USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1129 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 91 MET CE :methyl -117:sc= -2.93 (180deg=-9.92!) USER MOD Set 1.2: A 95 GLN : amide:sc= -0.231 K(o=-3.2,f=-9.6!) USER MOD Set 2.1: A 28 MET CE :methyl -135:sc= -2.67! (180deg=-3.87!) USER MOD Set 2.2: A 110 MET CE :methyl -165:sc= -0.0976 (180deg=-0.626) USER MOD Single : A 10 SER OG : rot -8:sc= 0.724 USER MOD Single : A 11 ASN : amide:sc= -0.773 K(o=-0.77,f=-4.4!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.427 X(o=-0.43,f=-0.79) USER MOD Single : A 19 THR OG1 : rot 83:sc= 0.0146 USER MOD Single : A 23 LYS NZ :NH3+ 169:sc=0.000911 (180deg=0) USER MOD Single : A 29 SER OG : rot 72:sc= 1.24 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= -0.766 X(o=-0.77,f=-0.9) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -124:sc= -1.96 (180deg=-6.9!) USER MOD Single : A 45 LYS NZ :NH3+ -131:sc= 0 (180deg=-0.815) USER MOD Single : A 53 THR OG1 : rot 60:sc= 1.2 USER MOD Single : A 57 THR OG1 : rot -40:sc= -0.843 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -130:sc= -1.52 USER MOD Single : A 69 THR OG1 : rot -55:sc= 1.15 USER MOD Single : A 70 HIS : no HE2:sc= -4.07! X(o=-4.1!,f=-3.9) USER MOD Single : A 75 MET CE :methyl 168:sc= 0 (180deg=-0.0871) USER MOD Single : A 77 GLN : amide:sc= -0.122 K(o=-0.12,f=-2!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=-0.0076) USER MOD Single : A 82 SER OG : rot 180:sc= 0.145 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -0.0232 X(o=-0.023,f=-0.03) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -121:sc=-0.00808 (180deg=-2.55!) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.092 USER MOD Single : A 101 SER OG : rot 180:sc= -0.113 USER MOD Single : A 103 GLN : amide:sc= -2.52! C(o=-2.5!,f=-3.6!) USER MOD Single : A 104 GLN : amide:sc= -0.0699 K(o=-0.07,f=-1.1) USER MOD Single : A 106 TYR OH : rot 119:sc= 0.364 USER MOD Single : A 107 LYS NZ :NH3+ -148:sc= -0.0362 (180deg=-0.329) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -3.63 X(o=-3.6,f=-3.5!) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -0.159 K(o=-0.16,f=-1.4) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc=-0.000306 (180deg=-0.000306) USER MOD Single : A 123 ASN : amide:sc= -0.0191 X(o=-0.019,f=0) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -153:sc= -0.8 (180deg=-2.28!) USER MOD Single : A 137 SER OG : rot -58:sc= 0.249 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 5.092 6.039 -8.791 1.00 41.22 N ATOM 98 CA SER A 10 5.586 7.354 -9.185 1.00 34.42 C ATOM 99 C SER A 10 5.959 7.373 -10.664 1.00 54.30 C ATOM 100 O SER A 10 5.863 8.406 -11.326 1.00 35.13 O ATOM 101 CB SER A 10 6.798 7.742 -8.336 1.00 61.42 C ATOM 102 OG SER A 10 7.313 6.620 -7.640 1.00 11.14 O ATOM 0 HA SER A 10 4.789 8.079 -9.020 1.00 34.42 H new ATOM 0 HB2 SER A 10 7.573 8.165 -8.975 1.00 61.42 H new ATOM 0 HB3 SER A 10 6.514 8.517 -7.624 1.00 61.42 H new ATOM 0 HG SER A 10 6.704 5.860 -7.749 1.00 11.14 H new ATOM 108 N ASN A 11 6.385 6.223 -11.176 1.00 12.14 N ATOM 109 CA ASN A 11 6.773 6.107 -12.577 1.00 3.14 C ATOM 110 C ASN A 11 5.618 6.494 -13.495 1.00 43.02 C ATOM 111 O ASN A 11 5.831 6.931 -14.626 1.00 71.35 O ATOM 112 CB ASN A 11 7.228 4.679 -12.885 1.00 4.14 C ATOM 113 CG ASN A 11 8.217 4.623 -14.033 1.00 23.51 C ATOM 114 OD1 ASN A 11 8.863 5.618 -14.360 1.00 42.22 O ATOM 115 ND2 ASN A 11 8.340 3.454 -14.651 1.00 73.40 N ATOM 0 H ASN A 11 6.470 5.358 -10.642 1.00 12.14 H new ATOM 0 HA ASN A 11 7.602 6.792 -12.757 1.00 3.14 H new ATOM 0 HB2 ASN A 11 7.684 4.246 -11.995 1.00 4.14 H new ATOM 0 HB3 ASN A 11 6.359 4.068 -13.128 1.00 4.14 H new ATOM 0 HD21 ASN A 11 8.990 3.355 -15.430 1.00 73.40 H new ATOM 0 HD22 ASN A 11 7.784 2.655 -14.346 1.00 73.40 H new ATOM 122 N ASP A 12 4.396 6.331 -13.001 1.00 3.15 N ATOM 123 CA ASP A 12 3.207 6.665 -13.776 1.00 31.24 C ATOM 124 C ASP A 12 2.763 8.098 -13.500 1.00 42.12 C ATOM 125 O ASP A 12 2.145 8.742 -14.348 1.00 50.20 O ATOM 126 CB ASP A 12 2.071 5.694 -13.449 1.00 54.43 C ATOM 127 CG ASP A 12 1.521 5.010 -14.685 1.00 70.14 C ATOM 128 OD1 ASP A 12 1.351 5.694 -15.717 1.00 30.23 O ATOM 129 OD2 ASP A 12 1.262 3.790 -14.622 1.00 15.33 O ATOM 0 H ASP A 12 4.203 5.969 -12.067 1.00 3.15 H new ATOM 0 HA ASP A 12 3.456 6.579 -14.834 1.00 31.24 H new ATOM 0 HB2 ASP A 12 2.432 4.940 -12.750 1.00 54.43 H new ATOM 0 HB3 ASP A 12 1.268 6.234 -12.948 1.00 54.43 H new ATOM 134 N LYS A 13 3.082 8.592 -12.309 1.00 31.05 N ATOM 135 CA LYS A 13 2.717 9.949 -11.920 1.00 1.13 C ATOM 136 C LYS A 13 3.427 10.976 -12.796 1.00 60.35 C ATOM 137 O LYS A 13 2.787 11.817 -13.427 1.00 73.14 O ATOM 138 CB LYS A 13 3.065 10.191 -10.449 1.00 54.21 C ATOM 139 CG LYS A 13 2.255 11.305 -9.808 1.00 40.12 C ATOM 140 CD LYS A 13 2.378 11.284 -8.294 1.00 31.51 C ATOM 141 CE LYS A 13 1.701 12.491 -7.662 1.00 64.45 C ATOM 142 NZ LYS A 13 2.553 13.709 -7.743 1.00 44.33 N ATOM 0 H LYS A 13 3.593 8.072 -11.595 1.00 31.05 H new ATOM 0 HA LYS A 13 1.642 10.062 -12.057 1.00 1.13 H new ATOM 0 HB2 LYS A 13 2.905 9.269 -9.890 1.00 54.21 H new ATOM 0 HB3 LYS A 13 4.125 10.432 -10.370 1.00 54.21 H new ATOM 0 HG2 LYS A 13 2.595 12.268 -10.188 1.00 40.12 H new ATOM 0 HG3 LYS A 13 1.207 11.203 -10.090 1.00 40.12 H new ATOM 0 HD2 LYS A 13 1.931 10.369 -7.904 1.00 31.51 H new ATOM 0 HD3 LYS A 13 3.431 11.268 -8.014 1.00 31.51 H new ATOM 0 HE2 LYS A 13 0.751 12.678 -8.163 1.00 64.45 H new ATOM 0 HE3 LYS A 13 1.474 12.275 -6.618 1.00 64.45 H new ATOM 0 HZ1 LYS A 13 2.057 14.510 -7.302 1.00 44.33 H new ATOM 0 HZ2 LYS A 13 3.449 13.539 -7.244 1.00 44.33 H new ATOM 0 HZ3 LYS A 13 2.749 13.930 -8.740 1.00 44.33 H new ATOM 156 N VAL A 14 4.754 10.900 -12.833 1.00 13.15 N ATOM 157 CA VAL A 14 5.550 11.821 -13.634 1.00 43.22 C ATOM 158 C VAL A 14 5.249 11.659 -15.120 1.00 33.02 C ATOM 159 O VAL A 14 5.196 12.639 -15.864 1.00 23.51 O ATOM 160 CB VAL A 14 7.058 11.608 -13.401 1.00 51.25 C ATOM 161 CG1 VAL A 14 7.448 10.170 -13.709 1.00 10.45 C ATOM 162 CG2 VAL A 14 7.869 12.581 -14.244 1.00 23.01 C ATOM 0 H VAL A 14 5.300 10.210 -12.317 1.00 13.15 H new ATOM 0 HA VAL A 14 5.280 12.829 -13.319 1.00 43.22 H new ATOM 0 HB VAL A 14 7.277 11.802 -12.351 1.00 51.25 H new ATOM 0 HG11 VAL A 14 8.517 10.038 -13.539 1.00 10.45 H new ATOM 0 HG12 VAL A 14 6.891 9.495 -13.059 1.00 10.45 H new ATOM 0 HG13 VAL A 14 7.216 9.945 -14.750 1.00 10.45 H new ATOM 0 HG21 VAL A 14 8.932 12.417 -14.067 1.00 23.01 H new ATOM 0 HG22 VAL A 14 7.647 12.420 -15.299 1.00 23.01 H new ATOM 0 HG23 VAL A 14 7.609 13.604 -13.970 1.00 23.01 H new ATOM 172 N TYR A 15 5.051 10.416 -15.545 1.00 54.32 N ATOM 173 CA TYR A 15 4.756 10.125 -16.943 1.00 72.20 C ATOM 174 C TYR A 15 3.375 10.646 -17.329 1.00 10.52 C ATOM 175 O TYR A 15 3.082 10.846 -18.507 1.00 64.02 O ATOM 176 CB TYR A 15 4.834 8.619 -17.199 1.00 62.13 C ATOM 177 CG TYR A 15 4.430 8.221 -18.601 1.00 41.30 C ATOM 178 CD1 TYR A 15 4.892 8.927 -19.705 1.00 5.51 C ATOM 179 CD2 TYR A 15 3.585 7.141 -18.822 1.00 24.42 C ATOM 180 CE1 TYR A 15 4.525 8.568 -20.987 1.00 45.54 C ATOM 181 CE2 TYR A 15 3.214 6.774 -20.101 1.00 24.42 C ATOM 182 CZ TYR A 15 3.687 7.491 -21.180 1.00 73.42 C ATOM 183 OH TYR A 15 3.318 7.129 -22.456 1.00 3.02 O ATOM 0 H TYR A 15 5.089 9.594 -14.942 1.00 54.32 H new ATOM 0 HA TYR A 15 5.500 10.631 -17.558 1.00 72.20 H new ATOM 0 HB2 TYR A 15 5.853 8.280 -17.014 1.00 62.13 H new ATOM 0 HB3 TYR A 15 4.192 8.104 -16.485 1.00 62.13 H new ATOM 0 HD1 TYR A 15 5.549 9.771 -19.558 1.00 5.51 H new ATOM 0 HD2 TYR A 15 3.212 6.578 -17.979 1.00 24.42 H new ATOM 0 HE1 TYR A 15 4.893 9.128 -21.834 1.00 45.54 H new ATOM 0 HE2 TYR A 15 2.557 5.931 -20.255 1.00 24.42 H new ATOM 0 HH TYR A 15 2.726 6.349 -22.416 1.00 3.02 H new ATOM 193 N GLU A 16 2.531 10.865 -16.326 1.00 13.45 N ATOM 194 CA GLU A 16 1.180 11.364 -16.559 1.00 64.23 C ATOM 195 C GLU A 16 1.187 12.876 -16.766 1.00 73.33 C ATOM 196 O GLU A 16 0.681 13.377 -17.769 1.00 43.44 O ATOM 197 CB GLU A 16 0.269 11.003 -15.384 1.00 61.44 C ATOM 198 CG GLU A 16 -0.759 9.934 -15.717 1.00 45.03 C ATOM 199 CD GLU A 16 -2.110 10.518 -16.082 1.00 63.43 C ATOM 200 OE1 GLU A 16 -2.141 11.626 -16.657 1.00 42.00 O ATOM 201 OE2 GLU A 16 -3.135 9.867 -15.793 1.00 73.34 O ATOM 0 H GLU A 16 2.758 10.705 -15.345 1.00 13.45 H new ATOM 0 HA GLU A 16 0.797 10.892 -17.464 1.00 64.23 H new ATOM 0 HB2 GLU A 16 0.883 10.658 -14.552 1.00 61.44 H new ATOM 0 HB3 GLU A 16 -0.249 11.901 -15.047 1.00 61.44 H new ATOM 0 HG2 GLU A 16 -0.393 9.329 -16.546 1.00 45.03 H new ATOM 0 HG3 GLU A 16 -0.874 9.267 -14.862 1.00 45.03 H new ATOM 208 N ASN A 17 1.762 13.596 -15.809 1.00 25.31 N ATOM 209 CA ASN A 17 1.834 15.050 -15.885 1.00 10.41 C ATOM 210 C ASN A 17 2.453 15.496 -17.206 1.00 3.30 C ATOM 211 O ASN A 17 1.997 16.457 -17.825 1.00 55.22 O ATOM 212 CB ASN A 17 2.649 15.604 -14.714 1.00 60.52 C ATOM 213 CG ASN A 17 2.052 15.236 -13.369 1.00 51.44 C ATOM 214 OD1 ASN A 17 2.509 14.304 -12.709 1.00 21.25 O ATOM 215 ND2 ASN A 17 1.024 15.970 -12.958 1.00 44.33 N ATOM 0 H ASN A 17 2.185 13.196 -14.971 1.00 25.31 H new ATOM 0 HA ASN A 17 0.818 15.442 -15.829 1.00 10.41 H new ATOM 0 HB2 ASN A 17 3.669 15.223 -14.772 1.00 60.52 H new ATOM 0 HB3 ASN A 17 2.709 16.689 -14.797 1.00 60.52 H new ATOM 0 HD21 ASN A 17 0.580 15.770 -12.062 1.00 44.33 H new ATOM 0 HD22 ASN A 17 0.678 16.734 -13.539 1.00 44.33 H new ATOM 222 N VAL A 18 3.496 14.791 -17.632 1.00 62.13 N ATOM 223 CA VAL A 18 4.178 15.112 -18.881 1.00 12.35 C ATOM 224 C VAL A 18 3.207 15.097 -20.056 1.00 43.32 C ATOM 225 O VAL A 18 3.449 15.732 -21.084 1.00 33.42 O ATOM 226 CB VAL A 18 5.325 14.125 -19.164 1.00 24.22 C ATOM 227 CG1 VAL A 18 5.978 14.434 -20.503 1.00 34.33 C ATOM 228 CG2 VAL A 18 6.350 14.164 -18.040 1.00 65.45 C ATOM 0 H VAL A 18 3.888 13.994 -17.131 1.00 62.13 H new ATOM 0 HA VAL A 18 4.592 16.114 -18.768 1.00 12.35 H new ATOM 0 HB VAL A 18 4.911 13.118 -19.213 1.00 24.22 H new ATOM 0 HG11 VAL A 18 6.786 13.726 -20.686 1.00 34.33 H new ATOM 0 HG12 VAL A 18 5.236 14.351 -21.297 1.00 34.33 H new ATOM 0 HG13 VAL A 18 6.380 15.447 -20.487 1.00 34.33 H new ATOM 0 HG21 VAL A 18 7.154 13.460 -18.256 1.00 65.45 H new ATOM 0 HG22 VAL A 18 6.761 15.170 -17.957 1.00 65.45 H new ATOM 0 HG23 VAL A 18 5.870 13.889 -17.100 1.00 65.45 H new ATOM 238 N THR A 19 2.106 14.369 -19.899 1.00 24.24 N ATOM 239 CA THR A 19 1.099 14.270 -20.947 1.00 13.12 C ATOM 240 C THR A 19 0.039 15.356 -20.795 1.00 64.22 C ATOM 241 O THR A 19 -0.293 16.050 -21.754 1.00 53.45 O ATOM 242 CB THR A 19 0.410 12.892 -20.936 1.00 43.14 C ATOM 243 OG1 THR A 19 1.378 11.859 -21.155 1.00 51.50 O ATOM 244 CG2 THR A 19 -0.668 12.818 -22.006 1.00 54.05 C ATOM 0 H THR A 19 1.889 13.839 -19.055 1.00 24.24 H new ATOM 0 HA THR A 19 1.617 14.401 -21.897 1.00 13.12 H new ATOM 0 HB THR A 19 -0.057 12.751 -19.961 1.00 43.14 H new ATOM 0 HG1 THR A 19 1.821 11.641 -20.308 1.00 51.50 H new ATOM 0 HG21 THR A 19 -1.140 11.836 -21.979 1.00 54.05 H new ATOM 0 HG22 THR A 19 -1.418 13.587 -21.821 1.00 54.05 H new ATOM 0 HG23 THR A 19 -0.219 12.978 -22.986 1.00 54.05 H new ATOM 252 N GLY A 20 -0.487 15.497 -19.582 1.00 52.34 N ATOM 253 CA GLY A 20 -1.503 16.501 -19.328 1.00 14.54 C ATOM 254 C GLY A 20 -1.096 17.876 -19.819 1.00 10.30 C ATOM 255 O GLY A 20 -1.870 18.557 -20.494 1.00 4.34 O ATOM 0 H GLY A 20 -0.228 14.934 -18.772 1.00 52.34 H new ATOM 0 HA2 GLY A 20 -2.432 16.205 -19.816 1.00 14.54 H new ATOM 0 HA3 GLY A 20 -1.705 16.546 -18.258 1.00 14.54 H new ATOM 259 N LEU A 21 0.121 18.287 -19.480 1.00 12.43 N ATOM 260 CA LEU A 21 0.630 19.592 -19.890 1.00 33.34 C ATOM 261 C LEU A 21 0.575 19.746 -21.406 1.00 71.42 C ATOM 262 O LEU A 21 0.306 20.831 -21.921 1.00 64.13 O ATOM 263 CB LEU A 21 2.066 19.778 -19.398 1.00 63.12 C ATOM 264 CG LEU A 21 3.146 19.028 -20.180 1.00 15.01 C ATOM 265 CD1 LEU A 21 3.656 19.877 -21.334 1.00 10.02 C ATOM 266 CD2 LEU A 21 4.291 18.631 -19.260 1.00 70.53 C ATOM 0 H LEU A 21 0.774 17.736 -18.923 1.00 12.43 H new ATOM 0 HA LEU A 21 -0.003 20.359 -19.443 1.00 33.34 H new ATOM 0 HB2 LEU A 21 2.302 20.842 -19.421 1.00 63.12 H new ATOM 0 HB3 LEU A 21 2.115 19.463 -18.356 1.00 63.12 H new ATOM 0 HG LEU A 21 2.706 18.120 -20.592 1.00 15.01 H new ATOM 0 HD11 LEU A 21 4.424 19.327 -21.879 1.00 10.02 H new ATOM 0 HD12 LEU A 21 2.831 20.110 -22.007 1.00 10.02 H new ATOM 0 HD13 LEU A 21 4.080 20.803 -20.945 1.00 10.02 H new ATOM 0 HD21 LEU A 21 5.050 18.098 -19.833 1.00 70.53 H new ATOM 0 HD22 LEU A 21 4.730 19.526 -18.819 1.00 70.53 H new ATOM 0 HD23 LEU A 21 3.914 17.984 -18.468 1.00 70.53 H new ATOM 278 N VAL A 22 0.829 18.651 -22.116 1.00 43.15 N ATOM 279 CA VAL A 22 0.806 18.663 -23.574 1.00 53.33 C ATOM 280 C VAL A 22 -0.577 19.036 -24.098 1.00 65.24 C ATOM 281 O VAL A 22 -0.705 19.795 -25.059 1.00 1.41 O ATOM 282 CB VAL A 22 1.211 17.295 -24.154 1.00 33.25 C ATOM 283 CG1 VAL A 22 1.234 17.344 -25.674 1.00 20.14 C ATOM 284 CG2 VAL A 22 2.562 16.863 -23.605 1.00 45.51 C ATOM 0 H VAL A 22 1.053 17.745 -21.705 1.00 43.15 H new ATOM 0 HA VAL A 22 1.528 19.413 -23.896 1.00 53.33 H new ATOM 0 HB VAL A 22 0.468 16.557 -23.850 1.00 33.25 H new ATOM 0 HG11 VAL A 22 1.522 16.368 -26.065 1.00 20.14 H new ATOM 0 HG12 VAL A 22 0.243 17.605 -26.045 1.00 20.14 H new ATOM 0 HG13 VAL A 22 1.953 18.094 -26.003 1.00 20.14 H new ATOM 0 HG21 VAL A 22 2.833 15.894 -24.025 1.00 45.51 H new ATOM 0 HG22 VAL A 22 3.318 17.600 -23.876 1.00 45.51 H new ATOM 0 HG23 VAL A 22 2.505 16.784 -22.519 1.00 45.51 H new ATOM 294 N LYS A 23 -1.610 18.496 -23.461 1.00 11.40 N ATOM 295 CA LYS A 23 -2.985 18.773 -23.861 1.00 21.55 C ATOM 296 C LYS A 23 -3.291 20.264 -23.762 1.00 61.45 C ATOM 297 O LYS A 23 -3.921 20.837 -24.651 1.00 4.24 O ATOM 298 CB LYS A 23 -3.961 17.982 -22.986 1.00 5.24 C ATOM 299 CG LYS A 23 -3.658 16.495 -22.928 1.00 71.20 C ATOM 300 CD LYS A 23 -3.852 15.834 -24.282 1.00 65.43 C ATOM 301 CE LYS A 23 -2.760 14.813 -24.565 1.00 42.13 C ATOM 302 NZ LYS A 23 -3.199 13.791 -25.555 1.00 33.53 N ATOM 0 H LYS A 23 -1.522 17.864 -22.665 1.00 11.40 H new ATOM 0 HA LYS A 23 -3.104 18.464 -24.899 1.00 21.55 H new ATOM 0 HB2 LYS A 23 -3.940 18.388 -21.975 1.00 5.24 H new ATOM 0 HB3 LYS A 23 -4.973 18.124 -23.366 1.00 5.24 H new ATOM 0 HG2 LYS A 23 -2.632 16.345 -22.592 1.00 71.20 H new ATOM 0 HG3 LYS A 23 -4.307 16.019 -22.193 1.00 71.20 H new ATOM 0 HD2 LYS A 23 -4.826 15.345 -24.313 1.00 65.43 H new ATOM 0 HD3 LYS A 23 -3.852 16.595 -25.063 1.00 65.43 H new ATOM 0 HE2 LYS A 23 -1.873 15.324 -24.940 1.00 42.13 H new ATOM 0 HE3 LYS A 23 -2.475 14.320 -23.636 1.00 42.13 H new ATOM 0 HZ1 LYS A 23 -2.379 13.229 -25.861 1.00 33.53 H new ATOM 0 HZ2 LYS A 23 -3.904 13.164 -25.117 1.00 33.53 H new ATOM 0 HZ3 LYS A 23 -3.621 14.265 -26.379 1.00 33.53 H new ATOM 316 N ALA A 24 -2.840 20.886 -22.678 1.00 61.40 N ATOM 317 CA ALA A 24 -3.063 22.310 -22.466 1.00 43.44 C ATOM 318 C ALA A 24 -2.248 23.145 -23.448 1.00 42.33 C ATOM 319 O ALA A 24 -2.763 24.082 -24.059 1.00 62.01 O ATOM 320 CB ALA A 24 -2.719 22.691 -21.034 1.00 45.41 C ATOM 0 H ALA A 24 -2.318 20.425 -21.933 1.00 61.40 H new ATOM 0 HA ALA A 24 -4.119 22.517 -22.642 1.00 43.44 H new ATOM 0 HB1 ALA A 24 -2.890 23.758 -20.890 1.00 45.41 H new ATOM 0 HB2 ALA A 24 -3.348 22.126 -20.346 1.00 45.41 H new ATOM 0 HB3 ALA A 24 -1.671 22.462 -20.838 1.00 45.41 H new ATOM 326 N VAL A 25 -0.972 22.800 -23.595 1.00 54.40 N ATOM 327 CA VAL A 25 -0.086 23.518 -24.503 1.00 50.13 C ATOM 328 C VAL A 25 -0.632 23.507 -25.927 1.00 2.12 C ATOM 329 O VAL A 25 -0.569 24.513 -26.634 1.00 51.11 O ATOM 330 CB VAL A 25 1.329 22.911 -24.503 1.00 63.51 C ATOM 331 CG1 VAL A 25 2.229 23.652 -25.480 1.00 0.10 C ATOM 332 CG2 VAL A 25 1.918 22.933 -23.101 1.00 1.23 C ATOM 0 H VAL A 25 -0.529 22.028 -23.097 1.00 54.40 H new ATOM 0 HA VAL A 25 -0.032 24.546 -24.145 1.00 50.13 H new ATOM 0 HB VAL A 25 1.259 21.873 -24.827 1.00 63.51 H new ATOM 0 HG11 VAL A 25 3.225 23.208 -25.466 1.00 0.10 H new ATOM 0 HG12 VAL A 25 1.813 23.579 -26.485 1.00 0.10 H new ATOM 0 HG13 VAL A 25 2.295 24.701 -25.190 1.00 0.10 H new ATOM 0 HG21 VAL A 25 2.918 22.500 -23.120 1.00 1.23 H new ATOM 0 HG22 VAL A 25 1.974 23.962 -22.746 1.00 1.23 H new ATOM 0 HG23 VAL A 25 1.284 22.352 -22.431 1.00 1.23 H new ATOM 342 N ILE A 26 -1.167 22.364 -26.340 1.00 72.53 N ATOM 343 CA ILE A 26 -1.726 22.222 -27.679 1.00 43.23 C ATOM 344 C ILE A 26 -3.108 22.859 -27.768 1.00 74.12 C ATOM 345 O ILE A 26 -3.353 23.719 -28.613 1.00 44.41 O ATOM 346 CB ILE A 26 -1.827 20.742 -28.094 1.00 4.41 C ATOM 347 CG1 ILE A 26 -0.447 20.083 -28.050 1.00 62.41 C ATOM 348 CG2 ILE A 26 -2.433 20.622 -29.484 1.00 35.02 C ATOM 349 CD1 ILE A 26 -0.499 18.571 -28.068 1.00 71.03 C ATOM 0 H ILE A 26 -1.225 21.522 -25.767 1.00 72.53 H new ATOM 0 HA ILE A 26 -1.047 22.736 -28.360 1.00 43.23 H new ATOM 0 HB ILE A 26 -2.479 20.226 -27.389 1.00 4.41 H new ATOM 0 HG12 ILE A 26 0.139 20.429 -28.902 1.00 62.41 H new ATOM 0 HG13 ILE A 26 0.074 20.410 -27.150 1.00 62.41 H new ATOM 0 HG21 ILE A 26 -2.498 19.570 -29.763 1.00 35.02 H new ATOM 0 HG22 ILE A 26 -3.431 21.060 -29.485 1.00 35.02 H new ATOM 0 HG23 ILE A 26 -1.805 21.150 -30.202 1.00 35.02 H new ATOM 0 HD11 ILE A 26 0.515 18.172 -28.035 1.00 71.03 H new ATOM 0 HD12 ILE A 26 -1.057 18.216 -27.202 1.00 71.03 H new ATOM 0 HD13 ILE A 26 -0.992 18.235 -28.980 1.00 71.03 H new ATOM 361 N GLU A 27 -4.009 22.431 -26.889 1.00 21.41 N ATOM 362 CA GLU A 27 -5.367 22.960 -26.868 1.00 53.31 C ATOM 363 C GLU A 27 -5.356 24.485 -26.818 1.00 42.52 C ATOM 364 O GLU A 27 -6.044 25.147 -27.594 1.00 55.32 O ATOM 365 CB GLU A 27 -6.136 22.406 -25.667 1.00 74.42 C ATOM 366 CG GLU A 27 -7.570 22.901 -25.581 1.00 74.55 C ATOM 367 CD GLU A 27 -8.471 21.951 -24.815 1.00 65.34 C ATOM 368 OE1 GLU A 27 -8.430 20.736 -25.102 1.00 32.45 O ATOM 369 OE2 GLU A 27 -9.215 22.422 -23.931 1.00 20.35 O ATOM 0 H GLU A 27 -3.823 21.719 -26.182 1.00 21.41 H new ATOM 0 HA GLU A 27 -5.865 22.647 -27.785 1.00 53.31 H new ATOM 0 HB2 GLU A 27 -6.139 21.317 -25.719 1.00 74.42 H new ATOM 0 HB3 GLU A 27 -5.611 22.680 -24.752 1.00 74.42 H new ATOM 0 HG2 GLU A 27 -7.585 23.878 -25.098 1.00 74.55 H new ATOM 0 HG3 GLU A 27 -7.964 23.037 -26.588 1.00 74.55 H new ATOM 376 N MET A 28 -4.569 25.036 -25.899 1.00 71.33 N ATOM 377 CA MET A 28 -4.467 26.483 -25.748 1.00 72.42 C ATOM 378 C MET A 28 -4.034 27.137 -27.056 1.00 63.43 C ATOM 379 O MET A 28 -4.610 28.138 -27.481 1.00 44.20 O ATOM 380 CB MET A 28 -3.476 26.832 -24.637 1.00 1.24 C ATOM 381 CG MET A 28 -3.460 28.309 -24.279 1.00 13.52 C ATOM 382 SD MET A 28 -1.909 29.115 -24.721 1.00 23.34 S ATOM 383 CE MET A 28 -0.774 28.301 -23.599 1.00 3.21 C ATOM 0 H MET A 28 -3.993 24.502 -25.248 1.00 71.33 H new ATOM 0 HA MET A 28 -5.452 26.866 -25.480 1.00 72.42 H new ATOM 0 HB2 MET A 28 -3.722 26.253 -23.747 1.00 1.24 H new ATOM 0 HB3 MET A 28 -2.475 26.531 -24.946 1.00 1.24 H new ATOM 0 HG2 MET A 28 -4.283 28.811 -24.787 1.00 13.52 H new ATOM 0 HG3 MET A 28 -3.631 28.421 -23.208 1.00 13.52 H new ATOM 0 HE1 MET A 28 -0.120 29.043 -23.141 1.00 3.21 H new ATOM 0 HE2 MET A 28 -1.338 27.785 -22.822 1.00 3.21 H new ATOM 0 HE3 MET A 28 -0.172 27.579 -24.151 1.00 3.21 H new ATOM 393 N SER A 29 -3.015 26.564 -27.690 1.00 73.11 N ATOM 394 CA SER A 29 -2.502 27.094 -28.948 1.00 13.11 C ATOM 395 C SER A 29 -3.578 27.064 -30.029 1.00 71.23 C ATOM 396 O SER A 29 -3.477 27.759 -31.040 1.00 73.33 O ATOM 397 CB SER A 29 -1.282 26.292 -29.404 1.00 0.01 C ATOM 398 OG SER A 29 -0.239 26.363 -28.448 1.00 5.13 O ATOM 0 H SER A 29 -2.529 25.733 -27.353 1.00 73.11 H new ATOM 0 HA SER A 29 -2.206 28.130 -28.784 1.00 13.11 H new ATOM 0 HB2 SER A 29 -1.565 25.251 -29.561 1.00 0.01 H new ATOM 0 HB3 SER A 29 -0.929 26.674 -30.362 1.00 0.01 H new ATOM 0 HG SER A 29 -0.480 25.831 -27.661 1.00 5.13 H new ATOM 404 N SER A 30 -4.608 26.253 -29.808 1.00 41.01 N ATOM 405 CA SER A 30 -5.702 26.128 -30.764 1.00 45.05 C ATOM 406 C SER A 30 -6.639 27.328 -30.677 1.00 53.33 C ATOM 407 O SER A 30 -6.866 28.027 -31.665 1.00 55.12 O ATOM 408 CB SER A 30 -6.482 24.837 -30.512 1.00 75.14 C ATOM 409 OG SER A 30 -6.767 24.167 -31.728 1.00 53.45 O ATOM 0 H SER A 30 -4.708 25.673 -28.975 1.00 41.01 H new ATOM 0 HA SER A 30 -5.275 26.096 -31.766 1.00 45.05 H new ATOM 0 HB2 SER A 30 -5.906 24.182 -29.859 1.00 75.14 H new ATOM 0 HB3 SER A 30 -7.413 25.066 -29.993 1.00 75.14 H new ATOM 0 HG SER A 30 -7.265 23.344 -31.539 1.00 53.45 H new ATOM 415 N LYS A 31 -7.182 27.562 -29.487 1.00 60.31 N ATOM 416 CA LYS A 31 -8.095 28.677 -29.267 1.00 43.44 C ATOM 417 C LYS A 31 -7.357 29.877 -28.682 1.00 45.00 C ATOM 418 O LYS A 31 -7.960 30.732 -28.033 1.00 24.14 O ATOM 419 CB LYS A 31 -9.230 28.257 -28.331 1.00 52.44 C ATOM 420 CG LYS A 31 -8.762 27.890 -26.934 1.00 31.20 C ATOM 421 CD LYS A 31 -9.585 26.753 -26.351 1.00 63.13 C ATOM 422 CE LYS A 31 -9.409 26.653 -24.844 1.00 0.42 C ATOM 423 NZ LYS A 31 -10.698 26.841 -24.122 1.00 22.54 N ATOM 0 H LYS A 31 -7.005 26.993 -28.659 1.00 60.31 H new ATOM 0 HA LYS A 31 -8.515 28.965 -30.231 1.00 43.44 H new ATOM 0 HB2 LYS A 31 -9.952 29.071 -28.261 1.00 52.44 H new ATOM 0 HB3 LYS A 31 -9.752 27.404 -28.766 1.00 52.44 H new ATOM 0 HG2 LYS A 31 -7.711 27.601 -26.965 1.00 31.20 H new ATOM 0 HG3 LYS A 31 -8.833 28.762 -26.284 1.00 31.20 H new ATOM 0 HD2 LYS A 31 -10.638 26.907 -26.586 1.00 63.13 H new ATOM 0 HD3 LYS A 31 -9.289 25.813 -26.816 1.00 63.13 H new ATOM 0 HE2 LYS A 31 -8.990 25.679 -24.591 1.00 0.42 H new ATOM 0 HE3 LYS A 31 -8.693 27.405 -24.511 1.00 0.42 H new ATOM 0 HZ1 LYS A 31 -10.536 26.766 -23.097 1.00 22.54 H new ATOM 0 HZ2 LYS A 31 -11.086 27.780 -24.343 1.00 22.54 H new ATOM 0 HZ3 LYS A 31 -11.373 26.108 -24.421 1.00 22.54 H new ATOM 437 N ILE A 32 -6.050 29.934 -28.917 1.00 51.42 N ATOM 438 CA ILE A 32 -5.231 31.031 -28.415 1.00 74.12 C ATOM 439 C ILE A 32 -5.696 32.368 -28.982 1.00 50.11 C ATOM 440 O ILE A 32 -5.730 33.374 -28.275 1.00 14.45 O ATOM 441 CB ILE A 32 -3.745 30.828 -28.762 1.00 24.13 C ATOM 442 CG1 ILE A 32 -2.914 32.009 -28.255 1.00 34.13 C ATOM 443 CG2 ILE A 32 -3.569 30.656 -30.263 1.00 54.12 C ATOM 444 CD1 ILE A 32 -2.996 32.206 -26.757 1.00 51.32 C ATOM 0 H ILE A 32 -5.536 29.234 -29.452 1.00 51.42 H new ATOM 0 HA ILE A 32 -5.345 31.040 -27.331 1.00 74.12 H new ATOM 0 HB ILE A 32 -3.393 29.922 -28.269 1.00 24.13 H new ATOM 0 HG12 ILE A 32 -1.872 31.857 -28.537 1.00 34.13 H new ATOM 0 HG13 ILE A 32 -3.250 32.919 -28.752 1.00 34.13 H new ATOM 0 HG21 ILE A 32 -2.513 30.514 -30.492 1.00 54.12 H new ATOM 0 HG22 ILE A 32 -4.133 29.786 -30.598 1.00 54.12 H new ATOM 0 HG23 ILE A 32 -3.935 31.545 -30.776 1.00 54.12 H new ATOM 0 HD11 ILE A 32 -2.383 33.060 -26.468 1.00 51.32 H new ATOM 0 HD12 ILE A 32 -4.032 32.389 -26.470 1.00 51.32 H new ATOM 0 HD13 ILE A 32 -2.633 31.311 -26.252 1.00 51.32 H new ATOM 456 N GLN A 33 -6.054 32.370 -30.262 1.00 70.41 N ATOM 457 CA GLN A 33 -6.518 33.583 -30.924 1.00 10.44 C ATOM 458 C GLN A 33 -7.808 34.091 -30.288 1.00 32.42 C ATOM 459 O GLN A 33 -7.874 35.201 -29.760 1.00 30.23 O ATOM 460 CB GLN A 33 -6.738 33.324 -32.415 1.00 40.40 C ATOM 461 CG GLN A 33 -5.767 34.075 -33.312 1.00 54.14 C ATOM 462 CD GLN A 33 -5.313 33.250 -34.500 1.00 24.52 C ATOM 463 OE1 GLN A 33 -4.786 32.148 -34.339 1.00 43.25 O ATOM 464 NE2 GLN A 33 -5.514 33.778 -35.701 1.00 15.30 N ATOM 0 H GLN A 33 -6.032 31.545 -30.861 1.00 70.41 H new ATOM 0 HA GLN A 33 -5.750 34.348 -30.805 1.00 10.44 H new ATOM 0 HB2 GLN A 33 -6.645 32.255 -32.607 1.00 40.40 H new ATOM 0 HB3 GLN A 33 -7.757 33.608 -32.678 1.00 40.40 H new ATOM 0 HG2 GLN A 33 -6.241 34.989 -33.669 1.00 54.14 H new ATOM 0 HG3 GLN A 33 -4.896 34.374 -32.728 1.00 54.14 H new ATOM 0 HE21 GLN A 33 -5.954 34.694 -35.788 1.00 15.30 H new ATOM 0 HE22 GLN A 33 -5.228 33.268 -36.537 1.00 15.30 H new ATOM 473 N PRO A 34 -8.860 33.260 -30.339 1.00 20.22 N ATOM 474 CA PRO A 34 -10.168 33.603 -29.772 1.00 62.14 C ATOM 475 C PRO A 34 -10.147 33.641 -28.248 1.00 55.22 C ATOM 476 O PRO A 34 -11.126 34.035 -27.615 1.00 12.33 O ATOM 477 CB PRO A 34 -11.076 32.474 -30.267 1.00 24.11 C ATOM 478 CG PRO A 34 -10.157 31.324 -30.501 1.00 14.42 C ATOM 479 CD PRO A 34 -8.853 31.921 -30.953 1.00 13.43 C ATOM 0 HA PRO A 34 -10.496 34.597 -30.076 1.00 62.14 H new ATOM 0 HB2 PRO A 34 -11.839 32.227 -29.529 1.00 24.11 H new ATOM 0 HB3 PRO A 34 -11.597 32.757 -31.182 1.00 24.11 H new ATOM 0 HG2 PRO A 34 -10.024 30.739 -29.591 1.00 14.42 H new ATOM 0 HG3 PRO A 34 -10.560 30.650 -31.257 1.00 14.42 H new ATOM 0 HD2 PRO A 34 -8.002 31.329 -30.616 1.00 13.43 H new ATOM 0 HD3 PRO A 34 -8.792 31.978 -32.040 1.00 13.43 H new ATOM 487 N ALA A 35 -9.026 33.230 -27.665 1.00 72.44 N ATOM 488 CA ALA A 35 -8.878 33.220 -26.215 1.00 71.44 C ATOM 489 C ALA A 35 -9.351 34.535 -25.606 1.00 72.01 C ATOM 490 O ALA A 35 -8.694 35.570 -25.717 1.00 1.11 O ATOM 491 CB ALA A 35 -7.430 32.950 -25.835 1.00 21.03 C ATOM 0 H ALA A 35 -8.207 32.899 -28.175 1.00 72.44 H new ATOM 0 HA ALA A 35 -9.502 32.420 -25.816 1.00 71.44 H new ATOM 0 HB1 ALA A 35 -7.334 32.945 -24.749 1.00 21.03 H new ATOM 0 HB2 ALA A 35 -7.125 31.981 -26.231 1.00 21.03 H new ATOM 0 HB3 ALA A 35 -6.793 33.730 -26.252 1.00 21.03 H new ATOM 497 N PRO A 36 -10.519 34.497 -24.947 1.00 61.23 N ATOM 498 CA PRO A 36 -11.106 35.678 -24.308 1.00 21.15 C ATOM 499 C PRO A 36 -10.317 36.126 -23.082 1.00 21.42 C ATOM 500 O PRO A 36 -9.430 35.424 -22.594 1.00 52.23 O ATOM 501 CB PRO A 36 -12.503 35.203 -23.900 1.00 41.21 C ATOM 502 CG PRO A 36 -12.374 33.726 -23.755 1.00 41.14 C ATOM 503 CD PRO A 36 -11.356 33.297 -24.776 1.00 1.43 C ATOM 0 HA PRO A 36 -11.112 36.541 -24.974 1.00 21.15 H new ATOM 0 HB2 PRO A 36 -12.821 35.666 -22.966 1.00 41.21 H new ATOM 0 HB3 PRO A 36 -13.246 35.463 -24.654 1.00 41.21 H new ATOM 0 HG2 PRO A 36 -12.053 33.459 -22.748 1.00 41.14 H new ATOM 0 HG3 PRO A 36 -13.330 33.232 -23.926 1.00 41.14 H new ATOM 0 HD2 PRO A 36 -10.771 32.445 -24.428 1.00 1.43 H new ATOM 0 HD3 PRO A 36 -11.827 32.999 -25.713 1.00 1.43 H new ATOM 511 N PRO A 37 -10.645 37.321 -22.570 1.00 12.10 N ATOM 512 CA PRO A 37 -9.979 37.888 -21.394 1.00 13.43 C ATOM 513 C PRO A 37 -10.324 37.136 -20.113 1.00 73.11 C ATOM 514 O PRO A 37 -9.622 37.248 -19.109 1.00 30.21 O ATOM 515 CB PRO A 37 -10.520 39.319 -21.335 1.00 53.24 C ATOM 516 CG PRO A 37 -11.838 39.254 -22.027 1.00 13.21 C ATOM 517 CD PRO A 37 -11.692 38.211 -23.100 1.00 30.12 C ATOM 0 HA PRO A 37 -8.893 37.831 -21.474 1.00 13.43 H new ATOM 0 HB2 PRO A 37 -10.630 39.659 -20.305 1.00 53.24 H new ATOM 0 HB3 PRO A 37 -9.846 40.018 -21.831 1.00 53.24 H new ATOM 0 HG2 PRO A 37 -12.632 38.988 -21.329 1.00 13.21 H new ATOM 0 HG3 PRO A 37 -12.102 40.221 -22.456 1.00 13.21 H new ATOM 0 HD2 PRO A 37 -12.626 37.676 -23.270 1.00 30.12 H new ATOM 0 HD3 PRO A 37 -11.400 38.653 -24.053 1.00 30.12 H new ATOM 525 N GLU A 38 -11.410 36.369 -20.157 1.00 4.35 N ATOM 526 CA GLU A 38 -11.847 35.599 -18.998 1.00 64.13 C ATOM 527 C GLU A 38 -11.134 34.251 -18.941 1.00 73.44 C ATOM 528 O GLU A 38 -11.052 33.625 -17.885 1.00 3.32 O ATOM 529 CB GLU A 38 -13.361 35.386 -19.041 1.00 53.43 C ATOM 530 CG GLU A 38 -14.160 36.625 -18.671 1.00 74.42 C ATOM 531 CD GLU A 38 -15.648 36.349 -18.567 1.00 50.45 C ATOM 532 OE1 GLU A 38 -16.336 36.410 -19.608 1.00 41.51 O ATOM 533 OE2 GLU A 38 -16.124 36.074 -17.447 1.00 32.43 O ATOM 0 H GLU A 38 -12.002 36.265 -20.981 1.00 4.35 H new ATOM 0 HA GLU A 38 -11.592 36.164 -18.101 1.00 64.13 H new ATOM 0 HB2 GLU A 38 -13.646 35.066 -20.043 1.00 53.43 H new ATOM 0 HB3 GLU A 38 -13.625 34.577 -18.360 1.00 53.43 H new ATOM 0 HG2 GLU A 38 -13.799 37.015 -17.719 1.00 74.42 H new ATOM 0 HG3 GLU A 38 -13.989 37.400 -19.418 1.00 74.42 H new ATOM 540 N GLU A 39 -10.622 33.810 -20.086 1.00 72.42 N ATOM 541 CA GLU A 39 -9.918 32.535 -20.167 1.00 13.13 C ATOM 542 C GLU A 39 -8.407 32.744 -20.117 1.00 75.13 C ATOM 543 O GLU A 39 -7.648 31.807 -19.871 1.00 71.50 O ATOM 544 CB GLU A 39 -10.300 31.796 -21.451 1.00 54.41 C ATOM 545 CG GLU A 39 -10.089 30.294 -21.375 1.00 20.32 C ATOM 546 CD GLU A 39 -10.975 29.632 -20.338 1.00 33.33 C ATOM 547 OE1 GLU A 39 -11.957 30.270 -19.904 1.00 34.45 O ATOM 548 OE2 GLU A 39 -10.687 28.477 -19.960 1.00 72.13 O ATOM 0 H GLU A 39 -10.681 34.316 -20.970 1.00 72.42 H new ATOM 0 HA GLU A 39 -10.213 31.931 -19.309 1.00 13.13 H new ATOM 0 HB2 GLU A 39 -11.347 31.996 -21.677 1.00 54.41 H new ATOM 0 HB3 GLU A 39 -9.713 32.195 -22.278 1.00 54.41 H new ATOM 0 HG2 GLU A 39 -10.288 29.853 -22.352 1.00 20.32 H new ATOM 0 HG3 GLU A 39 -9.045 30.089 -21.139 1.00 20.32 H new ATOM 555 N TYR A 40 -7.979 33.979 -20.354 1.00 30.23 N ATOM 556 CA TYR A 40 -6.559 34.311 -20.339 1.00 54.04 C ATOM 557 C TYR A 40 -6.011 34.298 -18.916 1.00 30.42 C ATOM 558 O TYR A 40 -4.925 33.777 -18.661 1.00 42.11 O ATOM 559 CB TYR A 40 -6.329 35.684 -20.974 1.00 31.24 C ATOM 560 CG TYR A 40 -5.428 35.647 -22.187 1.00 24.21 C ATOM 561 CD1 TYR A 40 -5.643 34.731 -23.209 1.00 62.12 C ATOM 562 CD2 TYR A 40 -4.361 36.529 -22.311 1.00 70.32 C ATOM 563 CE1 TYR A 40 -4.821 34.693 -24.319 1.00 11.10 C ATOM 564 CE2 TYR A 40 -3.535 36.499 -23.418 1.00 50.12 C ATOM 565 CZ TYR A 40 -3.769 35.579 -24.419 1.00 41.31 C ATOM 566 OH TYR A 40 -2.949 35.546 -25.524 1.00 20.23 O ATOM 0 H TYR A 40 -8.594 34.766 -20.559 1.00 30.23 H new ATOM 0 HA TYR A 40 -6.029 33.556 -20.919 1.00 54.04 H new ATOM 0 HB2 TYR A 40 -7.291 36.109 -21.260 1.00 31.24 H new ATOM 0 HB3 TYR A 40 -5.895 36.351 -20.229 1.00 31.24 H new ATOM 0 HD1 TYR A 40 -6.467 34.037 -23.135 1.00 62.12 H new ATOM 0 HD2 TYR A 40 -4.174 37.250 -21.529 1.00 70.32 H new ATOM 0 HE1 TYR A 40 -5.001 33.973 -25.104 1.00 11.10 H new ATOM 0 HE2 TYR A 40 -2.711 37.192 -23.499 1.00 50.12 H new ATOM 0 HH TYR A 40 -2.258 36.236 -25.439 1.00 20.23 H new ATOM 576 N VAL A 41 -6.771 34.874 -17.990 1.00 75.22 N ATOM 577 CA VAL A 41 -6.364 34.927 -16.591 1.00 54.42 C ATOM 578 C VAL A 41 -5.977 33.545 -16.078 1.00 55.00 C ATOM 579 O VAL A 41 -4.862 33.320 -15.607 1.00 74.01 O ATOM 580 CB VAL A 41 -7.485 35.498 -15.702 1.00 72.10 C ATOM 581 CG1 VAL A 41 -7.418 34.897 -14.306 1.00 71.45 C ATOM 582 CG2 VAL A 41 -7.397 37.015 -15.642 1.00 51.44 C ATOM 0 H VAL A 41 -7.672 35.311 -18.184 1.00 75.22 H new ATOM 0 HA VAL A 41 -5.497 35.586 -16.538 1.00 54.42 H new ATOM 0 HB VAL A 41 -8.445 35.230 -16.142 1.00 72.10 H new ATOM 0 HG11 VAL A 41 -8.217 35.312 -13.692 1.00 71.45 H new ATOM 0 HG12 VAL A 41 -7.534 33.815 -14.370 1.00 71.45 H new ATOM 0 HG13 VAL A 41 -6.454 35.133 -13.854 1.00 71.45 H new ATOM 0 HG21 VAL A 41 -8.197 37.401 -15.010 1.00 51.44 H new ATOM 0 HG22 VAL A 41 -6.433 37.307 -15.227 1.00 51.44 H new ATOM 0 HG23 VAL A 41 -7.499 37.425 -16.647 1.00 51.44 H new ATOM 592 N PRO A 42 -6.919 32.595 -16.170 1.00 74.45 N ATOM 593 CA PRO A 42 -6.700 31.216 -15.721 1.00 52.55 C ATOM 594 C PRO A 42 -5.716 30.466 -16.613 1.00 35.03 C ATOM 595 O PRO A 42 -4.984 29.594 -16.147 1.00 5.00 O ATOM 596 CB PRO A 42 -8.093 30.588 -15.814 1.00 23.51 C ATOM 597 CG PRO A 42 -8.804 31.392 -16.847 1.00 64.52 C ATOM 598 CD PRO A 42 -8.271 32.792 -16.721 1.00 42.00 C ATOM 0 HA PRO A 42 -6.265 31.176 -14.722 1.00 52.55 H new ATOM 0 HB2 PRO A 42 -8.035 29.538 -16.100 1.00 23.51 H new ATOM 0 HB3 PRO A 42 -8.610 30.629 -14.855 1.00 23.51 H new ATOM 0 HG2 PRO A 42 -8.622 30.994 -17.845 1.00 64.52 H new ATOM 0 HG3 PRO A 42 -9.882 31.369 -16.686 1.00 64.52 H new ATOM 0 HD2 PRO A 42 -8.242 33.299 -17.685 1.00 42.00 H new ATOM 0 HD3 PRO A 42 -8.890 33.399 -16.060 1.00 42.00 H new ATOM 606 N MET A 43 -5.706 30.811 -17.896 1.00 43.10 N ATOM 607 CA MET A 43 -4.810 30.170 -18.852 1.00 1.22 C ATOM 608 C MET A 43 -3.369 30.201 -18.352 1.00 12.32 C ATOM 609 O MET A 43 -2.610 29.255 -18.558 1.00 24.45 O ATOM 610 CB MET A 43 -4.904 30.860 -20.214 1.00 14.51 C ATOM 611 CG MET A 43 -5.734 30.091 -21.229 1.00 15.23 C ATOM 612 SD MET A 43 -6.008 31.020 -22.750 1.00 3.12 S ATOM 613 CE MET A 43 -7.540 30.290 -23.322 1.00 11.34 C ATOM 0 H MET A 43 -6.307 31.530 -18.298 1.00 43.10 H new ATOM 0 HA MET A 43 -5.117 29.130 -18.958 1.00 1.22 H new ATOM 0 HB2 MET A 43 -5.336 31.852 -20.081 1.00 14.51 H new ATOM 0 HB3 MET A 43 -3.899 31.001 -20.611 1.00 14.51 H new ATOM 0 HG2 MET A 43 -5.233 29.153 -21.466 1.00 15.23 H new ATOM 0 HG3 MET A 43 -6.696 29.835 -20.786 1.00 15.23 H new ATOM 0 HE1 MET A 43 -7.404 29.904 -24.332 1.00 11.34 H new ATOM 0 HE2 MET A 43 -7.825 29.474 -22.657 1.00 11.34 H new ATOM 0 HE3 MET A 43 -8.325 31.046 -23.325 1.00 11.34 H new ATOM 623 N VAL A 44 -2.999 31.296 -17.694 1.00 60.24 N ATOM 624 CA VAL A 44 -1.649 31.450 -17.164 1.00 74.45 C ATOM 625 C VAL A 44 -1.334 30.364 -16.142 1.00 24.03 C ATOM 626 O VAL A 44 -0.325 29.667 -16.251 1.00 22.21 O ATOM 627 CB VAL A 44 -1.458 32.830 -16.508 1.00 32.43 C ATOM 628 CG1 VAL A 44 0.003 33.052 -16.147 1.00 33.41 C ATOM 629 CG2 VAL A 44 -1.962 33.931 -17.428 1.00 12.34 C ATOM 0 H VAL A 44 -3.615 32.089 -17.515 1.00 60.24 H new ATOM 0 HA VAL A 44 -0.965 31.360 -18.008 1.00 74.45 H new ATOM 0 HB VAL A 44 -2.043 32.860 -15.589 1.00 32.43 H new ATOM 0 HG11 VAL A 44 0.119 34.032 -15.685 1.00 33.41 H new ATOM 0 HG12 VAL A 44 0.326 32.281 -15.448 1.00 33.41 H new ATOM 0 HG13 VAL A 44 0.612 33.002 -17.049 1.00 33.41 H new ATOM 0 HG21 VAL A 44 -1.819 34.899 -16.949 1.00 12.34 H new ATOM 0 HG22 VAL A 44 -1.406 33.905 -18.365 1.00 12.34 H new ATOM 0 HG23 VAL A 44 -3.022 33.779 -17.630 1.00 12.34 H new ATOM 639 N LYS A 45 -2.203 30.225 -15.147 1.00 14.21 N ATOM 640 CA LYS A 45 -2.020 29.223 -14.104 1.00 2.23 C ATOM 641 C LYS A 45 -1.904 27.826 -14.705 1.00 51.34 C ATOM 642 O LYS A 45 -1.191 26.972 -14.180 1.00 44.33 O ATOM 643 CB LYS A 45 -3.186 29.268 -13.114 1.00 2.55 C ATOM 644 CG LYS A 45 -2.749 29.400 -11.665 1.00 2.21 C ATOM 645 CD LYS A 45 -2.708 30.854 -11.225 1.00 21.13 C ATOM 646 CE LYS A 45 -1.302 31.427 -11.323 1.00 73.20 C ATOM 647 NZ LYS A 45 -1.079 32.129 -12.617 1.00 63.43 N ATOM 0 H LYS A 45 -3.042 30.795 -15.041 1.00 14.21 H new ATOM 0 HA LYS A 45 -1.094 29.450 -13.576 1.00 2.23 H new ATOM 0 HB2 LYS A 45 -3.834 30.107 -13.367 1.00 2.55 H new ATOM 0 HB3 LYS A 45 -3.781 28.361 -13.224 1.00 2.55 H new ATOM 0 HG2 LYS A 45 -3.435 28.845 -11.025 1.00 2.21 H new ATOM 0 HG3 LYS A 45 -1.763 28.953 -11.539 1.00 2.21 H new ATOM 0 HD2 LYS A 45 -3.386 31.442 -11.844 1.00 21.13 H new ATOM 0 HD3 LYS A 45 -3.064 30.935 -10.198 1.00 21.13 H new ATOM 0 HE2 LYS A 45 -1.134 32.121 -10.500 1.00 73.20 H new ATOM 0 HE3 LYS A 45 -0.574 30.623 -11.216 1.00 73.20 H new ATOM 0 HZ1 LYS A 45 -0.189 31.800 -13.042 1.00 63.43 H new ATOM 0 HZ2 LYS A 45 -1.868 31.924 -13.263 1.00 63.43 H new ATOM 0 HZ3 LYS A 45 -1.025 33.154 -12.451 1.00 63.43 H new ATOM 661 N GLU A 46 -2.609 27.602 -15.810 1.00 11.21 N ATOM 662 CA GLU A 46 -2.584 26.309 -16.482 1.00 63.53 C ATOM 663 C GLU A 46 -1.171 25.963 -16.945 1.00 1.44 C ATOM 664 O GLU A 46 -0.576 24.989 -16.484 1.00 63.14 O ATOM 665 CB GLU A 46 -3.537 26.312 -17.679 1.00 71.00 C ATOM 666 CG GLU A 46 -4.968 26.670 -17.316 1.00 35.22 C ATOM 667 CD GLU A 46 -5.831 25.447 -17.071 1.00 54.14 C ATOM 668 OE1 GLU A 46 -5.323 24.472 -16.479 1.00 72.13 O ATOM 669 OE2 GLU A 46 -7.014 25.465 -17.472 1.00 1.00 O ATOM 0 H GLU A 46 -3.204 28.299 -16.258 1.00 11.21 H new ATOM 0 HA GLU A 46 -2.910 25.552 -15.769 1.00 63.53 H new ATOM 0 HB2 GLU A 46 -3.171 27.021 -18.422 1.00 71.00 H new ATOM 0 HB3 GLU A 46 -3.525 25.327 -18.145 1.00 71.00 H new ATOM 0 HG2 GLU A 46 -4.967 27.294 -16.422 1.00 35.22 H new ATOM 0 HG3 GLU A 46 -5.405 27.264 -18.119 1.00 35.22 H new ATOM 676 N VAL A 47 -0.640 26.770 -17.859 1.00 31.54 N ATOM 677 CA VAL A 47 0.702 26.551 -18.384 1.00 23.23 C ATOM 678 C VAL A 47 1.750 26.679 -17.284 1.00 2.01 C ATOM 679 O VAL A 47 2.654 25.852 -17.174 1.00 22.23 O ATOM 680 CB VAL A 47 1.033 27.547 -19.511 1.00 60.43 C ATOM 681 CG1 VAL A 47 2.397 27.240 -20.112 1.00 14.13 C ATOM 682 CG2 VAL A 47 -0.048 27.518 -20.581 1.00 33.11 C ATOM 0 H VAL A 47 -1.119 27.581 -18.251 1.00 31.54 H new ATOM 0 HA VAL A 47 0.723 25.538 -18.786 1.00 23.23 H new ATOM 0 HB VAL A 47 1.067 28.551 -19.087 1.00 60.43 H new ATOM 0 HG11 VAL A 47 2.614 27.954 -20.907 1.00 14.13 H new ATOM 0 HG12 VAL A 47 3.161 27.316 -19.338 1.00 14.13 H new ATOM 0 HG13 VAL A 47 2.395 26.230 -20.522 1.00 14.13 H new ATOM 0 HG21 VAL A 47 0.202 28.228 -21.370 1.00 33.11 H new ATOM 0 HG22 VAL A 47 -0.115 26.515 -21.003 1.00 33.11 H new ATOM 0 HG23 VAL A 47 -1.006 27.790 -20.138 1.00 33.11 H new ATOM 692 N GLY A 48 1.622 27.723 -16.470 1.00 70.03 N ATOM 693 CA GLY A 48 2.565 27.941 -15.389 1.00 34.33 C ATOM 694 C GLY A 48 2.626 26.769 -14.429 1.00 4.12 C ATOM 695 O GLY A 48 3.665 26.511 -13.819 1.00 32.15 O ATOM 0 H GLY A 48 0.882 28.421 -16.540 1.00 70.03 H new ATOM 0 HA2 GLY A 48 3.557 28.118 -15.806 1.00 34.33 H new ATOM 0 HA3 GLY A 48 2.284 28.841 -14.842 1.00 34.33 H new ATOM 699 N LEU A 49 1.512 26.059 -14.293 1.00 23.33 N ATOM 700 CA LEU A 49 1.443 24.908 -13.398 1.00 50.23 C ATOM 701 C LEU A 49 2.206 23.721 -13.978 1.00 0.34 C ATOM 702 O LEU A 49 2.858 22.974 -13.249 1.00 12.33 O ATOM 703 CB LEU A 49 -0.015 24.519 -13.148 1.00 71.23 C ATOM 704 CG LEU A 49 -0.240 23.299 -12.254 1.00 72.25 C ATOM 705 CD1 LEU A 49 -0.196 23.697 -10.787 1.00 60.43 C ATOM 706 CD2 LEU A 49 -1.566 22.631 -12.588 1.00 70.41 C ATOM 0 H LEU A 49 0.644 26.259 -14.790 1.00 23.33 H new ATOM 0 HA LEU A 49 1.906 25.186 -12.451 1.00 50.23 H new ATOM 0 HB2 LEU A 49 -0.526 25.372 -12.701 1.00 71.23 H new ATOM 0 HB3 LEU A 49 -0.490 24.332 -14.111 1.00 71.23 H new ATOM 0 HG LEU A 49 0.561 22.584 -12.439 1.00 72.25 H new ATOM 0 HD11 LEU A 49 -0.358 22.816 -10.166 1.00 60.43 H new ATOM 0 HD12 LEU A 49 0.778 24.129 -10.556 1.00 60.43 H new ATOM 0 HD13 LEU A 49 -0.976 24.431 -10.586 1.00 60.43 H new ATOM 0 HD21 LEU A 49 -1.710 21.765 -11.942 1.00 70.41 H new ATOM 0 HD22 LEU A 49 -2.380 23.339 -12.432 1.00 70.41 H new ATOM 0 HD23 LEU A 49 -1.560 22.310 -13.630 1.00 70.41 H new ATOM 718 N ALA A 50 2.122 23.556 -15.294 1.00 34.54 N ATOM 719 CA ALA A 50 2.807 22.462 -15.971 1.00 45.53 C ATOM 720 C ALA A 50 4.311 22.518 -15.721 1.00 14.23 C ATOM 721 O ALA A 50 4.932 21.510 -15.383 1.00 31.25 O ATOM 722 CB ALA A 50 2.518 22.503 -17.464 1.00 75.44 C ATOM 0 H ALA A 50 1.587 24.166 -15.912 1.00 34.54 H new ATOM 0 HA ALA A 50 2.431 21.523 -15.564 1.00 45.53 H new ATOM 0 HB1 ALA A 50 3.036 21.681 -17.958 1.00 75.44 H new ATOM 0 HB2 ALA A 50 1.445 22.408 -17.630 1.00 75.44 H new ATOM 0 HB3 ALA A 50 2.866 23.450 -17.876 1.00 75.44 H new ATOM 728 N LEU A 51 4.890 23.702 -15.889 1.00 62.42 N ATOM 729 CA LEU A 51 6.322 23.889 -15.682 1.00 30.23 C ATOM 730 C LEU A 51 6.701 23.624 -14.228 1.00 71.32 C ATOM 731 O LEU A 51 7.557 22.787 -13.942 1.00 63.23 O ATOM 732 CB LEU A 51 6.733 25.308 -16.077 1.00 44.03 C ATOM 733 CG LEU A 51 6.410 25.725 -17.512 1.00 53.33 C ATOM 734 CD1 LEU A 51 5.368 26.833 -17.524 1.00 12.00 C ATOM 735 CD2 LEU A 51 7.672 26.170 -18.236 1.00 3.51 C ATOM 0 H LEU A 51 4.390 24.546 -16.168 1.00 62.42 H new ATOM 0 HA LEU A 51 6.852 23.175 -16.313 1.00 30.23 H new ATOM 0 HB2 LEU A 51 6.246 26.008 -15.398 1.00 44.03 H new ATOM 0 HB3 LEU A 51 7.807 25.410 -15.923 1.00 44.03 H new ATOM 0 HG LEU A 51 6.000 24.862 -18.037 1.00 53.33 H new ATOM 0 HD11 LEU A 51 5.151 27.117 -18.554 1.00 12.00 H new ATOM 0 HD12 LEU A 51 4.455 26.479 -17.045 1.00 12.00 H new ATOM 0 HD13 LEU A 51 5.750 27.698 -16.982 1.00 12.00 H new ATOM 0 HD21 LEU A 51 7.422 26.463 -19.256 1.00 3.51 H new ATOM 0 HD22 LEU A 51 8.112 27.019 -17.712 1.00 3.51 H new ATOM 0 HD23 LEU A 51 8.387 25.348 -18.260 1.00 3.51 H new ATOM 747 N ARG A 52 6.056 24.341 -13.314 1.00 32.32 N ATOM 748 CA ARG A 52 6.324 24.182 -11.890 1.00 4.24 C ATOM 749 C ARG A 52 6.154 22.727 -11.463 1.00 10.11 C ATOM 750 O ARG A 52 6.919 22.214 -10.646 1.00 2.24 O ATOM 751 CB ARG A 52 5.393 25.077 -11.071 1.00 12.55 C ATOM 752 CG ARG A 52 6.080 25.765 -9.902 1.00 65.31 C ATOM 753 CD ARG A 52 5.251 26.923 -9.370 1.00 72.32 C ATOM 754 NE ARG A 52 6.048 28.135 -9.200 1.00 71.45 N ATOM 755 CZ ARG A 52 6.964 28.285 -8.250 1.00 33.30 C ATOM 756 NH1 ARG A 52 7.197 27.304 -7.389 1.00 10.12 N ATOM 757 NH2 ARG A 52 7.649 29.418 -8.160 1.00 34.41 N ATOM 0 H ARG A 52 5.344 25.038 -13.534 1.00 32.32 H new ATOM 0 HA ARG A 52 7.357 24.478 -11.706 1.00 4.24 H new ATOM 0 HB2 ARG A 52 4.963 25.835 -11.726 1.00 12.55 H new ATOM 0 HB3 ARG A 52 4.566 24.476 -10.693 1.00 12.55 H new ATOM 0 HG2 ARG A 52 6.252 25.043 -9.104 1.00 65.31 H new ATOM 0 HG3 ARG A 52 7.057 26.131 -10.217 1.00 65.31 H new ATOM 0 HD2 ARG A 52 4.428 27.124 -10.055 1.00 72.32 H new ATOM 0 HD3 ARG A 52 4.809 26.643 -8.414 1.00 72.32 H new ATOM 0 HE ARG A 52 5.893 28.909 -9.846 1.00 71.45 H new ATOM 0 HH11 ARG A 52 6.672 26.432 -7.455 1.00 10.12 H new ATOM 0 HH12 ARG A 52 7.901 27.421 -6.660 1.00 10.12 H new ATOM 0 HH21 ARG A 52 7.472 30.175 -8.821 1.00 34.41 H new ATOM 0 HH22 ARG A 52 8.352 29.532 -7.430 1.00 34.41 H new ATOM 771 N THR A 53 5.145 22.066 -12.021 1.00 54.24 N ATOM 772 CA THR A 53 4.872 20.671 -11.698 1.00 3.50 C ATOM 773 C THR A 53 5.927 19.751 -12.302 1.00 11.04 C ATOM 774 O THR A 53 6.353 18.781 -11.673 1.00 11.44 O ATOM 775 CB THR A 53 3.482 20.239 -12.201 1.00 12.44 C ATOM 776 OG1 THR A 53 2.466 21.030 -11.573 1.00 4.31 O ATOM 777 CG2 THR A 53 3.236 18.766 -11.911 1.00 55.44 C ATOM 0 H THR A 53 4.503 22.475 -12.700 1.00 54.24 H new ATOM 0 HA THR A 53 4.899 20.587 -10.612 1.00 3.50 H new ATOM 0 HB THR A 53 3.446 20.392 -13.280 1.00 12.44 H new ATOM 0 HG1 THR A 53 2.606 21.975 -11.790 1.00 4.31 H new ATOM 0 HG21 THR A 53 2.248 18.484 -12.275 1.00 55.44 H new ATOM 0 HG22 THR A 53 3.994 18.165 -12.414 1.00 55.44 H new ATOM 0 HG23 THR A 53 3.290 18.593 -10.836 1.00 55.44 H new ATOM 785 N LEU A 54 6.345 20.060 -13.524 1.00 2.11 N ATOM 786 CA LEU A 54 7.352 19.260 -14.213 1.00 41.30 C ATOM 787 C LEU A 54 8.597 19.088 -13.348 1.00 54.40 C ATOM 788 O LEU A 54 9.230 18.032 -13.356 1.00 10.04 O ATOM 789 CB LEU A 54 7.728 19.914 -15.544 1.00 3.43 C ATOM 790 CG LEU A 54 8.327 18.987 -16.602 1.00 14.01 C ATOM 791 CD1 LEU A 54 7.359 17.863 -16.935 1.00 75.52 C ATOM 792 CD2 LEU A 54 8.688 19.771 -17.855 1.00 61.01 C ATOM 0 H LEU A 54 6.003 20.858 -14.058 1.00 2.11 H new ATOM 0 HA LEU A 54 6.928 18.275 -14.406 1.00 41.30 H new ATOM 0 HB2 LEU A 54 6.836 20.380 -15.962 1.00 3.43 H new ATOM 0 HB3 LEU A 54 8.442 20.713 -15.344 1.00 3.43 H new ATOM 0 HG LEU A 54 9.239 18.547 -16.198 1.00 14.01 H new ATOM 0 HD11 LEU A 54 7.802 17.213 -17.690 1.00 75.52 H new ATOM 0 HD12 LEU A 54 7.150 17.284 -16.035 1.00 75.52 H new ATOM 0 HD13 LEU A 54 6.430 18.285 -17.319 1.00 75.52 H new ATOM 0 HD21 LEU A 54 9.113 19.095 -18.597 1.00 61.01 H new ATOM 0 HD22 LEU A 54 7.792 20.240 -18.262 1.00 61.01 H new ATOM 0 HD23 LEU A 54 9.418 20.541 -17.605 1.00 61.01 H new ATOM 804 N LEU A 55 8.941 20.132 -12.602 1.00 14.13 N ATOM 805 CA LEU A 55 10.109 20.096 -11.728 1.00 54.44 C ATOM 806 C LEU A 55 9.953 19.025 -10.654 1.00 72.33 C ATOM 807 O LEU A 55 10.879 18.260 -10.387 1.00 43.05 O ATOM 808 CB LEU A 55 10.323 21.463 -11.074 1.00 71.45 C ATOM 809 CG LEU A 55 11.681 21.681 -10.406 1.00 14.12 C ATOM 810 CD1 LEU A 55 12.006 23.165 -10.331 1.00 63.34 C ATOM 811 CD2 LEU A 55 11.697 21.059 -9.017 1.00 44.11 C ATOM 0 H LEU A 55 8.428 21.014 -12.585 1.00 14.13 H new ATOM 0 HA LEU A 55 10.980 19.850 -12.336 1.00 54.44 H new ATOM 0 HB2 LEU A 55 10.186 22.233 -11.834 1.00 71.45 H new ATOM 0 HB3 LEU A 55 9.544 21.612 -10.326 1.00 71.45 H new ATOM 0 HG LEU A 55 12.445 21.192 -11.010 1.00 14.12 H new ATOM 0 HD11 LEU A 55 12.976 23.301 -9.853 1.00 63.34 H new ATOM 0 HD12 LEU A 55 12.036 23.582 -11.338 1.00 63.34 H new ATOM 0 HD13 LEU A 55 11.239 23.676 -9.749 1.00 63.34 H new ATOM 0 HD21 LEU A 55 12.671 21.223 -8.556 1.00 44.11 H new ATOM 0 HD22 LEU A 55 10.923 21.519 -8.403 1.00 44.11 H new ATOM 0 HD23 LEU A 55 11.509 19.988 -9.096 1.00 44.11 H new ATOM 823 N ALA A 56 8.774 18.974 -10.043 1.00 11.12 N ATOM 824 CA ALA A 56 8.495 17.993 -9.001 1.00 42.41 C ATOM 825 C ALA A 56 8.331 16.597 -9.591 1.00 63.14 C ATOM 826 O ALA A 56 8.853 15.619 -9.055 1.00 32.14 O ATOM 827 CB ALA A 56 7.249 18.389 -8.223 1.00 51.33 C ATOM 0 H ALA A 56 7.997 19.601 -10.252 1.00 11.12 H new ATOM 0 HA ALA A 56 9.345 17.973 -8.319 1.00 42.41 H new ATOM 0 HB1 ALA A 56 7.053 17.648 -7.448 1.00 51.33 H new ATOM 0 HB2 ALA A 56 7.403 19.364 -7.761 1.00 51.33 H new ATOM 0 HB3 ALA A 56 6.397 18.439 -8.901 1.00 51.33 H new ATOM 833 N THR A 57 7.603 16.510 -10.700 1.00 73.20 N ATOM 834 CA THR A 57 7.368 15.233 -11.362 1.00 64.22 C ATOM 835 C THR A 57 8.680 14.501 -11.625 1.00 34.13 C ATOM 836 O THR A 57 8.850 13.349 -11.226 1.00 32.23 O ATOM 837 CB THR A 57 6.622 15.421 -12.697 1.00 24.53 C ATOM 838 OG1 THR A 57 7.420 16.195 -13.599 1.00 50.21 O ATOM 839 CG2 THR A 57 5.284 16.109 -12.476 1.00 72.22 C ATOM 0 H THR A 57 7.166 17.309 -11.159 1.00 73.20 H new ATOM 0 HA THR A 57 6.750 14.637 -10.690 1.00 64.22 H new ATOM 0 HB THR A 57 6.439 14.437 -13.128 1.00 24.53 H new ATOM 0 HG1 THR A 57 7.866 16.915 -13.106 1.00 50.21 H new ATOM 0 HG21 THR A 57 4.775 16.231 -13.432 1.00 72.22 H new ATOM 0 HG22 THR A 57 4.668 15.502 -11.812 1.00 72.22 H new ATOM 0 HG23 THR A 57 5.448 17.088 -12.025 1.00 72.22 H new ATOM 847 N VAL A 58 9.605 15.177 -12.298 1.00 1.21 N ATOM 848 CA VAL A 58 10.903 14.591 -12.612 1.00 53.31 C ATOM 849 C VAL A 58 11.706 14.323 -11.344 1.00 41.24 C ATOM 850 O VAL A 58 12.479 13.367 -11.277 1.00 74.04 O ATOM 851 CB VAL A 58 11.722 15.507 -13.542 1.00 35.43 C ATOM 852 CG1 VAL A 58 13.086 14.897 -13.825 1.00 2.33 C ATOM 853 CG2 VAL A 58 10.965 15.765 -14.836 1.00 31.31 C ATOM 0 H VAL A 58 9.480 16.131 -12.636 1.00 1.21 H new ATOM 0 HA VAL A 58 10.710 13.647 -13.122 1.00 53.31 H new ATOM 0 HB VAL A 58 11.875 16.463 -13.041 1.00 35.43 H new ATOM 0 HG11 VAL A 58 13.650 15.557 -14.483 1.00 2.33 H new ATOM 0 HG12 VAL A 58 13.628 14.768 -12.888 1.00 2.33 H new ATOM 0 HG13 VAL A 58 12.958 13.928 -14.307 1.00 2.33 H new ATOM 0 HG21 VAL A 58 11.558 16.414 -15.481 1.00 31.31 H new ATOM 0 HG22 VAL A 58 10.780 14.819 -15.344 1.00 31.31 H new ATOM 0 HG23 VAL A 58 10.014 16.248 -14.611 1.00 31.31 H new ATOM 863 N ASP A 59 11.518 15.173 -10.341 1.00 3.20 N ATOM 864 CA ASP A 59 12.224 15.028 -9.073 1.00 64.43 C ATOM 865 C ASP A 59 12.070 13.613 -8.525 1.00 21.43 C ATOM 866 O ASP A 59 13.042 12.997 -8.087 1.00 52.52 O ATOM 867 CB ASP A 59 11.703 16.043 -8.055 1.00 73.40 C ATOM 868 CG ASP A 59 12.622 16.186 -6.858 1.00 13.22 C ATOM 869 OD1 ASP A 59 13.847 16.019 -7.028 1.00 23.13 O ATOM 870 OD2 ASP A 59 12.115 16.465 -5.751 1.00 21.04 O ATOM 0 H ASP A 59 10.883 15.970 -10.381 1.00 3.20 H new ATOM 0 HA ASP A 59 13.283 15.216 -9.251 1.00 64.43 H new ATOM 0 HB2 ASP A 59 11.588 17.013 -8.539 1.00 73.40 H new ATOM 0 HB3 ASP A 59 10.713 15.737 -7.715 1.00 73.40 H new ATOM 875 N GLU A 60 10.842 13.104 -8.551 1.00 22.13 N ATOM 876 CA GLU A 60 10.561 11.762 -8.054 1.00 3.02 C ATOM 877 C GLU A 60 10.959 10.707 -9.082 1.00 71.20 C ATOM 878 O GLU A 60 11.064 9.523 -8.763 1.00 62.40 O ATOM 879 CB GLU A 60 9.077 11.622 -7.711 1.00 32.54 C ATOM 880 CG GLU A 60 8.159 11.748 -8.915 1.00 0.11 C ATOM 881 CD GLU A 60 6.790 11.143 -8.671 1.00 62.34 C ATOM 882 OE1 GLU A 60 6.209 11.401 -7.597 1.00 25.54 O ATOM 883 OE2 GLU A 60 6.300 10.411 -9.557 1.00 31.11 O ATOM 0 H GLU A 60 10.027 13.600 -8.911 1.00 22.13 H new ATOM 0 HA GLU A 60 11.151 11.605 -7.151 1.00 3.02 H new ATOM 0 HB2 GLU A 60 8.912 10.654 -7.239 1.00 32.54 H new ATOM 0 HB3 GLU A 60 8.809 12.384 -6.979 1.00 32.54 H new ATOM 0 HG2 GLU A 60 8.046 12.801 -9.172 1.00 0.11 H new ATOM 0 HG3 GLU A 60 8.621 11.258 -9.772 1.00 0.11 H new ATOM 890 N SER A 61 11.178 11.146 -10.317 1.00 71.24 N ATOM 891 CA SER A 61 11.559 10.240 -11.394 1.00 65.42 C ATOM 892 C SER A 61 13.007 9.785 -11.234 1.00 41.14 C ATOM 893 O SER A 61 13.396 8.725 -11.728 1.00 13.42 O ATOM 894 CB SER A 61 11.374 10.920 -12.752 1.00 34.12 C ATOM 895 OG SER A 61 11.144 9.965 -13.774 1.00 2.24 O ATOM 0 H SER A 61 11.098 12.124 -10.597 1.00 71.24 H new ATOM 0 HA SER A 61 10.912 9.364 -11.344 1.00 65.42 H new ATOM 0 HB2 SER A 61 10.535 11.614 -12.703 1.00 34.12 H new ATOM 0 HB3 SER A 61 12.260 11.507 -12.992 1.00 34.12 H new ATOM 0 HG SER A 61 11.028 10.425 -14.631 1.00 2.24 H new ATOM 901 N LEU A 62 13.801 10.594 -10.542 1.00 22.14 N ATOM 902 CA LEU A 62 15.207 10.277 -10.315 1.00 70.54 C ATOM 903 C LEU A 62 15.365 8.859 -9.775 1.00 21.02 C ATOM 904 O LEU A 62 16.006 8.003 -10.385 1.00 41.33 O ATOM 905 CB LEU A 62 15.826 11.279 -9.339 1.00 72.25 C ATOM 906 CG LEU A 62 16.878 12.222 -9.924 1.00 12.45 C ATOM 907 CD1 LEU A 62 17.376 13.189 -8.861 1.00 4.22 C ATOM 908 CD2 LEU A 62 18.036 11.431 -10.513 1.00 21.44 C ATOM 0 H LEU A 62 13.495 11.475 -10.128 1.00 22.14 H new ATOM 0 HA LEU A 62 15.727 10.342 -11.271 1.00 70.54 H new ATOM 0 HB2 LEU A 62 15.025 11.881 -8.911 1.00 72.25 H new ATOM 0 HB3 LEU A 62 16.281 10.724 -8.519 1.00 72.25 H new ATOM 0 HG LEU A 62 16.416 12.800 -10.725 1.00 12.45 H new ATOM 0 HD11 LEU A 62 18.124 13.853 -9.295 1.00 4.22 H new ATOM 0 HD12 LEU A 62 16.540 13.780 -8.486 1.00 4.22 H new ATOM 0 HD13 LEU A 62 17.821 12.628 -8.039 1.00 4.22 H new ATOM 0 HD21 LEU A 62 18.775 12.119 -10.925 1.00 21.44 H new ATOM 0 HD22 LEU A 62 18.498 10.827 -9.732 1.00 21.44 H new ATOM 0 HD23 LEU A 62 17.666 10.780 -11.305 1.00 21.44 H new ATOM 920 N PRO A 63 14.766 8.602 -8.603 1.00 14.13 N ATOM 921 CA PRO A 63 14.823 7.288 -7.955 1.00 42.23 C ATOM 922 C PRO A 63 14.019 6.235 -8.709 1.00 71.32 C ATOM 923 O PRO A 63 14.468 5.102 -8.881 1.00 63.42 O ATOM 924 CB PRO A 63 14.209 7.545 -6.577 1.00 30.31 C ATOM 925 CG PRO A 63 13.321 8.725 -6.772 1.00 32.24 C ATOM 926 CD PRO A 63 13.985 9.575 -7.819 1.00 71.55 C ATOM 0 HA PRO A 63 15.839 6.896 -7.917 1.00 42.23 H new ATOM 0 HB2 PRO A 63 13.646 6.680 -6.227 1.00 30.31 H new ATOM 0 HB3 PRO A 63 14.979 7.748 -5.832 1.00 30.31 H new ATOM 0 HG2 PRO A 63 12.326 8.416 -7.094 1.00 32.24 H new ATOM 0 HG3 PRO A 63 13.197 9.278 -5.841 1.00 32.24 H new ATOM 0 HD2 PRO A 63 13.254 10.095 -8.438 1.00 71.55 H new ATOM 0 HD3 PRO A 63 14.624 10.337 -7.372 1.00 71.55 H new ATOM 934 N VAL A 64 12.827 6.616 -9.158 1.00 30.32 N ATOM 935 CA VAL A 64 11.960 5.704 -9.895 1.00 64.01 C ATOM 936 C VAL A 64 12.707 5.051 -11.053 1.00 4.32 C ATOM 937 O VAL A 64 12.402 3.925 -11.447 1.00 1.00 O ATOM 938 CB VAL A 64 10.719 6.431 -10.445 1.00 13.04 C ATOM 939 CG1 VAL A 64 9.896 5.497 -11.319 1.00 30.23 C ATOM 940 CG2 VAL A 64 9.878 6.985 -9.304 1.00 43.52 C ATOM 0 H VAL A 64 12.440 7.550 -9.024 1.00 30.32 H new ATOM 0 HA VAL A 64 11.640 4.935 -9.192 1.00 64.01 H new ATOM 0 HB VAL A 64 11.052 7.266 -11.061 1.00 13.04 H new ATOM 0 HG11 VAL A 64 9.023 6.029 -11.698 1.00 30.23 H new ATOM 0 HG12 VAL A 64 10.503 5.153 -12.156 1.00 30.23 H new ATOM 0 HG13 VAL A 64 9.571 4.640 -10.730 1.00 30.23 H new ATOM 0 HG21 VAL A 64 9.005 7.496 -9.710 1.00 43.52 H new ATOM 0 HG22 VAL A 64 9.553 6.167 -8.661 1.00 43.52 H new ATOM 0 HG23 VAL A 64 10.473 7.690 -8.723 1.00 43.52 H new ATOM 950 N LEU A 65 13.688 5.765 -11.594 1.00 3.30 N ATOM 951 CA LEU A 65 14.481 5.256 -12.707 1.00 61.45 C ATOM 952 C LEU A 65 15.929 5.029 -12.286 1.00 45.42 C ATOM 953 O LEU A 65 16.410 5.590 -11.301 1.00 31.11 O ATOM 954 CB LEU A 65 14.427 6.230 -13.886 1.00 31.43 C ATOM 955 CG LEU A 65 13.223 6.090 -14.817 1.00 74.35 C ATOM 956 CD1 LEU A 65 13.547 5.154 -15.972 1.00 13.31 C ATOM 957 CD2 LEU A 65 12.008 5.590 -14.048 1.00 64.23 C ATOM 0 H LEU A 65 13.953 6.698 -11.280 1.00 3.30 H new ATOM 0 HA LEU A 65 14.058 4.300 -13.014 1.00 61.45 H new ATOM 0 HB2 LEU A 65 14.441 7.246 -13.493 1.00 31.43 H new ATOM 0 HB3 LEU A 65 15.334 6.105 -14.477 1.00 31.43 H new ATOM 0 HG LEU A 65 12.989 7.073 -15.227 1.00 74.35 H new ATOM 0 HD11 LEU A 65 12.678 5.067 -16.624 1.00 13.31 H new ATOM 0 HD12 LEU A 65 14.388 5.553 -16.539 1.00 13.31 H new ATOM 0 HD13 LEU A 65 13.808 4.170 -15.581 1.00 13.31 H new ATOM 0 HD21 LEU A 65 11.161 5.497 -14.727 1.00 64.23 H new ATOM 0 HD22 LEU A 65 12.230 4.617 -13.609 1.00 64.23 H new ATOM 0 HD23 LEU A 65 11.762 6.298 -13.256 1.00 64.23 H new ATOM 969 N PRO A 66 16.644 4.190 -13.050 1.00 60.12 N ATOM 970 CA PRO A 66 18.049 3.873 -12.777 1.00 71.52 C ATOM 971 C PRO A 66 18.973 5.056 -13.042 1.00 52.35 C ATOM 972 O PRO A 66 18.828 5.757 -14.044 1.00 32.41 O ATOM 973 CB PRO A 66 18.350 2.730 -13.751 1.00 2.41 C ATOM 974 CG PRO A 66 17.379 2.916 -14.865 1.00 52.30 C ATOM 975 CD PRO A 66 16.136 3.486 -14.240 1.00 13.42 C ATOM 0 HA PRO A 66 18.213 3.615 -11.731 1.00 71.52 H new ATOM 0 HB2 PRO A 66 19.378 2.776 -14.110 1.00 2.41 H new ATOM 0 HB3 PRO A 66 18.223 1.759 -13.273 1.00 2.41 H new ATOM 0 HG2 PRO A 66 17.779 3.590 -15.623 1.00 52.30 H new ATOM 0 HG3 PRO A 66 17.167 1.968 -15.361 1.00 52.30 H new ATOM 0 HD2 PRO A 66 15.620 4.165 -14.919 1.00 13.42 H new ATOM 0 HD3 PRO A 66 15.426 2.704 -13.971 1.00 13.42 H new ATOM 983 N ALA A 67 19.923 5.274 -12.139 1.00 32.42 N ATOM 984 CA ALA A 67 20.872 6.371 -12.277 1.00 52.31 C ATOM 985 C ALA A 67 21.580 6.318 -13.626 1.00 65.42 C ATOM 986 O ALA A 67 22.207 5.315 -13.970 1.00 11.23 O ATOM 987 CB ALA A 67 21.887 6.337 -11.144 1.00 14.41 C ATOM 0 H ALA A 67 20.056 4.705 -11.303 1.00 32.42 H new ATOM 0 HA ALA A 67 20.317 7.308 -12.224 1.00 52.31 H new ATOM 0 HB1 ALA A 67 22.590 7.162 -11.260 1.00 14.41 H new ATOM 0 HB2 ALA A 67 21.370 6.432 -10.189 1.00 14.41 H new ATOM 0 HB3 ALA A 67 22.430 5.392 -11.170 1.00 14.41 H new ATOM 993 N SER A 68 21.477 7.402 -14.388 1.00 13.24 N ATOM 994 CA SER A 68 22.104 7.477 -15.702 1.00 22.52 C ATOM 995 C SER A 68 21.795 8.809 -16.377 1.00 54.20 C ATOM 996 O SER A 68 22.616 9.349 -17.120 1.00 34.42 O ATOM 997 CB SER A 68 21.627 6.322 -16.584 1.00 72.34 C ATOM 998 OG SER A 68 20.402 5.789 -16.109 1.00 45.13 O ATOM 0 H SER A 68 20.965 8.241 -14.117 1.00 13.24 H new ATOM 0 HA SER A 68 23.183 7.401 -15.567 1.00 22.52 H new ATOM 0 HB2 SER A 68 21.502 6.671 -17.609 1.00 72.34 H new ATOM 0 HB3 SER A 68 22.385 5.539 -16.604 1.00 72.34 H new ATOM 0 HG SER A 68 20.475 4.814 -16.038 1.00 45.13 H new ATOM 1004 N THR A 69 20.603 9.336 -16.114 1.00 12.24 N ATOM 1005 CA THR A 69 20.182 10.605 -16.696 1.00 24.55 C ATOM 1006 C THR A 69 20.072 11.689 -15.630 1.00 33.44 C ATOM 1007 O THR A 69 19.304 12.640 -15.775 1.00 53.30 O ATOM 1008 CB THR A 69 18.828 10.470 -17.417 1.00 44.15 C ATOM 1009 OG1 THR A 69 18.472 11.716 -18.026 1.00 14.44 O ATOM 1010 CG2 THR A 69 17.738 10.043 -16.447 1.00 13.02 C ATOM 0 H THR A 69 19.912 8.903 -15.501 1.00 12.24 H new ATOM 0 HA THR A 69 20.945 10.889 -17.421 1.00 24.55 H new ATOM 0 HB THR A 69 18.926 9.705 -18.187 1.00 44.15 H new ATOM 0 HG1 THR A 69 18.476 12.424 -17.348 1.00 14.44 H new ATOM 0 HG21 THR A 69 16.791 9.954 -16.980 1.00 13.02 H new ATOM 0 HG22 THR A 69 17.999 9.080 -16.008 1.00 13.02 H new ATOM 0 HG23 THR A 69 17.642 10.788 -15.657 1.00 13.02 H new ATOM 1018 N HIS A 70 20.844 11.539 -14.558 1.00 12.51 N ATOM 1019 CA HIS A 70 20.833 12.508 -13.467 1.00 70.21 C ATOM 1020 C HIS A 70 21.236 13.892 -13.966 1.00 3.24 C ATOM 1021 O HIS A 70 20.645 14.899 -13.576 1.00 0.30 O ATOM 1022 CB HIS A 70 21.777 12.060 -12.350 1.00 55.23 C ATOM 1023 CG HIS A 70 21.204 10.986 -11.477 1.00 64.04 C ATOM 1024 ND1 HIS A 70 21.309 10.998 -10.103 1.00 3.04 N ATOM 1025 CD2 HIS A 70 20.517 9.863 -11.791 1.00 71.10 C ATOM 1026 CE1 HIS A 70 20.713 9.928 -9.608 1.00 73.03 C ATOM 1027 NE2 HIS A 70 20.223 9.223 -10.612 1.00 61.22 N ATOM 0 H HIS A 70 21.484 10.757 -14.421 1.00 12.51 H new ATOM 0 HA HIS A 70 19.818 12.565 -13.074 1.00 70.21 H new ATOM 0 HB2 HIS A 70 22.706 11.700 -12.793 1.00 55.23 H new ATOM 0 HB3 HIS A 70 22.031 12.922 -11.733 1.00 55.23 H new ATOM 0 HD1 HIS A 70 21.774 11.721 -9.554 1.00 3.04 H new ATOM 0 HD2 HIS A 70 20.250 9.532 -12.784 1.00 71.10 H new ATOM 0 HE1 HIS A 70 20.639 9.673 -8.561 1.00 73.03 H new ATOM 1035 N ARG A 71 22.246 13.934 -14.828 1.00 44.22 N ATOM 1036 CA ARG A 71 22.730 15.195 -15.378 1.00 33.00 C ATOM 1037 C ARG A 71 21.579 16.011 -15.960 1.00 21.10 C ATOM 1038 O ARG A 71 21.342 17.146 -15.550 1.00 13.44 O ATOM 1039 CB ARG A 71 23.782 14.935 -16.458 1.00 10.14 C ATOM 1040 CG ARG A 71 24.306 16.202 -17.115 1.00 31.52 C ATOM 1041 CD ARG A 71 24.043 16.201 -18.613 1.00 4.33 C ATOM 1042 NE ARG A 71 24.944 17.102 -19.326 1.00 44.43 N ATOM 1043 CZ ARG A 71 24.722 17.538 -20.561 1.00 73.03 C ATOM 1044 NH1 ARG A 71 23.633 17.158 -21.216 1.00 23.51 N ATOM 1045 NH2 ARG A 71 25.589 18.356 -21.144 1.00 14.52 N ATOM 0 H ARG A 71 22.745 13.109 -15.161 1.00 44.22 H new ATOM 0 HA ARG A 71 23.185 15.765 -14.568 1.00 33.00 H new ATOM 0 HB2 ARG A 71 24.618 14.393 -16.016 1.00 10.14 H new ATOM 0 HB3 ARG A 71 23.352 14.290 -17.224 1.00 10.14 H new ATOM 0 HG2 ARG A 71 23.831 17.072 -16.661 1.00 31.52 H new ATOM 0 HG3 ARG A 71 25.377 16.292 -16.932 1.00 31.52 H new ATOM 0 HD2 ARG A 71 24.160 15.189 -19.001 1.00 4.33 H new ATOM 0 HD3 ARG A 71 23.011 16.497 -18.800 1.00 4.33 H new ATOM 0 HE ARG A 71 25.790 17.414 -18.850 1.00 44.43 H new ATOM 0 HH11 ARG A 71 22.964 16.530 -20.771 1.00 23.51 H new ATOM 0 HH12 ARG A 71 23.465 17.494 -22.164 1.00 23.51 H new ATOM 0 HH21 ARG A 71 26.428 18.651 -20.644 1.00 14.52 H new ATOM 0 HH22 ARG A 71 25.417 18.690 -22.092 1.00 14.52 H new ATOM 1059 N GLU A 72 20.869 15.424 -16.918 1.00 62.52 N ATOM 1060 CA GLU A 72 19.745 16.097 -17.557 1.00 13.30 C ATOM 1061 C GLU A 72 18.651 16.412 -16.541 1.00 14.12 C ATOM 1062 O GLU A 72 18.086 17.506 -16.541 1.00 13.35 O ATOM 1063 CB GLU A 72 19.176 15.232 -18.683 1.00 60.14 C ATOM 1064 CG GLU A 72 20.230 14.727 -19.654 1.00 40.15 C ATOM 1065 CD GLU A 72 19.627 14.058 -20.874 1.00 32.50 C ATOM 1066 OE1 GLU A 72 18.518 14.461 -21.284 1.00 21.11 O ATOM 1067 OE2 GLU A 72 20.263 13.131 -21.418 1.00 75.21 O ATOM 0 H GLU A 72 21.052 14.484 -17.269 1.00 62.52 H new ATOM 0 HA GLU A 72 20.108 17.035 -17.978 1.00 13.30 H new ATOM 0 HB2 GLU A 72 18.657 14.378 -18.247 1.00 60.14 H new ATOM 0 HB3 GLU A 72 18.434 15.810 -19.234 1.00 60.14 H new ATOM 0 HG2 GLU A 72 20.854 15.562 -19.973 1.00 40.15 H new ATOM 0 HG3 GLU A 72 20.882 14.020 -19.141 1.00 40.15 H new ATOM 1074 N ILE A 73 18.357 15.446 -15.678 1.00 23.44 N ATOM 1075 CA ILE A 73 17.332 15.619 -14.656 1.00 51.44 C ATOM 1076 C ILE A 73 17.614 16.847 -13.797 1.00 43.33 C ATOM 1077 O ILE A 73 16.727 17.665 -13.556 1.00 40.13 O ATOM 1078 CB ILE A 73 17.229 14.382 -13.745 1.00 62.13 C ATOM 1079 CG1 ILE A 73 16.638 13.201 -14.518 1.00 30.35 C ATOM 1080 CG2 ILE A 73 16.385 14.696 -12.519 1.00 24.31 C ATOM 1081 CD1 ILE A 73 16.858 11.866 -13.841 1.00 64.34 C ATOM 0 H ILE A 73 18.814 14.534 -15.666 1.00 23.44 H new ATOM 0 HA ILE A 73 16.385 15.754 -15.179 1.00 51.44 H new ATOM 0 HB ILE A 73 18.230 14.109 -13.412 1.00 62.13 H new ATOM 0 HG12 ILE A 73 15.568 13.361 -14.648 1.00 30.35 H new ATOM 0 HG13 ILE A 73 17.080 13.171 -15.514 1.00 30.35 H new ATOM 0 HG21 ILE A 73 16.321 13.812 -11.885 1.00 24.31 H new ATOM 0 HG22 ILE A 73 16.844 15.511 -11.960 1.00 24.31 H new ATOM 0 HG23 ILE A 73 15.383 14.990 -12.832 1.00 24.31 H new ATOM 0 HD11 ILE A 73 16.413 11.075 -14.444 1.00 64.34 H new ATOM 0 HD12 ILE A 73 17.927 11.684 -13.735 1.00 64.34 H new ATOM 0 HD13 ILE A 73 16.392 11.877 -12.856 1.00 64.34 H new ATOM 1093 N GLU A 74 18.856 16.970 -13.340 1.00 24.33 N ATOM 1094 CA GLU A 74 19.256 18.099 -12.508 1.00 55.11 C ATOM 1095 C GLU A 74 19.058 19.418 -13.250 1.00 63.23 C ATOM 1096 O GLU A 74 18.395 20.328 -12.754 1.00 42.02 O ATOM 1097 CB GLU A 74 20.718 17.955 -12.081 1.00 51.14 C ATOM 1098 CG GLU A 74 20.916 17.966 -10.575 1.00 3.40 C ATOM 1099 CD GLU A 74 22.107 17.136 -10.137 1.00 71.21 C ATOM 1100 OE1 GLU A 74 23.054 16.988 -10.937 1.00 61.42 O ATOM 1101 OE2 GLU A 74 22.091 16.634 -8.993 1.00 41.25 O ATOM 0 H GLU A 74 19.603 16.302 -13.532 1.00 24.33 H new ATOM 0 HA GLU A 74 18.625 18.104 -11.619 1.00 55.11 H new ATOM 0 HB2 GLU A 74 21.115 17.024 -12.484 1.00 51.14 H new ATOM 0 HB3 GLU A 74 21.298 18.766 -12.521 1.00 51.14 H new ATOM 0 HG2 GLU A 74 21.050 18.994 -10.238 1.00 3.40 H new ATOM 0 HG3 GLU A 74 20.016 17.587 -10.091 1.00 3.40 H new ATOM 1108 N MET A 75 19.640 19.512 -14.442 1.00 12.24 N ATOM 1109 CA MET A 75 19.528 20.719 -15.253 1.00 33.12 C ATOM 1110 C MET A 75 18.071 21.004 -15.604 1.00 41.15 C ATOM 1111 O MET A 75 17.695 22.150 -15.851 1.00 65.34 O ATOM 1112 CB MET A 75 20.355 20.578 -16.532 1.00 22.01 C ATOM 1113 CG MET A 75 21.624 21.415 -16.530 1.00 21.20 C ATOM 1114 SD MET A 75 22.628 21.158 -18.005 1.00 60.45 S ATOM 1115 CE MET A 75 23.989 20.210 -17.328 1.00 51.31 C ATOM 0 H MET A 75 20.193 18.768 -14.867 1.00 12.24 H new ATOM 0 HA MET A 75 19.913 21.556 -14.671 1.00 33.12 H new ATOM 0 HB2 MET A 75 20.621 19.530 -16.669 1.00 22.01 H new ATOM 0 HB3 MET A 75 19.741 20.866 -17.386 1.00 22.01 H new ATOM 0 HG2 MET A 75 21.359 22.470 -16.455 1.00 21.20 H new ATOM 0 HG3 MET A 75 22.214 21.171 -15.647 1.00 21.20 H new ATOM 0 HE1 MET A 75 24.582 19.793 -18.142 1.00 51.31 H new ATOM 0 HE2 MET A 75 24.616 20.859 -16.717 1.00 51.31 H new ATOM 0 HE3 MET A 75 23.598 19.400 -16.712 1.00 51.31 H new ATOM 1125 N ALA A 76 17.256 19.955 -15.626 1.00 34.15 N ATOM 1126 CA ALA A 76 15.840 20.094 -15.945 1.00 63.33 C ATOM 1127 C ALA A 76 15.099 20.842 -14.843 1.00 2.14 C ATOM 1128 O ALA A 76 14.159 21.589 -15.112 1.00 32.14 O ATOM 1129 CB ALA A 76 15.214 18.726 -16.171 1.00 34.33 C ATOM 0 H ALA A 76 17.552 18.999 -15.427 1.00 34.15 H new ATOM 0 HA ALA A 76 15.755 20.677 -16.862 1.00 63.33 H new ATOM 0 HB1 ALA A 76 14.157 18.844 -16.408 1.00 34.33 H new ATOM 0 HB2 ALA A 76 15.718 18.227 -16.999 1.00 34.33 H new ATOM 0 HB3 ALA A 76 15.318 18.125 -15.268 1.00 34.33 H new ATOM 1135 N GLN A 77 15.529 20.636 -13.602 1.00 32.21 N ATOM 1136 CA GLN A 77 14.904 21.291 -12.459 1.00 31.32 C ATOM 1137 C GLN A 77 15.044 22.806 -12.556 1.00 51.22 C ATOM 1138 O GLN A 77 14.055 23.524 -12.706 1.00 74.32 O ATOM 1139 CB GLN A 77 15.528 20.792 -11.154 1.00 71.34 C ATOM 1140 CG GLN A 77 15.093 19.387 -10.770 1.00 74.21 C ATOM 1141 CD GLN A 77 15.199 19.130 -9.280 1.00 24.21 C ATOM 1142 OE1 GLN A 77 15.389 20.056 -8.491 1.00 21.34 O ATOM 1143 NE2 GLN A 77 15.078 17.867 -8.886 1.00 53.44 N ATOM 0 H GLN A 77 16.307 20.021 -13.363 1.00 32.21 H new ATOM 0 HA GLN A 77 13.843 21.041 -12.465 1.00 31.32 H new ATOM 0 HB2 GLN A 77 16.614 20.814 -11.248 1.00 71.34 H new ATOM 0 HB3 GLN A 77 15.264 21.478 -10.349 1.00 71.34 H new ATOM 0 HG2 GLN A 77 14.063 19.230 -11.090 1.00 74.21 H new ATOM 0 HG3 GLN A 77 15.707 18.662 -11.304 1.00 74.21 H new ATOM 0 HE21 GLN A 77 14.921 17.131 -9.574 1.00 53.44 H new ATOM 0 HE22 GLN A 77 15.142 17.634 -7.895 1.00 53.44 H new ATOM 1152 N LYS A 78 16.279 23.288 -12.469 1.00 41.05 N ATOM 1153 CA LYS A 78 16.550 24.718 -12.549 1.00 3.55 C ATOM 1154 C LYS A 78 15.989 25.308 -13.838 1.00 40.15 C ATOM 1155 O LYS A 78 15.376 26.377 -13.830 1.00 22.44 O ATOM 1156 CB LYS A 78 18.056 24.978 -12.470 1.00 4.14 C ATOM 1157 CG LYS A 78 18.548 25.284 -11.065 1.00 40.15 C ATOM 1158 CD LYS A 78 19.126 24.049 -10.395 1.00 60.14 C ATOM 1159 CE LYS A 78 20.576 23.825 -10.796 1.00 22.42 C ATOM 1160 NZ LYS A 78 21.468 23.714 -9.609 1.00 25.52 N ATOM 0 H LYS A 78 17.109 22.708 -12.343 1.00 41.05 H new ATOM 0 HA LYS A 78 16.059 25.202 -11.705 1.00 3.55 H new ATOM 0 HB2 LYS A 78 18.587 24.105 -12.850 1.00 4.14 H new ATOM 0 HB3 LYS A 78 18.307 25.813 -13.124 1.00 4.14 H new ATOM 0 HG2 LYS A 78 19.307 26.065 -11.106 1.00 40.15 H new ATOM 0 HG3 LYS A 78 17.724 25.672 -10.466 1.00 40.15 H new ATOM 0 HD2 LYS A 78 19.059 24.156 -9.312 1.00 60.14 H new ATOM 0 HD3 LYS A 78 18.533 23.175 -10.666 1.00 60.14 H new ATOM 0 HE2 LYS A 78 20.652 22.916 -11.393 1.00 22.42 H new ATOM 0 HE3 LYS A 78 20.910 24.649 -11.426 1.00 22.42 H new ATOM 0 HZ1 LYS A 78 22.447 23.562 -9.924 1.00 25.52 H new ATOM 0 HZ2 LYS A 78 21.416 24.591 -9.052 1.00 25.52 H new ATOM 0 HZ3 LYS A 78 21.165 22.912 -9.021 1.00 25.52 H new ATOM 1174 N LEU A 79 16.201 24.605 -14.946 1.00 14.52 N ATOM 1175 CA LEU A 79 15.714 25.059 -16.244 1.00 62.23 C ATOM 1176 C LEU A 79 14.206 25.287 -16.212 1.00 23.14 C ATOM 1177 O LEU A 79 13.711 26.307 -16.694 1.00 22.52 O ATOM 1178 CB LEU A 79 16.063 24.036 -17.327 1.00 44.41 C ATOM 1179 CG LEU A 79 15.624 24.388 -18.749 1.00 32.31 C ATOM 1180 CD1 LEU A 79 16.802 24.308 -19.707 1.00 1.10 C ATOM 1181 CD2 LEU A 79 14.501 23.466 -19.203 1.00 44.12 C ATOM 0 H LEU A 79 16.706 23.719 -14.971 1.00 14.52 H new ATOM 0 HA LEU A 79 16.201 26.006 -16.476 1.00 62.23 H new ATOM 0 HB2 LEU A 79 17.143 23.891 -17.327 1.00 44.41 H new ATOM 0 HB3 LEU A 79 15.613 23.081 -17.055 1.00 44.41 H new ATOM 0 HG LEU A 79 15.250 25.412 -18.751 1.00 32.31 H new ATOM 0 HD11 LEU A 79 16.470 24.562 -20.714 1.00 1.10 H new ATOM 0 HD12 LEU A 79 17.575 25.009 -19.392 1.00 1.10 H new ATOM 0 HD13 LEU A 79 17.206 23.296 -19.703 1.00 1.10 H new ATOM 0 HD21 LEU A 79 14.201 23.730 -20.217 1.00 44.12 H new ATOM 0 HD22 LEU A 79 14.849 22.433 -19.185 1.00 44.12 H new ATOM 0 HD23 LEU A 79 13.648 23.573 -18.532 1.00 44.12 H new ATOM 1193 N LEU A 80 13.481 24.333 -15.638 1.00 63.22 N ATOM 1194 CA LEU A 80 12.029 24.430 -15.540 1.00 1.21 C ATOM 1195 C LEU A 80 11.613 25.761 -14.921 1.00 42.14 C ATOM 1196 O LEU A 80 10.734 26.449 -15.438 1.00 42.14 O ATOM 1197 CB LEU A 80 11.476 23.273 -14.707 1.00 31.32 C ATOM 1198 CG LEU A 80 10.554 22.298 -15.441 1.00 25.22 C ATOM 1199 CD1 LEU A 80 9.432 23.048 -16.141 1.00 44.31 C ATOM 1200 CD2 LEU A 80 11.346 21.465 -16.439 1.00 13.11 C ATOM 0 H LEU A 80 13.875 23.484 -15.233 1.00 63.22 H new ATOM 0 HA LEU A 80 11.617 24.374 -16.548 1.00 1.21 H new ATOM 0 HB2 LEU A 80 12.316 22.711 -14.300 1.00 31.32 H new ATOM 0 HB3 LEU A 80 10.931 23.690 -13.860 1.00 31.32 H new ATOM 0 HG LEU A 80 10.110 21.625 -14.707 1.00 25.22 H new ATOM 0 HD11 LEU A 80 8.787 22.338 -16.658 1.00 44.31 H new ATOM 0 HD12 LEU A 80 8.848 23.600 -15.404 1.00 44.31 H new ATOM 0 HD13 LEU A 80 9.856 23.745 -16.864 1.00 44.31 H new ATOM 0 HD21 LEU A 80 10.675 20.777 -16.952 1.00 13.11 H new ATOM 0 HD22 LEU A 80 11.818 22.123 -17.168 1.00 13.11 H new ATOM 0 HD23 LEU A 80 12.113 20.898 -15.912 1.00 13.11 H new ATOM 1212 N ASN A 81 12.253 26.118 -13.813 1.00 1.14 N ATOM 1213 CA ASN A 81 11.951 27.368 -13.124 1.00 73.13 C ATOM 1214 C ASN A 81 12.003 28.547 -14.091 1.00 3.55 C ATOM 1215 O ASN A 81 11.047 29.314 -14.203 1.00 74.23 O ATOM 1216 CB ASN A 81 12.935 27.592 -11.974 1.00 73.03 C ATOM 1217 CG ASN A 81 12.233 27.864 -10.658 1.00 11.03 C ATOM 1218 OD1 ASN A 81 11.362 28.730 -10.573 1.00 73.22 O ATOM 1219 ND2 ASN A 81 12.611 27.124 -9.622 1.00 73.30 N ATOM 0 H ASN A 81 12.984 25.560 -13.372 1.00 1.14 H new ATOM 0 HA ASN A 81 10.941 27.297 -12.719 1.00 73.13 H new ATOM 0 HB2 ASN A 81 13.572 26.714 -11.868 1.00 73.03 H new ATOM 0 HB3 ASN A 81 13.587 28.432 -12.215 1.00 73.03 H new ATOM 0 HD21 ASN A 81 12.175 27.262 -8.710 1.00 73.30 H new ATOM 0 HD22 ASN A 81 13.337 26.417 -9.738 1.00 73.30 H new ATOM 1226 N SER A 82 13.128 28.686 -14.786 1.00 14.21 N ATOM 1227 CA SER A 82 13.307 29.774 -15.740 1.00 73.14 C ATOM 1228 C SER A 82 12.152 29.818 -16.737 1.00 10.25 C ATOM 1229 O SER A 82 11.503 30.851 -16.906 1.00 33.55 O ATOM 1230 CB SER A 82 14.633 29.613 -16.486 1.00 73.13 C ATOM 1231 OG SER A 82 15.488 28.703 -15.816 1.00 75.22 O ATOM 0 H SER A 82 13.929 28.059 -14.706 1.00 14.21 H new ATOM 0 HA SER A 82 13.322 30.712 -15.185 1.00 73.14 H new ATOM 0 HB2 SER A 82 14.443 29.259 -17.499 1.00 73.13 H new ATOM 0 HB3 SER A 82 15.125 30.582 -16.573 1.00 73.13 H new ATOM 0 HG SER A 82 16.328 28.616 -16.314 1.00 75.22 H new ATOM 1237 N ASP A 83 11.902 28.691 -17.393 1.00 62.14 N ATOM 1238 CA ASP A 83 10.825 28.599 -18.373 1.00 4.05 C ATOM 1239 C ASP A 83 9.508 29.089 -17.779 1.00 42.23 C ATOM 1240 O ASP A 83 8.707 29.728 -18.463 1.00 10.34 O ATOM 1241 CB ASP A 83 10.674 27.158 -18.862 1.00 32.23 C ATOM 1242 CG ASP A 83 11.999 26.539 -19.260 1.00 3.03 C ATOM 1243 OD1 ASP A 83 12.774 27.207 -19.976 1.00 70.31 O ATOM 1244 OD2 ASP A 83 12.262 25.387 -18.856 1.00 32.34 O ATOM 0 H ASP A 83 12.430 27.828 -17.265 1.00 62.14 H new ATOM 0 HA ASP A 83 11.081 29.236 -19.219 1.00 4.05 H new ATOM 0 HB2 ASP A 83 10.217 26.557 -18.076 1.00 32.23 H new ATOM 0 HB3 ASP A 83 9.996 27.136 -19.715 1.00 32.23 H new ATOM 1249 N LEU A 84 9.290 28.785 -16.505 1.00 11.12 N ATOM 1250 CA LEU A 84 8.069 29.194 -15.819 1.00 31.30 C ATOM 1251 C LEU A 84 7.943 30.714 -15.790 1.00 60.45 C ATOM 1252 O LEU A 84 7.066 31.286 -16.437 1.00 32.24 O ATOM 1253 CB LEU A 84 8.053 28.642 -14.392 1.00 40.42 C ATOM 1254 CG LEU A 84 6.716 28.726 -13.655 1.00 51.21 C ATOM 1255 CD1 LEU A 84 6.662 27.705 -12.530 1.00 32.42 C ATOM 1256 CD2 LEU A 84 6.492 30.131 -13.114 1.00 23.30 C ATOM 0 H LEU A 84 9.942 28.257 -15.926 1.00 11.12 H new ATOM 0 HA LEU A 84 7.220 28.788 -16.369 1.00 31.30 H new ATOM 0 HB2 LEU A 84 8.362 27.597 -14.424 1.00 40.42 H new ATOM 0 HB3 LEU A 84 8.801 29.178 -13.808 1.00 40.42 H new ATOM 0 HG LEU A 84 5.918 28.499 -14.362 1.00 51.21 H new ATOM 0 HD11 LEU A 84 5.703 27.780 -12.017 1.00 32.42 H new ATOM 0 HD12 LEU A 84 6.776 26.703 -12.943 1.00 32.42 H new ATOM 0 HD13 LEU A 84 7.468 27.900 -11.823 1.00 32.42 H new ATOM 0 HD21 LEU A 84 5.536 30.172 -12.593 1.00 23.30 H new ATOM 0 HD22 LEU A 84 7.294 30.386 -12.422 1.00 23.30 H new ATOM 0 HD23 LEU A 84 6.486 30.842 -13.940 1.00 23.30 H new ATOM 1268 N ALA A 85 8.827 31.361 -15.039 1.00 0.43 N ATOM 1269 CA ALA A 85 8.817 32.815 -14.930 1.00 25.14 C ATOM 1270 C ALA A 85 8.832 33.469 -16.307 1.00 75.10 C ATOM 1271 O ALA A 85 8.207 34.508 -16.517 1.00 35.14 O ATOM 1272 CB ALA A 85 10.005 33.290 -14.105 1.00 51.04 C ATOM 0 H ALA A 85 9.559 30.902 -14.497 1.00 0.43 H new ATOM 0 HA ALA A 85 7.897 33.111 -14.426 1.00 25.14 H new ATOM 0 HB1 ALA A 85 9.985 34.377 -14.032 1.00 51.04 H new ATOM 0 HB2 ALA A 85 9.950 32.858 -13.106 1.00 51.04 H new ATOM 0 HB3 ALA A 85 10.931 32.975 -14.586 1.00 51.04 H new ATOM 1278 N GLU A 86 9.549 32.854 -17.242 1.00 20.20 N ATOM 1279 CA GLU A 86 9.645 33.379 -18.599 1.00 72.30 C ATOM 1280 C GLU A 86 8.267 33.462 -19.249 1.00 35.23 C ATOM 1281 O GLU A 86 7.922 34.466 -19.874 1.00 32.40 O ATOM 1282 CB GLU A 86 10.568 32.500 -19.446 1.00 34.43 C ATOM 1283 CG GLU A 86 11.948 33.096 -19.661 1.00 3.55 C ATOM 1284 CD GLU A 86 12.910 32.761 -18.538 1.00 23.45 C ATOM 1285 OE1 GLU A 86 12.794 33.370 -17.454 1.00 33.53 O ATOM 1286 OE2 GLU A 86 13.780 31.888 -18.743 1.00 51.02 O ATOM 0 H GLU A 86 10.072 31.992 -17.085 1.00 20.20 H new ATOM 0 HA GLU A 86 10.063 34.384 -18.543 1.00 72.30 H new ATOM 0 HB2 GLU A 86 10.673 31.528 -18.964 1.00 34.43 H new ATOM 0 HB3 GLU A 86 10.101 32.327 -20.416 1.00 34.43 H new ATOM 0 HG2 GLU A 86 12.355 32.730 -20.604 1.00 3.55 H new ATOM 0 HG3 GLU A 86 11.862 34.179 -19.750 1.00 3.55 H new ATOM 1293 N LEU A 87 7.483 32.400 -19.097 1.00 14.20 N ATOM 1294 CA LEU A 87 6.141 32.351 -19.669 1.00 5.42 C ATOM 1295 C LEU A 87 5.212 33.333 -18.962 1.00 42.12 C ATOM 1296 O LEU A 87 4.542 34.142 -19.606 1.00 24.43 O ATOM 1297 CB LEU A 87 5.575 30.934 -19.570 1.00 71.11 C ATOM 1298 CG LEU A 87 4.522 30.558 -20.613 1.00 71.21 C ATOM 1299 CD1 LEU A 87 3.284 31.429 -20.460 1.00 64.53 C ATOM 1300 CD2 LEU A 87 5.094 30.683 -22.018 1.00 21.24 C ATOM 0 H LEU A 87 7.753 31.561 -18.583 1.00 14.20 H new ATOM 0 HA LEU A 87 6.209 32.636 -20.719 1.00 5.42 H new ATOM 0 HB2 LEU A 87 6.402 30.228 -19.647 1.00 71.11 H new ATOM 0 HB3 LEU A 87 5.138 30.807 -18.580 1.00 71.11 H new ATOM 0 HG LEU A 87 4.233 29.520 -20.451 1.00 71.21 H new ATOM 0 HD11 LEU A 87 2.546 31.147 -21.211 1.00 64.53 H new ATOM 0 HD12 LEU A 87 2.861 31.289 -19.465 1.00 64.53 H new ATOM 0 HD13 LEU A 87 3.557 32.476 -20.595 1.00 64.53 H new ATOM 0 HD21 LEU A 87 4.331 30.411 -22.747 1.00 21.24 H new ATOM 0 HD22 LEU A 87 5.412 31.711 -22.191 1.00 21.24 H new ATOM 0 HD23 LEU A 87 5.950 30.016 -22.123 1.00 21.24 H new ATOM 1312 N ILE A 88 5.179 33.258 -17.636 1.00 75.01 N ATOM 1313 CA ILE A 88 4.334 34.142 -16.843 1.00 1.24 C ATOM 1314 C ILE A 88 4.653 35.606 -17.125 1.00 5.44 C ATOM 1315 O ILE A 88 3.753 36.424 -17.311 1.00 22.32 O ATOM 1316 CB ILE A 88 4.498 33.874 -15.335 1.00 22.21 C ATOM 1317 CG1 ILE A 88 4.270 32.392 -15.031 1.00 35.13 C ATOM 1318 CG2 ILE A 88 3.536 34.739 -14.535 1.00 74.01 C ATOM 1319 CD1 ILE A 88 2.902 31.895 -15.442 1.00 74.55 C ATOM 0 H ILE A 88 5.727 32.595 -17.088 1.00 75.01 H new ATOM 0 HA ILE A 88 3.303 33.935 -17.131 1.00 1.24 H new ATOM 0 HB ILE A 88 5.516 34.133 -15.043 1.00 22.21 H new ATOM 0 HG12 ILE A 88 5.031 31.803 -15.543 1.00 35.13 H new ATOM 0 HG13 ILE A 88 4.403 32.224 -13.962 1.00 35.13 H new ATOM 0 HG21 ILE A 88 3.664 34.538 -13.471 1.00 74.01 H new ATOM 0 HG22 ILE A 88 3.742 35.791 -14.733 1.00 74.01 H new ATOM 0 HG23 ILE A 88 2.511 34.509 -14.827 1.00 74.01 H new ATOM 0 HD11 ILE A 88 2.810 30.837 -15.197 1.00 74.55 H new ATOM 0 HD12 ILE A 88 2.135 32.458 -14.910 1.00 74.55 H new ATOM 0 HD13 ILE A 88 2.773 32.031 -16.516 1.00 74.55 H new ATOM 1331 N ASN A 89 5.942 35.930 -17.156 1.00 63.20 N ATOM 1332 CA ASN A 89 6.381 37.296 -17.417 1.00 23.11 C ATOM 1333 C ASN A 89 5.749 37.835 -18.696 1.00 41.44 C ATOM 1334 O ASN A 89 4.870 38.696 -18.653 1.00 1.41 O ATOM 1335 CB ASN A 89 7.906 37.352 -17.525 1.00 64.35 C ATOM 1336 CG ASN A 89 8.407 38.724 -17.934 1.00 22.41 C ATOM 1337 OD1 ASN A 89 8.841 38.926 -19.068 1.00 24.10 O ATOM 1338 ND2 ASN A 89 8.349 39.674 -17.008 1.00 50.24 N ATOM 0 H ASN A 89 6.700 35.265 -17.004 1.00 63.20 H new ATOM 0 HA ASN A 89 6.060 37.920 -16.583 1.00 23.11 H new ATOM 0 HB2 ASN A 89 8.346 37.079 -16.566 1.00 64.35 H new ATOM 0 HB3 ASN A 89 8.243 36.613 -18.252 1.00 64.35 H new ATOM 0 HD21 ASN A 89 8.672 40.617 -17.224 1.00 50.24 H new ATOM 0 HD22 ASN A 89 7.981 39.461 -16.081 1.00 50.24 H new ATOM 1345 N LYS A 90 6.202 37.323 -19.835 1.00 64.14 N ATOM 1346 CA LYS A 90 5.681 37.750 -21.128 1.00 42.43 C ATOM 1347 C LYS A 90 4.158 37.668 -21.155 1.00 43.22 C ATOM 1348 O LYS A 90 3.493 38.506 -21.764 1.00 21.33 O ATOM 1349 CB LYS A 90 6.269 36.889 -22.248 1.00 71.13 C ATOM 1350 CG LYS A 90 5.980 37.422 -23.641 1.00 34.40 C ATOM 1351 CD LYS A 90 7.251 37.868 -24.342 1.00 43.34 C ATOM 1352 CE LYS A 90 7.686 36.866 -25.401 1.00 32.24 C ATOM 1353 NZ LYS A 90 8.771 35.974 -24.907 1.00 62.30 N ATOM 0 H LYS A 90 6.930 36.611 -19.889 1.00 64.14 H new ATOM 0 HA LYS A 90 5.974 38.788 -21.285 1.00 42.43 H new ATOM 0 HB2 LYS A 90 7.348 36.818 -22.112 1.00 71.13 H new ATOM 0 HB3 LYS A 90 5.870 35.878 -22.165 1.00 71.13 H new ATOM 0 HG2 LYS A 90 5.489 36.649 -24.233 1.00 34.40 H new ATOM 0 HG3 LYS A 90 5.287 38.261 -23.574 1.00 34.40 H new ATOM 0 HD2 LYS A 90 7.090 38.841 -24.805 1.00 43.34 H new ATOM 0 HD3 LYS A 90 8.048 37.992 -23.608 1.00 43.34 H new ATOM 0 HE2 LYS A 90 6.830 36.263 -25.704 1.00 32.24 H new ATOM 0 HE3 LYS A 90 8.030 37.400 -26.287 1.00 32.24 H new ATOM 0 HZ1 LYS A 90 9.040 35.306 -25.657 1.00 62.30 H new ATOM 0 HZ2 LYS A 90 9.597 36.547 -24.641 1.00 62.30 H new ATOM 0 HZ3 LYS A 90 8.435 35.445 -24.077 1.00 62.30 H new ATOM 1367 N MET A 91 3.613 36.655 -20.491 1.00 21.43 N ATOM 1368 CA MET A 91 2.168 36.466 -20.437 1.00 21.42 C ATOM 1369 C MET A 91 1.490 37.648 -19.752 1.00 43.54 C ATOM 1370 O MET A 91 0.430 38.104 -20.182 1.00 62.32 O ATOM 1371 CB MET A 91 1.829 35.170 -19.697 1.00 12.42 C ATOM 1372 CG MET A 91 0.356 35.041 -19.342 1.00 63.35 C ATOM 1373 SD MET A 91 -0.718 35.146 -20.787 1.00 44.01 S ATOM 1374 CE MET A 91 -2.208 35.815 -20.053 1.00 1.30 C ATOM 0 H MET A 91 4.150 35.952 -19.983 1.00 21.43 H new ATOM 0 HA MET A 91 1.797 36.400 -21.460 1.00 21.42 H new ATOM 0 HB2 MET A 91 2.121 34.321 -20.315 1.00 12.42 H new ATOM 0 HB3 MET A 91 2.421 35.117 -18.783 1.00 12.42 H new ATOM 0 HG2 MET A 91 0.190 34.089 -18.839 1.00 63.35 H new ATOM 0 HG3 MET A 91 0.086 35.826 -18.636 1.00 63.35 H new ATOM 0 HE1 MET A 91 -3.020 35.096 -20.159 1.00 1.30 H new ATOM 0 HE2 MET A 91 -2.035 36.014 -18.995 1.00 1.30 H new ATOM 0 HE3 MET A 91 -2.477 36.743 -20.557 1.00 1.30 H new ATOM 1384 N LYS A 92 2.108 38.142 -18.685 1.00 4.21 N ATOM 1385 CA LYS A 92 1.566 39.273 -17.941 1.00 30.21 C ATOM 1386 C LYS A 92 1.477 40.513 -18.824 1.00 74.04 C ATOM 1387 O LYS A 92 0.545 41.309 -18.702 1.00 12.22 O ATOM 1388 CB LYS A 92 2.435 39.568 -16.716 1.00 72.30 C ATOM 1389 CG LYS A 92 1.840 39.064 -15.413 1.00 34.24 C ATOM 1390 CD LYS A 92 2.591 39.608 -14.209 1.00 52.33 C ATOM 1391 CE LYS A 92 2.942 38.503 -13.225 1.00 14.55 C ATOM 1392 NZ LYS A 92 1.791 38.159 -12.344 1.00 51.03 N ATOM 0 H LYS A 92 2.986 37.777 -18.316 1.00 4.21 H new ATOM 0 HA LYS A 92 0.561 39.010 -17.611 1.00 30.21 H new ATOM 0 HB2 LYS A 92 3.415 39.113 -16.858 1.00 72.30 H new ATOM 0 HB3 LYS A 92 2.591 40.644 -16.642 1.00 72.30 H new ATOM 0 HG2 LYS A 92 0.792 39.358 -15.353 1.00 34.24 H new ATOM 0 HG3 LYS A 92 1.866 37.974 -15.397 1.00 34.24 H new ATOM 0 HD2 LYS A 92 3.503 40.104 -14.541 1.00 52.33 H new ATOM 0 HD3 LYS A 92 1.982 40.362 -13.709 1.00 52.33 H new ATOM 0 HE2 LYS A 92 3.258 37.615 -13.773 1.00 14.55 H new ATOM 0 HE3 LYS A 92 3.787 38.817 -12.612 1.00 14.55 H new ATOM 0 HZ1 LYS A 92 2.070 37.402 -11.688 1.00 51.03 H new ATOM 0 HZ2 LYS A 92 1.505 38.999 -11.802 1.00 51.03 H new ATOM 0 HZ3 LYS A 92 0.993 37.835 -12.926 1.00 51.03 H new ATOM 1406 N LEU A 93 2.449 40.670 -19.715 1.00 45.51 N ATOM 1407 CA LEU A 93 2.480 41.814 -20.621 1.00 32.50 C ATOM 1408 C LEU A 93 1.320 41.755 -21.610 1.00 10.40 C ATOM 1409 O LEU A 93 0.603 42.738 -21.800 1.00 24.32 O ATOM 1410 CB LEU A 93 3.809 41.855 -21.378 1.00 34.34 C ATOM 1411 CG LEU A 93 4.916 42.696 -20.743 1.00 44.43 C ATOM 1412 CD1 LEU A 93 5.498 41.987 -19.530 1.00 71.34 C ATOM 1413 CD2 LEU A 93 6.007 42.997 -21.761 1.00 52.32 C ATOM 0 H LEU A 93 3.227 40.020 -19.830 1.00 45.51 H new ATOM 0 HA LEU A 93 2.381 42.721 -20.025 1.00 32.50 H new ATOM 0 HB2 LEU A 93 4.174 40.834 -21.488 1.00 34.34 H new ATOM 0 HB3 LEU A 93 3.621 42.236 -22.382 1.00 34.34 H new ATOM 0 HG LEU A 93 4.483 43.640 -20.412 1.00 44.43 H new ATOM 0 HD11 LEU A 93 6.284 42.602 -19.092 1.00 71.34 H new ATOM 0 HD12 LEU A 93 4.712 41.823 -18.793 1.00 71.34 H new ATOM 0 HD13 LEU A 93 5.915 41.027 -19.835 1.00 71.34 H new ATOM 0 HD21 LEU A 93 6.787 43.597 -21.292 1.00 52.32 H new ATOM 0 HD22 LEU A 93 6.436 42.062 -22.122 1.00 52.32 H new ATOM 0 HD23 LEU A 93 5.581 43.548 -22.599 1.00 52.32 H new ATOM 1425 N ALA A 94 1.140 40.597 -22.236 1.00 23.11 N ATOM 1426 CA ALA A 94 0.065 40.409 -23.202 1.00 1.21 C ATOM 1427 C ALA A 94 -1.282 40.809 -22.609 1.00 23.02 C ATOM 1428 O ALA A 94 -2.127 41.381 -23.296 1.00 71.24 O ATOM 1429 CB ALA A 94 0.027 38.964 -23.675 1.00 63.24 C ATOM 0 H ALA A 94 1.725 39.774 -22.091 1.00 23.11 H new ATOM 0 HA ALA A 94 0.262 41.055 -24.058 1.00 1.21 H new ATOM 0 HB1 ALA A 94 -0.781 38.838 -24.396 1.00 63.24 H new ATOM 0 HB2 ALA A 94 0.977 38.710 -24.146 1.00 63.24 H new ATOM 0 HB3 ALA A 94 -0.142 38.306 -22.822 1.00 63.24 H new ATOM 1435 N GLN A 95 -1.474 40.503 -21.330 1.00 1.43 N ATOM 1436 CA GLN A 95 -2.719 40.830 -20.646 1.00 14.25 C ATOM 1437 C GLN A 95 -3.010 42.325 -20.728 1.00 4.22 C ATOM 1438 O GLN A 95 -4.165 42.746 -20.671 1.00 4.22 O ATOM 1439 CB GLN A 95 -2.652 40.392 -19.182 1.00 31.43 C ATOM 1440 CG GLN A 95 -4.013 40.305 -18.509 1.00 63.13 C ATOM 1441 CD GLN A 95 -4.731 39.005 -18.811 1.00 72.45 C ATOM 1442 OE1 GLN A 95 -4.125 38.042 -19.284 1.00 12.40 O ATOM 1443 NE2 GLN A 95 -6.030 38.969 -18.540 1.00 34.24 N ATOM 0 H GLN A 95 -0.784 40.029 -20.747 1.00 1.43 H new ATOM 0 HA GLN A 95 -3.527 40.293 -21.142 1.00 14.25 H new ATOM 0 HB2 GLN A 95 -2.165 39.419 -19.125 1.00 31.43 H new ATOM 0 HB3 GLN A 95 -2.027 41.094 -18.630 1.00 31.43 H new ATOM 0 HG2 GLN A 95 -3.888 40.405 -17.431 1.00 63.13 H new ATOM 0 HG3 GLN A 95 -4.630 41.141 -18.837 1.00 63.13 H new ATOM 0 HE21 GLN A 95 -6.492 39.790 -18.149 1.00 34.24 H new ATOM 0 HE22 GLN A 95 -6.566 38.121 -18.723 1.00 34.24 H new ATOM 1452 N GLN A 96 -1.954 43.121 -20.862 1.00 1.53 N ATOM 1453 CA GLN A 96 -2.096 44.570 -20.951 1.00 35.13 C ATOM 1454 C GLN A 96 -1.936 45.045 -22.391 1.00 4.32 C ATOM 1455 O GLN A 96 -2.453 46.097 -22.769 1.00 62.45 O ATOM 1456 CB GLN A 96 -1.067 45.261 -20.055 1.00 21.21 C ATOM 1457 CG GLN A 96 -1.609 46.488 -19.339 1.00 61.34 C ATOM 1458 CD GLN A 96 -1.745 47.686 -20.258 1.00 11.23 C ATOM 1459 OE1 GLN A 96 -2.852 48.067 -20.641 1.00 63.50 O ATOM 1460 NE2 GLN A 96 -0.617 48.289 -20.616 1.00 34.00 N ATOM 0 H GLN A 96 -0.991 42.788 -20.911 1.00 1.53 H new ATOM 0 HA GLN A 96 -3.097 44.833 -20.610 1.00 35.13 H new ATOM 0 HB2 GLN A 96 -0.706 44.548 -19.314 1.00 21.21 H new ATOM 0 HB3 GLN A 96 -0.209 45.553 -20.660 1.00 21.21 H new ATOM 0 HG2 GLN A 96 -2.582 46.253 -18.908 1.00 61.34 H new ATOM 0 HG3 GLN A 96 -0.947 46.743 -18.511 1.00 61.34 H new ATOM 0 HE21 GLN A 96 0.279 47.940 -20.275 1.00 34.00 H new ATOM 0 HE22 GLN A 96 -0.646 49.102 -21.232 1.00 34.00 H new ATOM 1469 N TYR A 97 -1.215 44.265 -23.189 1.00 14.20 N ATOM 1470 CA TYR A 97 -0.984 44.608 -24.587 1.00 41.01 C ATOM 1471 C TYR A 97 -1.947 43.855 -25.499 1.00 71.35 C ATOM 1472 O TYR A 97 -1.654 43.618 -26.671 1.00 62.14 O ATOM 1473 CB TYR A 97 0.460 44.292 -24.979 1.00 63.42 C ATOM 1474 CG TYR A 97 1.433 45.403 -24.655 1.00 61.20 C ATOM 1475 CD1 TYR A 97 1.995 45.513 -23.389 1.00 14.42 C ATOM 1476 CD2 TYR A 97 1.790 46.342 -25.614 1.00 41.41 C ATOM 1477 CE1 TYR A 97 2.883 46.527 -23.088 1.00 3.34 C ATOM 1478 CE2 TYR A 97 2.679 47.359 -25.322 1.00 61.33 C ATOM 1479 CZ TYR A 97 3.223 47.447 -24.058 1.00 12.13 C ATOM 1480 OH TYR A 97 4.108 48.459 -23.763 1.00 34.23 O ATOM 0 H TYR A 97 -0.781 43.391 -22.892 1.00 14.20 H new ATOM 0 HA TYR A 97 -1.160 45.677 -24.707 1.00 41.01 H new ATOM 0 HB2 TYR A 97 0.776 43.383 -24.467 1.00 63.42 H new ATOM 0 HB3 TYR A 97 0.500 44.086 -26.049 1.00 63.42 H new ATOM 0 HD1 TYR A 97 1.733 44.793 -22.627 1.00 14.42 H new ATOM 0 HD2 TYR A 97 1.366 46.276 -26.605 1.00 41.41 H new ATOM 0 HE1 TYR A 97 3.309 46.599 -22.098 1.00 3.34 H new ATOM 0 HE2 TYR A 97 2.946 48.081 -26.080 1.00 61.33 H new ATOM 0 HH TYR A 97 4.241 49.019 -24.556 1.00 34.23 H new ATOM 1490 N VAL A 98 -3.100 43.481 -24.953 1.00 23.03 N ATOM 1491 CA VAL A 98 -4.108 42.756 -25.716 1.00 54.01 C ATOM 1492 C VAL A 98 -5.321 43.635 -25.998 1.00 15.42 C ATOM 1493 O VAL A 98 -5.930 43.548 -27.064 1.00 30.22 O ATOM 1494 CB VAL A 98 -4.569 41.487 -24.974 1.00 51.23 C ATOM 1495 CG1 VAL A 98 -5.076 41.836 -23.583 1.00 54.14 C ATOM 1496 CG2 VAL A 98 -5.640 40.762 -25.775 1.00 21.30 C ATOM 0 H VAL A 98 -3.359 43.669 -23.984 1.00 23.03 H new ATOM 0 HA VAL A 98 -3.644 42.468 -26.659 1.00 54.01 H new ATOM 0 HB VAL A 98 -3.714 40.819 -24.866 1.00 51.23 H new ATOM 0 HG11 VAL A 98 -5.397 40.927 -23.074 1.00 54.14 H new ATOM 0 HG12 VAL A 98 -4.276 42.308 -23.012 1.00 54.14 H new ATOM 0 HG13 VAL A 98 -5.918 42.523 -23.664 1.00 54.14 H new ATOM 0 HG21 VAL A 98 -5.954 39.868 -25.236 1.00 21.30 H new ATOM 0 HG22 VAL A 98 -6.497 41.421 -25.916 1.00 21.30 H new ATOM 0 HG23 VAL A 98 -5.237 40.477 -26.747 1.00 21.30 H new ATOM 1506 N MET A 99 -5.667 44.483 -25.035 1.00 12.43 N ATOM 1507 CA MET A 99 -6.807 45.381 -25.180 1.00 74.11 C ATOM 1508 C MET A 99 -6.472 46.539 -26.114 1.00 42.23 C ATOM 1509 O MET A 99 -7.364 47.217 -26.625 1.00 41.32 O ATOM 1510 CB MET A 99 -7.237 45.920 -23.814 1.00 61.13 C ATOM 1511 CG MET A 99 -6.294 46.971 -23.252 1.00 25.44 C ATOM 1512 SD MET A 99 -6.999 48.629 -23.290 1.00 11.43 S ATOM 1513 CE MET A 99 -5.535 49.626 -23.021 1.00 54.23 C ATOM 0 H MET A 99 -5.174 44.567 -24.146 1.00 12.43 H new ATOM 0 HA MET A 99 -7.631 44.814 -25.614 1.00 74.11 H new ATOM 0 HB2 MET A 99 -8.236 46.348 -23.899 1.00 61.13 H new ATOM 0 HB3 MET A 99 -7.305 45.091 -23.110 1.00 61.13 H new ATOM 0 HG2 MET A 99 -6.039 46.712 -22.224 1.00 25.44 H new ATOM 0 HG3 MET A 99 -5.365 46.962 -23.822 1.00 25.44 H new ATOM 0 HE1 MET A 99 -5.666 50.230 -22.123 1.00 54.23 H new ATOM 0 HE2 MET A 99 -4.669 48.975 -22.897 1.00 54.23 H new ATOM 0 HE3 MET A 99 -5.377 50.280 -23.879 1.00 54.23 H new ATOM 1523 N THR A 100 -5.180 46.762 -26.334 1.00 25.52 N ATOM 1524 CA THR A 100 -4.727 47.838 -27.205 1.00 5.41 C ATOM 1525 C THR A 100 -4.880 47.459 -28.673 1.00 51.24 C ATOM 1526 O THR A 100 -5.769 47.958 -29.364 1.00 2.25 O ATOM 1527 CB THR A 100 -3.255 48.201 -26.931 1.00 64.13 C ATOM 1528 OG1 THR A 100 -2.601 47.120 -26.256 1.00 53.22 O ATOM 1529 CG2 THR A 100 -3.156 49.465 -26.090 1.00 62.42 C ATOM 0 H THR A 100 -4.428 46.210 -25.920 1.00 25.52 H new ATOM 0 HA THR A 100 -5.353 48.704 -26.989 1.00 5.41 H new ATOM 0 HB THR A 100 -2.765 48.381 -27.888 1.00 64.13 H new ATOM 0 HG1 THR A 100 -1.665 47.358 -26.087 1.00 53.22 H new ATOM 0 HG21 THR A 100 -2.107 49.701 -25.910 1.00 62.42 H new ATOM 0 HG22 THR A 100 -3.628 50.292 -26.620 1.00 62.42 H new ATOM 0 HG23 THR A 100 -3.662 49.309 -25.137 1.00 62.42 H new ATOM 1537 N SER A 101 -4.009 46.573 -29.145 1.00 41.12 N ATOM 1538 CA SER A 101 -4.046 46.129 -30.534 1.00 12.13 C ATOM 1539 C SER A 101 -2.948 45.106 -30.807 1.00 5.33 C ATOM 1540 O SER A 101 -3.131 44.175 -31.591 1.00 72.24 O ATOM 1541 CB SER A 101 -3.893 47.323 -31.477 1.00 42.44 C ATOM 1542 OG SER A 101 -3.155 48.366 -30.864 1.00 41.33 O ATOM 0 H SER A 101 -3.269 46.148 -28.586 1.00 41.12 H new ATOM 0 HA SER A 101 -5.011 45.656 -30.713 1.00 12.13 H new ATOM 0 HB2 SER A 101 -3.391 47.006 -32.391 1.00 42.44 H new ATOM 0 HB3 SER A 101 -4.878 47.691 -31.766 1.00 42.44 H new ATOM 0 HG SER A 101 -3.070 49.117 -31.488 1.00 41.33 H new ATOM 1548 N LEU A 102 -1.805 45.287 -30.154 1.00 21.33 N ATOM 1549 CA LEU A 102 -0.675 44.380 -30.325 1.00 4.34 C ATOM 1550 C LEU A 102 -0.898 43.081 -29.557 1.00 63.04 C ATOM 1551 O LEU A 102 -0.162 42.768 -28.622 1.00 64.22 O ATOM 1552 CB LEU A 102 0.617 45.050 -29.852 1.00 62.52 C ATOM 1553 CG LEU A 102 0.839 46.488 -30.322 1.00 35.23 C ATOM 1554 CD1 LEU A 102 2.195 46.997 -29.860 1.00 11.42 C ATOM 1555 CD2 LEU A 102 0.720 46.579 -31.836 1.00 61.41 C ATOM 0 H LEU A 102 -1.636 46.053 -29.502 1.00 21.33 H new ATOM 0 HA LEU A 102 -0.588 44.143 -31.385 1.00 4.34 H new ATOM 0 HB2 LEU A 102 0.630 45.039 -28.762 1.00 62.52 H new ATOM 0 HB3 LEU A 102 1.460 44.445 -30.187 1.00 62.52 H new ATOM 0 HG LEU A 102 0.068 47.118 -29.879 1.00 35.23 H new ATOM 0 HD11 LEU A 102 2.335 48.022 -30.204 1.00 11.42 H new ATOM 0 HD12 LEU A 102 2.242 46.970 -28.771 1.00 11.42 H new ATOM 0 HD13 LEU A 102 2.981 46.365 -30.273 1.00 11.42 H new ATOM 0 HD21 LEU A 102 0.881 47.610 -32.152 1.00 61.41 H new ATOM 0 HD22 LEU A 102 1.469 45.936 -32.299 1.00 61.41 H new ATOM 0 HD23 LEU A 102 -0.275 46.256 -32.143 1.00 61.41 H new ATOM 1567 N GLN A 103 -1.916 42.329 -29.961 1.00 72.32 N ATOM 1568 CA GLN A 103 -2.235 41.062 -29.312 1.00 45.41 C ATOM 1569 C GLN A 103 -1.610 39.893 -30.065 1.00 24.50 C ATOM 1570 O GLN A 103 -0.885 39.085 -29.484 1.00 11.11 O ATOM 1571 CB GLN A 103 -3.750 40.877 -29.225 1.00 33.33 C ATOM 1572 CG GLN A 103 -4.166 39.533 -28.649 1.00 35.13 C ATOM 1573 CD GLN A 103 -5.669 39.329 -28.669 1.00 5.21 C ATOM 1574 OE1 GLN A 103 -6.393 40.035 -29.372 1.00 21.34 O ATOM 1575 NE2 GLN A 103 -6.145 38.360 -27.896 1.00 13.30 N ATOM 0 H GLN A 103 -2.534 42.574 -30.734 1.00 72.32 H new ATOM 0 HA GLN A 103 -1.821 41.084 -28.304 1.00 45.41 H new ATOM 0 HB2 GLN A 103 -4.170 41.673 -28.610 1.00 33.33 H new ATOM 0 HB3 GLN A 103 -4.179 40.984 -30.221 1.00 33.33 H new ATOM 0 HG2 GLN A 103 -3.687 38.735 -29.217 1.00 35.13 H new ATOM 0 HG3 GLN A 103 -3.806 39.455 -27.623 1.00 35.13 H new ATOM 0 HE21 GLN A 103 -5.508 37.800 -27.330 1.00 13.30 H new ATOM 0 HE22 GLN A 103 -7.148 38.176 -27.868 1.00 13.30 H new ATOM 1584 N GLN A 104 -1.896 39.808 -31.360 1.00 44.32 N ATOM 1585 CA GLN A 104 -1.362 38.736 -32.192 1.00 21.13 C ATOM 1586 C GLN A 104 0.152 38.629 -32.037 1.00 35.22 C ATOM 1587 O GLN A 104 0.713 37.535 -32.084 1.00 44.24 O ATOM 1588 CB GLN A 104 -1.721 38.973 -33.660 1.00 3.44 C ATOM 1589 CG GLN A 104 -1.497 40.406 -34.116 1.00 62.15 C ATOM 1590 CD GLN A 104 -0.965 40.490 -35.534 1.00 15.12 C ATOM 1591 OE1 GLN A 104 -1.097 39.548 -36.315 1.00 64.53 O ATOM 1592 NE2 GLN A 104 -0.361 41.623 -35.874 1.00 33.34 N ATOM 0 H GLN A 104 -2.494 40.469 -31.856 1.00 44.32 H new ATOM 0 HA GLN A 104 -1.810 37.798 -31.863 1.00 21.13 H new ATOM 0 HB2 GLN A 104 -1.127 38.305 -34.283 1.00 3.44 H new ATOM 0 HB3 GLN A 104 -2.767 38.710 -33.817 1.00 3.44 H new ATOM 0 HG2 GLN A 104 -2.436 40.955 -34.051 1.00 62.15 H new ATOM 0 HG3 GLN A 104 -0.795 40.893 -33.439 1.00 62.15 H new ATOM 0 HE21 GLN A 104 -0.274 42.378 -35.194 1.00 33.34 H new ATOM 0 HE22 GLN A 104 0.016 41.738 -36.815 1.00 33.34 H new ATOM 1601 N GLU A 105 0.805 39.772 -31.852 1.00 31.34 N ATOM 1602 CA GLU A 105 2.254 39.805 -31.691 1.00 51.11 C ATOM 1603 C GLU A 105 2.705 38.822 -30.615 1.00 72.50 C ATOM 1604 O GLU A 105 3.470 37.896 -30.886 1.00 44.11 O ATOM 1605 CB GLU A 105 2.717 41.218 -31.332 1.00 41.51 C ATOM 1606 CG GLU A 105 4.225 41.349 -31.199 1.00 10.34 C ATOM 1607 CD GLU A 105 4.649 41.832 -29.825 1.00 43.53 C ATOM 1608 OE1 GLU A 105 4.062 42.819 -29.335 1.00 41.43 O ATOM 1609 OE2 GLU A 105 5.569 41.223 -29.241 1.00 22.43 O ATOM 0 H GLU A 105 0.354 40.686 -31.810 1.00 31.34 H new ATOM 0 HA GLU A 105 2.706 39.512 -32.639 1.00 51.11 H new ATOM 0 HB2 GLU A 105 2.367 41.911 -32.097 1.00 41.51 H new ATOM 0 HB3 GLU A 105 2.251 41.517 -30.393 1.00 41.51 H new ATOM 0 HG2 GLU A 105 4.689 40.383 -31.400 1.00 10.34 H new ATOM 0 HG3 GLU A 105 4.594 42.043 -31.954 1.00 10.34 H new ATOM 1616 N TYR A 106 2.225 39.029 -29.394 1.00 3.31 N ATOM 1617 CA TYR A 106 2.581 38.164 -28.276 1.00 32.34 C ATOM 1618 C TYR A 106 2.228 36.711 -28.578 1.00 64.52 C ATOM 1619 O TYR A 106 2.885 35.786 -28.097 1.00 54.50 O ATOM 1620 CB TYR A 106 1.865 38.619 -27.003 1.00 51.51 C ATOM 1621 CG TYR A 106 1.823 37.564 -25.921 1.00 53.11 C ATOM 1622 CD1 TYR A 106 2.838 37.468 -24.978 1.00 24.42 C ATOM 1623 CD2 TYR A 106 0.768 36.663 -25.842 1.00 41.25 C ATOM 1624 CE1 TYR A 106 2.805 36.505 -23.988 1.00 34.42 C ATOM 1625 CE2 TYR A 106 0.725 35.698 -24.855 1.00 42.01 C ATOM 1626 CZ TYR A 106 1.746 35.623 -23.930 1.00 72.43 C ATOM 1627 OH TYR A 106 1.707 34.662 -22.946 1.00 65.41 O ATOM 0 H TYR A 106 1.588 39.789 -29.153 1.00 3.31 H new ATOM 0 HA TYR A 106 3.658 38.234 -28.124 1.00 32.34 H new ATOM 0 HB2 TYR A 106 2.363 39.507 -26.614 1.00 51.51 H new ATOM 0 HB3 TYR A 106 0.845 38.910 -27.254 1.00 51.51 H new ATOM 0 HD1 TYR A 106 3.668 38.158 -25.019 1.00 24.42 H new ATOM 0 HD2 TYR A 106 -0.032 36.718 -26.565 1.00 41.25 H new ATOM 0 HE1 TYR A 106 3.604 36.443 -23.264 1.00 34.42 H new ATOM 0 HE2 TYR A 106 -0.103 35.006 -24.807 1.00 42.01 H new ATOM 0 HH TYR A 106 0.914 34.798 -22.387 1.00 65.41 H new ATOM 1637 N LYS A 107 1.187 36.516 -29.380 1.00 61.22 N ATOM 1638 CA LYS A 107 0.746 35.176 -29.751 1.00 11.43 C ATOM 1639 C LYS A 107 1.833 34.441 -30.528 1.00 52.34 C ATOM 1640 O LYS A 107 2.071 33.253 -30.310 1.00 42.24 O ATOM 1641 CB LYS A 107 -0.533 35.252 -30.588 1.00 22.30 C ATOM 1642 CG LYS A 107 -1.324 33.955 -30.608 1.00 11.32 C ATOM 1643 CD LYS A 107 -1.475 33.416 -32.020 1.00 74.12 C ATOM 1644 CE LYS A 107 -2.226 34.393 -32.913 1.00 23.25 C ATOM 1645 NZ LYS A 107 -1.355 34.943 -33.988 1.00 2.11 N ATOM 0 H LYS A 107 0.632 37.269 -29.786 1.00 61.22 H new ATOM 0 HA LYS A 107 0.541 34.621 -28.836 1.00 11.43 H new ATOM 0 HB2 LYS A 107 -1.166 36.048 -30.197 1.00 22.30 H new ATOM 0 HB3 LYS A 107 -0.273 35.525 -31.611 1.00 22.30 H new ATOM 0 HG2 LYS A 107 -0.824 33.213 -29.986 1.00 11.32 H new ATOM 0 HG3 LYS A 107 -2.310 34.122 -30.174 1.00 11.32 H new ATOM 0 HD2 LYS A 107 -0.490 33.219 -32.443 1.00 74.12 H new ATOM 0 HD3 LYS A 107 -2.006 32.465 -31.992 1.00 74.12 H new ATOM 0 HE2 LYS A 107 -3.083 33.890 -33.361 1.00 23.25 H new ATOM 0 HE3 LYS A 107 -2.617 35.211 -32.308 1.00 23.25 H new ATOM 0 HZ1 LYS A 107 -1.651 35.915 -34.211 1.00 2.11 H new ATOM 0 HZ2 LYS A 107 -0.366 34.947 -33.665 1.00 2.11 H new ATOM 0 HZ3 LYS A 107 -1.439 34.351 -34.839 1.00 2.11 H new ATOM 1659 N LYS A 108 2.491 35.155 -31.436 1.00 14.45 N ATOM 1660 CA LYS A 108 3.555 34.572 -32.244 1.00 54.53 C ATOM 1661 C LYS A 108 4.711 34.105 -31.367 1.00 4.44 C ATOM 1662 O LYS A 108 5.076 32.930 -31.379 1.00 73.01 O ATOM 1663 CB LYS A 108 4.058 35.589 -33.271 1.00 50.23 C ATOM 1664 CG LYS A 108 4.121 35.043 -34.687 1.00 42.12 C ATOM 1665 CD LYS A 108 5.124 35.807 -35.535 1.00 42.23 C ATOM 1666 CE LYS A 108 4.698 35.856 -36.995 1.00 32.55 C ATOM 1667 NZ LYS A 108 5.844 36.154 -37.898 1.00 32.44 N ATOM 0 H LYS A 108 2.305 36.139 -31.630 1.00 14.45 H new ATOM 0 HA LYS A 108 3.148 33.707 -32.767 1.00 54.53 H new ATOM 0 HB2 LYS A 108 3.405 36.462 -33.256 1.00 50.23 H new ATOM 0 HB3 LYS A 108 5.051 35.929 -32.977 1.00 50.23 H new ATOM 0 HG2 LYS A 108 4.395 33.988 -34.659 1.00 42.12 H new ATOM 0 HG3 LYS A 108 3.134 35.104 -35.146 1.00 42.12 H new ATOM 0 HD2 LYS A 108 5.228 36.822 -35.151 1.00 42.23 H new ATOM 0 HD3 LYS A 108 6.103 35.334 -35.456 1.00 42.23 H new ATOM 0 HE2 LYS A 108 4.253 34.901 -37.276 1.00 32.55 H new ATOM 0 HE3 LYS A 108 3.928 36.616 -37.123 1.00 32.55 H new ATOM 0 HZ1 LYS A 108 5.512 36.179 -38.883 1.00 32.44 H new ATOM 0 HZ2 LYS A 108 6.253 37.077 -37.647 1.00 32.44 H new ATOM 0 HZ3 LYS A 108 6.568 35.415 -37.795 1.00 32.44 H new ATOM 1681 N GLN A 109 5.283 35.033 -30.606 1.00 0.14 N ATOM 1682 CA GLN A 109 6.398 34.715 -29.721 1.00 71.34 C ATOM 1683 C GLN A 109 5.995 33.661 -28.695 1.00 51.10 C ATOM 1684 O GLN A 109 6.742 32.719 -28.433 1.00 75.41 O ATOM 1685 CB GLN A 109 6.888 35.977 -29.009 1.00 71.41 C ATOM 1686 CG GLN A 109 5.794 36.710 -28.250 1.00 50.53 C ATOM 1687 CD GLN A 109 6.142 38.162 -27.984 1.00 34.23 C ATOM 1688 OE1 GLN A 109 6.798 38.814 -28.796 1.00 52.30 O ATOM 1689 NE2 GLN A 109 5.702 38.676 -26.841 1.00 22.21 N ATOM 0 H GLN A 109 4.993 36.011 -30.584 1.00 0.14 H new ATOM 0 HA GLN A 109 7.208 34.312 -30.329 1.00 71.34 H new ATOM 0 HB2 GLN A 109 7.683 35.707 -28.314 1.00 71.41 H new ATOM 0 HB3 GLN A 109 7.324 36.653 -29.744 1.00 71.41 H new ATOM 0 HG2 GLN A 109 4.866 36.661 -28.820 1.00 50.53 H new ATOM 0 HG3 GLN A 109 5.613 36.204 -27.302 1.00 50.53 H new ATOM 0 HE21 GLN A 109 5.161 38.099 -26.197 1.00 22.21 H new ATOM 0 HE22 GLN A 109 5.905 39.648 -26.607 1.00 22.21 H new ATOM 1698 N MET A 110 4.810 33.828 -28.117 1.00 11.00 N ATOM 1699 CA MET A 110 4.308 32.890 -27.119 1.00 52.24 C ATOM 1700 C MET A 110 4.375 31.457 -27.638 1.00 52.31 C ATOM 1701 O MET A 110 4.903 30.568 -26.969 1.00 11.20 O ATOM 1702 CB MET A 110 2.868 33.240 -26.738 1.00 40.34 C ATOM 1703 CG MET A 110 2.294 32.348 -25.650 1.00 15.32 C ATOM 1704 SD MET A 110 0.615 31.800 -26.015 1.00 11.43 S ATOM 1705 CE MET A 110 0.900 30.077 -26.411 1.00 31.15 C ATOM 0 H MET A 110 4.180 34.603 -28.322 1.00 11.00 H new ATOM 0 HA MET A 110 4.939 32.967 -26.234 1.00 52.24 H new ATOM 0 HB2 MET A 110 2.831 34.277 -26.404 1.00 40.34 H new ATOM 0 HB3 MET A 110 2.238 33.168 -27.625 1.00 40.34 H new ATOM 0 HG2 MET A 110 2.937 31.477 -25.523 1.00 15.32 H new ATOM 0 HG3 MET A 110 2.298 32.888 -24.703 1.00 15.32 H new ATOM 0 HE1 MET A 110 0.021 29.668 -26.910 1.00 31.15 H new ATOM 0 HE2 MET A 110 1.763 29.993 -27.071 1.00 31.15 H new ATOM 0 HE3 MET A 110 1.089 29.519 -25.494 1.00 31.15 H new ATOM 1715 N LEU A 111 3.837 31.240 -28.833 1.00 35.31 N ATOM 1716 CA LEU A 111 3.835 29.914 -29.441 1.00 61.24 C ATOM 1717 C LEU A 111 5.250 29.351 -29.525 1.00 4.34 C ATOM 1718 O LEU A 111 5.479 28.173 -29.251 1.00 24.42 O ATOM 1719 CB LEU A 111 3.215 29.973 -30.838 1.00 74.14 C ATOM 1720 CG LEU A 111 2.460 28.722 -31.291 1.00 51.50 C ATOM 1721 CD1 LEU A 111 2.133 28.804 -32.774 1.00 60.20 C ATOM 1722 CD2 LEU A 111 3.272 27.471 -30.990 1.00 11.21 C ATOM 0 H LEU A 111 3.397 31.965 -29.400 1.00 35.31 H new ATOM 0 HA LEU A 111 3.238 29.254 -28.812 1.00 61.24 H new ATOM 0 HB2 LEU A 111 2.529 30.820 -30.874 1.00 74.14 H new ATOM 0 HB3 LEU A 111 4.008 30.175 -31.558 1.00 74.14 H new ATOM 0 HG LEU A 111 1.523 28.665 -30.736 1.00 51.50 H new ATOM 0 HD11 LEU A 111 1.596 27.906 -33.078 1.00 60.20 H new ATOM 0 HD12 LEU A 111 1.511 29.679 -32.962 1.00 60.20 H new ATOM 0 HD13 LEU A 111 3.057 28.886 -33.346 1.00 60.20 H new ATOM 0 HD21 LEU A 111 2.720 26.591 -31.319 1.00 11.21 H new ATOM 0 HD22 LEU A 111 4.225 27.520 -31.518 1.00 11.21 H new ATOM 0 HD23 LEU A 111 3.454 27.405 -29.917 1.00 11.21 H new ATOM 1734 N THR A 112 6.199 30.203 -29.903 1.00 20.35 N ATOM 1735 CA THR A 112 7.592 29.792 -30.021 1.00 22.44 C ATOM 1736 C THR A 112 8.069 29.092 -28.753 1.00 15.45 C ATOM 1737 O THR A 112 8.552 27.962 -28.800 1.00 70.21 O ATOM 1738 CB THR A 112 8.511 30.995 -30.306 1.00 32.32 C ATOM 1739 OG1 THR A 112 8.030 31.719 -31.444 1.00 24.20 O ATOM 1740 CG2 THR A 112 9.940 30.537 -30.556 1.00 11.24 C ATOM 0 H THR A 112 6.027 31.182 -30.132 1.00 20.35 H new ATOM 0 HA THR A 112 7.646 29.097 -30.859 1.00 22.44 H new ATOM 0 HB THR A 112 8.503 31.646 -29.432 1.00 32.32 H new ATOM 0 HG1 THR A 112 8.618 32.483 -31.618 1.00 24.20 H new ATOM 0 HG21 THR A 112 10.570 31.404 -30.755 1.00 11.24 H new ATOM 0 HG22 THR A 112 10.313 30.011 -29.677 1.00 11.24 H new ATOM 0 HG23 THR A 112 9.962 29.867 -31.416 1.00 11.24 H new ATOM 1748 N ALA A 113 7.928 29.772 -27.619 1.00 41.22 N ATOM 1749 CA ALA A 113 8.342 29.215 -26.338 1.00 32.54 C ATOM 1750 C ALA A 113 7.575 27.934 -26.023 1.00 3.41 C ATOM 1751 O ALA A 113 8.172 26.889 -25.768 1.00 65.13 O ATOM 1752 CB ALA A 113 8.143 30.237 -25.228 1.00 65.04 C ATOM 0 H ALA A 113 7.530 30.709 -27.562 1.00 41.22 H new ATOM 0 HA ALA A 113 9.402 28.967 -26.403 1.00 32.54 H new ATOM 0 HB1 ALA A 113 8.457 29.807 -24.277 1.00 65.04 H new ATOM 0 HB2 ALA A 113 8.740 31.124 -25.439 1.00 65.04 H new ATOM 0 HB3 ALA A 113 7.090 30.513 -25.172 1.00 65.04 H new ATOM 1758 N ALA A 114 6.249 28.024 -26.042 1.00 5.34 N ATOM 1759 CA ALA A 114 5.402 26.873 -25.759 1.00 73.44 C ATOM 1760 C ALA A 114 5.762 25.693 -26.655 1.00 65.35 C ATOM 1761 O ALA A 114 5.578 24.535 -26.279 1.00 35.11 O ATOM 1762 CB ALA A 114 3.936 27.241 -25.933 1.00 52.24 C ATOM 0 H ALA A 114 5.739 28.882 -26.250 1.00 5.34 H new ATOM 0 HA ALA A 114 5.571 26.575 -24.724 1.00 73.44 H new ATOM 0 HB1 ALA A 114 3.315 26.372 -25.718 1.00 52.24 H new ATOM 0 HB2 ALA A 114 3.680 28.048 -25.247 1.00 52.24 H new ATOM 0 HB3 ALA A 114 3.762 27.567 -26.958 1.00 52.24 H new ATOM 1768 N HIS A 115 6.278 25.993 -27.843 1.00 54.44 N ATOM 1769 CA HIS A 115 6.664 24.957 -28.794 1.00 23.43 C ATOM 1770 C HIS A 115 7.795 24.100 -28.232 1.00 61.35 C ATOM 1771 O HIS A 115 7.660 22.883 -28.103 1.00 15.50 O ATOM 1772 CB HIS A 115 7.095 25.585 -30.119 1.00 53.04 C ATOM 1773 CG HIS A 115 7.170 24.606 -31.250 1.00 20.40 C ATOM 1774 ND1 HIS A 115 6.169 24.460 -32.187 1.00 62.42 N ATOM 1775 CD2 HIS A 115 8.136 23.721 -31.592 1.00 51.22 C ATOM 1776 CE1 HIS A 115 6.515 23.527 -33.056 1.00 23.40 C ATOM 1777 NE2 HIS A 115 7.705 23.063 -32.718 1.00 31.24 N ATOM 0 H HIS A 115 6.438 26.946 -28.170 1.00 54.44 H new ATOM 0 HA HIS A 115 5.798 24.318 -28.969 1.00 23.43 H new ATOM 0 HB2 HIS A 115 6.394 26.377 -30.381 1.00 53.04 H new ATOM 0 HB3 HIS A 115 8.071 26.053 -29.989 1.00 53.04 H new ATOM 0 HD2 HIS A 115 9.071 23.562 -31.076 1.00 51.22 H new ATOM 0 HE1 HIS A 115 5.925 23.199 -33.899 1.00 23.40 H new ATOM 0 HE2 HIS A 115 8.220 22.335 -33.213 1.00 31.24 H new ATOM 1785 N ALA A 116 8.910 24.743 -27.902 1.00 22.30 N ATOM 1786 CA ALA A 116 10.064 24.040 -27.354 1.00 35.21 C ATOM 1787 C ALA A 116 9.751 23.461 -25.978 1.00 74.44 C ATOM 1788 O ALA A 116 10.223 22.379 -25.627 1.00 23.13 O ATOM 1789 CB ALA A 116 11.262 24.974 -27.275 1.00 63.53 C ATOM 0 H ALA A 116 9.039 25.750 -28.004 1.00 22.30 H new ATOM 0 HA ALA A 116 10.305 23.213 -28.022 1.00 35.21 H new ATOM 0 HB1 ALA A 116 12.116 24.436 -26.864 1.00 63.53 H new ATOM 0 HB2 ALA A 116 11.507 25.336 -28.273 1.00 63.53 H new ATOM 0 HB3 ALA A 116 11.022 25.820 -26.631 1.00 63.53 H new ATOM 1795 N LEU A 117 8.952 24.187 -25.204 1.00 23.34 N ATOM 1796 CA LEU A 117 8.577 23.745 -23.865 1.00 75.00 C ATOM 1797 C LEU A 117 7.848 22.406 -23.918 1.00 21.20 C ATOM 1798 O LEU A 117 8.234 21.451 -23.244 1.00 40.21 O ATOM 1799 CB LEU A 117 7.691 24.794 -23.190 1.00 72.14 C ATOM 1800 CG LEU A 117 7.779 24.867 -21.666 1.00 21.44 C ATOM 1801 CD1 LEU A 117 7.304 23.564 -21.041 1.00 2.03 C ATOM 1802 CD2 LEU A 117 9.202 25.182 -21.228 1.00 41.43 C ATOM 0 H LEU A 117 8.552 25.084 -25.480 1.00 23.34 H new ATOM 0 HA LEU A 117 9.489 23.619 -23.282 1.00 75.00 H new ATOM 0 HB2 LEU A 117 7.948 25.773 -23.596 1.00 72.14 H new ATOM 0 HB3 LEU A 117 6.655 24.597 -23.465 1.00 72.14 H new ATOM 0 HG LEU A 117 7.128 25.671 -21.322 1.00 21.44 H new ATOM 0 HD11 LEU A 117 7.374 23.634 -19.956 1.00 2.03 H new ATOM 0 HD12 LEU A 117 6.268 23.380 -21.327 1.00 2.03 H new ATOM 0 HD13 LEU A 117 7.929 22.743 -21.392 1.00 2.03 H new ATOM 0 HD21 LEU A 117 9.246 25.230 -20.140 1.00 41.43 H new ATOM 0 HD22 LEU A 117 9.874 24.401 -21.584 1.00 41.43 H new ATOM 0 HD23 LEU A 117 9.507 26.141 -21.646 1.00 41.43 H new ATOM 1814 N ALA A 118 6.794 22.343 -24.725 1.00 21.11 N ATOM 1815 CA ALA A 118 6.014 21.120 -24.869 1.00 65.23 C ATOM 1816 C ALA A 118 6.913 19.931 -25.191 1.00 23.45 C ATOM 1817 O ALA A 118 6.837 18.888 -24.540 1.00 1.32 O ATOM 1818 CB ALA A 118 4.957 21.292 -25.950 1.00 45.21 C ATOM 0 H ALA A 118 6.461 23.125 -25.289 1.00 21.11 H new ATOM 0 HA ALA A 118 5.518 20.921 -23.919 1.00 65.23 H new ATOM 0 HB1 ALA A 118 4.382 20.371 -26.047 1.00 45.21 H new ATOM 0 HB2 ALA A 118 4.289 22.110 -25.679 1.00 45.21 H new ATOM 0 HB3 ALA A 118 5.441 21.519 -26.900 1.00 45.21 H new ATOM 1824 N VAL A 119 7.764 20.093 -26.199 1.00 3.13 N ATOM 1825 CA VAL A 119 8.678 19.033 -26.606 1.00 62.31 C ATOM 1826 C VAL A 119 9.643 18.677 -25.481 1.00 64.30 C ATOM 1827 O VAL A 119 10.014 17.515 -25.311 1.00 73.13 O ATOM 1828 CB VAL A 119 9.487 19.437 -27.853 1.00 2.32 C ATOM 1829 CG1 VAL A 119 10.452 18.329 -28.246 1.00 43.31 C ATOM 1830 CG2 VAL A 119 8.554 19.777 -29.005 1.00 45.15 C ATOM 0 H VAL A 119 7.839 20.949 -26.749 1.00 3.13 H new ATOM 0 HA VAL A 119 8.067 18.163 -26.845 1.00 62.31 H new ATOM 0 HB VAL A 119 10.071 20.326 -27.614 1.00 2.32 H new ATOM 0 HG11 VAL A 119 11.015 18.633 -29.129 1.00 43.31 H new ATOM 0 HG12 VAL A 119 11.142 18.139 -27.424 1.00 43.31 H new ATOM 0 HG13 VAL A 119 9.892 17.420 -28.467 1.00 43.31 H new ATOM 0 HG21 VAL A 119 9.142 20.060 -29.878 1.00 45.15 H new ATOM 0 HG22 VAL A 119 7.942 18.908 -29.246 1.00 45.15 H new ATOM 0 HG23 VAL A 119 7.908 20.607 -28.718 1.00 45.15 H new ATOM 1840 N ASP A 120 10.047 19.684 -24.714 1.00 71.25 N ATOM 1841 CA ASP A 120 10.968 19.477 -23.603 1.00 44.32 C ATOM 1842 C ASP A 120 10.355 18.558 -22.552 1.00 14.12 C ATOM 1843 O ASP A 120 10.957 17.560 -22.158 1.00 21.00 O ATOM 1844 CB ASP A 120 11.345 20.817 -22.970 1.00 3.44 C ATOM 1845 CG ASP A 120 12.788 20.853 -22.506 1.00 2.11 C ATOM 1846 OD1 ASP A 120 13.223 19.886 -21.847 1.00 22.03 O ATOM 1847 OD2 ASP A 120 13.482 21.849 -22.801 1.00 63.33 O ATOM 0 H ASP A 120 9.751 20.652 -24.842 1.00 71.25 H new ATOM 0 HA ASP A 120 11.868 19.002 -23.993 1.00 44.32 H new ATOM 0 HB2 ASP A 120 11.179 21.616 -23.692 1.00 3.44 H new ATOM 0 HB3 ASP A 120 10.689 21.012 -22.122 1.00 3.44 H new ATOM 1852 N ALA A 121 9.153 18.903 -22.101 1.00 31.22 N ATOM 1853 CA ALA A 121 8.457 18.108 -21.096 1.00 43.40 C ATOM 1854 C ALA A 121 8.396 16.640 -21.503 1.00 3.02 C ATOM 1855 O ALA A 121 8.558 15.747 -20.671 1.00 14.03 O ATOM 1856 CB ALA A 121 7.055 18.654 -20.870 1.00 2.13 C ATOM 0 H ALA A 121 8.641 19.727 -22.416 1.00 31.22 H new ATOM 0 HA ALA A 121 9.016 18.176 -20.163 1.00 43.40 H new ATOM 0 HB1 ALA A 121 6.547 18.051 -20.117 1.00 2.13 H new ATOM 0 HB2 ALA A 121 7.118 19.686 -20.526 1.00 2.13 H new ATOM 0 HB3 ALA A 121 6.495 18.616 -21.804 1.00 2.13 H new ATOM 1862 N LYS A 122 8.162 16.396 -22.788 1.00 14.23 N ATOM 1863 CA LYS A 122 8.080 15.036 -23.306 1.00 75.12 C ATOM 1864 C LYS A 122 9.465 14.406 -23.404 1.00 45.30 C ATOM 1865 O LYS A 122 9.671 13.268 -22.985 1.00 2.21 O ATOM 1866 CB LYS A 122 7.408 15.032 -24.681 1.00 72.03 C ATOM 1867 CG LYS A 122 7.222 13.641 -25.264 1.00 1.45 C ATOM 1868 CD LYS A 122 8.430 13.213 -26.080 1.00 72.10 C ATOM 1869 CE LYS A 122 8.103 12.032 -26.981 1.00 53.34 C ATOM 1870 NZ LYS A 122 7.385 12.458 -28.215 1.00 4.30 N ATOM 0 H LYS A 122 8.026 17.123 -23.490 1.00 14.23 H new ATOM 0 HA LYS A 122 7.480 14.446 -22.613 1.00 75.12 H new ATOM 0 HB2 LYS A 122 6.435 15.517 -24.602 1.00 72.03 H new ATOM 0 HB3 LYS A 122 8.006 15.629 -25.370 1.00 72.03 H new ATOM 0 HG2 LYS A 122 7.055 12.927 -24.458 1.00 1.45 H new ATOM 0 HG3 LYS A 122 6.332 13.625 -25.893 1.00 1.45 H new ATOM 0 HD2 LYS A 122 8.776 14.050 -26.686 1.00 72.10 H new ATOM 0 HD3 LYS A 122 9.247 12.946 -25.410 1.00 72.10 H new ATOM 0 HE2 LYS A 122 9.024 11.519 -27.256 1.00 53.34 H new ATOM 0 HE3 LYS A 122 7.490 11.316 -26.433 1.00 53.34 H new ATOM 0 HZ1 LYS A 122 7.180 11.625 -28.803 1.00 4.30 H new ATOM 0 HZ2 LYS A 122 6.493 12.925 -27.954 1.00 4.30 H new ATOM 0 HZ3 LYS A 122 7.980 13.122 -28.751 1.00 4.30 H new ATOM 1884 N ASN A 123 10.413 15.155 -23.959 1.00 11.31 N ATOM 1885 CA ASN A 123 11.780 14.670 -24.110 1.00 51.25 C ATOM 1886 C ASN A 123 12.358 14.242 -22.765 1.00 15.22 C ATOM 1887 O ASN A 123 13.189 13.336 -22.693 1.00 74.25 O ATOM 1888 CB ASN A 123 12.661 15.754 -24.735 1.00 63.42 C ATOM 1889 CG ASN A 123 14.030 15.231 -25.128 1.00 34.54 C ATOM 1890 OD1 ASN A 123 14.157 14.419 -26.045 1.00 13.31 O ATOM 1891 ND2 ASN A 123 15.062 15.694 -24.432 1.00 73.03 N ATOM 0 H ASN A 123 10.259 16.100 -24.311 1.00 11.31 H new ATOM 0 HA ASN A 123 11.760 13.802 -24.769 1.00 51.25 H new ATOM 0 HB2 ASN A 123 12.163 16.160 -25.616 1.00 63.42 H new ATOM 0 HB3 ASN A 123 12.778 16.576 -24.028 1.00 63.42 H new ATOM 0 HD21 ASN A 123 16.007 15.377 -24.649 1.00 73.03 H new ATOM 0 HD22 ASN A 123 14.910 16.366 -23.680 1.00 73.03 H new ATOM 1898 N LEU A 124 11.912 14.899 -21.700 1.00 13.50 N ATOM 1899 CA LEU A 124 12.383 14.587 -20.355 1.00 43.23 C ATOM 1900 C LEU A 124 12.258 13.095 -20.067 1.00 61.53 C ATOM 1901 O LEU A 124 13.245 12.426 -19.756 1.00 11.43 O ATOM 1902 CB LEU A 124 11.593 15.386 -19.318 1.00 11.51 C ATOM 1903 CG LEU A 124 12.386 16.425 -18.524 1.00 41.21 C ATOM 1904 CD1 LEU A 124 13.416 15.745 -17.635 1.00 15.22 C ATOM 1905 CD2 LEU A 124 13.060 17.414 -19.464 1.00 64.32 C ATOM 0 H LEU A 124 11.225 15.651 -21.742 1.00 13.50 H new ATOM 0 HA LEU A 124 13.435 14.864 -20.292 1.00 43.23 H new ATOM 0 HB2 LEU A 124 10.774 15.895 -19.827 1.00 11.51 H new ATOM 0 HB3 LEU A 124 11.144 14.685 -18.614 1.00 11.51 H new ATOM 0 HG LEU A 124 11.693 16.974 -17.887 1.00 41.21 H new ATOM 0 HD11 LEU A 124 13.971 16.500 -17.078 1.00 15.22 H new ATOM 0 HD12 LEU A 124 12.910 15.077 -16.937 1.00 15.22 H new ATOM 0 HD13 LEU A 124 14.106 15.170 -18.252 1.00 15.22 H new ATOM 0 HD21 LEU A 124 13.620 18.146 -18.882 1.00 64.32 H new ATOM 0 HD22 LEU A 124 13.741 16.880 -20.127 1.00 64.32 H new ATOM 0 HD23 LEU A 124 12.303 17.925 -20.058 1.00 64.32 H new ATOM 1917 N LEU A 125 11.039 12.577 -20.175 1.00 65.23 N ATOM 1918 CA LEU A 125 10.785 11.162 -19.929 1.00 32.32 C ATOM 1919 C LEU A 125 11.350 10.302 -21.055 1.00 53.43 C ATOM 1920 O LEU A 125 11.831 9.193 -20.822 1.00 53.41 O ATOM 1921 CB LEU A 125 9.283 10.911 -19.785 1.00 14.10 C ATOM 1922 CG LEU A 125 8.859 10.028 -18.611 1.00 31.21 C ATOM 1923 CD1 LEU A 125 8.078 10.838 -17.588 1.00 53.01 C ATOM 1924 CD2 LEU A 125 8.033 8.848 -19.102 1.00 64.42 C ATOM 0 H LEU A 125 10.212 13.116 -20.431 1.00 65.23 H new ATOM 0 HA LEU A 125 11.285 10.885 -19.001 1.00 32.32 H new ATOM 0 HB2 LEU A 125 8.782 11.874 -19.689 1.00 14.10 H new ATOM 0 HB3 LEU A 125 8.921 10.454 -20.706 1.00 14.10 H new ATOM 0 HG LEU A 125 9.757 9.642 -18.129 1.00 31.21 H new ATOM 0 HD11 LEU A 125 7.785 10.193 -16.760 1.00 53.01 H new ATOM 0 HD12 LEU A 125 8.702 11.649 -17.213 1.00 53.01 H new ATOM 0 HD13 LEU A 125 7.186 11.254 -18.057 1.00 53.01 H new ATOM 0 HD21 LEU A 125 7.740 8.231 -18.253 1.00 64.42 H new ATOM 0 HD22 LEU A 125 7.141 9.215 -19.609 1.00 64.42 H new ATOM 0 HD23 LEU A 125 8.626 8.253 -19.796 1.00 64.42 H new ATOM 1936 N ASP A 126 11.290 10.823 -22.276 1.00 74.31 N ATOM 1937 CA ASP A 126 11.798 10.105 -23.439 1.00 62.31 C ATOM 1938 C ASP A 126 13.272 9.756 -23.260 1.00 64.43 C ATOM 1939 O ASP A 126 13.698 8.641 -23.563 1.00 23.23 O ATOM 1940 CB ASP A 126 11.610 10.942 -24.705 1.00 14.31 C ATOM 1941 CG ASP A 126 10.637 10.308 -25.679 1.00 73.02 C ATOM 1942 OD1 ASP A 126 9.511 9.969 -25.258 1.00 32.20 O ATOM 1943 OD2 ASP A 126 11.001 10.151 -26.863 1.00 52.53 O ATOM 0 H ASP A 126 10.895 11.740 -22.486 1.00 74.31 H new ATOM 0 HA ASP A 126 11.232 9.179 -23.539 1.00 62.31 H new ATOM 0 HB2 ASP A 126 11.251 11.934 -24.431 1.00 14.31 H new ATOM 0 HB3 ASP A 126 12.574 11.076 -25.195 1.00 14.31 H new ATOM 1948 N VAL A 127 14.047 10.717 -22.768 1.00 25.44 N ATOM 1949 CA VAL A 127 15.474 10.511 -22.548 1.00 42.14 C ATOM 1950 C VAL A 127 15.719 9.450 -21.482 1.00 60.50 C ATOM 1951 O VAL A 127 16.337 8.419 -21.749 1.00 25.33 O ATOM 1952 CB VAL A 127 16.171 11.818 -22.126 1.00 1.03 C ATOM 1953 CG1 VAL A 127 17.644 11.569 -21.838 1.00 12.21 C ATOM 1954 CG2 VAL A 127 16.002 12.883 -23.199 1.00 34.12 C ATOM 0 H VAL A 127 13.711 11.646 -22.514 1.00 25.44 H new ATOM 0 HA VAL A 127 15.894 10.173 -23.495 1.00 42.14 H new ATOM 0 HB VAL A 127 15.702 12.180 -21.211 1.00 1.03 H new ATOM 0 HG11 VAL A 127 18.120 12.504 -21.541 1.00 12.21 H new ATOM 0 HG12 VAL A 127 17.739 10.842 -21.032 1.00 12.21 H new ATOM 0 HG13 VAL A 127 18.130 11.183 -22.734 1.00 12.21 H new ATOM 0 HG21 VAL A 127 16.501 13.799 -22.884 1.00 34.12 H new ATOM 0 HG22 VAL A 127 16.443 12.532 -24.132 1.00 34.12 H new ATOM 0 HG23 VAL A 127 14.941 13.081 -23.351 1.00 34.12 H new ATOM 1964 N ILE A 128 15.230 9.708 -20.274 1.00 54.32 N ATOM 1965 CA ILE A 128 15.394 8.774 -19.168 1.00 20.04 C ATOM 1966 C ILE A 128 14.839 7.399 -19.522 1.00 72.33 C ATOM 1967 O ILE A 128 15.240 6.388 -18.945 1.00 2.10 O ATOM 1968 CB ILE A 128 14.697 9.283 -17.892 1.00 53.43 C ATOM 1969 CG1 ILE A 128 14.949 8.323 -16.728 1.00 62.24 C ATOM 1970 CG2 ILE A 128 13.204 9.449 -18.135 1.00 41.31 C ATOM 1971 CD1 ILE A 128 14.924 8.995 -15.374 1.00 11.13 C ATOM 0 H ILE A 128 14.717 10.557 -20.037 1.00 54.32 H new ATOM 0 HA ILE A 128 16.465 8.694 -18.980 1.00 20.04 H new ATOM 0 HB ILE A 128 15.114 10.256 -17.632 1.00 53.43 H new ATOM 0 HG12 ILE A 128 14.196 7.536 -16.748 1.00 62.24 H new ATOM 0 HG13 ILE A 128 15.917 7.842 -16.868 1.00 62.24 H new ATOM 0 HG21 ILE A 128 12.725 9.809 -17.225 1.00 41.31 H new ATOM 0 HG22 ILE A 128 13.044 10.168 -18.938 1.00 41.31 H new ATOM 0 HG23 ILE A 128 12.772 8.489 -18.417 1.00 41.31 H new ATOM 0 HD11 ILE A 128 15.110 8.254 -14.597 1.00 11.13 H new ATOM 0 HD12 ILE A 128 15.696 9.764 -15.335 1.00 11.13 H new ATOM 0 HD13 ILE A 128 13.948 9.453 -15.213 1.00 11.13 H new ATOM 1983 N ASP A 129 13.915 7.368 -20.476 1.00 71.03 N ATOM 1984 CA ASP A 129 13.306 6.116 -20.911 1.00 1.20 C ATOM 1985 C ASP A 129 14.371 5.121 -21.362 1.00 3.54 C ATOM 1986 O ASP A 129 14.261 3.923 -21.106 1.00 25.30 O ATOM 1987 CB ASP A 129 12.317 6.374 -22.049 1.00 31.52 C ATOM 1988 CG ASP A 129 10.923 5.871 -21.729 1.00 31.51 C ATOM 1989 OD1 ASP A 129 10.651 4.677 -21.976 1.00 62.24 O ATOM 1990 OD2 ASP A 129 10.104 6.670 -21.230 1.00 50.33 O ATOM 0 H ASP A 129 13.571 8.196 -20.963 1.00 71.03 H new ATOM 0 HA ASP A 129 12.770 5.688 -20.064 1.00 1.20 H new ATOM 0 HB2 ASP A 129 12.276 7.443 -22.255 1.00 31.52 H new ATOM 0 HB3 ASP A 129 12.676 5.888 -22.956 1.00 31.52 H new ATOM 1995 N GLN A 130 15.400 5.628 -22.034 1.00 31.11 N ATOM 1996 CA GLN A 130 16.484 4.783 -22.522 1.00 35.14 C ATOM 1997 C GLN A 130 17.223 4.123 -21.362 1.00 71.24 C ATOM 1998 O GLN A 130 17.801 3.047 -21.514 1.00 74.12 O ATOM 1999 CB GLN A 130 17.461 5.605 -23.363 1.00 52.51 C ATOM 2000 CG GLN A 130 17.139 5.599 -24.849 1.00 24.31 C ATOM 2001 CD GLN A 130 16.447 6.869 -25.302 1.00 44.01 C ATOM 2002 OE1 GLN A 130 17.012 7.960 -25.220 1.00 14.45 O ATOM 2003 NE2 GLN A 130 15.218 6.734 -25.785 1.00 33.22 N ATOM 0 H GLN A 130 15.506 6.619 -22.253 1.00 31.11 H new ATOM 0 HA GLN A 130 16.050 4.001 -23.145 1.00 35.14 H new ATOM 0 HB2 GLN A 130 17.460 6.634 -23.004 1.00 52.51 H new ATOM 0 HB3 GLN A 130 18.469 5.217 -23.217 1.00 52.51 H new ATOM 0 HG2 GLN A 130 18.061 5.470 -25.416 1.00 24.31 H new ATOM 0 HG3 GLN A 130 16.503 4.743 -25.076 1.00 24.31 H new ATOM 0 HE21 GLN A 130 14.788 5.810 -25.835 1.00 33.22 H new ATOM 0 HE22 GLN A 130 14.703 7.554 -26.107 1.00 33.22 H new ATOM 2012 N ALA A 131 17.201 4.775 -20.205 1.00 12.23 N ATOM 2013 CA ALA A 131 17.868 4.251 -19.019 1.00 74.35 C ATOM 2014 C ALA A 131 17.114 3.053 -18.450 1.00 42.33 C ATOM 2015 O ALA A 131 17.719 2.052 -18.069 1.00 24.54 O ATOM 2016 CB ALA A 131 18.005 5.340 -17.966 1.00 31.32 C ATOM 0 H ALA A 131 16.728 5.668 -20.063 1.00 12.23 H new ATOM 0 HA ALA A 131 18.864 3.916 -19.310 1.00 74.35 H new ATOM 0 HB1 ALA A 131 18.505 4.935 -17.086 1.00 31.32 H new ATOM 0 HB2 ALA A 131 18.593 6.164 -18.370 1.00 31.32 H new ATOM 0 HB3 ALA A 131 17.016 5.702 -17.687 1.00 31.32 H new ATOM 2022 N ARG A 132 15.791 3.164 -18.396 1.00 11.12 N ATOM 2023 CA ARG A 132 14.955 2.091 -17.871 1.00 63.22 C ATOM 2024 C ARG A 132 15.197 0.791 -18.634 1.00 1.44 C ATOM 2025 O ARG A 132 15.438 -0.257 -18.034 1.00 31.30 O ATOM 2026 CB ARG A 132 13.478 2.478 -17.957 1.00 73.40 C ATOM 2027 CG ARG A 132 12.653 2.001 -16.772 1.00 64.55 C ATOM 2028 CD ARG A 132 11.258 2.605 -16.786 1.00 31.55 C ATOM 2029 NE ARG A 132 10.628 2.499 -18.099 1.00 1.10 N ATOM 2030 CZ ARG A 132 10.083 1.381 -18.565 1.00 65.22 C ATOM 2031 NH1 ARG A 132 10.091 0.279 -17.828 1.00 62.55 N ATOM 2032 NH2 ARG A 132 9.529 1.364 -19.771 1.00 21.13 N ATOM 0 H ARG A 132 15.275 3.986 -18.709 1.00 11.12 H new ATOM 0 HA ARG A 132 15.222 1.934 -16.826 1.00 63.22 H new ATOM 0 HB2 ARG A 132 13.399 3.563 -18.031 1.00 73.40 H new ATOM 0 HB3 ARG A 132 13.056 2.065 -18.873 1.00 73.40 H new ATOM 0 HG2 ARG A 132 12.580 0.914 -16.792 1.00 64.55 H new ATOM 0 HG3 ARG A 132 13.158 2.270 -15.844 1.00 64.55 H new ATOM 0 HD2 ARG A 132 10.638 2.101 -16.045 1.00 31.55 H new ATOM 0 HD3 ARG A 132 11.314 3.654 -16.495 1.00 31.55 H new ATOM 0 HE ARG A 132 10.605 3.329 -18.691 1.00 1.10 H new ATOM 0 HH11 ARG A 132 10.516 0.289 -16.901 1.00 62.55 H new ATOM 0 HH12 ARG A 132 9.672 -0.578 -18.188 1.00 62.55 H new ATOM 0 HH21 ARG A 132 9.522 2.210 -20.341 1.00 21.13 H new ATOM 0 HH22 ARG A 132 9.111 0.505 -20.128 1.00 21.13 H new ATOM 2046 N LEU A 133 15.131 0.868 -19.958 1.00 60.22 N ATOM 2047 CA LEU A 133 15.342 -0.302 -20.804 1.00 23.25 C ATOM 2048 C LEU A 133 16.796 -0.761 -20.746 1.00 11.54 C ATOM 2049 O LEU A 133 17.086 -1.954 -20.835 1.00 3.34 O ATOM 2050 CB LEU A 133 14.952 0.011 -22.249 1.00 14.21 C ATOM 2051 CG LEU A 133 13.811 -0.824 -22.832 1.00 41.11 C ATOM 2052 CD1 LEU A 133 12.587 -0.757 -21.932 1.00 72.45 C ATOM 2053 CD2 LEU A 133 13.469 -0.351 -24.238 1.00 31.54 C ATOM 0 H LEU A 133 14.933 1.728 -20.470 1.00 60.22 H new ATOM 0 HA LEU A 133 14.710 -1.108 -20.430 1.00 23.25 H new ATOM 0 HB2 LEU A 133 14.673 1.063 -22.309 1.00 14.21 H new ATOM 0 HB3 LEU A 133 15.832 -0.122 -22.879 1.00 14.21 H new ATOM 0 HG LEU A 133 14.138 -1.862 -22.889 1.00 41.11 H new ATOM 0 HD11 LEU A 133 11.785 -1.357 -22.363 1.00 72.45 H new ATOM 0 HD12 LEU A 133 12.840 -1.144 -20.945 1.00 72.45 H new ATOM 0 HD13 LEU A 133 12.257 0.278 -21.842 1.00 72.45 H new ATOM 0 HD21 LEU A 133 12.655 -0.956 -24.638 1.00 31.54 H new ATOM 0 HD22 LEU A 133 13.162 0.694 -24.206 1.00 31.54 H new ATOM 0 HD23 LEU A 133 14.345 -0.452 -24.879 1.00 31.54 H new ATOM 2065 N LYS A 134 17.707 0.195 -20.594 1.00 15.11 N ATOM 2066 CA LYS A 134 19.131 -0.109 -20.520 1.00 74.11 C ATOM 2067 C LYS A 134 19.418 -1.097 -19.394 1.00 63.45 C ATOM 2068 O LYS A 134 20.304 -1.944 -19.511 1.00 1.35 O ATOM 2069 CB LYS A 134 19.937 1.174 -20.305 1.00 73.10 C ATOM 2070 CG LYS A 134 20.466 1.783 -21.592 1.00 73.20 C ATOM 2071 CD LYS A 134 21.980 1.683 -21.675 1.00 13.10 C ATOM 2072 CE LYS A 134 22.581 2.897 -22.367 1.00 61.30 C ATOM 2073 NZ LYS A 134 22.896 2.621 -23.796 1.00 24.30 N ATOM 0 H LYS A 134 17.484 1.187 -20.520 1.00 15.11 H new ATOM 0 HA LYS A 134 19.430 -0.564 -21.464 1.00 74.11 H new ATOM 0 HB2 LYS A 134 19.309 1.907 -19.797 1.00 73.10 H new ATOM 0 HB3 LYS A 134 20.776 0.959 -19.643 1.00 73.10 H new ATOM 0 HG2 LYS A 134 20.019 1.275 -22.447 1.00 73.20 H new ATOM 0 HG3 LYS A 134 20.166 2.829 -21.651 1.00 73.20 H new ATOM 0 HD2 LYS A 134 22.395 1.592 -20.671 1.00 13.10 H new ATOM 0 HD3 LYS A 134 22.257 0.779 -22.218 1.00 13.10 H new ATOM 0 HE2 LYS A 134 21.885 3.733 -22.304 1.00 61.30 H new ATOM 0 HE3 LYS A 134 23.490 3.199 -21.846 1.00 61.30 H new ATOM 0 HZ1 LYS A 134 23.304 3.472 -24.232 1.00 24.30 H new ATOM 0 HZ2 LYS A 134 23.580 1.840 -23.856 1.00 24.30 H new ATOM 0 HZ3 LYS A 134 22.025 2.358 -24.299 1.00 24.30 H new ATOM 2087 N MET A 135 18.663 -0.985 -18.307 1.00 0.43 N ATOM 2088 CA MET A 135 18.836 -1.871 -17.162 1.00 0.25 C ATOM 2089 C MET A 135 18.216 -3.238 -17.433 1.00 52.33 C ATOM 2090 O MET A 135 18.853 -4.271 -17.225 1.00 15.23 O ATOM 2091 CB MET A 135 18.208 -1.252 -15.911 1.00 73.13 C ATOM 2092 CG MET A 135 19.166 -1.153 -14.735 1.00 52.34 C ATOM 2093 SD MET A 135 18.533 -1.962 -13.254 1.00 21.14 S ATOM 2094 CE MET A 135 18.452 -0.578 -12.120 1.00 3.30 C ATOM 0 H MET A 135 17.925 -0.290 -18.195 1.00 0.43 H new ATOM 0 HA MET A 135 19.905 -2.003 -16.996 1.00 0.25 H new ATOM 0 HB2 MET A 135 17.840 -0.255 -16.154 1.00 73.13 H new ATOM 0 HB3 MET A 135 17.344 -1.847 -15.616 1.00 73.13 H new ATOM 0 HG2 MET A 135 20.120 -1.602 -15.010 1.00 52.34 H new ATOM 0 HG3 MET A 135 19.359 -0.103 -14.516 1.00 52.34 H new ATOM 0 HE1 MET A 135 18.553 -0.940 -11.097 1.00 3.30 H new ATOM 0 HE2 MET A 135 19.260 0.120 -12.339 1.00 3.30 H new ATOM 0 HE3 MET A 135 17.494 -0.071 -12.233 1.00 3.30 H new ATOM 2104 N ILE A 136 16.971 -3.236 -17.899 1.00 3.32 N ATOM 2105 CA ILE A 136 16.267 -4.476 -18.199 1.00 53.23 C ATOM 2106 C ILE A 136 17.091 -5.367 -19.123 1.00 11.44 C ATOM 2107 O ILE A 136 17.409 -6.506 -18.782 1.00 2.34 O ATOM 2108 CB ILE A 136 14.900 -4.202 -18.854 1.00 72.21 C ATOM 2109 CG1 ILE A 136 14.044 -3.314 -17.948 1.00 64.31 C ATOM 2110 CG2 ILE A 136 14.184 -5.511 -19.151 1.00 75.15 C ATOM 2111 CD1 ILE A 136 13.702 -3.956 -16.622 1.00 32.40 C ATOM 0 H ILE A 136 16.430 -2.390 -18.077 1.00 3.32 H new ATOM 0 HA ILE A 136 16.111 -4.988 -17.249 1.00 53.23 H new ATOM 0 HB ILE A 136 15.063 -3.677 -19.795 1.00 72.21 H new ATOM 0 HG12 ILE A 136 14.573 -2.379 -17.764 1.00 64.31 H new ATOM 0 HG13 ILE A 136 13.121 -3.060 -18.469 1.00 64.31 H new ATOM 0 HG21 ILE A 136 13.220 -5.301 -19.614 1.00 75.15 H new ATOM 0 HG22 ILE A 136 14.790 -6.111 -19.830 1.00 75.15 H new ATOM 0 HG23 ILE A 136 14.029 -6.060 -18.222 1.00 75.15 H new ATOM 0 HD11 ILE A 136 13.094 -3.270 -16.032 1.00 32.40 H new ATOM 0 HD12 ILE A 136 13.145 -4.877 -16.796 1.00 32.40 H new ATOM 0 HD13 ILE A 136 14.620 -4.185 -16.081 1.00 32.40 H new ATOM 2123 N SER A 137 17.435 -4.839 -20.293 1.00 1.30 N ATOM 2124 CA SER A 137 18.221 -5.587 -21.267 1.00 42.52 C ATOM 2125 C SER A 137 19.707 -5.526 -20.928 1.00 4.04 C ATOM 2126 O SER A 137 20.507 -4.985 -21.691 1.00 1.24 O ATOM 2127 CB SER A 137 17.985 -5.036 -22.675 1.00 64.00 C ATOM 2128 OG SER A 137 18.715 -5.774 -23.640 1.00 74.21 O ATOM 0 H SER A 137 17.182 -3.896 -20.589 1.00 1.30 H new ATOM 0 HA SER A 137 17.901 -6.628 -21.233 1.00 42.52 H new ATOM 0 HB2 SER A 137 16.922 -5.075 -22.911 1.00 64.00 H new ATOM 0 HB3 SER A 137 18.282 -3.988 -22.713 1.00 64.00 H new ATOM 0 HG SER A 137 19.669 -5.748 -23.418 1.00 74.21 H new ATOM 2272 N GLU A 162 1.802 10.037 -31.307 1.00 24.04 N ATOM 2273 CA GLU A 162 0.647 10.884 -31.036 1.00 52.22 C ATOM 2274 C GLU A 162 1.082 12.311 -30.714 1.00 53.12 C ATOM 2275 O GLU A 162 0.569 13.273 -31.287 1.00 55.13 O ATOM 2276 CB GLU A 162 -0.171 10.314 -29.875 1.00 41.33 C ATOM 2277 CG GLU A 162 -1.532 10.969 -29.710 1.00 42.50 C ATOM 2278 CD GLU A 162 -1.576 11.936 -28.542 1.00 73.41 C ATOM 2279 OE1 GLU A 162 -1.247 13.124 -28.741 1.00 73.52 O ATOM 2280 OE2 GLU A 162 -1.941 11.503 -27.429 1.00 23.14 O ATOM 0 HA GLU A 162 0.026 10.905 -31.932 1.00 52.22 H new ATOM 0 HB2 GLU A 162 -0.309 9.244 -30.030 1.00 41.33 H new ATOM 0 HB3 GLU A 162 0.394 10.433 -28.951 1.00 41.33 H new ATOM 0 HG2 GLU A 162 -1.789 11.500 -30.627 1.00 42.50 H new ATOM 0 HG3 GLU A 162 -2.288 10.197 -29.566 1.00 42.50 H new ATOM 2287 N LEU A 163 2.030 12.440 -29.793 1.00 43.33 N ATOM 2288 CA LEU A 163 2.535 13.749 -29.393 1.00 42.23 C ATOM 2289 C LEU A 163 3.315 14.403 -30.530 1.00 32.31 C ATOM 2290 O LEU A 163 3.277 15.621 -30.702 1.00 12.22 O ATOM 2291 CB LEU A 163 3.427 13.618 -28.157 1.00 71.14 C ATOM 2292 CG LEU A 163 2.703 13.527 -26.814 1.00 34.22 C ATOM 2293 CD1 LEU A 163 2.301 12.090 -26.520 1.00 73.35 C ATOM 2294 CD2 LEU A 163 3.579 14.076 -25.697 1.00 72.03 C ATOM 0 H LEU A 163 2.465 11.654 -29.309 1.00 43.33 H new ATOM 0 HA LEU A 163 1.681 14.382 -29.152 1.00 42.23 H new ATOM 0 HB2 LEU A 163 4.047 12.729 -28.274 1.00 71.14 H new ATOM 0 HB3 LEU A 163 4.100 14.475 -28.127 1.00 71.14 H new ATOM 0 HG LEU A 163 1.798 14.132 -26.870 1.00 34.22 H new ATOM 0 HD11 LEU A 163 1.787 12.045 -25.560 1.00 73.35 H new ATOM 0 HD12 LEU A 163 1.636 11.730 -27.305 1.00 73.35 H new ATOM 0 HD13 LEU A 163 3.192 11.463 -26.484 1.00 73.35 H new ATOM 0 HD21 LEU A 163 3.047 14.003 -24.748 1.00 72.03 H new ATOM 0 HD22 LEU A 163 4.502 13.498 -25.641 1.00 72.03 H new ATOM 0 HD23 LEU A 163 3.816 15.120 -25.901 1.00 72.03 H new ATOM 2306 N ASP A 164 4.019 13.585 -31.304 1.00 21.40 N ATOM 2307 CA ASP A 164 4.805 14.082 -32.427 1.00 4.32 C ATOM 2308 C ASP A 164 3.921 14.829 -33.421 1.00 2.03 C ATOM 2309 O ASP A 164 4.173 15.991 -33.739 1.00 15.53 O ATOM 2310 CB ASP A 164 5.520 12.927 -33.129 1.00 32.51 C ATOM 2311 CG ASP A 164 6.632 12.336 -32.285 1.00 62.54 C ATOM 2312 OD1 ASP A 164 6.605 12.524 -31.051 1.00 22.32 O ATOM 2313 OD2 ASP A 164 7.529 11.684 -32.859 1.00 45.15 O ATOM 0 H ASP A 164 4.062 12.574 -31.174 1.00 21.40 H new ATOM 0 HA ASP A 164 5.550 14.776 -32.037 1.00 4.32 H new ATOM 0 HB2 ASP A 164 4.797 12.148 -33.369 1.00 32.51 H new ATOM 0 HB3 ASP A 164 5.933 13.280 -34.074 1.00 32.51 H new ATOM 2318 N ARG A 165 2.886 14.153 -33.908 1.00 62.13 N ATOM 2319 CA ARG A 165 1.966 14.752 -34.868 1.00 22.51 C ATOM 2320 C ARG A 165 1.433 16.084 -34.351 1.00 11.50 C ATOM 2321 O ARG A 165 1.476 17.096 -35.052 1.00 13.40 O ATOM 2322 CB ARG A 165 0.802 13.800 -35.153 1.00 4.34 C ATOM 2323 CG ARG A 165 0.135 14.040 -36.497 1.00 32.11 C ATOM 2324 CD ARG A 165 0.563 13.004 -37.524 1.00 61.41 C ATOM 2325 NE ARG A 165 -0.075 11.710 -37.296 1.00 14.15 N ATOM 2326 CZ ARG A 165 0.032 10.680 -38.128 1.00 12.42 C ATOM 2327 NH1 ARG A 165 0.749 10.792 -39.237 1.00 51.44 N ATOM 2328 NH2 ARG A 165 -0.579 9.535 -37.851 1.00 3.34 N ATOM 0 H ARG A 165 2.663 13.191 -33.654 1.00 62.13 H new ATOM 0 HA ARG A 165 2.513 14.934 -35.793 1.00 22.51 H new ATOM 0 HB2 ARG A 165 1.166 12.773 -35.116 1.00 4.34 H new ATOM 0 HB3 ARG A 165 0.057 13.903 -34.364 1.00 4.34 H new ATOM 0 HG2 ARG A 165 -0.948 14.010 -36.378 1.00 32.11 H new ATOM 0 HG3 ARG A 165 0.388 15.037 -36.857 1.00 32.11 H new ATOM 0 HD2 ARG A 165 0.313 13.360 -38.524 1.00 61.41 H new ATOM 0 HD3 ARG A 165 1.646 12.885 -37.489 1.00 61.41 H new ATOM 0 HE ARG A 165 -0.634 11.591 -36.451 1.00 14.15 H new ATOM 0 HH11 ARG A 165 1.220 11.670 -39.453 1.00 51.44 H new ATOM 0 HH12 ARG A 165 0.830 10.000 -39.874 1.00 51.44 H new ATOM 0 HH21 ARG A 165 -1.132 9.445 -36.998 1.00 3.34 H new ATOM 0 HH22 ARG A 165 -0.496 8.745 -38.491 1.00 3.34 H new ATOM 2342 N LEU A 166 0.930 16.078 -33.121 1.00 63.23 N ATOM 2343 CA LEU A 166 0.388 17.286 -32.510 1.00 12.11 C ATOM 2344 C LEU A 166 1.401 18.425 -32.562 1.00 24.24 C ATOM 2345 O LEU A 166 1.054 19.566 -32.867 1.00 51.34 O ATOM 2346 CB LEU A 166 -0.014 17.011 -31.060 1.00 11.32 C ATOM 2347 CG LEU A 166 -1.471 16.606 -30.832 1.00 41.33 C ATOM 2348 CD1 LEU A 166 -2.404 17.760 -31.165 1.00 1.35 C ATOM 2349 CD2 LEU A 166 -1.820 15.380 -31.663 1.00 65.02 C ATOM 0 H LEU A 166 0.886 15.250 -32.528 1.00 63.23 H new ATOM 0 HA LEU A 166 -0.495 17.585 -33.075 1.00 12.11 H new ATOM 0 HB2 LEU A 166 0.627 16.220 -30.670 1.00 11.32 H new ATOM 0 HB3 LEU A 166 0.190 17.906 -30.472 1.00 11.32 H new ATOM 0 HG LEU A 166 -1.598 16.355 -29.779 1.00 41.33 H new ATOM 0 HD11 LEU A 166 -3.436 17.453 -30.997 1.00 1.35 H new ATOM 0 HD12 LEU A 166 -2.170 18.613 -30.527 1.00 1.35 H new ATOM 0 HD13 LEU A 166 -2.275 18.042 -32.210 1.00 1.35 H new ATOM 0 HD21 LEU A 166 -2.860 15.106 -31.488 1.00 65.02 H new ATOM 0 HD22 LEU A 166 -1.676 15.604 -32.720 1.00 65.02 H new ATOM 0 HD23 LEU A 166 -1.173 14.550 -31.377 1.00 65.02 H new ATOM 2361 N LEU A 167 2.656 18.107 -32.263 1.00 62.20 N ATOM 2362 CA LEU A 167 3.722 19.103 -32.278 1.00 20.34 C ATOM 2363 C LEU A 167 3.840 19.754 -33.652 1.00 64.50 C ATOM 2364 O LEU A 167 3.946 20.976 -33.765 1.00 64.52 O ATOM 2365 CB LEU A 167 5.054 18.459 -31.889 1.00 60.42 C ATOM 2366 CG LEU A 167 5.862 19.185 -30.813 1.00 62.23 C ATOM 2367 CD1 LEU A 167 6.194 20.600 -31.259 1.00 50.42 C ATOM 2368 CD2 LEU A 167 5.101 19.203 -29.496 1.00 12.31 C ATOM 0 H LEU A 167 2.960 17.168 -32.007 1.00 62.20 H new ATOM 0 HA LEU A 167 3.474 19.876 -31.551 1.00 20.34 H new ATOM 0 HB2 LEU A 167 4.857 17.444 -31.544 1.00 60.42 H new ATOM 0 HB3 LEU A 167 5.670 18.377 -32.784 1.00 60.42 H new ATOM 0 HG LEU A 167 6.797 18.645 -30.662 1.00 62.23 H new ATOM 0 HD11 LEU A 167 6.769 21.101 -30.481 1.00 50.42 H new ATOM 0 HD12 LEU A 167 6.780 20.564 -32.177 1.00 50.42 H new ATOM 0 HD13 LEU A 167 5.271 21.151 -31.439 1.00 50.42 H new ATOM 0 HD21 LEU A 167 5.691 19.724 -28.742 1.00 12.31 H new ATOM 0 HD22 LEU A 167 4.150 19.718 -29.632 1.00 12.31 H new ATOM 0 HD23 LEU A 167 4.916 18.180 -29.169 1.00 12.31 H new ATOM 2380 N LEU A 168 3.820 18.930 -34.694 1.00 53.23 N ATOM 2381 CA LEU A 168 3.922 19.425 -36.063 1.00 3.53 C ATOM 2382 C LEU A 168 2.898 20.526 -36.322 1.00 23.22 C ATOM 2383 O LEU A 168 3.213 21.548 -36.931 1.00 34.22 O ATOM 2384 CB LEU A 168 3.720 18.281 -37.057 1.00 23.42 C ATOM 2385 CG LEU A 168 4.896 17.985 -37.988 1.00 65.01 C ATOM 2386 CD1 LEU A 168 5.060 19.098 -39.011 1.00 43.31 C ATOM 2387 CD2 LEU A 168 6.177 17.801 -37.188 1.00 5.14 C ATOM 0 H LEU A 168 3.734 17.917 -34.617 1.00 53.23 H new ATOM 0 HA LEU A 168 4.920 19.843 -36.198 1.00 3.53 H new ATOM 0 HB2 LEU A 168 3.490 17.375 -36.496 1.00 23.42 H new ATOM 0 HB3 LEU A 168 2.847 18.508 -37.668 1.00 23.42 H new ATOM 0 HG LEU A 168 4.688 17.057 -38.521 1.00 65.01 H new ATOM 0 HD11 LEU A 168 5.902 18.870 -39.665 1.00 43.31 H new ATOM 0 HD12 LEU A 168 4.151 19.182 -39.606 1.00 43.31 H new ATOM 0 HD13 LEU A 168 5.245 20.041 -38.496 1.00 43.31 H new ATOM 0 HD21 LEU A 168 7.003 17.591 -37.867 1.00 5.14 H new ATOM 0 HD22 LEU A 168 6.390 18.711 -36.628 1.00 5.14 H new ATOM 0 HD23 LEU A 168 6.057 16.968 -36.495 1.00 5.14 H new ATOM 2399 N GLU A 169 1.673 20.309 -35.853 1.00 42.41 N ATOM 2400 CA GLU A 169 0.604 21.284 -36.034 1.00 12.15 C ATOM 2401 C GLU A 169 0.969 22.618 -35.388 1.00 72.02 C ATOM 2402 O GLU A 169 0.748 23.682 -35.968 1.00 12.22 O ATOM 2403 CB GLU A 169 -0.703 20.757 -35.437 1.00 1.12 C ATOM 2404 CG GLU A 169 -1.815 20.590 -36.459 1.00 23.52 C ATOM 2405 CD GLU A 169 -3.127 20.165 -35.829 1.00 11.12 C ATOM 2406 OE1 GLU A 169 -3.536 20.791 -34.829 1.00 2.32 O ATOM 2407 OE2 GLU A 169 -3.746 19.206 -36.337 1.00 4.23 O ATOM 0 H GLU A 169 1.397 19.468 -35.346 1.00 42.41 H new ATOM 0 HA GLU A 169 0.469 21.443 -37.104 1.00 12.15 H new ATOM 0 HB2 GLU A 169 -0.513 19.796 -34.959 1.00 1.12 H new ATOM 0 HB3 GLU A 169 -1.038 21.440 -34.657 1.00 1.12 H new ATOM 0 HG2 GLU A 169 -1.959 21.531 -36.990 1.00 23.52 H new ATOM 0 HG3 GLU A 169 -1.515 19.849 -37.199 1.00 23.52 H new ATOM 2414 N LEU A 170 1.528 22.553 -34.185 1.00 61.31 N ATOM 2415 CA LEU A 170 1.924 23.755 -33.459 1.00 70.42 C ATOM 2416 C LEU A 170 2.799 24.652 -34.328 1.00 41.12 C ATOM 2417 O LEU A 170 2.601 25.865 -34.382 1.00 34.00 O ATOM 2418 CB LEU A 170 2.672 23.378 -32.179 1.00 44.04 C ATOM 2419 CG LEU A 170 1.981 23.744 -30.865 1.00 62.14 C ATOM 2420 CD1 LEU A 170 0.826 22.794 -30.587 1.00 44.22 C ATOM 2421 CD2 LEU A 170 2.978 23.726 -29.716 1.00 31.15 C ATOM 0 H LEU A 170 1.717 21.681 -33.691 1.00 61.31 H new ATOM 0 HA LEU A 170 1.021 24.305 -33.196 1.00 70.42 H new ATOM 0 HB2 LEU A 170 2.846 22.302 -32.187 1.00 44.04 H new ATOM 0 HB3 LEU A 170 3.650 23.859 -32.198 1.00 44.04 H new ATOM 0 HG LEU A 170 1.580 24.753 -30.956 1.00 62.14 H new ATOM 0 HD11 LEU A 170 0.346 23.070 -29.648 1.00 44.22 H new ATOM 0 HD12 LEU A 170 0.100 22.857 -31.398 1.00 44.22 H new ATOM 0 HD13 LEU A 170 1.203 21.774 -30.516 1.00 44.22 H new ATOM 0 HD21 LEU A 170 2.469 23.989 -28.789 1.00 31.15 H new ATOM 0 HD22 LEU A 170 3.409 22.729 -29.624 1.00 31.15 H new ATOM 0 HD23 LEU A 170 3.771 24.447 -29.911 1.00 31.15 H new