 O THR A 70 106.999 5.273 7.398 1.00 0.00 O ATOM 1115 CB THR A 70 107.152 5.056 10.481 1.00 0.00 C ATOM 1116 OG1 THR A 70 106.515 4.896 11.773 1.00 0.00 O ATOM 1117 CG2 THR A 70 108.566 5.595 10.670 1.00 0.00 C ATOM 0 H THR A 70 104.860 4.509 9.846 1.00 0.00 H new ATOM 0 HA THR A 70 106.247 6.961 10.119 1.00 0.00 H new ATOM 0 HB THR A 70 107.233 4.097 9.970 1.00 0.00 H new ATOM 0 HG1 THR A 70 107.054 4.298 12.332 1.00 0.00 H new ATOM 0 HG21 THR A 70 109.140 4.902 11.285 1.00 0.00 H new ATOM 0 HG22 THR A 70 109.047 5.703 9.698 1.00 0.00 H new ATOM 0 HG23 THR A 70 108.522 6.566 11.163 1.00 0.00 H new ATOM 1125 N CYS A 71 107.346 7.406 8.015 1.00 0.00 N ATOM 1126 CA CYS A 71 107.840 7.809 6.749 1.00 0.00 C ATOM 1127 C CYS A 71 109.326 7.541 6.649 1.00 0.00 C ATOM 1128 O CYS A 71 110.155 8.364 7.024 1.00 0.00 O ATOM 1129 CB CYS A 71 107.527 9.278 6.509 1.00 0.00 C ATOM 1130 SG CYS A 71 107.976 9.866 4.862 1.00 0.00 S ATOM 0 H CYS A 71 107.364 8.140 8.723 1.00 0.00 H new ATOM 0 HA CYS A 71 107.345 7.225 5.974 1.00 0.00 H new ATOM 0 HB2 CYS A 71 106.460 9.441 6.663 1.00 0.00 H new ATOM 0 HB3 CYS A 71 108.052 9.877 7.253 1.00 0.00 H new ATOM 0 HG CYS A 71 109.199 9.517 4.595 1.00 0.00 H new ATOM 1136 N VAL A 72 109.649 6.373 6.154 1.00 0.00 N ATOM 1137 CA VAL A 72 111.031 5.963 5.935 1.00 0.00 C ATOM 1138 C VAL A 72 111.481 6.459 4.549 1.00 0.00 C ATOM 1139 O VAL A 72 112.611 6.239 4.093 1.00 0.00 O ATOM 1140 CB VAL A 72 111.150 4.410 6.062 1.00 0.00 C ATOM 1141 CG1 VAL A 72 112.571 3.914 5.891 1.00 0.00 C ATOM 1142 CG2 VAL A 72 110.629 3.977 7.405 1.00 0.00 C ATOM 0 H VAL A 72 108.962 5.668 5.887 1.00 0.00 H new ATOM 0 HA VAL A 72 111.684 6.403 6.689 1.00 0.00 H new ATOM 0 HB VAL A 72 110.557 3.974 5.258 1.00 0.00 H new ATOM 0 HG11 VAL A 72 112.592 2.829 5.989 1.00 0.00 H new ATOM 0 HG12 VAL A 72 112.939 4.196 4.904 1.00 0.00 H new ATOM 0 HG13 VAL A 72 113.207 4.360 6.656 1.00 0.00 H new ATOM 0 HG21 VAL A 72 110.711 2.894 7.495 1.00 0.00 H new ATOM 0 HG22 VAL A 72 111.214 4.452 8.193 1.00 0.00 H new ATOM 0 HG23 VAL A 72 109.584 4.271 7.502 1.00 0.00 H new ATOM 1152 N LEU A 73 110.597 7.174 3.912 1.00 0.00 N ATOM 1153 CA LEU A 73 110.843 7.688 2.630 1.00 0.00 C ATOM 1154 C LEU A 73 111.757 8.869 2.787 1.00 0.00 C ATOM 1155 O LEU A 73 111.366 9.929 3.304 1.00 0.00 O ATOM 1156 CB LEU A 73 109.502 8.074 2.044 1.00 0.00 C ATOM 1157 CG LEU A 73 109.431 8.302 0.558 1.00 0.00 C ATOM 1158 CD1 LEU A 73 110.072 7.144 -0.175 1.00 0.00 C ATOM 1159 CD2 LEU A 73 107.989 8.389 0.172 1.00 0.00 C ATOM 0 H LEU A 73 109.679 7.409 4.289 1.00 0.00 H new ATOM 0 HA LEU A 73 111.322 6.973 1.962 1.00 0.00 H new ATOM 0 HB2 LEU A 73 108.786 7.292 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 73 109.168 8.985 2.540 1.00 0.00 H new ATOM 0 HG LEU A 73 109.958 9.219 0.297 1.00 0.00 H new ATOM 0 HD11 LEU A 73 110.016 7.318 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 73 111.116 7.057 0.125 1.00 0.00 H new ATOM 0 HD13 LEU A 73 109.546 6.222 0.071 1.00 0.00 H new ATOM 0 HD21 LEU A 73 107.909 8.554 -0.902 1.00 0.00 H new ATOM 0 HD22 LEU A 73 107.485 7.459 0.434 1.00 0.00 H new ATOM 0 HD23 LEU A 73 107.520 9.218 0.702 1.00 0.00 H new ATOM 1171 N GLY A 74 112.963 8.687 2.322 1.00 0.00 N ATOM 1172 CA GLY A 74 113.972 9.660 2.519 1.00 0.00 C ATOM 1173 C GLY A 74 114.421 9.685 3.963 1.00 0.00 C ATOM 1174 O GLY A 74 114.628 10.750 4.537 1.00 0.00 O ATOM 0 H GLY A 74 113.261 7.862 1.801 1.00 0.00 H new ATOM 0 HA2 GLY A 74 114.823 9.444 1.873 1.00 0.00 H new ATOM 0 HA3 GLY A 74 113.596 10.643 2.233 1.00 0.00 H new ATOM 1178 N HIS A 75 114.507 8.528 4.570 1.00 0.00 N ATOM 1179 CA HIS A 75 114.969 8.434 5.921 1.00 0.00 C ATOM 1180 C HIS A 75 116.476 8.452 5.897 1.00 0.00 C ATOM 1181 O HIS A 75 117.087 7.970 4.946 1.00 0.00 O ATOM 1182 CB HIS A 75 114.476 7.143 6.563 1.00 0.00 C ATOM 1183 CG HIS A 75 113.848 7.331 7.902 1.00 0.00 C ATOM 1184 ND1 HIS A 75 112.643 7.968 8.128 1.00 0.00 N ATOM 1185 CD2 HIS A 75 114.285 6.948 9.093 1.00 0.00 C ATOM 1186 CE1 HIS A 75 112.407 7.946 9.436 1.00 0.00 C ATOM 1187 NE2 HIS A 75 113.378 7.337 10.075 1.00 0.00 N ATOM 0 H HIS A 75 114.260 7.636 4.142 1.00 0.00 H new ATOM 0 HA HIS A 75 114.585 9.270 6.506 1.00 0.00 H new ATOM 0 HB2 HIS A 75 113.753 6.672 5.897 1.00 0.00 H new ATOM 0 HB3 HIS A 75 115.315 6.455 6.661 1.00 0.00 H new ATOM 0 HD1 HIS A 75 112.041 8.382 7.417 1.00 0.00 H new ATOM 0 HD2 HIS A 75 115.206 6.414 9.275 1.00 0.00 H new ATOM 0 HE1 HIS A 75 111.534 8.372 9.909 1.00 0.00 H new ATOM 1195 N THR A 76 117.070 9.041 6.900 1.00 0.00 N ATOM 1196 CA THR A 76 118.500 9.074 6.982 1.00 0.00 C ATOM 1197 C THR A 76 118.973 7.685 7.414 1.00 0.00 C ATOM 1198 O THR A 76 118.277 7.075 8.232 1.00 0.00 O ATOM 1199 CB THR A 76 118.900 10.118 8.052 1.00 0.00 C ATOM 1200 OG1 THR A 76 118.361 11.407 7.698 1.00 0.00 O ATOM 1201 CG2 THR A 76 120.407 10.222 8.245 1.00 0.00 C ATOM 0 H THR A 76 116.584 9.503 7.669 1.00 0.00 H new ATOM 0 HA THR A 76 118.949 9.342 6.026 1.00 0.00 H new ATOM 0 HB THR A 76 118.482 9.781 9.001 1.00 0.00 H new ATOM 0 HG1 THR A 76 118.614 12.066 8.378 1.00 0.00 H new ATOM 0 HG21 THR A 76 120.625 10.970 9.007 1.00 0.00 H new ATOM 0 HG22 THR A 76 120.801 9.256 8.561 1.00 0.00 H new ATOM 0 HG23 THR A 76 120.875 10.515 7.305 1.00 0.00 H new ATOM 1209 N HIS A 77 120.096 7.184 6.886 1.00 0.00 N ATOM 1210 CA HIS A 77 120.567 5.815 7.200 1.00 0.00 C ATOM 1211 C HIS A 77 120.571 5.527 8.659 1.00 0.00 C ATOM 1212 O HIS A 77 120.011 4.544 9.089 1.00 0.00 O ATOM 1213 CB HIS A 77 121.944 5.518 6.580 1.00 0.00 C ATOM 1214 CG HIS A 77 122.443 4.121 6.862 1.00 0.00 C ATOM 1215 ND1 HIS A 77 122.180 3.022 6.078 1.00 0.00 N ATOM 1216 CD2 HIS A 77 123.211 3.673 7.873 1.00 0.00 C ATOM 1217 CE1 HIS A 77 122.796 1.969 6.632 1.00 0.00 C ATOM 1218 NE2 HIS A 77 123.440 2.318 7.727 1.00 0.00 N ATOM 0 H HIS A 77 120.698 7.697 6.242 1.00 0.00 H new ATOM 0 HA HIS A 77 119.842 5.142 6.742 1.00 0.00 H new ATOM 0 HB2 HIS A 77 121.887 5.664 5.501 1.00 0.00 H new ATOM 0 HB3 HIS A 77 122.668 6.238 6.961 1.00 0.00 H new ATOM 0 HD1 HIS A 77 121.617 3.011 5.227 1.00 0.00 H new ATOM 0 HD2 HIS A 77 123.592 4.283 8.679 1.00 0.00 H new ATOM 0 HE1 HIS A 77 122.768 0.966 6.233 1.00 0.00 H new ATOM 1226 N ALA A 78 121.123 6.439 9.400 1.00 0.00 N ATOM 1227 CA ALA A 78 121.264 6.305 10.836 1.00 0.00 C ATOM 1228 C ALA A 78 119.899 6.151 11.495 1.00 0.00 C ATOM 1229 O ALA A 78 119.719 5.363 12.418 1.00 0.00 O ATOM 1230 CB ALA A 78 121.996 7.511 11.383 1.00 0.00 C ATOM 0 H ALA A 78 121.496 7.313 9.029 1.00 0.00 H new ATOM 0 HA ALA A 78 121.843 5.409 11.060 1.00 0.00 H new ATOM 0 HB1 ALA A 78 122.103 7.412 12.463 1.00 0.00 H new ATOM 0 HB2 ALA A 78 122.983 7.576 10.925 1.00 0.00 H new ATOM 0 HB3 ALA A 78 121.430 8.414 11.156 1.00 0.00 H new ATOM 1236 N GLN A 79 118.928 6.848 10.948 1.00 0.00 N ATOM 1237 CA GLN A 79 117.599 6.827 11.471 1.00 0.00 C ATOM 1238 C GLN A 79 116.903 5.522 11.116 1.00 0.00 C ATOM 1239 O GLN A 79 116.394 4.826 11.991 1.00 0.00 O ATOM 1240 CB GLN A 79 116.805 8.018 10.948 1.00 0.00 C ATOM 1241 CG GLN A 79 117.359 9.368 11.360 1.00 0.00 C ATOM 1242 CD GLN A 79 117.474 9.539 12.857 1.00 0.00 C ATOM 1243 OE1 GLN A 79 116.703 8.982 13.633 1.00 0.00 O ATOM 1244 NE2 GLN A 79 118.449 10.284 13.265 1.00 0.00 N ATOM 0 H GLN A 79 119.047 7.443 10.128 1.00 0.00 H new ATOM 0 HA GLN A 79 117.654 6.898 12.557 1.00 0.00 H new ATOM 0 HB2 GLN A 79 116.773 7.969 9.860 1.00 0.00 H new ATOM 0 HB3 GLN A 79 115.777 7.937 11.301 1.00 0.00 H new ATOM 0 HG2 GLN A 79 118.343 9.501 10.910 1.00 0.00 H new ATOM 0 HG3 GLN A 79 116.717 10.153 10.961 1.00 0.00 H new ATOM 0 HE21 GLN A 79 119.068 10.730 12.588 1.00 0.00 H new ATOM 0 HE22 GLN A 79 118.599 10.426 14.264 1.00 0.00 H new ATOM 1253 N VAL A 80 116.927 5.175 9.834 1.00 0.00 N ATOM 1254 CA VAL A 80 116.266 3.974 9.354 1.00 0.00 C ATOM 1255 C VAL A 80 116.885 2.708 9.947 1.00 0.00 C ATOM 1256 O VAL A 80 116.156 1.825 10.425 1.00 0.00 O ATOM 1257 CB VAL A 80 116.186 3.891 7.791 1.00 0.00 C ATOM 1258 CG1 VAL A 80 117.555 3.991 7.144 1.00 0.00 C ATOM 1259 CG2 VAL A 80 115.483 2.603 7.377 1.00 0.00 C ATOM 0 H VAL A 80 117.400 5.713 9.108 1.00 0.00 H new ATOM 0 HA VAL A 80 115.238 4.043 9.709 1.00 0.00 H new ATOM 0 HB VAL A 80 115.607 4.745 7.439 1.00 0.00 H new ATOM 0 HG11 VAL A 80 117.451 3.929 6.061 1.00 0.00 H new ATOM 0 HG12 VAL A 80 118.015 4.943 7.410 1.00 0.00 H new ATOM 0 HG13 VAL A 80 118.184 3.173 7.496 1.00 0.00 H new ATOM 0 HG21 VAL A 80 115.430 2.551 6.290 1.00 0.00 H new ATOM 0 HG22 VAL A 80 116.041 1.746 7.755 1.00 0.00 H new ATOM 0 HG23 VAL A 80 114.474 2.590 7.790 1.00 0.00 H new ATOM 1269 N VAL A 81 118.219 2.654 9.981 1.00 0.00 N ATOM 1270 CA VAL A 81 118.921 1.495 10.508 1.00 0.00 C ATOM 1271 C VAL A 81 118.549 1.284 11.951 1.00 0.00 C ATOM 1272 O VAL A 81 118.240 0.194 12.346 1.00 0.00 O ATOM 1273 CB VAL A 81 120.500 1.543 10.323 1.00 0.00 C ATOM 1274 CG1 VAL A 81 121.174 2.627 11.153 1.00 0.00 C ATOM 1275 CG2 VAL A 81 121.132 0.191 10.615 1.00 0.00 C ATOM 0 H VAL A 81 118.828 3.401 9.649 1.00 0.00 H new ATOM 0 HA VAL A 81 118.595 0.642 9.912 1.00 0.00 H new ATOM 0 HB VAL A 81 120.665 1.797 9.276 1.00 0.00 H new ATOM 0 HG11 VAL A 81 122.250 2.603 10.978 1.00 0.00 H new ATOM 0 HG12 VAL A 81 120.781 3.602 10.865 1.00 0.00 H new ATOM 0 HG13 VAL A 81 120.974 2.453 12.210 1.00 0.00 H new ATOM 0 HG21 VAL A 81 122.212 0.257 10.480 1.00 0.00 H new ATOM 0 HG22 VAL A 81 120.912 -0.099 11.642 1.00 0.00 H new ATOM 0 HG23 VAL A 81 120.726 -0.556 9.932 1.00 0.00 H new ATOM 1285 N LYS A 82 118.480 2.359 12.688 1.00 0.00 N ATOM 1286 CA LYS A 82 118.163 2.319 14.086 1.00 0.00 C ATOM 1287 C LYS A 82 116.740 1.826 14.356 1.00 0.00 C ATOM 1288 O LYS A 82 116.532 1.076 15.279 1.00 0.00 O ATOM 1289 CB LYS A 82 118.334 3.689 14.645 1.00 0.00 C ATOM 1290 CG LYS A 82 117.916 3.851 16.085 1.00 0.00 C ATOM 1291 CD LYS A 82 117.929 5.302 16.467 1.00 0.00 C ATOM 1292 CE LYS A 82 116.943 6.119 15.615 1.00 0.00 C ATOM 1293 NZ LYS A 82 116.872 7.528 16.023 1.00 0.00 N ATOM 0 H LYS A 82 118.645 3.299 12.328 1.00 0.00 H new ATOM 0 HA LYS A 82 118.837 1.610 14.566 1.00 0.00 H new ATOM 0 HB2 LYS A 82 119.382 3.973 14.553 1.00 0.00 H new ATOM 0 HB3 LYS A 82 117.760 4.387 14.036 1.00 0.00 H new ATOM 0 HG2 LYS A 82 116.918 3.438 16.230 1.00 0.00 H new ATOM 0 HG3 LYS A 82 118.590 3.291 16.733 1.00 0.00 H new ATOM 0 HD2 LYS A 82 117.671 5.404 17.521 1.00 0.00 H new ATOM 0 HD3 LYS A 82 118.935 5.702 16.345 1.00 0.00 H new ATOM 0 HE2 LYS A 82 117.241 6.063 14.568 1.00 0.00 H new ATOM 0 HE3 LYS A 82 115.951 5.674 15.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 116.966 8.137 15.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 115.957 7.711 16.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 117.642 7.736 16.690 1.00 0.00 H new ATOM 1307 N ILE A 83 115.778 2.221 13.543 1.00 0.00 N ATOM 1308 CA ILE A 83 114.390 1.843 13.805 1.00 0.00 C ATOM 1309 C ILE A 83 114.236 0.374 13.520 1.00 0.00 C ATOM 1310 O ILE A 83 113.740 -0.406 14.338 1.00 0.00 O ATOM 1311 CB ILE A 83 113.390 2.661 12.942 1.00 0.00 C ATOM 1312 CG1 ILE A 83 113.509 4.155 13.273 1.00 0.00 C ATOM 1313 CG2 ILE A 83 111.949 2.173 13.165 1.00 0.00 C ATOM 1314 CD1 ILE A 83 112.613 5.041 12.443 1.00 0.00 C ATOM 0 H ILE A 83 115.920 2.792 12.710 1.00 0.00 H new ATOM 0 HA ILE A 83 114.161 2.059 14.848 1.00 0.00 H new ATOM 0 HB ILE A 83 113.638 2.512 11.891 1.00 0.00 H new ATOM 0 HG12 ILE A 83 113.274 4.303 14.327 1.00 0.00 H new ATOM 0 HG13 ILE A 83 114.544 4.467 13.131 1.00 0.00 H new ATOM 0 HG21 ILE A 83 111.267 2.760 12.550 1.00 0.00 H new ATOM 0 HG22 ILE A 83 111.874 1.122 12.887 1.00 0.00 H new ATOM 0 HG23 ILE A 83 111.684 2.291 14.216 1.00 0.00 H new ATOM 0 HD11 ILE A 83 112.756 6.081 12.737 1.00 0.00 H new ATOM 0 HD12 ILE A 83 112.862 4.925 11.388 1.00 0.00 H new ATOM 0 HD13 ILE A 83 111.573 4.758 12.603 1.00 0.00 H new ATOM 1326 N PHE A 84 114.768 0.007 12.398 1.00 0.00 N ATOM 1327 CA PHE A 84 114.741 -1.333 11.899 1.00 0.00 C ATOM 1328 C PHE A 84 115.558 -2.288 12.786 1.00 0.00 C ATOM 1329 O PHE A 84 115.268 -3.484 12.865 1.00 0.00 O ATOM 1330 CB PHE A 84 115.218 -1.310 10.447 1.00 0.00 C ATOM 1331 CG PHE A 84 114.151 -0.873 9.450 1.00 0.00 C ATOM 1332 CD1 PHE A 84 113.462 0.321 9.606 1.00 0.00 C ATOM 1333 CD2 PHE A 84 113.841 -1.666 8.365 1.00 0.00 C ATOM 1334 CE1 PHE A 84 112.490 0.701 8.705 1.00 0.00 C ATOM 1335 CE2 PHE A 84 112.874 -1.293 7.459 1.00 0.00 C ATOM 1336 CZ PHE A 84 112.197 -0.110 7.631 1.00 0.00 C ATOM 0 H PHE A 84 115.252 0.657 11.779 1.00 0.00 H new ATOM 0 HA PHE A 84 113.724 -1.724 11.928 1.00 0.00 H new ATOM 0 HB2 PHE A 84 116.072 -0.638 10.367 1.00 0.00 H new ATOM 0 HB3 PHE A 84 115.569 -2.305 10.175 1.00 0.00 H new ATOM 0 HD1 PHE A 84 113.690 0.962 10.445 1.00 0.00 H new ATOM 0 HD2 PHE A 84 114.367 -2.598 8.223 1.00 0.00 H new ATOM 0 HE1 PHE A 84 111.960 1.632 8.841 1.00 0.00 H new ATOM 0 HE2 PHE A 84 112.648 -1.928 6.615 1.00 0.00 H new ATOM 0 HZ PHE A 84 111.435 0.184 6.924 1.00 0.00 H new ATOM 1346 N GLN A 85 116.573 -1.749 13.434 1.00 0.00 N ATOM 1347 CA GLN A 85 117.395 -2.488 14.380 1.00 0.00 C ATOM 1348 C GLN A 85 116.808 -2.494 15.804 1.00 0.00 C ATOM 1349 O GLN A 85 117.106 -3.388 16.607 1.00 0.00 O ATOM 1350 CB GLN A 85 118.827 -1.954 14.388 1.00 0.00 C ATOM 1351 CG GLN A 85 119.668 -2.412 13.237 1.00 0.00 C ATOM 1352 CD GLN A 85 121.118 -2.007 13.376 1.00 0.00 C ATOM 1353 OE1 GLN A 85 121.439 -0.985 13.970 1.00 0.00 O ATOM 1354 NE2 GLN A 85 122.005 -2.803 12.837 1.00 0.00 N ATOM 0 H GLN A 85 116.855 -0.776 13.319 1.00 0.00 H new ATOM 0 HA GLN A 85 117.406 -3.524 14.041 1.00 0.00 H new ATOM 0 HB2 GLN A 85 118.795 -0.864 14.387 1.00 0.00 H new ATOM 0 HB3 GLN A 85 119.309 -2.258 15.317 1.00 0.00 H new ATOM 0 HG2 GLN A 85 119.604 -3.497 13.155 1.00 0.00 H new ATOM 0 HG3 GLN A 85 119.267 -1.998 12.312 1.00 0.00 H new ATOM 0 HE21 GLN A 85 121.704 -3.647 12.349 1.00 0.00 H new ATOM 0 HE22 GLN A 85 122.998 -2.580 12.905 1.00 0.00 H new ATOM 1363 N SER A 86 115.986 -1.509 16.122 1.00 0.00 N ATOM 1364 CA SER A 86 115.397 -1.411 17.445 1.00 0.00 C ATOM 1365 C SER A 86 114.038 -2.111 17.470 1.00 0.00 C ATOM 1366 O SER A 86 113.357 -2.167 18.510 1.00 0.00 O ATOM 1367 CB SER A 86 115.277 0.058 17.897 1.00 0.00 C ATOM 1368 OG SER A 86 114.937 0.156 19.276 1.00 0.00 O ATOM 0 H SER A 86 115.711 -0.765 15.481 1.00 0.00 H new ATOM 0 HA SER A 86 116.056 -1.914 18.153 1.00 0.00 H new ATOM 0 HB2 SER A 86 116.221 0.573 17.717 1.00 0.00 H new ATOM 0 HB3 SER A 86 114.519 0.563 17.298 1.00 0.00 H new ATOM 0 HG SER A 86 114.283 -0.538 19.502 1.00 0.00 H new ATOM 1374 N ILE A 87 113.639 -2.606 16.323 1.00 0.00 N ATOM 1375 CA ILE A 87 112.465 -3.399 16.180 1.00 0.00 C ATOM 1376 C ILE A 87 112.472 -4.625 17.148 1.00 0.00 C ATOM 1377 O ILE A 87 113.512 -5.268 17.354 1.00 0.00 O ATOM 1378 CB ILE A 87 112.290 -3.832 14.693 1.00 0.00 C ATOM 1379 CG1 ILE A 87 111.499 -2.795 13.893 1.00 0.00 C ATOM 1380 CG2 ILE A 87 111.710 -5.184 14.528 1.00 0.00 C ATOM 1381 CD1 ILE A 87 110.933 -3.344 12.591 1.00 0.00 C ATOM 0 H ILE A 87 114.142 -2.459 15.448 1.00 0.00 H new ATOM 0 HA ILE A 87 111.604 -2.792 16.461 1.00 0.00 H new ATOM 0 HB ILE A 87 113.300 -3.886 14.287 1.00 0.00 H new ATOM 0 HG12 ILE A 87 110.681 -2.419 14.507 1.00 0.00 H new ATOM 0 HG13 ILE A 87 112.146 -1.947 13.671 1.00 0.00 H new ATOM 0 HG21 ILE A 87 111.619 -5.414 13.466 1.00 0.00 H new ATOM 0 HG22 ILE A 87 112.359 -5.919 15.004 1.00 0.00 H new ATOM 0 HG23 ILE A 87 110.724 -5.216 14.992 1.00 0.00 H new ATOM 0 HD11 ILE A 87 110.384 -2.558 12.073 1.00 0.00 H new ATOM 0 HD12 ILE A 87 111.749 -3.694 11.959 1.00 0.00 H new ATOM 0 HD13 ILE A 87 110.260 -4.174 12.808 1.00 0.00 H new ATOM 1393 N PRO A 88 111.324 -4.930 17.770 1.00 0.00 N ATOM 1394 CA PRO A 88 111.194 -6.035 18.707 1.00 0.00 C ATOM 1395 C PRO A 88 110.714 -7.310 18.017 1.00 0.00 C ATOM 1396 O PRO A 88 110.013 -7.269 17.006 1.00 0.00 O ATOM 1397 CB PRO A 88 110.122 -5.520 19.673 1.00 0.00 C ATOM 1398 CG PRO A 88 109.304 -4.519 18.893 1.00 0.00 C ATOM 1399 CD PRO A 88 110.035 -4.246 17.594 1.00 0.00 C ATOM 0 HA PRO A 88 112.138 -6.301 19.182 1.00 0.00 H new ATOM 0 HB2 PRO A 88 109.498 -6.337 20.034 1.00 0.00 H new ATOM 0 HB3 PRO A 88 110.576 -5.055 20.548 1.00 0.00 H new ATOM 0 HG2 PRO A 88 108.306 -4.910 18.696 1.00 0.00 H new ATOM 0 HG3 PRO A 88 109.179 -3.599 19.463 1.00 0.00 H new ATOM 0 HD2 PRO A 88 109.488 -4.637 16.736 1.00 0.00 H new ATOM 0 HD3 PRO A 88 110.168 -3.177 17.426 1.00 0.00 H new ATOM 1407 N ILE A 89 111.137 -8.435 18.540 1.00 0.00 N ATOM 1408 CA ILE A 89 110.731 -9.733 18.019 1.00 0.00 C ATOM 1409 C ILE A 89 109.236 -9.939 18.295 1.00 0.00 C ATOM 1410 O ILE A 89 108.748 -9.551 19.363 1.00 0.00 O ATOM 1411 CB ILE A 89 111.475 -10.871 18.756 1.00 0.00 C ATOM 1412 CG1 ILE A 89 112.964 -10.602 18.845 1.00 0.00 C ATOM 1413 CG2 ILE A 89 111.230 -12.204 18.067 1.00 0.00 C ATOM 1414 CD1 ILE A 89 113.687 -11.552 19.747 1.00 0.00 C ATOM 0 H ILE A 89 111.771 -8.485 19.337 1.00 0.00 H new ATOM 0 HA ILE A 89 110.957 -9.755 16.953 1.00 0.00 H new ATOM 0 HB ILE A 89 111.079 -10.914 19.771 1.00 0.00 H new ATOM 0 HG12 ILE A 89 113.397 -10.661 17.846 1.00 0.00 H new ATOM 0 HG13 ILE A 89 113.121 -9.584 19.201 1.00 0.00 H new ATOM 0 HG21 ILE A 89 111.762 -12.992 18.600 1.00 0.00 H new ATOM 0 HG22 ILE A 89 110.162 -12.423 18.067 1.00 0.00 H new ATOM 0 HG23 ILE A 89 111.590 -12.154 17.040 1.00 0.00 H new ATOM 0 HD11 ILE A 89 114.748 -11.302 19.764 1.00 0.00 H new ATOM 0 HD12 ILE A 89 113.280 -11.477 20.756 1.00 0.00 H new ATOM 0 HD13 ILE A 89 113.560 -12.570 19.380 1.00 0.00 H new ATOM 1426 N GLY A 90 108.524 -10.542 17.358 1.00 0.00 N ATOM 1427 CA GLY A 90 107.133 -10.863 17.593 1.00 0.00 C ATOM 1428 C GLY A 90 106.209 -9.755 17.188 1.00 0.00 C ATOM 1429 O GLY A 90 105.022 -9.771 17.516 1.00 0.00 O ATOM 0 H GLY A 90 108.882 -10.814 16.442 1.00 0.00 H new ATOM 0 HA2 GLY A 90 106.874 -11.767 17.041 1.00 0.00 H new ATOM 0 HA3 GLY A 90 106.989 -11.083 18.651 1.00 0.00 H new ATOM 1433 N ALA A 91 106.735 -8.803 16.474 1.00 0.00 N ATOM 1434 CA ALA A 91 105.969 -7.569 16.186 1.00 0.00 C ATOM 1435 C ALA A 91 105.494 -7.519 14.721 1.00 0.00 C ATOM 1436 O ALA A 91 105.582 -8.502 14.008 1.00 0.00 O ATOM 1437 CB ALA A 91 106.764 -6.327 16.608 1.00 0.00 C ATOM 0 H ALA A 91 107.673 -8.830 16.075 1.00 0.00 H new ATOM 0 HA ALA A 91 105.060 -7.580 16.787 1.00 0.00 H new ATOM 0 HB1 ALA A 91 106.183 -5.431 16.388 1.00 0.00 H new ATOM 0 HB2 ALA A 91 106.969 -6.372 17.678 1.00 0.00 H new ATOM 0 HB3 ALA A 91 107.705 -6.293 16.059 1.00 0.00 H new ATOM 1443 N SER A 92 104.996 -6.382 14.279 1.00 0.00 N ATOM 1444 CA SER A 92 104.354 -6.264 12.969 1.00 0.00 C ATOM 1445 C SER A 92 104.555 -4.889 12.352 1.00 0.00 C ATOM 1446 O SER A 92 104.684 -3.888 13.070 1.00 0.00 O ATOM 1447 CB SER A 92 102.871 -6.564 13.132 1.00 0.00 C ATOM 1448 OG SER A 92 102.133 -6.289 11.961 1.00 0.00 O ATOM 0 H SER A 92 105.021 -5.511 14.810 1.00 0.00 H new ATOM 0 HA SER A 92 104.815 -6.979 12.288 1.00 0.00 H new ATOM 0 HB2 SER A 92 102.743 -7.613 13.401 1.00 0.00 H new ATOM 0 HB3 SER A 92 102.472 -5.973 13.956 1.00 0.00 H new ATOM 0 HG SER A 92 101.284 -6.777 11.987 1.00 0.00 H new ATOM 1454 N VAL A 93 104.625 -4.861 11.025 1.00 0.00 N ATOM 1455 CA VAL A 93 104.669 -3.625 10.261 1.00 0.00 C ATOM 1456 C VAL A 93 103.976 -3.789 8.972 1.00 0.00 C ATOM 1457 O VAL A 93 103.815 -4.886 8.500 1.00 0.00 O ATOM 1458 CB VAL A 93 106.077 -3.101 9.906 1.00 0.00 C ATOM 1459 CG1 VAL A 93 106.886 -2.619 11.072 1.00 0.00 C ATOM 1460 CG2 VAL A 93 106.841 -4.042 8.998 1.00 0.00 C ATOM 0 H VAL A 93 104.653 -5.702 10.448 1.00 0.00 H new ATOM 0 HA VAL A 93 104.194 -2.907 10.930 1.00 0.00 H new ATOM 0 HB VAL A 93 105.890 -2.196 9.328 1.00 0.00 H new ATOM 0 HG11 VAL A 93 107.858 -2.271 10.722 1.00 0.00 H new ATOM 0 HG12 VAL A 93 106.363 -1.799 11.564 1.00 0.00 H new ATOM 0 HG13 VAL A 93 107.027 -3.436 11.780 1.00 0.00 H new ATOM 0 HG21 VAL A 93 107.823 -3.622 8.782 1.00 0.00 H new ATOM 0 HG22 VAL A 93 106.959 -5.007 9.491 1.00 0.00 H new ATOM 0 HG23 VAL A 93 106.291 -4.175 8.067 1.00 0.00 H new ATOM 1470 N ASP A 94 103.632 -2.687 8.407 1.00 0.00 N ATOM 1471 CA ASP A 94 103.070 -2.618 7.090 1.00 0.00 C ATOM 1472 C ASP A 94 104.137 -2.055 6.235 1.00 0.00 C ATOM 1473 O ASP A 94 104.473 -0.889 6.355 1.00 0.00 O ATOM 1474 CB ASP A 94 101.930 -1.658 7.089 1.00 0.00 C ATOM 1475 CG ASP A 94 101.198 -1.573 5.777 1.00 0.00 C ATOM 1476 OD1 ASP A 94 100.598 -2.578 5.348 1.00 0.00 O ATOM 1477 OD2 ASP A 94 101.137 -0.475 5.209 1.00 0.00 O ATOM 0 H ASP A 94 103.734 -1.777 8.855 1.00 0.00 H new ATOM 0 HA ASP A 94 102.722 -3.594 6.751 1.00 0.00 H new ATOM 0 HB2 ASP A 94 101.225 -1.948 7.868 1.00 0.00 H new ATOM 0 HB3 ASP A 94 102.303 -0.667 7.349 1.00 0.00 H new ATOM 1482 N LEU A 95 104.698 -2.837 5.432 1.00 0.00 N ATOM 1483 CA LEU A 95 105.793 -2.387 4.661 1.00 0.00 C ATOM 1484 C LEU A 95 105.305 -1.854 3.332 1.00 0.00 C ATOM 1485 O LEU A 95 104.767 -2.593 2.513 1.00 0.00 O ATOM 1486 CB LEU A 95 106.781 -3.516 4.489 1.00 0.00 C ATOM 1487 CG LEU A 95 108.224 -3.115 4.285 1.00 0.00 C ATOM 1488 CD1 LEU A 95 108.722 -2.350 5.515 1.00 0.00 C ATOM 1489 CD2 LEU A 95 109.049 -4.354 4.079 1.00 0.00 C ATOM 0 H LEU A 95 104.426 -3.808 5.277 1.00 0.00 H new ATOM 0 HA LEU A 95 106.301 -1.569 5.173 1.00 0.00 H new ATOM 0 HB2 LEU A 95 106.725 -4.157 5.369 1.00 0.00 H new ATOM 0 HB3 LEU A 95 106.469 -4.118 3.635 1.00 0.00 H new ATOM 0 HG LEU A 95 108.312 -2.470 3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 95 109.763 -2.061 5.367 1.00 0.00 H new ATOM 0 HD12 LEU A 95 108.114 -1.457 5.658 1.00 0.00 H new ATOM 0 HD13 LEU A 95 108.644 -2.987 6.396 1.00 0.00 H new ATOM 0 HD21 LEU A 95 110.092 -4.076 3.931 1.00 0.00 H new ATOM 0 HD22 LEU A 95 108.966 -4.996 4.956 1.00 0.00 H new ATOM 0 HD23 LEU A 95 108.688 -4.890 3.201 1.00 0.00 H new ATOM 1501 N GLU A 96 105.483 -0.573 3.157 1.00 0.00 N ATOM 1502 CA GLU A 96 105.069 0.148 1.976 1.00 0.00 C ATOM 1503 C GLU A 96 106.268 0.102 1.027 1.00 0.00 C ATOM 1504 O GLU A 96 107.301 0.755 1.296 1.00 0.00 O ATOM 1505 CB GLU A 96 104.810 1.603 2.402 1.00 0.00 C ATOM 1506 CG GLU A 96 103.978 2.456 1.464 1.00 0.00 C ATOM 1507 CD GLU A 96 102.495 2.162 1.568 1.00 0.00 C ATOM 1508 OE1 GLU A 96 101.904 2.470 2.630 1.00 0.00 O ATOM 1509 OE2 GLU A 96 101.890 1.652 0.624 1.00 0.00 O ATOM 0 H GLU A 96 105.935 0.020 3.853 1.00 0.00 H new ATOM 0 HA GLU A 96 104.176 -0.265 1.506 1.00 0.00 H new ATOM 0 HB2 GLU A 96 104.317 1.589 3.374 1.00 0.00 H new ATOM 0 HB3 GLU A 96 105.774 2.093 2.540 1.00 0.00 H new ATOM 0 HG2 GLU A 96 104.152 3.509 1.686 1.00 0.00 H new ATOM 0 HG3 GLU A 96 104.307 2.288 0.438 1.00 0.00 H new ATOM 1516 N LEU A 97 106.187 -0.672 -0.034 1.00 0.00 N ATOM 1517 CA LEU A 97 107.338 -0.837 -0.890 1.00 0.00 C ATOM 1518 C LEU A 97 106.991 -0.895 -2.378 1.00 0.00 C ATOM 1519 O LEU A 97 105.833 -1.064 -2.759 1.00 0.00 O ATOM 1520 CB LEU A 97 108.245 -2.020 -0.407 1.00 0.00 C ATOM 1521 CG LEU A 97 107.821 -3.506 -0.550 1.00 0.00 C ATOM 1522 CD1 LEU A 97 108.768 -4.322 0.292 1.00 0.00 C ATOM 1523 CD2 LEU A 97 106.402 -3.777 -0.102 1.00 0.00 C ATOM 0 H LEU A 97 105.354 -1.187 -0.319 1.00 0.00 H new ATOM 0 HA LEU A 97 107.934 0.071 -0.794 1.00 0.00 H new ATOM 0 HB2 LEU A 97 109.197 -1.916 -0.927 1.00 0.00 H new ATOM 0 HB3 LEU A 97 108.440 -1.852 0.652 1.00 0.00 H new ATOM 0 HG LEU A 97 107.862 -3.770 -1.607 1.00 0.00 H new ATOM 0 HD11 LEU A 97 108.503 -5.377 0.219 1.00 0.00 H new ATOM 0 HD12 LEU A 97 109.788 -4.178 -0.065 1.00 0.00 H new ATOM 0 HD13 LEU A 97 108.699 -4.002 1.332 1.00 0.00 H new ATOM 0 HD21 LEU A 97 106.176 -4.835 -0.231 1.00 0.00 H new ATOM 0 HD22 LEU A 97 106.295 -3.508 0.949 1.00 0.00 H new ATOM 0 HD23 LEU A 97 105.712 -3.183 -0.701 1.00 0.00 H new ATOM 1535 N CYS A 98 107.974 -0.672 -3.211 1.00 0.00 N ATOM 1536 CA CYS A 98 107.761 -0.689 -4.641 1.00 0.00 C ATOM 1537 C CYS A 98 108.676 -1.662 -5.335 1.00 0.00 C ATOM 1538 O CYS A 98 109.886 -1.577 -5.223 1.00 0.00 O ATOM 1539 CB CYS A 98 107.863 0.713 -5.245 1.00 0.00 C ATOM 1540 SG CYS A 98 106.682 1.888 -4.546 1.00 0.00 S ATOM 0 H CYS A 98 108.934 -0.476 -2.926 1.00 0.00 H new ATOM 0 HA CYS A 98 106.742 -1.038 -4.806 1.00 0.00 H new ATOM 0 HB2 CYS A 98 108.874 1.092 -5.093 1.00 0.00 H new ATOM 0 HB3 CYS A 98 107.705 0.648 -6.322 1.00 0.00 H new ATOM 0 HG CYS A 98 105.580 1.268 -4.243 1.00 0.00 H new ATOM 1546 N ARG A 99 108.082 -2.565 -6.052 1.00 0.00 N ATOM 1547 CA ARG A 99 108.796 -3.587 -6.760 1.00 0.00 C ATOM 1548 C ARG A 99 109.032 -3.082 -8.157 1.00 0.00 C ATOM 1549 O ARG A 99 108.194 -2.364 -8.687 1.00 0.00 O ATOM 1550 CB ARG A 99 107.931 -4.843 -6.825 1.00 0.00 C ATOM 1551 CG ARG A 99 108.587 -6.035 -7.469 1.00 0.00 C ATOM 1552 CD ARG A 99 109.602 -6.638 -6.549 1.00 0.00 C ATOM 1553 NE ARG A 99 108.971 -7.137 -5.365 1.00 0.00 N ATOM 1554 CZ ARG A 99 108.647 -8.378 -5.102 1.00 0.00 C ATOM 1555 NH1 ARG A 99 108.722 -9.324 -6.036 1.00 0.00 N ATOM 1556 NH2 ARG A 99 108.229 -8.657 -3.901 1.00 0.00 N ATOM 0 H ARG A 99 107.070 -2.615 -6.165 1.00 0.00 H new ATOM 0 HA ARG A 99 109.738 -3.821 -6.264 1.00 0.00 H new ATOM 0 HB2 ARG A 99 107.634 -5.114 -5.812 1.00 0.00 H new ATOM 0 HB3 ARG A 99 107.018 -4.609 -7.373 1.00 0.00 H new ATOM 0 HG2 ARG A 99 107.832 -6.779 -7.724 1.00 0.00 H new ATOM 0 HG3 ARG A 99 109.066 -5.734 -8.401 1.00 0.00 H new ATOM 0 HD2 ARG A 99 110.127 -7.447 -7.057 1.00 0.00 H new ATOM 0 HD3 ARG A 99 110.350 -5.891 -6.283 1.00 0.00 H new ATOM 0 HE ARG A 99 108.749 -6.449 -4.646 1.00 0.00 H new ATOM 0 HH11 ARG A 99 109.037 -9.088 -6.977 1.00 0.00 H new ATOM 0 HH12 ARG A 99 108.465 -10.285 -5.810 1.00 0.00 H new ATOM 0 HH21 ARG A 99 108.162 -7.919 -3.200 1.00 0.00 H new ATOM 0 HH22 ARG A 99 107.968 -9.613 -3.661 1.00 0.00 H new ATOM 1570 N GLY A 100 110.121 -3.448 -8.757 1.00 0.00 N ATOM 1571 CA GLY A 100 110.370 -2.988 -10.094 1.00 0.00 C ATOM 1572 C GLY A 100 111.782 -2.568 -10.300 1.00 0.00 C ATOM 1573 O GLY A 100 112.122 -2.026 -11.350 1.00 0.00 O ATOM 0 H GLY A 100 110.840 -4.051 -8.357 1.00 0.00 H new ATOM 0 HA2 GLY A 100 110.124 -3.782 -10.799 1.00 0.00 H new ATOM 0 HA3 GLY A 100 109.709 -2.150 -10.315 1.00 0.00 H new ATOM 1577 N TYR A 101 112.605 -2.775 -9.311 1.00 0.00 N ATOM 1578 CA TYR A 101 113.998 -2.478 -9.434 1.00 0.00 C ATOM 1579 C TYR A 101 114.797 -3.747 -9.569 1.00 0.00 C ATOM 1580 O TYR A 101 115.040 -4.436 -8.583 1.00 0.00 O ATOM 1581 CB TYR A 101 114.503 -1.633 -8.261 1.00 0.00 C ATOM 1582 CG TYR A 101 114.225 -0.154 -8.406 1.00 0.00 C ATOM 1583 CD1 TYR A 101 112.947 0.373 -8.245 1.00 0.00 C ATOM 1584 CD2 TYR A 101 115.254 0.719 -8.717 1.00 0.00 C ATOM 1585 CE1 TYR A 101 112.716 1.728 -8.388 1.00 0.00 C ATOM 1586 CE2 TYR A 101 115.032 2.068 -8.863 1.00 0.00 C ATOM 1587 CZ TYR A 101 113.767 2.570 -8.700 1.00 0.00 C ATOM 1588 OH TYR A 101 113.547 3.923 -8.843 1.00 0.00 O ATOM 0 H TYR A 101 112.329 -3.152 -8.404 1.00 0.00 H new ATOM 0 HA TYR A 101 114.133 -1.886 -10.339 1.00 0.00 H new ATOM 0 HB2 TYR A 101 114.039 -1.991 -7.342 1.00 0.00 H new ATOM 0 HB3 TYR A 101 115.578 -1.782 -8.155 1.00 0.00 H new ATOM 0 HD1 TYR A 101 112.125 -0.285 -8.005 1.00 0.00 H new ATOM 0 HD2 TYR A 101 116.254 0.331 -8.848 1.00 0.00 H new ATOM 0 HE1 TYR A 101 111.721 2.127 -8.257 1.00 0.00 H new ATOM 0 HE2 TYR A 101 115.851 2.729 -9.105 1.00 0.00 H new ATOM 0 HH TYR A 101 113.096 4.093 -9.696 1.00 0.00 H new ATOM 1598 N PRO A 102 115.184 -4.105 -10.805 1.00 0.00 N ATOM 1599 CA PRO A 102 116.032 -5.253 -11.039 1.00 0.00 C ATOM 1600 C PRO A 102 117.380 -4.955 -10.445 1.00 0.00 C ATOM 1601 O PRO A 102 117.895 -3.857 -10.641 1.00 0.00 O ATOM 1602 CB PRO A 102 116.152 -5.329 -12.574 1.00 0.00 C ATOM 1603 CG PRO A 102 115.078 -4.444 -13.099 1.00 0.00 C ATOM 1604 CD PRO A 102 114.860 -3.400 -12.054 1.00 0.00 C ATOM 0 HA PRO A 102 115.651 -6.179 -10.608 1.00 0.00 H new ATOM 0 HB2 PRO A 102 117.134 -4.995 -12.908 1.00 0.00 H new ATOM 0 HB3 PRO A 102 116.026 -6.352 -12.928 1.00 0.00 H new ATOM 0 HG2 PRO A 102 115.372 -3.993 -14.046 1.00 0.00 H new ATOM 0 HG3 PRO A 102 114.164 -5.008 -13.285 1.00 0.00 H new ATOM 0 HD2 PRO A 102 115.505 -2.535 -12.208 1.00 0.00 H new ATOM 0 HD3 PRO A 102 113.833 -3.036 -12.056 1.00 0.00 H new ATOM 1612 N LEU A 103 117.918 -5.883 -9.689 1.00 0.00 N ATOM 1613 CA LEU A 103 119.194 -5.683 -9.036 1.00 0.00 C ATOM 1614 C LEU A 103 120.294 -5.678 -10.116 1.00 0.00 C ATOM 1615 O LEU A 103 120.664 -6.733 -10.627 1.00 0.00 O ATOM 1616 CB LEU A 103 119.410 -6.818 -8.010 1.00 0.00 C ATOM 1617 CG LEU A 103 120.107 -6.451 -6.690 1.00 0.00 C ATOM 1618 CD1 LEU A 103 121.483 -5.861 -6.895 1.00 0.00 C ATOM 1619 CD2 LEU A 103 119.239 -5.507 -5.905 1.00 0.00 C ATOM 0 H LEU A 103 117.490 -6.791 -9.509 1.00 0.00 H new ATOM 0 HA LEU A 103 119.225 -4.733 -8.503 1.00 0.00 H new ATOM 0 HB2 LEU A 103 118.437 -7.246 -7.770 1.00 0.00 H new ATOM 0 HB3 LEU A 103 119.993 -7.603 -8.493 1.00 0.00 H new ATOM 0 HG LEU A 103 120.249 -7.375 -6.130 1.00 0.00 H new ATOM 0 HD11 LEU A 103 121.924 -5.622 -5.927 1.00 0.00 H new ATOM 0 HD12 LEU A 103 122.114 -6.582 -7.414 1.00 0.00 H new ATOM 0 HD13 LEU A 103 121.404 -4.952 -7.492 1.00 0.00 H new ATOM 0 HD21 LEU A 103 119.736 -5.249 -4.970 1.00 0.00 H new ATOM 0 HD22 LEU A 103 119.067 -4.601 -6.487 1.00 0.00 H new ATOM 0 HD23 LEU A 103 118.284 -5.986 -5.688 1.00 0.00 H new ATOM 1631 N PRO A 104 120.846 -4.497 -10.468 1.00 0.00 N ATOM 1632 CA PRO A 104 121.767 -4.355 -11.580 1.00 0.00 C ATOM 1633 C PRO A 104 123.213 -4.416 -11.119 1.00 0.00 C ATOM 1634 O PRO A 104 124.070 -3.647 -11.573 1.00 0.00 O ATOM 1635 CB PRO A 104 121.421 -2.958 -12.088 1.00 0.00 C ATOM 1636 CG PRO A 104 121.039 -2.181 -10.853 1.00 0.00 C ATOM 1637 CD PRO A 104 120.649 -3.193 -9.790 1.00 0.00 C ATOM 0 HA PRO A 104 121.675 -5.143 -12.327 1.00 0.00 H new ATOM 0 HB2 PRO A 104 122.270 -2.501 -12.596 1.00 0.00 H new ATOM 0 HB3 PRO A 104 120.600 -2.990 -12.805 1.00 0.00 H new ATOM 0 HG2 PRO A 104 121.872 -1.566 -10.512 1.00 0.00 H new ATOM 0 HG3 PRO A 104 120.210 -1.506 -11.064 1.00 0.00 H new ATOM 0 HD2 PRO A 104 121.274 -3.104 -8.902 1.00 0.00 H new ATOM 0 HD3 PRO A 104 119.616 -3.060 -9.468 1.00 0.00 H new ATOM 1645 N PHE A 105 123.462 -5.316 -10.221 1.00 0.00 N ATOM 1646 CA PHE A 105 124.741 -5.503 -9.620 1.00 0.00 C ATOM 1647 C PHE A 105 124.634 -6.831 -8.912 1.00 0.00 C ATOM 1648 O PHE A 105 123.524 -7.376 -8.814 1.00 0.00 O ATOM 1649 CB PHE A 105 124.977 -4.360 -8.611 1.00 0.00 C ATOM 1650 CG PHE A 105 126.404 -4.182 -8.184 1.00 0.00 C ATOM 1651 CD1 PHE A 105 127.293 -3.501 -8.995 1.00 0.00 C ATOM 1652 CD2 PHE A 105 126.851 -4.676 -6.978 1.00 0.00 C ATOM 1653 CE1 PHE A 105 128.601 -3.320 -8.612 1.00 0.00 C ATOM 1654 CE2 PHE A 105 128.158 -4.501 -6.589 1.00 0.00 C ATOM 1655 CZ PHE A 105 129.035 -3.822 -7.405 1.00 0.00 C ATOM 0 H PHE A 105 122.754 -5.963 -9.875 1.00 0.00 H new ATOM 0 HA PHE A 105 125.567 -5.495 -10.331 1.00 0.00 H new ATOM 0 HB2 PHE A 105 124.625 -3.427 -9.052 1.00 0.00 H new ATOM 0 HB3 PHE A 105 124.368 -4.544 -7.726 1.00 0.00 H new ATOM 0 HD1 PHE A 105 126.955 -3.106 -9.942 1.00 0.00 H new ATOM 0 HD2 PHE A 105 126.168 -5.206 -6.331 1.00 0.00 H new ATOM 0 HE1 PHE A 105 129.285 -2.786 -9.255 1.00 0.00 H new ATOM 0 HE2 PHE A 105 128.497 -4.896 -5.643 1.00 0.00 H new ATOM 0 HZ PHE A 105 130.061 -3.683 -7.099 1.00 0.00 H new ATOM 1665 N ASP A 106 125.726 -7.380 -8.458 1.00 0.00 N ATOM 1666 CA ASP A 106 125.659 -8.645 -7.756 1.00 0.00 C ATOM 1667 C ASP A 106 125.217 -8.379 -6.358 1.00 0.00 C ATOM 1668 O ASP A 106 125.672 -7.418 -5.733 1.00 0.00 O ATOM 1669 CB ASP A 106 127.000 -9.336 -7.645 1.00 0.00 C ATOM 1670 CG ASP A 106 127.722 -9.547 -8.945 1.00 0.00 C ATOM 1671 OD1 ASP A 106 127.487 -10.577 -9.619 1.00 0.00 O ATOM 1672 OD2 ASP A 106 128.567 -8.716 -9.297 1.00 0.00 O ATOM 0 H ASP A 106 126.661 -6.985 -8.555 1.00 0.00 H new ATOM 0 HA ASP A 106 124.978 -9.282 -8.320 1.00 0.00 H new ATOM 0 HB2 ASP A 106 127.639 -8.750 -6.984 1.00 0.00 H new ATOM 0 HB3 ASP A 106 126.853 -10.305 -7.169 1.00 0.00 H new ATOM 1677 N PRO A 107 124.368 -9.223 -5.808 1.00 0.00 N ATOM 1678 CA PRO A 107 123.902 -9.095 -4.452 1.00 0.00 C ATOM 1679 C PRO A 107 124.818 -9.936 -3.574 1.00 0.00 C ATOM 1680 O PRO A 107 124.671 -10.027 -2.365 1.00 0.00 O ATOM 1681 CB PRO A 107 122.484 -9.719 -4.555 1.00 0.00 C ATOM 1682 CG PRO A 107 122.365 -10.169 -5.992 1.00 0.00 C ATOM 1683 CD PRO A 107 123.749 -10.397 -6.410 1.00 0.00 C ATOM 0 HA PRO A 107 123.890 -8.088 -4.035 1.00 0.00 H new ATOM 0 HB2 PRO A 107 122.369 -10.557 -3.867 1.00 0.00 H new ATOM 0 HB3 PRO A 107 121.712 -8.992 -4.303 1.00 0.00 H new ATOM 0 HG2 PRO A 107 121.768 -11.077 -6.077 1.00 0.00 H new ATOM 0 HG3 PRO A 107 121.882 -9.411 -6.609 1.00 0.00 H new ATOM 0 HD2 PRO A 107 124.156 -11.332 -6.024 1.00 0.00 H new ATOM 0 HD3 PRO A 107 123.862 -10.423 -7.494 1.00 0.00 H new ATOM 1691 N ASP A 108 125.777 -10.535 -4.259 1.00 0.00 N ATOM 1692 CA ASP A 108 126.754 -11.384 -3.696 1.00 0.00 C ATOM 1693 C ASP A 108 127.825 -10.552 -3.045 1.00 0.00 C ATOM 1694 O ASP A 108 128.393 -10.920 -2.023 1.00 0.00 O ATOM 1695 CB ASP A 108 127.380 -12.250 -4.784 1.00 0.00 C ATOM 1696 CG ASP A 108 128.570 -13.040 -4.288 1.00 0.00 C ATOM 1697 OD1 ASP A 108 128.380 -14.041 -3.571 1.00 0.00 O ATOM 1698 OD2 ASP A 108 129.720 -12.674 -4.620 1.00 0.00 O ATOM 0 H ASP A 108 125.880 -10.423 -5.268 1.00 0.00 H new ATOM 0 HA ASP A 108 126.283 -12.026 -2.952 1.00 0.00 H new ATOM 0 HB2 ASP A 108 126.629 -12.938 -5.172 1.00 0.00 H new ATOM 0 HB3 ASP A 108 127.691 -11.615 -5.614 1.00 0.00 H new ATOM 1703 N ASP A 109 128.052 -9.413 -3.673 1.00 0.00 N ATOM 1704 CA ASP A 109 129.060 -8.435 -3.310 1.00 0.00 C ATOM 1705 C ASP A 109 128.982 -8.050 -1.835 1.00 0.00 C ATOM 1706 O ASP A 109 127.950 -7.531 -1.368 1.00 0.00 O ATOM 1707 CB ASP A 109 128.876 -7.195 -4.193 1.00 0.00 C ATOM 1708 CG ASP A 109 129.827 -6.069 -3.866 1.00 0.00 C ATOM 1709 OD1 ASP A 109 131.062 -6.260 -3.971 1.00 0.00 O ATOM 1710 OD2 ASP A 109 129.359 -4.965 -3.504 1.00 0.00 O ATOM 0 H ASP A 109 127.511 -9.131 -4.491 1.00 0.00 H new ATOM 0 HA ASP A 109 130.045 -8.875 -3.469 1.00 0.00 H new ATOM 0 HB2 ASP A 109 129.010 -7.480 -5.236 1.00 0.00 H new ATOM 0 HB3 ASP A 109 127.852 -6.835 -4.090 1.00 0.00 H new ATOM 1715 N PRO A 110 130.044 -8.403 -1.066 1.00 0.00 N ATOM 1716 CA PRO A 110 130.206 -8.016 0.344 1.00 0.00 C ATOM 1717 C PRO A 110 130.296 -6.513 0.548 1.00 0.00 C ATOM 1718 O PRO A 110 129.797 -5.721 -0.248 1.00 0.00 O ATOM 1719 CB PRO A 110 131.564 -8.614 0.703 1.00 0.00 C ATOM 1720 CG PRO A 110 131.675 -9.789 -0.172 1.00 0.00 C ATOM 1721 CD PRO A 110 131.142 -9.307 -1.487 1.00 0.00 C ATOM 0 HA PRO A 110 129.358 -8.354 0.940 1.00 0.00 H new ATOM 0 HB2 PRO A 110 132.373 -7.905 0.524 1.00 0.00 H new ATOM 0 HB3 PRO A 110 131.612 -8.894 1.755 1.00 0.00 H new ATOM 0 HG2 PRO A 110 132.708 -10.127 -0.259 1.00 0.00 H new ATOM 0 HG3 PRO A 110 131.096 -10.629 0.211 1.00 0.00 H new ATOM 0 HD2 PRO A 110 131.902 -8.783 -2.067 1.00 0.00 H new ATOM 0 HD3 PRO A 110 130.779 -10.128 -2.105 1.00 0.00 H new ATOM 1729 N ASN A 111 130.957 -6.141 1.630 1.00 0.00 N ATOM 1730 CA ASN A 111 131.129 -4.786 2.026 1.00 0.00 C ATOM 1731 C ASN A 111 129.793 -4.203 2.389 1.00 0.00 C ATOM 1732 O ASN A 111 129.206 -3.411 1.643 1.00 0.00 O ATOM 1733 CB ASN A 111 131.840 -3.915 0.990 1.00 0.00 C ATOM 1734 CG ASN A 111 133.340 -4.167 0.796 1.00 0.00 C ATOM 1735 OD1 ASN A 111 133.809 -5.357 1.055 1.00 0.00 O flip ATOM 1736 ND2 ASN A 111 134.085 -3.254 0.429 1.00 0.00 N flip ATOM 0 H ASN A 111 131.396 -6.807 2.266 1.00 0.00 H new ATOM 0 HA ASN A 111 131.790 -4.792 2.892 1.00 0.00 H new ATOM 0 HB2 ASN A 111 131.344 -4.054 0.029 1.00 0.00 H new ATOM 0 HB3 ASN A 111 131.703 -2.871 1.271 1.00 0.00 H new ATOM 0 HD21 ASN A 111 133.700 -2.330 0.231 1.00 0.00 H new ATOM 0 HD22 ASN A 111 135.085 -3.423 0.324 1.00 0.00 H new ATOM 1743 N THR A 112 129.282 -4.656 3.493 1.00 0.00 N ATOM 1744 CA THR A 112 128.022 -4.201 4.006 1.00 0.00 C ATOM 1745 C THR A 112 128.214 -2.817 4.702 1.00 0.00 C ATOM 1746 O THR A 112 129.058 -2.038 4.247 1.00 0.00 O ATOM 1747 CB THR A 112 127.447 -5.305 4.922 1.00 0.00 C ATOM 1748 OG1 THR A 112 127.732 -6.560 4.266 1.00 0.00 O ATOM 1749 CG2 THR A 112 125.916 -5.201 5.027 1.00 0.00 C ATOM 0 H THR A 112 129.734 -5.363 4.073 1.00 0.00 H new ATOM 0 HA THR A 112 127.291 -4.033 3.215 1.00 0.00 H new ATOM 0 HB THR A 112 127.881 -5.217 5.918 1.00 0.00 H new ATOM 0 HG1 THR A 112 127.388 -7.299 4.810 1.00 0.00 H new ATOM 0 HG21 THR A 112 125.541 -5.991 5.678 1.00 0.00 H new ATOM 0 HG22 THR A 112 125.645 -4.230 5.442 1.00 0.00 H new ATOM 0 HG23 THR A 112 125.475 -5.308 4.036 1.00 0.00 H new ATOM 1757 N SER A 113 127.435 -2.493 5.720 1.00 0.00 N ATOM 1758 CA SER A 113 127.449 -1.167 6.339 1.00 0.00 C ATOM 1759 C SER A 113 128.818 -0.785 6.813 1.00 0.00 C ATOM 1760 O SER A 113 129.303 -1.271 7.841 1.00 0.00 O ATOM 1761 CB SER A 113 126.477 -1.139 7.497 1.00 0.00 C ATOM 1762 OG SER A 113 125.675 -2.332 7.493 1.00 0.00 O ATOM 0 H SER A 113 126.771 -3.140 6.146 1.00 0.00 H new ATOM 0 HA SER A 113 127.149 -0.441 5.583 1.00 0.00 H new ATOM 0 HB2 SER A 113 127.021 -1.060 8.438 1.00 0.00 H new ATOM 0 HB3 SER A 113 125.837 -0.260 7.424 1.00 0.00 H new ATOM 0 HG SER A 113 124.954 -2.239 6.836 1.00 0.00 H new ATOM 1768 N LEU A 114 129.440 0.050 6.045 1.00 0.00 N ATOM 1769 CA LEU A 114 130.671 0.572 6.382 1.00 0.00 C ATOM 1770 C LEU A 114 130.441 1.592 7.446 1.00 0.00 C ATOM 1771 O LEU A 114 129.642 2.501 7.284 1.00 0.00 O ATOM 1772 CB LEU A 114 131.421 1.134 5.120 1.00 0.00 C ATOM 1773 CG LEU A 114 130.807 2.300 4.244 1.00 0.00 C ATOM 1774 CD1 LEU A 114 129.383 2.055 3.740 1.00 0.00 C ATOM 1775 CD2 LEU A 114 130.942 3.655 4.903 1.00 0.00 C ATOM 0 H LEU A 114 129.075 0.379 5.151 1.00 0.00 H new ATOM 0 HA LEU A 114 131.335 -0.200 6.771 1.00 0.00 H new ATOM 0 HB2 LEU A 114 132.400 1.474 5.459 1.00 0.00 H new ATOM 0 HB3 LEU A 114 131.591 0.291 4.451 1.00 0.00 H new ATOM 0 HG LEU A 114 131.424 2.302 3.346 1.00 0.00 H new ATOM 0 HD11 LEU A 114 129.053 2.911 3.151 1.00 0.00 H new ATOM 0 HD12 LEU A 114 129.366 1.159 3.120 1.00 0.00 H new ATOM 0 HD13 LEU A 114 128.714 1.921 4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 114 130.505 4.418 4.259 1.00 0.00 H new ATOM 0 HD22 LEU A 114 130.422 3.647 5.861 1.00 0.00 H new ATOM 0 HD23 LEU A 114 131.997 3.878 5.064 1.00 0.00 H new ATOM 1787 N VAL A 115 131.015 1.372 8.553 1.00 0.00 N ATOM 1788 CA VAL A 115 130.889 2.287 9.604 1.00 0.00 C ATOM 1789 C VAL A 115 132.237 2.734 10.046 1.00 0.00 C ATOM 1790 O VAL A 115 133.073 1.943 10.529 1.00 0.00 O ATOM 1791 CB VAL A 115 129.988 1.807 10.788 1.00 0.00 C ATOM 1792 CG1 VAL A 115 130.506 0.537 11.461 1.00 0.00 C ATOM 1793 CG2 VAL A 115 129.777 2.947 11.792 1.00 0.00 C ATOM 0 H VAL A 115 131.586 0.552 8.758 1.00 0.00 H new ATOM 0 HA VAL A 115 130.344 3.145 9.210 1.00 0.00 H new ATOM 0 HB VAL A 115 129.020 1.534 10.368 1.00 0.00 H new ATOM 0 HG11 VAL A 115 129.836 0.257 12.274 1.00 0.00 H new ATOM 0 HG12 VAL A 115 130.548 -0.271 10.730 1.00 0.00 H new ATOM 0 HG13 VAL A 115 131.504 0.718 11.859 1.00 0.00 H new ATOM 0 HG21 VAL A 115 129.148 2.599 12.611 1.00 0.00 H new ATOM 0 HG22 VAL A 115 130.741 3.268 12.186 1.00 0.00 H new ATOM 0 HG23 VAL A 115 129.292 3.786 11.293 1.00 0.00 H new ATOM 1803 N THR A 116 132.482 3.962 9.835 1.00 0.00 N ATOM 1804 CA THR A 116 133.706 4.521 10.188 1.00 0.00 C ATOM 1805 C THR A 116 133.489 5.291 11.469 1.00 0.00 C ATOM 1806 O THR A 116 132.385 5.811 11.725 1.00 0.00 O ATOM 1807 CB THR A 116 134.274 5.429 9.046 1.00 0.00 C ATOM 1808 OG1 THR A 116 135.654 5.740 9.288 1.00 0.00 O ATOM 1809 CG2 THR A 116 133.490 6.731 8.909 1.00 0.00 C ATOM 0 H THR A 116 131.825 4.613 9.405 1.00 0.00 H new ATOM 0 HA THR A 116 134.454 3.743 10.341 1.00 0.00 H new ATOM 0 HB THR A 116 134.176 4.866 8.118 1.00 0.00 H new ATOM 0 HG1 THR A 116 135.993 6.307 8.564 1.00 0.00 H new ATOM 0 HG21 THR A 116 133.918 7.331 8.105 1.00 0.00 H new ATOM 0 HG22 THR A 116 132.449 6.506 8.679 1.00 0.00 H new ATOM 0 HG23 THR A 116 133.543 7.288 9.845 1.00 0.00 H new ATOM 1817 N SER A 117 134.464 5.308 12.284 1.00 0.00 N ATOM 1818 CA SER A 117 134.384 6.020 13.490 1.00 0.00 C ATOM 1819 C SER A 117 135.497 7.038 13.438 1.00 0.00 C ATOM 1820 O SER A 117 136.591 6.738 12.950 1.00 0.00 O ATOM 1821 CB SER A 117 134.551 5.068 14.693 1.00 0.00 C ATOM 1822 OG SER A 117 134.369 5.736 15.943 1.00 0.00 O ATOM 0 H SER A 117 135.349 4.824 12.132 1.00 0.00 H new ATOM 0 HA SER A 117 133.415 6.503 13.613 1.00 0.00 H new ATOM 0 HB2 SER A 117 133.832 4.253 14.611 1.00 0.00 H new ATOM 0 HB3 SER A 117 135.544 4.620 14.664 1.00 0.00 H new ATOM 0 HG SER A 117 134.482 5.095 16.676 1.00 0.00 H new ATOM 1828 N VAL A 118 135.232 8.225 13.841 1.00 0.00 N ATOM 1829 CA VAL A 118 136.242 9.235 13.831 1.00 0.00 C ATOM 1830 C VAL A 118 136.754 9.359 15.247 1.00 0.00 C ATOM 1831 O VAL A 118 136.031 9.819 16.134 1.00 0.00 O ATOM 1832 CB VAL A 118 135.686 10.593 13.328 1.00 0.00 C ATOM 1833 CG1 VAL A 118 136.808 11.597 13.142 1.00 0.00 C ATOM 1834 CG2 VAL A 118 134.913 10.416 12.026 1.00 0.00 C ATOM 0 H VAL A 118 134.321 8.530 14.185 1.00 0.00 H new ATOM 0 HA VAL A 118 137.044 8.959 13.147 1.00 0.00 H new ATOM 0 HB VAL A 118 135.001 10.975 14.085 1.00 0.00 H new ATOM 0 HG11 VAL A 118 136.396 12.542 12.789 1.00 0.00 H new ATOM 0 HG12 VAL A 118 137.316 11.756 14.093 1.00 0.00 H new ATOM 0 HG13 VAL A 118 137.520 11.216 12.410 1.00 0.00 H new ATOM 0 HG21 VAL A 118 134.533 11.382 11.694 1.00 0.00 H new ATOM 0 HG22 VAL A 118 135.574 10.004 11.263 1.00 0.00 H new ATOM 0 HG23 VAL A 118 134.078 9.734 12.188 1.00 0.00 H new ATOM 1844 N ALA A 119 137.962 8.899 15.481 1.00 0.00 N ATOM 1845 CA ALA A 119 138.501 8.894 16.819 1.00 0.00 C ATOM 1846 C ALA A 119 139.862 9.568 16.890 1.00 0.00 C ATOM 1847 O ALA A 119 140.901 8.917 17.006 1.00 0.00 O ATOM 1848 CB ALA A 119 138.547 7.466 17.355 1.00 0.00 C ATOM 0 H ALA A 119 138.586 8.526 14.766 1.00 0.00 H new ATOM 0 HA ALA A 119 137.839 9.481 17.455 1.00 0.00 H new ATOM 0 HB1 ALA A 119 138.955 7.470 18.366 1.00 0.00 H new ATOM 0 HB2 ALA A 119 137.539 7.051 17.372 1.00 0.00 H new ATOM 0 HB3 ALA A 119 139.180 6.856 16.711 1.00 0.00 H new ATOM 1854 N ILE A 120 139.839 10.872 16.801 1.00 0.00 N ATOM 1855 CA ILE A 120 141.028 11.707 16.920 1.00 0.00 C ATOM 1856 C ILE A 120 140.739 12.823 17.956 1.00 0.00 C ATOM 1857 O ILE A 120 141.624 13.306 18.683 1.00 0.00 O ATOM 1858 CB ILE A 120 141.390 12.390 15.548 1.00 0.00 C ATOM 1859 CG1 ILE A 120 141.680 11.390 14.402 1.00 0.00 C ATOM 1860 CG2 ILE A 120 142.566 13.347 15.689 1.00 0.00 C ATOM 1861 CD1 ILE A 120 140.464 10.762 13.746 1.00 0.00 C ATOM 0 H ILE A 120 138.983 11.403 16.641 1.00 0.00 H new ATOM 0 HA ILE A 120 141.864 11.078 17.228 1.00 0.00 H new ATOM 0 HB ILE A 120 140.493 12.945 15.273 1.00 0.00 H new ATOM 0 HG12 ILE A 120 142.258 11.905 13.634 1.00 0.00 H new ATOM 0 HG13 ILE A 120 142.310 10.592 14.793 1.00 0.00 H new ATOM 0 HG21 ILE A 120 142.786 13.798 14.722 1.00 0.00 H new ATOM 0 HG22 ILE A 120 142.315 14.129 16.406 1.00 0.00 H new ATOM 0 HG23 ILE A 120 143.440 12.800 16.041 1.00 0.00 H new ATOM 0 HD11 ILE A 120 140.787 10.080 12.959 1.00 0.00 H new ATOM 0 HD12 ILE A 120 139.892 10.210 14.492 1.00 0.00 H new ATOM 0 HD13 ILE A 120 139.839 11.544 13.315 1.00 0.00 H new ATOM 1873 N LEU A 121 139.491 13.185 18.014 1.00 0.00 N ATOM 1874 CA LEU A 121 138.975 14.236 18.817 1.00 0.00 C ATOM 1875 C LEU A 121 138.061 13.587 19.864 1.00 0.00 C ATOM 1876 O LEU A 121 138.466 12.610 20.491 1.00 0.00 O ATOM 1877 CB LEU A 121 138.206 15.167 17.861 1.00 0.00 C ATOM 1878 CG LEU A 121 138.393 16.655 18.075 1.00 0.00 C ATOM 1879 CD1 LEU A 121 137.730 17.443 16.957 1.00 0.00 C ATOM 1880 CD2 LEU A 121 137.878 17.114 19.425 1.00 0.00 C ATOM 0 H LEU A 121 138.768 12.720 17.465 1.00 0.00 H new ATOM 0 HA LEU A 121 139.735 14.816 19.340 1.00 0.00 H new ATOM 0 HB2 LEU A 121 138.503 14.929 16.840 1.00 0.00 H new ATOM 0 HB3 LEU A 121 137.143 14.941 17.945 1.00 0.00 H new ATOM 0 HG LEU A 121 139.466 16.847 18.059 1.00 0.00 H new ATOM 0 HD11 LEU A 121 137.875 18.510 17.128 1.00 0.00 H new ATOM 0 HD12 LEU A 121 138.176 17.165 16.002 1.00 0.00 H new ATOM 0 HD13 LEU A 121 136.663 17.220 16.938 1.00 0.00 H new ATOM 0 HD21 LEU A 121 138.036 18.188 19.529 1.00 0.00 H new ATOM 0 HD22 LEU A 121 136.813 16.894 19.502 1.00 0.00 H new ATOM 0 HD23 LEU A 121 138.415 16.590 20.216 1.00 0.00 H new ATOM 1892 N ASP A 122 136.863 14.109 20.060 1.00 0.00 N ATOM 1893 CA ASP A 122 135.933 13.535 20.994 1.00 0.00 C ATOM 1894 C ASP A 122 135.438 12.191 20.481 1.00 0.00 C ATOM 1895 O ASP A 122 134.692 12.080 19.501 1.00 0.00 O ATOM 1896 CB ASP A 122 134.777 14.492 21.326 1.00 0.00 C ATOM 1897 CG ASP A 122 133.861 14.808 20.166 1.00 0.00 C ATOM 1898 OD1 ASP A 122 134.306 15.454 19.190 1.00 0.00 O ATOM 1899 OD2 ASP A 122 132.650 14.459 20.231 1.00 0.00 O ATOM 0 H ASP A 122 136.517 14.937 19.576 1.00 0.00 H new ATOM 0 HA ASP A 122 136.458 13.366 21.934 1.00 0.00 H new ATOM 0 HB2 ASP A 122 134.184 14.057 22.131 1.00 0.00 H new ATOM 0 HB3 ASP A 122 135.194 15.425 21.706 1.00 0.00 H new ATOM 1904 N LYS A 123 135.906 11.185 21.114 1.00 0.00 N ATOM 1905 CA LYS A 123 135.624 9.830 20.747 1.00 0.00 C ATOM 1906 C LYS A 123 134.964 9.080 21.871 1.00 0.00 C ATOM 1907 O LYS A 123 135.270 7.898 22.138 1.00 0.00 O ATOM 1908 CB LYS A 123 136.899 9.149 20.271 1.00 0.00 C ATOM 1909 CG LYS A 123 138.109 9.451 21.132 1.00 0.00 C ATOM 1910 CD LYS A 123 139.338 8.778 20.597 1.00 0.00 C ATOM 1911 CE LYS A 123 140.573 9.285 21.283 1.00 0.00 C ATOM 1912 NZ LYS A 123 141.750 8.464 20.938 1.00 0.00 N ATOM 0 H LYS A 123 136.515 11.271 21.928 1.00 0.00 H new ATOM 0 HA LYS A 123 134.912 9.830 19.922 1.00 0.00 H new ATOM 0 HB2 LYS A 123 136.739 8.071 20.250 1.00 0.00 H new ATOM 0 HB3 LYS A 123 137.106 9.460 19.247 1.00 0.00 H new ATOM 0 HG2 LYS A 123 138.270 10.528 21.173 1.00 0.00 H new ATOM 0 HG3 LYS A 123 137.924 9.118 22.153 1.00 0.00 H new ATOM 0 HD2 LYS A 123 139.257 7.700 20.737 1.00 0.00 H new ATOM 0 HD3 LYS A 123 139.415 8.955 19.524 1.00 0.00 H new ATOM 0 HE2 LYS A 123 140.752 10.321 20.996 1.00 0.00 H new ATOM 0 HE3 LYS A 123 140.423 9.275 22.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 142.589 8.837 21.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 141.586 7.481 21.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 141.905 8.495 19.910 1.00 0.00 H new ATOM 1926 N GLU A 124 134.058 9.755 22.522 1.00 0.00 N ATOM 1927 CA GLU A 124 133.286 9.158 23.566 1.00 0.00 C ATOM 1928 C GLU A 124 132.249 8.279 22.886 1.00 0.00 C ATOM 1929 O GLU A 124 131.565 8.751 21.974 1.00 0.00 O ATOM 1930 CB GLU A 124 132.623 10.245 24.415 1.00 0.00 C ATOM 1931 CG GLU A 124 133.616 11.261 24.970 1.00 0.00 C ATOM 1932 CD GLU A 124 132.966 12.308 25.826 1.00 0.00 C ATOM 1933 OE1 GLU A 124 132.464 13.315 25.282 1.00 0.00 O ATOM 1934 OE2 GLU A 124 132.954 12.151 27.073 1.00 0.00 O ATOM 0 H GLU A 124 133.837 10.734 22.341 1.00 0.00 H new ATOM 0 HA GLU A 124 133.906 8.565 24.238 1.00 0.00 H new ATOM 0 HB2 GLU A 124 131.879 10.765 23.812 1.00 0.00 H new ATOM 0 HB3 GLU A 124 132.091 9.777 25.243 1.00 0.00 H new ATOM 0 HG2 GLU A 124 134.373 10.739 25.556 1.00 0.00 H new ATOM 0 HG3 GLU A 124 134.133 11.746 24.142 1.00 0.00 H new ATOM 1941 N PRO A 125 132.179 6.982 23.243 1.00 0.00 N ATOM 1942 CA PRO A 125 131.280 6.023 22.595 1.00 0.00 C ATOM 1943 C PRO A 125 129.808 6.438 22.688 1.00 0.00 C ATOM 1944 O PRO A 125 129.359 6.798 23.770 1.00 0.00 O ATOM 1945 CB PRO A 125 131.516 4.721 23.365 1.00 0.00 C ATOM 1946 CG PRO A 125 132.847 4.885 23.993 1.00 0.00 C ATOM 1947 CD PRO A 125 132.976 6.342 24.303 1.00 0.00 C ATOM 1948 OXT PRO A 125 129.123 6.411 21.664 1.00 0.00 O ATOM 0 HA PRO A 125 131.485 5.944 21.527 1.00 0.00 H new ATOM 0 HB2 PRO A 125 130.742 4.560 24.116 1.00 0.00 H new ATOM 0 HB3 PRO A 125 131.497 3.859 22.698 1.00 0.00 H new ATOM 0 HG2 PRO A 125 132.928 4.284 24.899 1.00 0.00 H new ATOM 0 HG3 PRO A 125 133.640 4.557 23.320 1.00 0.00 H new ATOM 0 HD2 PRO A 125 132.591 6.578 25.295 1.00 0.00 H new ATOM 0 HD3 PRO A 125 134.016 6.669 24.278 1.00 0.00 H new TER 1956 PRO A 125 ATOM 1957 N ARG B 151 129.315 15.223 10.017 1.00 0.00 N ATOM 1958 CA ARG B 151 130.451 14.301 10.003 1.00 0.00 C ATOM 1959 C ARG B 151 130.671 13.781 8.601 1.00 0.00 C ATOM 1960 O ARG B 151 129.711 13.556 7.855 1.00 0.00 O ATOM 1961 CB ARG B 151 130.191 13.130 10.958 1.00 0.00 C ATOM 1962 CG ARG B 151 131.309 12.096 11.019 1.00 0.00 C ATOM 1963 CD ARG B 151 131.013 11.040 12.055 1.00 0.00 C ATOM 1964 NE ARG B 151 130.888 11.640 13.383 1.00 0.00 N ATOM 1965 CZ ARG B 151 130.476 11.012 14.475 1.00 0.00 C ATOM 1966 NH1 ARG B 151 130.160 9.726 14.436 1.00 0.00 N ATOM 1967 NH2 ARG B 151 130.380 11.684 15.604 1.00 0.00 N ATOM 0 HA ARG B 151 131.343 14.833 10.332 1.00 0.00 H new ATOM 0 HB2 ARG B 151 130.026 13.526 11.960 1.00 0.00 H new ATOM 0 HB3 ARG B 151 129.270 12.631 10.657 1.00 0.00 H new ATOM 0 HG2 ARG B 151 131.430 11.628 10.042 1.00 0.00 H new ATOM 0 HG3 ARG B 151 132.252 12.588 11.256 1.00 0.00 H new ATOM 0 HD2 ARG B 151 130.091 10.519 11.797 1.00 0.00 H new ATOM 0 HD3 ARG B 151 131.809 10.295 12.060 1.00 0.00 H new ATOM 0 HE ARG B 151 131.139 12.624 13.477 1.00 0.00 H new ATOM 0 HH11 ARG B 151 130.233 9.209 13.560 1.00 0.00 H new ATOM 0 HH12 ARG B 151 129.844 9.253 15.282 1.00 0.00 H new ATOM 0 HH21 ARG B 151 130.621 12.675 15.630 1.00 0.00 H new ATOM 0 HH22 ARG B 151 130.064 11.214 16.452 1.00 0.00 H new ATOM 1983 N SER B 152 131.926 13.597 8.239 1.00 0.00 N ATOM 1984 CA SER B 152 132.282 13.071 6.958 1.00 0.00 C ATOM 1985 C SER B 152 132.111 11.556 6.974 1.00 0.00 C ATOM 1986 O SER B 152 133.045 10.825 7.354 1.00 0.00 O ATOM 1987 CB SER B 152 133.729 13.444 6.633 1.00 0.00 C ATOM 1988 OG SER B 152 133.919 14.862 6.664 1.00 0.00 O ATOM 0 H SER B 152 132.724 13.813 8.837 1.00 0.00 H new ATOM 0 HA SER B 152 131.634 13.494 6.190 1.00 0.00 H new ATOM 0 HB2 SER B 152 134.399 12.969 7.350 1.00 0.00 H new ATOM 0 HB3 SER B 152 133.993 13.061 5.647 1.00 0.00 H new ATOM 0 HG SER B 152 134.853 15.072 6.454 1.00 0.00 H new ATOM 1994 N SER B 153 130.890 11.113 6.624 1.00 0.00 N ATOM 1995 CA SER B 153 130.504 9.706 6.553 1.00 0.00 C ATOM 1996 C SER B 153 130.306 9.086 7.944 1.00 0.00 C ATOM 1997 O SER B 153 130.842 9.563 8.943 1.00 0.00 O ATOM 1998 CB SER B 153 131.506 8.895 5.720 1.00 0.00 C ATOM 1999 OG SER B 153 131.654 9.464 4.426 1.00 0.00 O ATOM 0 H SER B 153 130.130 11.747 6.378 1.00 0.00 H new ATOM 0 HA SER B 153 129.538 9.668 6.049 1.00 0.00 H new ATOM 0 HB2 SER B 153 132.472 8.870 6.225 1.00 0.00 H new ATOM 0 HB3 SER B 153 131.165 7.863 5.633 1.00 0.00 H new ATOM 0 HG SER B 153 132.297 8.936 3.908 1.00 0.00 H new ATOM 2005 N ARG B 154 129.490 8.056 8.000 1.00 0.00 N ATOM 2006 CA ARG B 154 129.239 7.351 9.241 1.00 0.00 C ATOM 2007 C ARG B 154 128.996 5.869 8.957 1.00 0.00 C ATOM 2008 O ARG B 154 129.842 5.044 9.212 1.00 0.00 O ATOM 2009 CB ARG B 154 128.106 8.034 10.127 1.00 0.00 C ATOM 2010 CG ARG B 154 126.639 8.155 9.577 1.00 0.00 C ATOM 2011 CD ARG B 154 126.526 8.919 8.251 1.00 0.00 C ATOM 2012 NE ARG B 154 125.124 9.300 7.914 1.00 0.00 N ATOM 2013 CZ ARG B 154 124.485 9.060 6.733 1.00 0.00 C ATOM 2014 NH1 ARG B 154 124.896 8.090 5.929 1.00 0.00 N ATOM 2015 NH2 ARG B 154 123.385 9.748 6.414 1.00 0.00 N ATOM 0 H ARG B 154 128.985 7.685 7.195 1.00 0.00 H new ATOM 0 HA ARG B 154 130.132 7.420 9.863 1.00 0.00 H new ATOM 0 HB2 ARG B 154 128.055 7.484 11.067 1.00 0.00 H new ATOM 0 HB3 ARG B 154 128.446 9.042 10.366 1.00 0.00 H new ATOM 0 HG2 ARG B 154 126.229 7.154 9.443 1.00 0.00 H new ATOM 0 HG3 ARG B 154 126.022 8.654 10.325 1.00 0.00 H new ATOM 0 HD2 ARG B 154 127.138 9.819 8.304 1.00 0.00 H new ATOM 0 HD3 ARG B 154 126.932 8.304 7.448 1.00 0.00 H new ATOM 0 HE ARG B 154 124.592 9.787 8.636 1.00 0.00 H new ATOM 0 HH11 ARG B 154 125.697 7.515 6.191 1.00 0.00 H new ATOM 0 HH12 ARG B 154 124.412 7.918 5.048 1.00 0.00 H new ATOM 0 HH21 ARG B 154 123.022 10.454 7.054 1.00 0.00 H new ATOM 0 HH22 ARG B 154 122.909 9.567 5.530 1.00 0.00 H new ATOM 2029 N THR B 155 127.878 5.593 8.383 1.00 0.00 N ATOM 2030 CA THR B 155 127.439 4.312 7.953 1.00 0.00 C ATOM 2031 C THR B 155 126.395 4.659 6.912 1.00 0.00 C ATOM 2032 O THR B 155 125.735 5.700 7.079 1.00 0.00 O ATOM 2033 CB THR B 155 126.830 3.479 9.145 1.00 0.00 C ATOM 2034 OG1 THR B 155 126.177 2.280 8.683 1.00 0.00 O ATOM 2035 CG2 THR B 155 125.905 4.311 10.034 1.00 0.00 C ATOM 0 H THR B 155 127.189 6.319 8.186 1.00 0.00 H new ATOM 0 HA THR B 155 128.240 3.683 7.565 1.00 0.00 H new ATOM 0 HB THR B 155 127.673 3.177 9.767 1.00 0.00 H new ATOM 0 HG1 THR B 155 125.265 2.494 8.395 1.00 0.00 H new ATOM 0 HG21 THR B 155 125.515 3.687 10.838 1.00 0.00 H new ATOM 0 HG22 THR B 155 126.463 5.145 10.460 1.00 0.00 H new ATOM 0 HG23 THR B 155 125.077 4.696 9.438 1.00 0.00 H new ATOM 2043 N ARG B 156 126.268 3.919 5.822 1.00 0.00 N ATOM 2044 CA ARG B 156 125.323 4.338 4.782 1.00 0.00 C ATOM 2045 C ARG B 156 124.935 3.197 3.869 1.00 0.00 C ATOM 2046 O ARG B 156 125.684 2.222 3.750 1.00 0.00 O ATOM 2047 CB ARG B 156 125.927 5.477 3.941 1.00 0.00 C ATOM 2048 CG ARG B 156 127.065 5.072 3.016 1.00 0.00 C ATOM 2049 CD ARG B 156 127.699 6.278 2.336 1.00 0.00 C ATOM 2050 NE ARG B 156 126.711 7.173 1.683 1.00 0.00 N ATOM 2051 CZ ARG B 156 126.927 7.848 0.531 1.00 0.00 C ATOM 2052 NH1 ARG B 156 128.074 7.703 -0.128 1.00 0.00 N ATOM 2053 NH2 ARG B 156 126.009 8.680 0.066 1.00 0.00 N ATOM 0 H ARG B 156 126.781 3.058 5.631 1.00 0.00 H new ATOM 0 HA ARG B 156 124.423 4.684 5.291 1.00 0.00 H new ATOM 0 HB2 ARG B 156 125.134 5.922 3.340 1.00 0.00 H new ATOM 0 HB3 ARG B 156 126.289 6.252 4.616 1.00 0.00 H new ATOM 0 HG2 ARG B 156 127.824 4.536 3.586 1.00 0.00 H new ATOM 0 HG3 ARG B 156 126.690 4.383 2.259 1.00 0.00 H new ATOM 0 HD2 ARG B 156 128.262 6.848 3.075 1.00 0.00 H new ATOM 0 HD3 ARG B 156 128.413 5.931 1.589 1.00 0.00 H new ATOM 0 HE ARG B 156 125.804 7.287 2.136 1.00 0.00 H new ATOM 0 HH11 ARG B 156 128.796 7.080 0.235 1.00 0.00 H new ATOM 0 HH12 ARG B 156 128.231 8.215 -0.996 1.00 0.00 H new ATOM 0 HH21 ARG B 156 125.136 8.813 0.577 1.00 0.00 H new ATOM 0 HH22 ARG B 156 126.174 9.188 -0.803 1.00 0.00 H new ATOM 2067 N ARG B 157 123.740 3.328 3.240 1.00 0.00 N ATOM 2068 CA ARG B 157 123.195 2.436 2.249 1.00 0.00 C ATOM 2069 C ARG B 157 122.932 1.010 2.696 1.00 0.00 C ATOM 2070 O ARG B 157 121.783 0.609 2.749 1.00 0.00 O ATOM 2071 CB ARG B 157 123.809 2.559 0.824 1.00 0.00 C ATOM 2072 CG ARG B 157 125.184 1.989 0.604 1.00 0.00 C ATOM 2073 CD ARG B 157 125.609 2.169 -0.843 1.00 0.00 C ATOM 2074 NE ARG B 157 126.773 1.348 -1.157 1.00 0.00 N ATOM 2075 CZ ARG B 157 127.673 1.591 -2.117 1.00 0.00 C ATOM 2076 NH1 ARG B 157 127.542 2.645 -2.925 1.00 0.00 N ATOM 2077 NH2 ARG B 157 128.691 0.764 -2.284 1.00 0.00 N ATOM 0 H ARG B 157 123.116 4.110 3.439 1.00 0.00 H new ATOM 0 HA ARG B 157 122.189 2.841 2.136 1.00 0.00 H new ATOM 0 HB2 ARG B 157 123.129 2.075 0.123 1.00 0.00 H new ATOM 0 HB3 ARG B 157 123.838 3.616 0.561 1.00 0.00 H new ATOM 0 HG2 ARG B 157 125.898 2.482 1.263 1.00 0.00 H new ATOM 0 HG3 ARG B 157 125.191 0.930 0.862 1.00 0.00 H new ATOM 0 HD2 ARG B 157 124.784 1.902 -1.503 1.00 0.00 H new ATOM 0 HD3 ARG B 157 125.840 3.218 -1.029 1.00 0.00 H new ATOM 0 HE ARG B 157 126.914 0.511 -0.592 1.00 0.00 H new ATOM 0 HH11 ARG B 157 126.749 3.277 -2.815 1.00 0.00 H new ATOM 0 HH12 ARG B 157 128.235 2.819 -3.653 1.00 0.00 H new ATOM 0 HH21 ARG B 157 128.787 -0.054 -1.683 1.00 0.00 H new ATOM 0 HH22 ARG B 157 129.380 0.944 -3.014 1.00 0.00 H new ATOM 2091 N GLU B 158 123.950 0.300 3.068 1.00 0.00 N ATOM 2092 CA GLU B 158 123.854 -1.107 3.390 1.00 0.00 C ATOM 2093 C GLU B 158 123.160 -1.284 4.746 1.00 0.00 C ATOM 2094 O GLU B 158 123.819 -1.357 5.783 1.00 0.00 O ATOM 2095 CB GLU B 158 125.244 -1.695 3.510 1.00 0.00 C ATOM 2096 CG GLU B 158 126.266 -1.269 2.458 1.00 0.00 C ATOM 2097 CD GLU B 158 125.965 -1.720 1.068 1.00 0.00 C ATOM 2098 OE1 GLU B 158 125.465 -2.831 0.883 1.00 0.00 O ATOM 2099 OE2 GLU B 158 126.316 -0.984 0.126 1.00 0.00 O ATOM 0 H GLU B 158 124.892 0.679 3.161 1.00 0.00 H new ATOM 0 HA GLU B 158 123.289 -1.605 2.603 1.00 0.00 H new ATOM 0 HB2 GLU B 158 125.639 -1.435 4.492 1.00 0.00 H new ATOM 0 HB3 GLU B 158 125.157 -2.781 3.479 1.00 0.00 H new ATOM 0 HG2 GLU B 158 126.339 -0.181 2.463 1.00 0.00 H new ATOM 0 HG3 GLU B 158 127.244 -1.655 2.746 1.00 0.00 H new ATOM 2106 N THR B 159 121.871 -1.345 4.753 1.00 0.00 N ATOM 2107 CA THR B 159 121.169 -1.510 5.985 1.00 0.00 C ATOM 2108 C THR B 159 120.786 -2.976 6.111 1.00 0.00 C ATOM 2109 O THR B 159 120.048 -3.516 5.278 1.00 0.00 O ATOM 2110 CB THR B 159 119.910 -0.612 6.041 1.00 0.00 C ATOM 2111 OG1 THR B 159 120.231 0.667 5.456 1.00 0.00 O ATOM 2112 CG2 THR B 159 119.449 -0.396 7.503 1.00 0.00 C ATOM 0 H THR B 159 121.281 -1.283 3.923 1.00 0.00 H new ATOM 0 HA THR B 159 121.809 -1.211 6.815 1.00 0.00 H new ATOM 0 HB THR B 159 119.104 -1.099 5.492 1.00 0.00 H new ATOM 0 HG1 THR B 159 119.441 1.247 5.483 1.00 0.00 H new ATOM 0 HG21 THR B 159 118.563 0.238 7.515 1.00 0.00 H new ATOM 0 HG22 THR B 159 119.212 -1.359 7.956 1.00 0.00 H new ATOM 0 HG23 THR B 159 120.247 0.085 8.069 1.00 0.00 H new ATOM 2120 N GLN B 160 121.361 -3.632 7.075 1.00 0.00 N ATOM 2121 CA GLN B 160 121.055 -5.010 7.334 1.00 0.00 C ATOM 2122 C GLN B 160 119.898 -5.048 8.281 1.00 0.00 C ATOM 2123 O GLN B 160 120.052 -4.752 9.473 1.00 0.00 O ATOM 2124 CB GLN B 160 122.275 -5.738 7.909 1.00 0.00 C ATOM 2125 CG GLN B 160 122.031 -7.186 8.331 1.00 0.00 C ATOM 2126 CD GLN B 160 123.251 -7.812 8.988 1.00 0.00 C ATOM 2127 OE1 GLN B 160 124.055 -7.125 9.630 1.00 0.00 O ATOM 2128 NE2 GLN B 160 123.395 -9.106 8.843 1.00 0.00 N ATOM 0 H GLN B 160 122.055 -3.229 7.704 1.00 0.00 H new ATOM 0 HA GLN B 160 120.792 -5.524 6.409 1.00 0.00 H new ATOM 0 HB2 GLN B 160 123.071 -5.723 7.165 1.00 0.00 H new ATOM 0 HB3 GLN B 160 122.636 -5.181 8.773 1.00 0.00 H new ATOM 0 HG2 GLN B 160 121.190 -7.223 9.023 1.00 0.00 H new ATOM 0 HG3 GLN B 160 121.751 -7.774 7.457 1.00 0.00 H new ATOM 0 HE21 GLN B 160 122.710 -9.638 8.306 1.00 0.00 H new ATOM 0 HE22 GLN B 160 124.192 -9.581 9.267 1.00 0.00 H new ATOM 2137 N VAL B 161 118.747 -5.365 7.772 1.00 0.00 N ATOM 2138 CA VAL B 161 117.579 -5.333 8.575 1.00 0.00 C ATOM 2139 C VAL B 161 117.074 -6.731 8.809 1.00 0.00 C ATOM 2140 O VAL B 161 116.541 -7.020 9.903 1.00 0.00 O ATOM 2141 CB VAL B 161 116.456 -4.402 8.017 1.00 0.00 C ATOM 2142 CG1 VAL B 161 116.985 -3.035 7.716 1.00 0.00 C ATOM 2143 CG2 VAL B 161 115.791 -4.953 6.793 1.00 0.00 C ATOM 2144 OXT VAL B 161 117.276 -7.578 7.934 1.00 0.00 O ATOM 0 H VAL B 161 118.599 -5.648 6.803 1.00 0.00 H new ATOM 0 HA VAL B 161 117.866 -4.891 9.529 1.00 0.00 H new ATOM 0 HB VAL B 161 115.706 -4.342 8.806 1.00 0.00 H new ATOM 0 HG11 VAL B 161 116.180 -2.410 7.329 1.00 0.00 H new ATOM 0 HG12 VAL B 161 117.383 -2.590 8.628 1.00 0.00 H new ATOM 0 HG13 VAL B 161 117.778 -3.107 6.971 1.00 0.00 H new ATOM 0 HG21 VAL B 161 115.021 -4.260 6.454 1.00 0.00 H new ATOM 0 HG22 VAL B 161 116.532 -5.085 6.005 1.00 0.00 H new ATOM 0 HG23 VAL B 161 115.336 -5.915 7.028 1.00 0.00 H new TER 2154 VAL B 161