USER MOD reduce.3.24.130724 H: found=0, std=0, add=528, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 527 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 13 LYS NZ :NH3+ 176:sc= 1.51! (180deg=0.631) USER MOD Set 1.2: A 15 ASN : amide:sc= -0.916! C(o=1.3!,f=-20!) USER MOD Set 1.3: A 21 THR OG1 : rot -104:sc= 0.73 USER MOD Set 2.1: A 6 THR OG1 : rot -76:sc= 2.09 USER MOD Set 2.2: A 8 LYS NZ :NH3+ -179:sc= 1.22! (180deg=0.871) USER MOD Single : A 1 THR N :NH3+ -130:sc= 0.575 (180deg=0.0104) USER MOD Single : A 1 THR OG1 : rot 60:sc= 1.48 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 160:sc= -1.47 USER MOD Single : A 23 LYS NZ :NH3+ 178:sc= 1.35 (180deg=1.21) USER MOD Single : A 27 LYS NZ :NH3+ 154:sc= 0.754 (180deg=-0.302!) USER MOD Single : A 31 THR OG1 : rot -120:sc= -2.14 USER MOD Single : A 32 ASN : amide:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : A 35 ASN : amide:sc= -0.426 K(o=-0.43,f=-1.3) USER MOD Single : A 37 GLN : amide:sc= -0.604 X(o=-0.6,f=-0.55) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -101:sc= 0.964 USER MOD Single : A 44 GLN : amide:sc= -0.0203 X(o=-0.02,f=0) USER MOD Single : A 46 THR OG1 : rot -96:sc= 1.15 USER MOD Single : A 48 MET CE :methyl -170:sc= 0 (180deg=-0.201) USER MOD Single : A 49 THR OG1 : rot -65:sc= 0.478 USER MOD Single : A 51 THR OG1 : rot -170:sc= -0.97 USER MOD Single : A 53 LYS NZ :NH3+ -179:sc= 1.66 (180deg=1.6) USER MOD Single : A 54 THR OG1 : rot -67:sc= 0.876 USER MOD Single : A 55 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.46) USER MOD Single : A 58 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.017) USER MOD Single : A 59 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 64 SER OG : rot -55:sc= 0.726 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 48.463 56.284 -71.605 1.00 0.00 N ATOM 2 CA THR A 1 47.037 56.612 -71.286 1.00 0.00 C ATOM 3 C THR A 1 46.526 57.700 -72.243 1.00 0.00 C ATOM 4 O THR A 1 47.304 58.309 -72.955 1.00 0.00 O ATOM 5 CB THR A 1 46.934 57.125 -69.839 1.00 0.00 C ATOM 6 OG1 THR A 1 48.214 57.541 -69.384 1.00 0.00 O ATOM 7 CG2 THR A 1 46.414 56.009 -68.934 1.00 0.00 C ATOM 0 H1 THR A 1 48.571 55.253 -71.694 1.00 0.00 H new ATOM 0 H2 THR A 1 48.732 56.738 -72.501 1.00 0.00 H new ATOM 0 H3 THR A 1 49.078 56.632 -70.842 1.00 0.00 H new ATOM 0 HA THR A 1 46.432 55.712 -71.400 1.00 0.00 H new ATOM 0 HB THR A 1 46.246 57.970 -69.808 1.00 0.00 H new ATOM 0 HG1 THR A 1 48.551 58.255 -69.964 1.00 0.00 H new ATOM 0 HG21 THR A 1 46.342 56.375 -67.910 1.00 0.00 H new ATOM 0 HG22 THR A 1 45.429 55.692 -69.276 1.00 0.00 H new ATOM 0 HG23 THR A 1 47.100 55.163 -68.969 1.00 0.00 H new ATOM 17 N PRO A 2 45.227 57.916 -72.228 1.00 0.00 N ATOM 18 CA PRO A 2 44.580 58.934 -73.083 1.00 0.00 C ATOM 19 C PRO A 2 44.793 60.340 -72.488 1.00 0.00 C ATOM 20 O PRO A 2 43.847 61.062 -72.212 1.00 0.00 O ATOM 21 CB PRO A 2 43.099 58.528 -73.060 1.00 0.00 C ATOM 22 CG PRO A 2 42.896 57.686 -71.777 1.00 0.00 C ATOM 23 CD PRO A 2 44.285 57.167 -71.364 1.00 0.00 C ATOM 0 HA PRO A 2 44.982 58.976 -74.095 1.00 0.00 H new ATOM 0 HB2 PRO A 2 42.455 59.408 -73.053 1.00 0.00 H new ATOM 0 HB3 PRO A 2 42.841 57.951 -73.948 1.00 0.00 H new ATOM 0 HG2 PRO A 2 42.457 58.290 -70.983 1.00 0.00 H new ATOM 0 HG3 PRO A 2 42.213 56.857 -71.962 1.00 0.00 H new ATOM 0 HD2 PRO A 2 44.481 57.352 -70.308 1.00 0.00 H new ATOM 0 HD3 PRO A 2 44.371 56.092 -71.521 1.00 0.00 H new ATOM 31 N ASP A 3 46.032 60.730 -72.284 1.00 0.00 N ATOM 32 CA ASP A 3 46.311 62.080 -71.702 1.00 0.00 C ATOM 33 C ASP A 3 46.412 63.127 -72.833 1.00 0.00 C ATOM 34 O ASP A 3 45.721 63.024 -73.832 1.00 0.00 O ATOM 35 CB ASP A 3 47.610 62.033 -70.886 1.00 0.00 C ATOM 36 CG ASP A 3 47.669 60.749 -70.051 1.00 0.00 C ATOM 37 OD1 ASP A 3 47.076 60.725 -68.986 1.00 0.00 O ATOM 38 OD2 ASP A 3 48.309 59.808 -70.486 1.00 0.00 O ATOM 0 H ASP A 3 46.859 60.171 -72.496 1.00 0.00 H new ATOM 0 HA ASP A 3 45.495 62.367 -71.039 1.00 0.00 H new ATOM 0 HB2 ASP A 3 48.469 62.079 -71.555 1.00 0.00 H new ATOM 0 HB3 ASP A 3 47.668 62.903 -70.232 1.00 0.00 H new ATOM 43 N CYS A 4 47.244 64.148 -72.691 1.00 0.00 N ATOM 44 CA CYS A 4 47.333 65.175 -73.783 1.00 0.00 C ATOM 45 C CYS A 4 48.483 66.177 -73.564 1.00 0.00 C ATOM 46 O CYS A 4 49.554 66.008 -74.111 1.00 0.00 O ATOM 47 CB CYS A 4 46.009 65.935 -73.867 1.00 0.00 C ATOM 48 SG CYS A 4 46.156 67.309 -75.033 1.00 0.00 S ATOM 0 H CYS A 4 47.849 64.307 -71.885 1.00 0.00 H new ATOM 0 HA CYS A 4 47.537 64.645 -74.714 1.00 0.00 H new ATOM 0 HB2 CYS A 4 45.213 65.261 -74.185 1.00 0.00 H new ATOM 0 HB3 CYS A 4 45.733 66.311 -72.882 1.00 0.00 H new ATOM 53 N VAL A 5 48.258 67.245 -72.822 1.00 0.00 N ATOM 54 CA VAL A 5 49.334 68.282 -72.646 1.00 0.00 C ATOM 55 C VAL A 5 49.463 68.734 -71.178 1.00 0.00 C ATOM 56 O VAL A 5 48.999 68.082 -70.263 1.00 0.00 O ATOM 57 CB VAL A 5 48.973 69.504 -73.511 1.00 0.00 C ATOM 58 CG1 VAL A 5 48.803 69.084 -74.973 1.00 0.00 C ATOM 59 CG2 VAL A 5 47.662 70.121 -73.002 1.00 0.00 C ATOM 0 H VAL A 5 47.383 67.441 -72.335 1.00 0.00 H new ATOM 0 HA VAL A 5 50.286 67.845 -72.947 1.00 0.00 H new ATOM 0 HB VAL A 5 49.777 70.237 -73.443 1.00 0.00 H new ATOM 0 HG11 VAL A 5 48.548 69.956 -75.575 1.00 0.00 H new ATOM 0 HG12 VAL A 5 49.734 68.651 -75.338 1.00 0.00 H new ATOM 0 HG13 VAL A 5 48.005 68.345 -75.049 1.00 0.00 H new ATOM 0 HG21 VAL A 5 47.405 70.986 -73.614 1.00 0.00 H new ATOM 0 HG22 VAL A 5 46.863 69.382 -73.066 1.00 0.00 H new ATOM 0 HG23 VAL A 5 47.785 70.433 -71.965 1.00 0.00 H new ATOM 69 N THR A 6 50.101 69.865 -70.966 1.00 0.00 N ATOM 70 CA THR A 6 50.285 70.415 -69.596 1.00 0.00 C ATOM 71 C THR A 6 49.230 71.494 -69.335 1.00 0.00 C ATOM 72 O THR A 6 48.361 71.726 -70.159 1.00 0.00 O ATOM 73 CB THR A 6 51.691 71.002 -69.484 1.00 0.00 C ATOM 74 OG1 THR A 6 51.922 71.987 -70.496 1.00 0.00 O ATOM 75 CG2 THR A 6 52.701 69.869 -69.623 1.00 0.00 C ATOM 0 H THR A 6 50.508 70.436 -71.707 1.00 0.00 H new ATOM 0 HA THR A 6 50.167 69.626 -68.853 1.00 0.00 H new ATOM 0 HB THR A 6 51.798 71.490 -68.515 1.00 0.00 H new ATOM 0 HG1 THR A 6 52.077 71.543 -71.356 1.00 0.00 H new ATOM 0 HG21 THR A 6 53.711 70.271 -69.545 1.00 0.00 H new ATOM 0 HG22 THR A 6 52.539 69.138 -68.831 1.00 0.00 H new ATOM 0 HG23 THR A 6 52.576 69.387 -70.592 1.00 0.00 H new ATOM 83 N GLY A 7 49.271 72.139 -68.191 1.00 0.00 N ATOM 84 CA GLY A 7 48.236 73.171 -67.895 1.00 0.00 C ATOM 85 C GLY A 7 48.794 74.357 -67.100 1.00 0.00 C ATOM 86 O GLY A 7 48.416 74.581 -65.965 1.00 0.00 O ATOM 0 H GLY A 7 49.969 71.995 -67.461 1.00 0.00 H new ATOM 0 HA2 GLY A 7 47.812 73.534 -68.831 1.00 0.00 H new ATOM 0 HA3 GLY A 7 47.422 72.713 -67.333 1.00 0.00 H new ATOM 90 N LYS A 8 49.639 75.147 -67.716 1.00 0.00 N ATOM 91 CA LYS A 8 50.162 76.379 -67.050 1.00 0.00 C ATOM 92 C LYS A 8 48.988 77.379 -67.036 1.00 0.00 C ATOM 93 O LYS A 8 47.850 76.965 -66.923 1.00 0.00 O ATOM 94 CB LYS A 8 51.358 76.958 -67.836 1.00 0.00 C ATOM 95 CG LYS A 8 52.460 75.909 -67.985 1.00 0.00 C ATOM 96 CD LYS A 8 52.187 75.051 -69.211 1.00 0.00 C ATOM 97 CE LYS A 8 53.496 74.710 -69.917 1.00 0.00 C ATOM 98 NZ LYS A 8 53.181 73.890 -71.117 1.00 0.00 N ATOM 0 H LYS A 8 49.991 74.989 -68.660 1.00 0.00 H new ATOM 0 HA LYS A 8 50.520 76.167 -66.043 1.00 0.00 H new ATOM 0 HB2 LYS A 8 51.028 77.289 -68.821 1.00 0.00 H new ATOM 0 HB3 LYS A 8 51.750 77.835 -67.320 1.00 0.00 H new ATOM 0 HG2 LYS A 8 53.430 76.397 -68.079 1.00 0.00 H new ATOM 0 HG3 LYS A 8 52.503 75.283 -67.093 1.00 0.00 H new ATOM 0 HD2 LYS A 8 51.675 74.135 -68.916 1.00 0.00 H new ATOM 0 HD3 LYS A 8 51.524 75.581 -69.895 1.00 0.00 H new ATOM 0 HE2 LYS A 8 54.019 75.621 -70.207 1.00 0.00 H new ATOM 0 HE3 LYS A 8 54.158 74.162 -69.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 54.064 73.633 -71.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 52.682 73.026 -70.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 52.577 74.437 -71.763 1.00 0.00 H new ATOM 112 N VAL A 9 49.215 78.669 -67.167 1.00 0.00 N ATOM 113 CA VAL A 9 48.048 79.626 -67.168 1.00 0.00 C ATOM 114 C VAL A 9 48.402 80.954 -67.842 1.00 0.00 C ATOM 115 O VAL A 9 48.420 81.990 -67.206 1.00 0.00 O ATOM 116 CB VAL A 9 47.648 79.921 -65.735 1.00 0.00 C ATOM 117 CG1 VAL A 9 46.468 80.898 -65.726 1.00 0.00 C ATOM 118 CG2 VAL A 9 47.269 78.617 -65.043 1.00 0.00 C ATOM 0 H VAL A 9 50.135 79.097 -67.271 1.00 0.00 H new ATOM 0 HA VAL A 9 47.235 79.156 -67.722 1.00 0.00 H new ATOM 0 HB VAL A 9 48.481 80.376 -65.200 1.00 0.00 H new ATOM 0 HG11 VAL A 9 46.180 81.111 -64.697 1.00 0.00 H new ATOM 0 HG12 VAL A 9 46.759 81.825 -66.220 1.00 0.00 H new ATOM 0 HG13 VAL A 9 45.624 80.454 -66.255 1.00 0.00 H new ATOM 0 HG21 VAL A 9 46.980 78.823 -64.012 1.00 0.00 H new ATOM 0 HG22 VAL A 9 46.433 78.156 -65.569 1.00 0.00 H new ATOM 0 HG23 VAL A 9 48.122 77.939 -65.052 1.00 0.00 H new ATOM 128 N GLU A 10 48.645 80.985 -69.113 1.00 0.00 N ATOM 129 CA GLU A 10 48.978 82.301 -69.705 1.00 0.00 C ATOM 130 C GLU A 10 47.764 82.877 -70.426 1.00 0.00 C ATOM 131 O GLU A 10 47.842 83.164 -71.610 1.00 0.00 O ATOM 132 CB GLU A 10 50.174 82.151 -70.663 1.00 0.00 C ATOM 133 CG GLU A 10 51.493 82.511 -69.950 1.00 0.00 C ATOM 134 CD GLU A 10 51.438 82.124 -68.466 1.00 0.00 C ATOM 135 OE1 GLU A 10 51.504 80.938 -68.177 1.00 0.00 O ATOM 136 OE2 GLU A 10 51.333 83.026 -67.646 1.00 0.00 O ATOM 0 H GLU A 10 48.630 80.189 -69.750 1.00 0.00 H new ATOM 0 HA GLU A 10 49.257 82.995 -68.912 1.00 0.00 H new ATOM 0 HB2 GLU A 10 50.223 81.127 -71.034 1.00 0.00 H new ATOM 0 HB3 GLU A 10 50.035 82.797 -71.530 1.00 0.00 H new ATOM 0 HG2 GLU A 10 52.324 81.997 -70.433 1.00 0.00 H new ATOM 0 HG3 GLU A 10 51.682 83.580 -70.044 1.00 0.00 H new ATOM 143 N TYR A 11 46.659 83.054 -69.698 1.00 0.00 N ATOM 144 CA TYR A 11 45.380 83.642 -70.292 1.00 0.00 C ATOM 145 C TYR A 11 44.174 82.702 -70.057 1.00 0.00 C ATOM 146 O TYR A 11 44.022 81.694 -70.722 1.00 0.00 O ATOM 147 CB TYR A 11 45.570 83.882 -71.810 1.00 0.00 C ATOM 148 CG TYR A 11 44.322 84.384 -72.505 1.00 0.00 C ATOM 149 CD1 TYR A 11 43.268 83.508 -72.796 1.00 0.00 C ATOM 150 CD2 TYR A 11 44.247 85.720 -72.911 1.00 0.00 C ATOM 151 CE1 TYR A 11 42.141 83.969 -73.481 1.00 0.00 C ATOM 152 CE2 TYR A 11 43.122 86.180 -73.605 1.00 0.00 C ATOM 153 CZ TYR A 11 42.068 85.304 -73.888 1.00 0.00 C ATOM 154 OH TYR A 11 40.962 85.757 -74.576 1.00 0.00 O ATOM 0 H TYR A 11 46.588 82.814 -68.709 1.00 0.00 H new ATOM 0 HA TYR A 11 45.176 84.590 -69.794 1.00 0.00 H new ATOM 0 HB2 TYR A 11 46.373 84.604 -71.958 1.00 0.00 H new ATOM 0 HB3 TYR A 11 45.888 82.951 -72.280 1.00 0.00 H new ATOM 0 HD1 TYR A 11 43.327 82.474 -72.490 1.00 0.00 H new ATOM 0 HD2 TYR A 11 45.058 86.398 -72.689 1.00 0.00 H new ATOM 0 HE1 TYR A 11 41.326 83.294 -73.696 1.00 0.00 H new ATOM 0 HE2 TYR A 11 43.067 87.211 -73.922 1.00 0.00 H new ATOM 0 HH TYR A 11 41.072 86.709 -74.782 1.00 0.00 H new ATOM 164 N THR A 12 43.310 83.031 -69.117 1.00 0.00 N ATOM 165 CA THR A 12 42.101 82.172 -68.853 1.00 0.00 C ATOM 166 C THR A 12 40.831 83.008 -69.098 1.00 0.00 C ATOM 167 O THR A 12 40.346 83.692 -68.210 1.00 0.00 O ATOM 168 CB THR A 12 42.135 81.747 -67.402 1.00 0.00 C ATOM 169 OG1 THR A 12 43.154 80.775 -67.215 1.00 0.00 O ATOM 170 CG2 THR A 12 40.786 81.164 -67.004 1.00 0.00 C ATOM 0 H THR A 12 43.389 83.856 -68.522 1.00 0.00 H new ATOM 0 HA THR A 12 42.101 81.301 -69.508 1.00 0.00 H new ATOM 0 HB THR A 12 42.346 82.615 -66.777 1.00 0.00 H new ATOM 0 HG1 THR A 12 43.176 80.501 -66.274 1.00 0.00 H new ATOM 0 HG21 THR A 12 40.816 80.859 -65.958 1.00 0.00 H new ATOM 0 HG22 THR A 12 40.010 81.917 -67.141 1.00 0.00 H new ATOM 0 HG23 THR A 12 40.566 80.298 -67.628 1.00 0.00 H new ATOM 178 N LYS A 13 40.301 82.967 -70.293 1.00 0.00 N ATOM 179 CA LYS A 13 39.077 83.768 -70.619 1.00 0.00 C ATOM 180 C LYS A 13 37.832 83.199 -69.919 1.00 0.00 C ATOM 181 O LYS A 13 37.164 82.314 -70.436 1.00 0.00 O ATOM 182 CB LYS A 13 38.876 83.760 -72.143 1.00 0.00 C ATOM 183 CG LYS A 13 37.655 84.603 -72.520 1.00 0.00 C ATOM 184 CD LYS A 13 36.896 83.909 -73.655 1.00 0.00 C ATOM 185 CE LYS A 13 35.533 83.435 -73.151 1.00 0.00 C ATOM 186 NZ LYS A 13 35.691 82.162 -72.388 1.00 0.00 N ATOM 0 H LYS A 13 40.665 82.409 -71.065 1.00 0.00 H new ATOM 0 HA LYS A 13 39.216 84.788 -70.262 1.00 0.00 H new ATOM 0 HB2 LYS A 13 39.765 84.153 -72.636 1.00 0.00 H new ATOM 0 HB3 LYS A 13 38.743 82.737 -72.494 1.00 0.00 H new ATOM 0 HG2 LYS A 13 37.004 84.729 -71.655 1.00 0.00 H new ATOM 0 HG3 LYS A 13 37.968 85.599 -72.832 1.00 0.00 H new ATOM 0 HD2 LYS A 13 36.766 84.596 -74.491 1.00 0.00 H new ATOM 0 HD3 LYS A 13 37.472 83.061 -74.025 1.00 0.00 H new ATOM 0 HE2 LYS A 13 35.085 84.198 -72.514 1.00 0.00 H new ATOM 0 HE3 LYS A 13 34.856 83.284 -73.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 34.773 81.879 -71.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 36.037 81.416 -73.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 36.374 82.302 -71.616 1.00 0.00 H new ATOM 200 N TYR A 14 37.494 83.722 -68.761 1.00 0.00 N ATOM 201 CA TYR A 14 36.278 83.234 -68.041 1.00 0.00 C ATOM 202 C TYR A 14 35.034 83.959 -68.568 1.00 0.00 C ATOM 203 O TYR A 14 35.085 85.118 -68.962 1.00 0.00 O ATOM 204 CB TYR A 14 36.417 83.459 -66.514 1.00 0.00 C ATOM 205 CG TYR A 14 35.431 84.509 -66.021 1.00 0.00 C ATOM 206 CD1 TYR A 14 34.121 84.140 -65.682 1.00 0.00 C ATOM 207 CD2 TYR A 14 35.825 85.845 -65.912 1.00 0.00 C ATOM 208 CE1 TYR A 14 33.211 85.105 -65.236 1.00 0.00 C ATOM 209 CE2 TYR A 14 34.912 86.812 -65.463 1.00 0.00 C ATOM 210 CZ TYR A 14 33.604 86.440 -65.126 1.00 0.00 C ATOM 211 OH TYR A 14 32.698 87.387 -64.685 1.00 0.00 O ATOM 0 H TYR A 14 38.009 84.464 -68.287 1.00 0.00 H new ATOM 0 HA TYR A 14 36.174 82.164 -68.222 1.00 0.00 H new ATOM 0 HB2 TYR A 14 36.245 82.520 -65.988 1.00 0.00 H new ATOM 0 HB3 TYR A 14 37.434 83.774 -66.281 1.00 0.00 H new ATOM 0 HD1 TYR A 14 33.814 83.108 -65.765 1.00 0.00 H new ATOM 0 HD2 TYR A 14 36.832 86.134 -66.173 1.00 0.00 H new ATOM 0 HE1 TYR A 14 32.203 84.817 -64.976 1.00 0.00 H new ATOM 0 HE2 TYR A 14 35.218 87.844 -65.377 1.00 0.00 H new ATOM 0 HH TYR A 14 33.129 88.267 -64.664 1.00 0.00 H new ATOM 221 N ASN A 15 33.919 83.276 -68.540 1.00 0.00 N ATOM 222 CA ASN A 15 32.631 83.873 -68.993 1.00 0.00 C ATOM 223 C ASN A 15 31.462 82.981 -68.541 1.00 0.00 C ATOM 224 O ASN A 15 30.428 83.472 -68.120 1.00 0.00 O ATOM 225 CB ASN A 15 32.629 84.029 -70.526 1.00 0.00 C ATOM 226 CG ASN A 15 32.509 82.664 -71.211 1.00 0.00 C ATOM 227 OD1 ASN A 15 33.501 82.028 -71.501 1.00 0.00 O ATOM 228 ND2 ASN A 15 31.334 82.183 -71.490 1.00 0.00 N ATOM 0 H ASN A 15 33.848 82.312 -68.216 1.00 0.00 H new ATOM 0 HA ASN A 15 32.515 84.861 -68.547 1.00 0.00 H new ATOM 0 HB2 ASN A 15 31.800 84.668 -70.830 1.00 0.00 H new ATOM 0 HB3 ASN A 15 33.546 84.523 -70.847 1.00 0.00 H new ATOM 0 HD21 ASN A 15 31.250 81.276 -71.950 1.00 0.00 H new ATOM 0 HD22 ASN A 15 30.496 82.712 -71.249 1.00 0.00 H new ATOM 235 N ASP A 16 31.626 81.680 -68.627 1.00 0.00 N ATOM 236 CA ASP A 16 30.547 80.731 -68.221 1.00 0.00 C ATOM 237 C ASP A 16 30.219 80.902 -66.726 1.00 0.00 C ATOM 238 O ASP A 16 29.130 81.298 -66.353 1.00 0.00 O ATOM 239 CB ASP A 16 31.018 79.292 -68.493 1.00 0.00 C ATOM 240 CG ASP A 16 31.746 79.234 -69.840 1.00 0.00 C ATOM 241 OD1 ASP A 16 32.888 79.668 -69.889 1.00 0.00 O ATOM 242 OD2 ASP A 16 31.155 78.766 -70.793 1.00 0.00 O ATOM 0 H ASP A 16 32.477 81.233 -68.967 1.00 0.00 H new ATOM 0 HA ASP A 16 29.646 80.940 -68.798 1.00 0.00 H new ATOM 0 HB2 ASP A 16 31.682 78.959 -67.695 1.00 0.00 H new ATOM 0 HB3 ASP A 16 30.164 78.615 -68.501 1.00 0.00 H new ATOM 247 N ASP A 17 31.175 80.594 -65.891 1.00 0.00 N ATOM 248 CA ASP A 17 31.026 80.690 -64.396 1.00 0.00 C ATOM 249 C ASP A 17 32.274 80.036 -63.785 1.00 0.00 C ATOM 250 O ASP A 17 32.873 80.533 -62.848 1.00 0.00 O ATOM 251 CB ASP A 17 29.764 79.937 -63.941 1.00 0.00 C ATOM 252 CG ASP A 17 28.961 80.810 -62.977 1.00 0.00 C ATOM 253 OD1 ASP A 17 28.160 81.602 -63.451 1.00 0.00 O ATOM 254 OD2 ASP A 17 29.159 80.675 -61.783 1.00 0.00 O ATOM 0 H ASP A 17 32.093 80.266 -66.191 1.00 0.00 H new ATOM 0 HA ASP A 17 30.929 81.728 -64.078 1.00 0.00 H new ATOM 0 HB2 ASP A 17 29.153 79.676 -64.805 1.00 0.00 H new ATOM 0 HB3 ASP A 17 30.042 79.002 -63.454 1.00 0.00 H new ATOM 259 N ASP A 18 32.674 78.937 -64.375 1.00 0.00 N ATOM 260 CA ASP A 18 33.902 78.200 -63.948 1.00 0.00 C ATOM 261 C ASP A 18 34.554 77.579 -65.203 1.00 0.00 C ATOM 262 O ASP A 18 35.763 77.543 -65.318 1.00 0.00 O ATOM 263 CB ASP A 18 33.532 77.100 -62.936 1.00 0.00 C ATOM 264 CG ASP A 18 34.697 76.112 -62.777 1.00 0.00 C ATOM 265 OD1 ASP A 18 35.621 76.425 -62.046 1.00 0.00 O ATOM 266 OD2 ASP A 18 34.644 75.056 -63.388 1.00 0.00 O ATOM 0 H ASP A 18 32.184 78.508 -65.160 1.00 0.00 H new ATOM 0 HA ASP A 18 34.602 78.882 -63.465 1.00 0.00 H new ATOM 0 HB2 ASP A 18 33.292 77.548 -61.972 1.00 0.00 H new ATOM 0 HB3 ASP A 18 32.640 76.571 -63.273 1.00 0.00 H new ATOM 271 N THR A 19 33.750 77.108 -66.143 1.00 0.00 N ATOM 272 CA THR A 19 34.288 76.503 -67.406 1.00 0.00 C ATOM 273 C THR A 19 35.352 77.438 -68.006 1.00 0.00 C ATOM 274 O THR A 19 36.541 77.207 -67.866 1.00 0.00 O ATOM 275 CB THR A 19 33.115 76.309 -68.389 1.00 0.00 C ATOM 276 OG1 THR A 19 32.402 75.132 -68.040 1.00 0.00 O ATOM 277 CG2 THR A 19 33.620 76.185 -69.830 1.00 0.00 C ATOM 0 H THR A 19 32.732 77.120 -66.081 1.00 0.00 H new ATOM 0 HA THR A 19 34.754 75.538 -67.204 1.00 0.00 H new ATOM 0 HB THR A 19 32.462 77.180 -68.325 1.00 0.00 H new ATOM 0 HG1 THR A 19 31.503 75.167 -68.429 1.00 0.00 H new ATOM 0 HG21 THR A 19 32.773 76.049 -70.502 1.00 0.00 H new ATOM 0 HG22 THR A 19 34.160 77.091 -70.106 1.00 0.00 H new ATOM 0 HG23 THR A 19 34.287 75.327 -69.909 1.00 0.00 H new ATOM 285 N PHE A 20 34.929 78.492 -68.664 1.00 0.00 N ATOM 286 CA PHE A 20 35.892 79.471 -69.259 1.00 0.00 C ATOM 287 C PHE A 20 36.640 78.863 -70.446 1.00 0.00 C ATOM 288 O PHE A 20 36.537 77.682 -70.749 1.00 0.00 O ATOM 289 CB PHE A 20 36.955 79.883 -68.221 1.00 0.00 C ATOM 290 CG PHE A 20 36.346 80.283 -66.894 1.00 0.00 C ATOM 291 CD1 PHE A 20 34.988 80.601 -66.783 1.00 0.00 C ATOM 292 CD2 PHE A 20 37.170 80.352 -65.766 1.00 0.00 C ATOM 293 CE1 PHE A 20 34.461 80.986 -65.547 1.00 0.00 C ATOM 294 CE2 PHE A 20 36.642 80.738 -64.533 1.00 0.00 C ATOM 295 CZ PHE A 20 35.288 81.056 -64.422 1.00 0.00 C ATOM 0 H PHE A 20 33.946 78.717 -68.815 1.00 0.00 H new ATOM 0 HA PHE A 20 35.305 80.331 -69.582 1.00 0.00 H new ATOM 0 HB2 PHE A 20 37.646 79.054 -68.065 1.00 0.00 H new ATOM 0 HB3 PHE A 20 37.539 80.715 -68.615 1.00 0.00 H new ATOM 0 HD1 PHE A 20 34.348 80.549 -67.651 1.00 0.00 H new ATOM 0 HD2 PHE A 20 38.218 80.106 -65.849 1.00 0.00 H new ATOM 0 HE1 PHE A 20 33.412 81.230 -65.461 1.00 0.00 H new ATOM 0 HE2 PHE A 20 37.282 80.791 -63.664 1.00 0.00 H new ATOM 0 HZ PHE A 20 34.879 81.356 -63.468 1.00 0.00 H new ATOM 305 N THR A 21 37.449 79.679 -71.070 1.00 0.00 N ATOM 306 CA THR A 21 38.300 79.213 -72.192 1.00 0.00 C ATOM 307 C THR A 21 39.743 79.471 -71.776 1.00 0.00 C ATOM 308 O THR A 21 40.198 80.597 -71.680 1.00 0.00 O ATOM 309 CB THR A 21 37.979 79.932 -73.496 1.00 0.00 C ATOM 310 OG1 THR A 21 36.606 80.319 -73.525 1.00 0.00 O ATOM 311 CG2 THR A 21 38.264 78.951 -74.621 1.00 0.00 C ATOM 0 H THR A 21 37.554 80.667 -70.840 1.00 0.00 H new ATOM 0 HA THR A 21 38.120 78.155 -72.384 1.00 0.00 H new ATOM 0 HB THR A 21 38.581 80.835 -73.598 1.00 0.00 H new ATOM 0 HG1 THR A 21 36.107 79.710 -74.108 1.00 0.00 H new ATOM 0 HG21 THR A 21 38.048 79.423 -75.579 1.00 0.00 H new ATOM 0 HG22 THR A 21 39.313 78.657 -74.590 1.00 0.00 H new ATOM 0 HG23 THR A 21 37.636 78.068 -74.502 1.00 0.00 H new ATOM 319 N VAL A 22 40.420 78.420 -71.456 1.00 0.00 N ATOM 320 CA VAL A 22 41.810 78.502 -70.942 1.00 0.00 C ATOM 321 C VAL A 22 42.859 78.444 -72.058 1.00 0.00 C ATOM 322 O VAL A 22 42.906 77.517 -72.841 1.00 0.00 O ATOM 323 CB VAL A 22 42.000 77.319 -69.992 1.00 0.00 C ATOM 324 CG1 VAL A 22 43.453 77.212 -69.559 1.00 0.00 C ATOM 325 CG2 VAL A 22 41.122 77.516 -68.757 1.00 0.00 C ATOM 0 H VAL A 22 40.058 77.469 -71.531 1.00 0.00 H new ATOM 0 HA VAL A 22 41.951 79.460 -70.441 1.00 0.00 H new ATOM 0 HB VAL A 22 41.717 76.403 -70.511 1.00 0.00 H new ATOM 0 HG11 VAL A 22 43.570 76.365 -68.883 1.00 0.00 H new ATOM 0 HG12 VAL A 22 44.084 77.067 -70.436 1.00 0.00 H new ATOM 0 HG13 VAL A 22 43.748 78.128 -69.047 1.00 0.00 H new ATOM 0 HG21 VAL A 22 41.255 76.674 -68.078 1.00 0.00 H new ATOM 0 HG22 VAL A 22 41.407 78.439 -68.251 1.00 0.00 H new ATOM 0 HG23 VAL A 22 40.077 77.576 -69.060 1.00 0.00 H new ATOM 335 N LYS A 23 43.734 79.417 -72.064 1.00 0.00 N ATOM 336 CA LYS A 23 44.869 79.478 -73.038 1.00 0.00 C ATOM 337 C LYS A 23 46.125 79.178 -72.226 1.00 0.00 C ATOM 338 O LYS A 23 46.906 80.067 -71.899 1.00 0.00 O ATOM 339 CB LYS A 23 44.974 80.891 -73.603 1.00 0.00 C ATOM 340 CG LYS A 23 45.827 80.886 -74.871 1.00 0.00 C ATOM 341 CD LYS A 23 46.750 82.106 -74.858 1.00 0.00 C ATOM 342 CE LYS A 23 48.199 81.652 -74.664 1.00 0.00 C ATOM 343 NZ LYS A 23 48.475 81.469 -73.207 1.00 0.00 N ATOM 0 H LYS A 23 43.708 80.200 -71.411 1.00 0.00 H new ATOM 0 HA LYS A 23 44.733 78.779 -73.863 1.00 0.00 H new ATOM 0 HB2 LYS A 23 43.979 81.277 -73.826 1.00 0.00 H new ATOM 0 HB3 LYS A 23 45.415 81.556 -72.861 1.00 0.00 H new ATOM 0 HG2 LYS A 23 46.415 79.970 -74.925 1.00 0.00 H new ATOM 0 HG3 LYS A 23 45.188 80.907 -75.754 1.00 0.00 H new ATOM 0 HD2 LYS A 23 46.653 82.658 -75.793 1.00 0.00 H new ATOM 0 HD3 LYS A 23 46.461 82.785 -74.056 1.00 0.00 H new ATOM 0 HE2 LYS A 23 48.373 80.718 -75.198 1.00 0.00 H new ATOM 0 HE3 LYS A 23 48.882 82.391 -75.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 49.449 81.128 -73.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 48.358 82.378 -72.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 47.810 80.774 -72.812 1.00 0.00 H new ATOM 357 N VAL A 24 46.298 77.949 -71.842 1.00 0.00 N ATOM 358 CA VAL A 24 47.460 77.608 -70.975 1.00 0.00 C ATOM 359 C VAL A 24 48.031 76.237 -71.335 1.00 0.00 C ATOM 360 O VAL A 24 47.661 75.631 -72.325 1.00 0.00 O ATOM 361 CB VAL A 24 46.987 77.615 -69.517 1.00 0.00 C ATOM 362 CG1 VAL A 24 45.973 78.745 -69.298 1.00 0.00 C ATOM 363 CG2 VAL A 24 46.329 76.280 -69.178 1.00 0.00 C ATOM 0 H VAL A 24 45.690 77.167 -72.088 1.00 0.00 H new ATOM 0 HA VAL A 24 48.252 78.343 -71.123 1.00 0.00 H new ATOM 0 HB VAL A 24 47.851 77.772 -68.871 1.00 0.00 H new ATOM 0 HG11 VAL A 24 45.643 78.741 -68.259 1.00 0.00 H new ATOM 0 HG12 VAL A 24 46.440 79.703 -69.527 1.00 0.00 H new ATOM 0 HG13 VAL A 24 45.114 78.595 -69.952 1.00 0.00 H new ATOM 0 HG21 VAL A 24 45.995 76.292 -68.140 1.00 0.00 H new ATOM 0 HG22 VAL A 24 45.472 76.120 -69.833 1.00 0.00 H new ATOM 0 HG23 VAL A 24 47.049 75.474 -69.318 1.00 0.00 H new ATOM 373 N GLY A 25 48.938 75.748 -70.530 1.00 0.00 N ATOM 374 CA GLY A 25 49.555 74.411 -70.814 1.00 0.00 C ATOM 375 C GLY A 25 50.252 74.488 -72.154 1.00 0.00 C ATOM 376 O GLY A 25 51.342 75.028 -72.272 1.00 0.00 O ATOM 0 H GLY A 25 49.280 76.213 -69.689 1.00 0.00 H new ATOM 0 HA2 GLY A 25 50.265 74.146 -70.031 1.00 0.00 H new ATOM 0 HA3 GLY A 25 48.790 73.634 -70.827 1.00 0.00 H new ATOM 380 N ASP A 26 49.623 73.975 -73.163 1.00 0.00 N ATOM 381 CA ASP A 26 50.214 74.034 -74.519 1.00 0.00 C ATOM 382 C ASP A 26 49.122 74.370 -75.543 1.00 0.00 C ATOM 383 O ASP A 26 49.341 74.257 -76.739 1.00 0.00 O ATOM 384 CB ASP A 26 50.833 72.672 -74.863 1.00 0.00 C ATOM 385 CG ASP A 26 51.797 72.236 -73.753 1.00 0.00 C ATOM 386 OD1 ASP A 26 52.955 72.609 -73.820 1.00 0.00 O ATOM 387 OD2 ASP A 26 51.359 71.537 -72.848 1.00 0.00 O ATOM 0 H ASP A 26 48.716 73.513 -73.107 1.00 0.00 H new ATOM 0 HA ASP A 26 50.984 74.805 -74.546 1.00 0.00 H new ATOM 0 HB2 ASP A 26 50.047 71.927 -74.986 1.00 0.00 H new ATOM 0 HB3 ASP A 26 51.364 72.735 -75.813 1.00 0.00 H new ATOM 392 N LYS A 27 47.947 74.764 -75.088 1.00 0.00 N ATOM 393 CA LYS A 27 46.830 75.075 -76.035 1.00 0.00 C ATOM 394 C LYS A 27 45.822 76.059 -75.404 1.00 0.00 C ATOM 395 O LYS A 27 45.981 76.524 -74.280 1.00 0.00 O ATOM 396 CB LYS A 27 46.094 73.764 -76.380 1.00 0.00 C ATOM 397 CG LYS A 27 47.028 72.810 -77.134 1.00 0.00 C ATOM 398 CD LYS A 27 47.328 73.384 -78.522 1.00 0.00 C ATOM 399 CE LYS A 27 48.428 72.560 -79.197 1.00 0.00 C ATOM 400 NZ LYS A 27 49.762 73.111 -78.807 1.00 0.00 N ATOM 0 H LYS A 27 47.719 74.882 -74.101 1.00 0.00 H new ATOM 0 HA LYS A 27 47.250 75.535 -76.930 1.00 0.00 H new ATOM 0 HB2 LYS A 27 45.738 73.288 -75.466 1.00 0.00 H new ATOM 0 HB3 LYS A 27 45.217 73.981 -76.989 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.955 72.674 -76.576 1.00 0.00 H new ATOM 0 HG3 LYS A 27 46.565 71.828 -77.227 1.00 0.00 H new ATOM 0 HD2 LYS A 27 46.426 73.373 -79.133 1.00 0.00 H new ATOM 0 HD3 LYS A 27 47.641 74.424 -78.435 1.00 0.00 H new ATOM 0 HE2 LYS A 27 48.351 71.515 -78.898 1.00 0.00 H new ATOM 0 HE3 LYS A 27 48.310 72.592 -80.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 50.479 72.360 -78.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 50.018 73.888 -79.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.718 73.469 -77.831 1.00 0.00 H new ATOM 414 N GLU A 28 44.774 76.357 -76.135 1.00 0.00 N ATOM 415 CA GLU A 28 43.720 77.283 -75.632 1.00 0.00 C ATOM 416 C GLU A 28 42.350 76.731 -76.036 1.00 0.00 C ATOM 417 O GLU A 28 42.125 76.425 -77.197 1.00 0.00 O ATOM 418 CB GLU A 28 43.919 78.665 -76.253 1.00 0.00 C ATOM 419 CG GLU A 28 42.832 79.621 -75.734 1.00 0.00 C ATOM 420 CD GLU A 28 42.871 80.937 -76.516 1.00 0.00 C ATOM 421 OE1 GLU A 28 42.802 80.885 -77.733 1.00 0.00 O ATOM 422 OE2 GLU A 28 42.966 81.975 -75.882 1.00 0.00 O ATOM 0 H GLU A 28 44.606 75.990 -77.072 1.00 0.00 H new ATOM 0 HA GLU A 28 43.782 77.366 -74.547 1.00 0.00 H new ATOM 0 HB2 GLU A 28 44.907 79.050 -76.001 1.00 0.00 H new ATOM 0 HB3 GLU A 28 43.871 78.598 -77.340 1.00 0.00 H new ATOM 0 HG2 GLU A 28 41.851 79.158 -75.836 1.00 0.00 H new ATOM 0 HG3 GLU A 28 42.984 79.815 -74.672 1.00 0.00 H new ATOM 429 N LEU A 29 41.432 76.586 -75.102 1.00 0.00 N ATOM 430 CA LEU A 29 40.085 76.038 -75.473 1.00 0.00 C ATOM 431 C LEU A 29 39.111 76.057 -74.274 1.00 0.00 C ATOM 432 O LEU A 29 39.498 76.290 -73.139 1.00 0.00 O ATOM 433 CB LEU A 29 40.277 74.607 -76.029 1.00 0.00 C ATOM 434 CG LEU A 29 40.056 73.523 -74.962 1.00 0.00 C ATOM 435 CD1 LEU A 29 40.388 72.164 -75.574 1.00 0.00 C ATOM 436 CD2 LEU A 29 40.974 73.739 -73.759 1.00 0.00 C ATOM 0 H LEU A 29 41.555 76.819 -74.117 1.00 0.00 H new ATOM 0 HA LEU A 29 39.634 76.669 -76.239 1.00 0.00 H new ATOM 0 HB2 LEU A 29 39.583 74.446 -76.854 1.00 0.00 H new ATOM 0 HB3 LEU A 29 41.284 74.511 -76.436 1.00 0.00 H new ATOM 0 HG LEU A 29 39.019 73.570 -74.630 1.00 0.00 H new ATOM 0 HD11 LEU A 29 40.236 71.383 -74.829 1.00 0.00 H new ATOM 0 HD12 LEU A 29 39.737 71.981 -76.429 1.00 0.00 H new ATOM 0 HD13 LEU A 29 41.428 72.156 -75.901 1.00 0.00 H new ATOM 0 HD21 LEU A 29 40.796 72.958 -73.020 1.00 0.00 H new ATOM 0 HD22 LEU A 29 42.014 73.701 -74.083 1.00 0.00 H new ATOM 0 HD23 LEU A 29 40.768 74.713 -73.314 1.00 0.00 H new ATOM 448 N PHE A 30 37.842 75.824 -74.541 1.00 0.00 N ATOM 449 CA PHE A 30 36.806 75.819 -73.465 1.00 0.00 C ATOM 450 C PHE A 30 37.042 74.615 -72.558 1.00 0.00 C ATOM 451 O PHE A 30 37.653 73.634 -72.949 1.00 0.00 O ATOM 452 CB PHE A 30 35.405 75.725 -74.088 1.00 0.00 C ATOM 453 CG PHE A 30 34.777 77.099 -74.165 1.00 0.00 C ATOM 454 CD1 PHE A 30 34.160 77.649 -73.036 1.00 0.00 C ATOM 455 CD2 PHE A 30 34.803 77.818 -75.367 1.00 0.00 C ATOM 456 CE1 PHE A 30 33.571 78.918 -73.106 1.00 0.00 C ATOM 457 CE2 PHE A 30 34.212 79.087 -75.438 1.00 0.00 C ATOM 458 CZ PHE A 30 33.596 79.637 -74.307 1.00 0.00 C ATOM 0 H PHE A 30 37.481 75.635 -75.476 1.00 0.00 H new ATOM 0 HA PHE A 30 36.875 76.740 -72.887 1.00 0.00 H new ATOM 0 HB2 PHE A 30 35.470 75.290 -75.085 1.00 0.00 H new ATOM 0 HB3 PHE A 30 34.777 75.063 -73.492 1.00 0.00 H new ATOM 0 HD1 PHE A 30 34.138 77.094 -72.110 1.00 0.00 H new ATOM 0 HD2 PHE A 30 35.279 77.394 -76.239 1.00 0.00 H new ATOM 0 HE1 PHE A 30 33.097 79.342 -72.233 1.00 0.00 H new ATOM 0 HE2 PHE A 30 34.232 79.641 -76.365 1.00 0.00 H new ATOM 0 HZ PHE A 30 33.141 80.615 -74.361 1.00 0.00 H new ATOM 468 N THR A 31 36.610 74.705 -71.335 1.00 0.00 N ATOM 469 CA THR A 31 36.874 73.578 -70.368 1.00 0.00 C ATOM 470 C THR A 31 35.732 73.451 -69.352 1.00 0.00 C ATOM 471 O THR A 31 35.434 74.382 -68.640 1.00 0.00 O ATOM 472 CB THR A 31 38.203 73.901 -69.657 1.00 0.00 C ATOM 473 OG1 THR A 31 38.116 73.627 -68.262 1.00 0.00 O ATOM 474 CG2 THR A 31 38.527 75.387 -69.877 1.00 0.00 C ATOM 0 H THR A 31 36.090 75.496 -70.954 1.00 0.00 H new ATOM 0 HA THR A 31 36.937 72.625 -70.894 1.00 0.00 H new ATOM 0 HB THR A 31 38.992 73.275 -70.073 1.00 0.00 H new ATOM 0 HG1 THR A 31 38.283 74.449 -67.756 1.00 0.00 H new ATOM 0 HG21 THR A 31 39.465 75.632 -69.380 1.00 0.00 H new ATOM 0 HG22 THR A 31 38.620 75.585 -70.945 1.00 0.00 H new ATOM 0 HG23 THR A 31 37.726 75.999 -69.463 1.00 0.00 H new ATOM 482 N ASN A 32 35.101 72.301 -69.274 1.00 0.00 N ATOM 483 CA ASN A 32 33.980 72.123 -68.295 1.00 0.00 C ATOM 484 C ASN A 32 34.049 70.740 -67.622 1.00 0.00 C ATOM 485 O ASN A 32 34.295 69.731 -68.261 1.00 0.00 O ATOM 486 CB ASN A 32 32.632 72.281 -69.018 1.00 0.00 C ATOM 487 CG ASN A 32 32.624 71.480 -70.324 1.00 0.00 C ATOM 488 OD1 ASN A 32 32.188 70.351 -70.353 1.00 0.00 O ATOM 489 ND2 ASN A 32 33.082 72.022 -71.415 1.00 0.00 N ATOM 0 H ASN A 32 35.313 71.482 -69.844 1.00 0.00 H new ATOM 0 HA ASN A 32 34.075 72.886 -67.522 1.00 0.00 H new ATOM 0 HB2 ASN A 32 31.824 71.940 -68.371 1.00 0.00 H new ATOM 0 HB3 ASN A 32 32.448 73.334 -69.230 1.00 0.00 H new ATOM 0 HD21 ASN A 32 33.072 71.496 -72.289 1.00 0.00 H new ATOM 0 HD22 ASN A 32 33.450 72.973 -71.396 1.00 0.00 H new ATOM 496 N ARG A 33 33.811 70.702 -66.329 1.00 0.00 N ATOM 497 CA ARG A 33 33.828 69.408 -65.570 1.00 0.00 C ATOM 498 C ARG A 33 33.091 69.598 -64.240 1.00 0.00 C ATOM 499 O ARG A 33 32.157 68.878 -63.939 1.00 0.00 O ATOM 500 CB ARG A 33 35.275 68.963 -65.295 1.00 0.00 C ATOM 501 CG ARG A 33 35.302 67.471 -64.910 1.00 0.00 C ATOM 502 CD ARG A 33 34.788 67.280 -63.475 1.00 0.00 C ATOM 503 NE ARG A 33 35.319 65.995 -62.911 1.00 0.00 N ATOM 504 CZ ARG A 33 34.964 65.584 -61.723 1.00 0.00 C ATOM 505 NH1 ARG A 33 34.024 66.183 -61.060 1.00 0.00 N ATOM 506 NH2 ARG A 33 35.548 64.549 -61.203 1.00 0.00 N ATOM 0 H ARG A 33 33.603 71.524 -65.761 1.00 0.00 H new ATOM 0 HA ARG A 33 33.334 68.640 -66.166 1.00 0.00 H new ATOM 0 HB2 ARG A 33 35.890 69.130 -66.179 1.00 0.00 H new ATOM 0 HB3 ARG A 33 35.702 69.563 -64.491 1.00 0.00 H new ATOM 0 HG2 ARG A 33 34.686 66.899 -65.603 1.00 0.00 H new ATOM 0 HG3 ARG A 33 36.318 67.085 -64.994 1.00 0.00 H new ATOM 0 HD2 ARG A 33 35.101 68.118 -62.852 1.00 0.00 H new ATOM 0 HD3 ARG A 33 33.698 67.268 -63.468 1.00 0.00 H new ATOM 0 HE ARG A 33 35.967 65.434 -63.464 1.00 0.00 H new ATOM 0 HH11 ARG A 33 33.548 66.989 -61.465 1.00 0.00 H new ATOM 0 HH12 ARG A 33 33.760 65.848 -60.133 1.00 0.00 H new ATOM 0 HH21 ARG A 33 36.279 64.062 -61.721 1.00 0.00 H new ATOM 0 HH22 ARG A 33 35.276 64.222 -60.276 1.00 0.00 H new ATOM 520 N TRP A 34 33.503 70.568 -63.444 1.00 0.00 N ATOM 521 CA TRP A 34 32.824 70.816 -62.124 1.00 0.00 C ATOM 522 C TRP A 34 33.501 71.968 -61.338 1.00 0.00 C ATOM 523 O TRP A 34 32.863 72.619 -60.530 1.00 0.00 O ATOM 524 CB TRP A 34 32.811 69.503 -61.306 1.00 0.00 C ATOM 525 CG TRP A 34 33.943 69.421 -60.319 1.00 0.00 C ATOM 526 CD1 TRP A 34 33.776 69.241 -58.991 1.00 0.00 C ATOM 527 CD2 TRP A 34 35.389 69.477 -60.542 1.00 0.00 C ATOM 528 NE1 TRP A 34 35.014 69.190 -58.383 1.00 0.00 N ATOM 529 CE2 TRP A 34 36.039 69.334 -59.292 1.00 0.00 C ATOM 530 CE3 TRP A 34 36.193 69.641 -61.685 1.00 0.00 C ATOM 531 CZ2 TRP A 34 37.428 69.352 -59.182 1.00 0.00 C ATOM 532 CZ3 TRP A 34 37.592 69.661 -61.577 1.00 0.00 C ATOM 533 CH2 TRP A 34 38.208 69.517 -60.328 1.00 0.00 C ATOM 0 H TRP A 34 34.279 71.196 -63.653 1.00 0.00 H new ATOM 0 HA TRP A 34 31.797 71.132 -62.309 1.00 0.00 H new ATOM 0 HB2 TRP A 34 31.864 69.421 -60.773 1.00 0.00 H new ATOM 0 HB3 TRP A 34 32.867 68.655 -61.988 1.00 0.00 H new ATOM 0 HD1 TRP A 34 32.826 69.151 -58.486 1.00 0.00 H new ATOM 0 HE1 TRP A 34 35.153 69.061 -57.381 1.00 0.00 H new ATOM 0 HE3 TRP A 34 35.729 69.752 -62.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 37.898 69.239 -58.216 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 38.197 69.788 -62.463 1.00 0.00 H new ATOM 0 HH2 TRP A 34 39.285 69.534 -60.251 1.00 0.00 H new ATOM 544 N ASN A 35 34.773 72.227 -61.571 1.00 0.00 N ATOM 545 CA ASN A 35 35.485 73.332 -60.849 1.00 0.00 C ATOM 546 C ASN A 35 36.956 73.371 -61.300 1.00 0.00 C ATOM 547 O ASN A 35 37.865 73.071 -60.542 1.00 0.00 O ATOM 548 CB ASN A 35 35.415 73.100 -59.332 1.00 0.00 C ATOM 549 CG ASN A 35 35.639 74.427 -58.605 1.00 0.00 C ATOM 550 OD1 ASN A 35 36.759 74.800 -58.321 1.00 0.00 O ATOM 551 ND2 ASN A 35 34.616 75.165 -58.292 1.00 0.00 N ATOM 0 H ASN A 35 35.350 71.713 -62.237 1.00 0.00 H new ATOM 0 HA ASN A 35 35.005 74.282 -61.084 1.00 0.00 H new ATOM 0 HB2 ASN A 35 34.445 72.683 -59.061 1.00 0.00 H new ATOM 0 HB3 ASN A 35 36.170 72.374 -59.029 1.00 0.00 H new ATOM 0 HD21 ASN A 35 34.756 76.053 -57.810 1.00 0.00 H new ATOM 0 HD22 ASN A 35 33.673 74.856 -58.528 1.00 0.00 H new ATOM 558 N LEU A 36 37.196 73.742 -62.534 1.00 0.00 N ATOM 559 CA LEU A 36 38.604 73.807 -63.044 1.00 0.00 C ATOM 560 C LEU A 36 39.292 75.090 -62.538 1.00 0.00 C ATOM 561 O LEU A 36 40.509 75.178 -62.519 1.00 0.00 O ATOM 562 CB LEU A 36 38.594 73.783 -64.577 1.00 0.00 C ATOM 563 CG LEU A 36 38.979 72.381 -65.063 1.00 0.00 C ATOM 564 CD1 LEU A 36 37.789 71.738 -65.777 1.00 0.00 C ATOM 565 CD2 LEU A 36 40.155 72.478 -66.036 1.00 0.00 C ATOM 0 H LEU A 36 36.479 74.003 -63.211 1.00 0.00 H new ATOM 0 HA LEU A 36 39.160 72.945 -62.675 1.00 0.00 H new ATOM 0 HB2 LEU A 36 37.606 74.051 -64.950 1.00 0.00 H new ATOM 0 HB3 LEU A 36 39.294 74.521 -64.969 1.00 0.00 H new ATOM 0 HG LEU A 36 39.263 71.772 -64.205 1.00 0.00 H new ATOM 0 HD11 LEU A 36 38.066 70.742 -66.121 1.00 0.00 H new ATOM 0 HD12 LEU A 36 36.948 71.663 -65.087 1.00 0.00 H new ATOM 0 HD13 LEU A 36 37.503 72.351 -66.632 1.00 0.00 H new ATOM 0 HD21 LEU A 36 40.426 71.480 -66.380 1.00 0.00 H new ATOM 0 HD22 LEU A 36 39.870 73.091 -66.891 1.00 0.00 H new ATOM 0 HD23 LEU A 36 41.008 72.932 -65.532 1.00 0.00 H new ATOM 577 N GLN A 37 38.523 76.074 -62.115 1.00 0.00 N ATOM 578 CA GLN A 37 39.120 77.345 -61.593 1.00 0.00 C ATOM 579 C GLN A 37 40.150 77.017 -60.507 1.00 0.00 C ATOM 580 O GLN A 37 41.274 77.488 -60.539 1.00 0.00 O ATOM 581 CB GLN A 37 38.013 78.207 -60.980 1.00 0.00 C ATOM 582 CG GLN A 37 37.490 79.195 -62.020 1.00 0.00 C ATOM 583 CD GLN A 37 36.669 80.275 -61.318 1.00 0.00 C ATOM 584 OE1 GLN A 37 37.195 81.300 -60.940 1.00 0.00 O ATOM 585 NE2 GLN A 37 35.395 80.092 -61.122 1.00 0.00 N ATOM 0 H GLN A 37 37.503 76.047 -62.111 1.00 0.00 H new ATOM 0 HA GLN A 37 39.603 77.881 -62.410 1.00 0.00 H new ATOM 0 HB2 GLN A 37 37.200 77.573 -60.626 1.00 0.00 H new ATOM 0 HB3 GLN A 37 38.397 78.746 -60.114 1.00 0.00 H new ATOM 0 HG2 GLN A 37 38.322 79.647 -62.560 1.00 0.00 H new ATOM 0 HG3 GLN A 37 36.876 78.676 -62.756 1.00 0.00 H new ATOM 0 HE21 GLN A 37 34.949 79.231 -61.439 1.00 0.00 H new ATOM 0 HE22 GLN A 37 34.843 80.810 -60.652 1.00 0.00 H new ATOM 594 N SER A 38 39.760 76.208 -59.548 1.00 0.00 N ATOM 595 CA SER A 38 40.687 75.818 -58.435 1.00 0.00 C ATOM 596 C SER A 38 41.993 75.252 -59.008 1.00 0.00 C ATOM 597 O SER A 38 43.066 75.492 -58.476 1.00 0.00 O ATOM 598 CB SER A 38 40.010 74.753 -57.566 1.00 0.00 C ATOM 599 OG SER A 38 40.630 74.728 -56.286 1.00 0.00 O ATOM 0 H SER A 38 38.828 75.797 -59.489 1.00 0.00 H new ATOM 0 HA SER A 38 40.916 76.699 -57.835 1.00 0.00 H new ATOM 0 HB2 SER A 38 38.947 74.972 -57.464 1.00 0.00 H new ATOM 0 HB3 SER A 38 40.090 73.775 -58.041 1.00 0.00 H new ATOM 0 HG SER A 38 40.198 74.049 -55.727 1.00 0.00 H new ATOM 605 N LEU A 39 41.911 74.506 -60.087 1.00 0.00 N ATOM 606 CA LEU A 39 43.139 73.916 -60.708 1.00 0.00 C ATOM 607 C LEU A 39 43.953 75.020 -61.390 1.00 0.00 C ATOM 608 O LEU A 39 45.158 75.089 -61.234 1.00 0.00 O ATOM 609 CB LEU A 39 42.729 72.858 -61.743 1.00 0.00 C ATOM 610 CG LEU A 39 42.423 71.533 -61.038 1.00 0.00 C ATOM 611 CD1 LEU A 39 41.154 71.674 -60.197 1.00 0.00 C ATOM 612 CD2 LEU A 39 42.213 70.441 -62.085 1.00 0.00 C ATOM 0 H LEU A 39 41.039 74.280 -60.566 1.00 0.00 H new ATOM 0 HA LEU A 39 43.749 73.449 -59.935 1.00 0.00 H new ATOM 0 HB2 LEU A 39 41.853 73.197 -62.296 1.00 0.00 H new ATOM 0 HB3 LEU A 39 43.529 72.717 -62.469 1.00 0.00 H new ATOM 0 HG LEU A 39 43.259 71.269 -60.390 1.00 0.00 H new ATOM 0 HD11 LEU A 39 40.941 70.729 -59.698 1.00 0.00 H new ATOM 0 HD12 LEU A 39 41.298 72.454 -59.450 1.00 0.00 H new ATOM 0 HD13 LEU A 39 40.317 71.940 -60.843 1.00 0.00 H new ATOM 0 HD21 LEU A 39 41.995 69.496 -61.587 1.00 0.00 H new ATOM 0 HD22 LEU A 39 41.378 70.712 -62.731 1.00 0.00 H new ATOM 0 HD23 LEU A 39 43.116 70.334 -62.686 1.00 0.00 H new ATOM 624 N LEU A 40 43.308 75.891 -62.132 1.00 0.00 N ATOM 625 CA LEU A 40 44.056 77.000 -62.810 1.00 0.00 C ATOM 626 C LEU A 40 44.683 77.909 -61.744 1.00 0.00 C ATOM 627 O LEU A 40 45.806 78.365 -61.881 1.00 0.00 O ATOM 628 CB LEU A 40 43.094 77.819 -63.675 1.00 0.00 C ATOM 629 CG LEU A 40 42.601 76.969 -64.845 1.00 0.00 C ATOM 630 CD1 LEU A 40 41.285 77.543 -65.368 1.00 0.00 C ATOM 631 CD2 LEU A 40 43.644 76.990 -65.964 1.00 0.00 C ATOM 0 H LEU A 40 42.301 75.882 -62.297 1.00 0.00 H new ATOM 0 HA LEU A 40 44.837 76.579 -63.442 1.00 0.00 H new ATOM 0 HB2 LEU A 40 42.248 78.156 -63.076 1.00 0.00 H new ATOM 0 HB3 LEU A 40 43.596 78.712 -64.048 1.00 0.00 H new ATOM 0 HG LEU A 40 42.446 75.943 -64.511 1.00 0.00 H new ATOM 0 HD11 LEU A 40 40.931 76.939 -66.203 1.00 0.00 H new ATOM 0 HD12 LEU A 40 40.541 77.533 -64.571 1.00 0.00 H new ATOM 0 HD13 LEU A 40 41.443 78.568 -65.703 1.00 0.00 H new ATOM 0 HD21 LEU A 40 43.294 76.384 -66.799 1.00 0.00 H new ATOM 0 HD22 LEU A 40 43.797 78.016 -66.299 1.00 0.00 H new ATOM 0 HD23 LEU A 40 44.585 76.585 -65.592 1.00 0.00 H new ATOM 643 N LEU A 41 43.952 78.167 -60.683 1.00 0.00 N ATOM 644 CA LEU A 41 44.460 79.039 -59.580 1.00 0.00 C ATOM 645 C LEU A 41 45.579 78.318 -58.816 1.00 0.00 C ATOM 646 O LEU A 41 46.721 78.732 -58.854 1.00 0.00 O ATOM 647 CB LEU A 41 43.303 79.351 -58.622 1.00 0.00 C ATOM 648 CG LEU A 41 42.748 80.747 -58.911 1.00 0.00 C ATOM 649 CD1 LEU A 41 42.363 80.861 -60.388 1.00 0.00 C ATOM 650 CD2 LEU A 41 41.506 80.981 -58.051 1.00 0.00 C ATOM 0 H LEU A 41 43.011 77.803 -60.535 1.00 0.00 H new ATOM 0 HA LEU A 41 44.857 79.964 -59.998 1.00 0.00 H new ATOM 0 HB2 LEU A 41 42.515 78.606 -58.735 1.00 0.00 H new ATOM 0 HB3 LEU A 41 43.649 79.294 -57.590 1.00 0.00 H new ATOM 0 HG LEU A 41 43.510 81.491 -58.679 1.00 0.00 H new ATOM 0 HD11 LEU A 41 41.969 81.858 -60.585 1.00 0.00 H new ATOM 0 HD12 LEU A 41 43.243 80.690 -61.008 1.00 0.00 H new ATOM 0 HD13 LEU A 41 41.602 80.117 -60.624 1.00 0.00 H new ATOM 0 HD21 LEU A 41 41.106 81.975 -58.253 1.00 0.00 H new ATOM 0 HD22 LEU A 41 40.752 80.231 -58.289 1.00 0.00 H new ATOM 0 HD23 LEU A 41 41.774 80.905 -56.997 1.00 0.00 H new ATOM 662 N SER A 42 45.255 77.242 -58.131 1.00 0.00 N ATOM 663 CA SER A 42 46.293 76.477 -57.357 1.00 0.00 C ATOM 664 C SER A 42 47.545 76.259 -58.217 1.00 0.00 C ATOM 665 O SER A 42 48.661 76.290 -57.720 1.00 0.00 O ATOM 666 CB SER A 42 45.726 75.118 -56.936 1.00 0.00 C ATOM 667 OG SER A 42 45.178 74.459 -58.072 1.00 0.00 O ATOM 0 H SER A 42 44.311 76.859 -58.074 1.00 0.00 H new ATOM 0 HA SER A 42 46.563 77.053 -56.472 1.00 0.00 H new ATOM 0 HB2 SER A 42 46.511 74.507 -56.491 1.00 0.00 H new ATOM 0 HB3 SER A 42 44.958 75.253 -56.175 1.00 0.00 H new ATOM 0 HG SER A 42 44.203 74.562 -58.071 1.00 0.00 H new ATOM 673 N ALA A 43 47.369 76.042 -59.500 1.00 0.00 N ATOM 674 CA ALA A 43 48.540 75.830 -60.401 1.00 0.00 C ATOM 675 C ALA A 43 49.430 77.076 -60.392 1.00 0.00 C ATOM 676 O ALA A 43 50.522 77.041 -59.894 1.00 0.00 O ATOM 677 CB ALA A 43 48.047 75.570 -61.829 1.00 0.00 C ATOM 0 H ALA A 43 46.460 76.003 -59.960 1.00 0.00 H new ATOM 0 HA ALA A 43 49.113 74.972 -60.049 1.00 0.00 H new ATOM 0 HB1 ALA A 43 48.902 75.415 -62.487 1.00 0.00 H new ATOM 0 HB2 ALA A 43 47.416 74.682 -61.840 1.00 0.00 H new ATOM 0 HB3 ALA A 43 47.472 76.428 -62.177 1.00 0.00 H new ATOM 683 N GLN A 44 48.959 78.171 -60.935 1.00 0.00 N ATOM 684 CA GLN A 44 49.763 79.433 -60.976 1.00 0.00 C ATOM 685 C GLN A 44 50.154 79.859 -59.561 1.00 0.00 C ATOM 686 O GLN A 44 51.237 80.369 -59.338 1.00 0.00 O ATOM 687 CB GLN A 44 48.932 80.542 -61.634 1.00 0.00 C ATOM 688 CG GLN A 44 49.617 81.002 -62.926 1.00 0.00 C ATOM 689 CD GLN A 44 50.562 82.168 -62.627 1.00 0.00 C ATOM 690 OE1 GLN A 44 50.366 83.260 -63.116 1.00 0.00 O ATOM 691 NE2 GLN A 44 51.587 81.986 -61.843 1.00 0.00 N ATOM 0 H GLN A 44 48.034 78.245 -61.359 1.00 0.00 H new ATOM 0 HA GLN A 44 50.670 79.258 -61.554 1.00 0.00 H new ATOM 0 HB2 GLN A 44 47.929 80.177 -61.853 1.00 0.00 H new ATOM 0 HB3 GLN A 44 48.823 81.383 -60.949 1.00 0.00 H new ATOM 0 HG2 GLN A 44 50.174 80.175 -63.367 1.00 0.00 H new ATOM 0 HG3 GLN A 44 48.868 81.308 -63.656 1.00 0.00 H new ATOM 0 HE21 GLN A 44 51.756 81.069 -61.429 1.00 0.00 H new ATOM 0 HE22 GLN A 44 52.220 82.760 -61.643 1.00 0.00 H new ATOM 700 N ILE A 45 49.283 79.654 -58.608 1.00 0.00 N ATOM 701 CA ILE A 45 49.598 80.044 -57.205 1.00 0.00 C ATOM 702 C ILE A 45 50.818 79.253 -56.720 1.00 0.00 C ATOM 703 O ILE A 45 51.797 79.814 -56.262 1.00 0.00 O ATOM 704 CB ILE A 45 48.405 79.720 -56.307 1.00 0.00 C ATOM 705 CG1 ILE A 45 47.228 80.638 -56.655 1.00 0.00 C ATOM 706 CG2 ILE A 45 48.794 79.930 -54.840 1.00 0.00 C ATOM 707 CD1 ILE A 45 46.003 80.247 -55.823 1.00 0.00 C ATOM 0 H ILE A 45 48.364 79.232 -58.743 1.00 0.00 H new ATOM 0 HA ILE A 45 49.810 81.112 -57.164 1.00 0.00 H new ATOM 0 HB ILE A 45 48.113 78.682 -56.463 1.00 0.00 H new ATOM 0 HG12 ILE A 45 47.495 81.677 -56.460 1.00 0.00 H new ATOM 0 HG13 ILE A 45 46.997 80.562 -57.718 1.00 0.00 H new ATOM 0 HG21 ILE A 45 47.942 79.698 -54.201 1.00 0.00 H new ATOM 0 HG22 ILE A 45 49.626 79.274 -54.587 1.00 0.00 H new ATOM 0 HG23 ILE A 45 49.091 80.968 -54.687 1.00 0.00 H new ATOM 0 HD11 ILE A 45 45.169 80.902 -56.074 1.00 0.00 H new ATOM 0 HD12 ILE A 45 45.731 79.214 -56.039 1.00 0.00 H new ATOM 0 HD13 ILE A 45 46.236 80.346 -54.763 1.00 0.00 H new ATOM 719 N THR A 46 50.748 77.947 -56.825 1.00 0.00 N ATOM 720 CA THR A 46 51.882 77.072 -56.386 1.00 0.00 C ATOM 721 C THR A 46 52.973 77.081 -57.460 1.00 0.00 C ATOM 722 O THR A 46 54.153 77.067 -57.162 1.00 0.00 O ATOM 723 CB THR A 46 51.374 75.634 -56.176 1.00 0.00 C ATOM 724 OG1 THR A 46 50.821 75.123 -57.385 1.00 0.00 O ATOM 725 CG2 THR A 46 50.305 75.625 -55.080 1.00 0.00 C ATOM 0 H THR A 46 49.944 77.444 -57.201 1.00 0.00 H new ATOM 0 HA THR A 46 52.291 77.448 -55.448 1.00 0.00 H new ATOM 0 HB THR A 46 52.212 75.004 -55.878 1.00 0.00 H new ATOM 0 HG1 THR A 46 49.850 75.254 -57.382 1.00 0.00 H new ATOM 0 HG21 THR A 46 49.945 74.607 -54.931 1.00 0.00 H new ATOM 0 HG22 THR A 46 50.734 75.998 -54.150 1.00 0.00 H new ATOM 0 HG23 THR A 46 49.473 76.264 -55.378 1.00 0.00 H new ATOM 733 N GLY A 47 52.574 77.110 -58.703 1.00 0.00 N ATOM 734 CA GLY A 47 53.549 77.126 -59.830 1.00 0.00 C ATOM 735 C GLY A 47 52.864 77.681 -61.070 1.00 0.00 C ATOM 736 O GLY A 47 52.773 78.878 -61.233 1.00 0.00 O ATOM 0 H GLY A 47 51.595 77.124 -58.989 1.00 0.00 H new ATOM 0 HA2 GLY A 47 54.413 77.738 -59.572 1.00 0.00 H new ATOM 0 HA3 GLY A 47 53.918 76.119 -60.023 1.00 0.00 H new ATOM 740 N MET A 48 52.359 76.801 -61.913 1.00 0.00 N ATOM 741 CA MET A 48 51.622 77.205 -63.168 1.00 0.00 C ATOM 742 C MET A 48 51.965 76.249 -64.320 1.00 0.00 C ATOM 743 O MET A 48 52.467 76.662 -65.347 1.00 0.00 O ATOM 744 CB MET A 48 51.943 78.649 -63.605 1.00 0.00 C ATOM 745 CG MET A 48 53.434 78.803 -63.932 1.00 0.00 C ATOM 746 SD MET A 48 53.886 80.555 -63.856 1.00 0.00 S ATOM 747 CE MET A 48 53.013 81.088 -65.352 1.00 0.00 C ATOM 0 H MET A 48 52.428 75.792 -61.781 1.00 0.00 H new ATOM 0 HA MET A 48 50.559 77.152 -62.934 1.00 0.00 H new ATOM 0 HB2 MET A 48 51.346 78.910 -64.479 1.00 0.00 H new ATOM 0 HB3 MET A 48 51.667 79.343 -62.811 1.00 0.00 H new ATOM 0 HG2 MET A 48 54.034 78.230 -63.225 1.00 0.00 H new ATOM 0 HG3 MET A 48 53.643 78.404 -64.925 1.00 0.00 H new ATOM 0 HE1 MET A 48 53.302 82.110 -65.597 1.00 0.00 H new ATOM 0 HE2 MET A 48 53.273 80.428 -66.180 1.00 0.00 H new ATOM 0 HE3 MET A 48 51.937 81.047 -65.180 1.00 0.00 H new ATOM 757 N THR A 49 51.682 74.978 -64.176 1.00 0.00 N ATOM 758 CA THR A 49 51.973 74.019 -65.290 1.00 0.00 C ATOM 759 C THR A 49 51.487 72.617 -64.910 1.00 0.00 C ATOM 760 O THR A 49 52.263 71.690 -64.729 1.00 0.00 O ATOM 761 CB THR A 49 53.477 74.028 -65.628 1.00 0.00 C ATOM 762 OG1 THR A 49 53.765 72.987 -66.555 1.00 0.00 O ATOM 763 CG2 THR A 49 54.314 73.831 -64.362 1.00 0.00 C ATOM 0 H THR A 49 51.265 74.564 -63.342 1.00 0.00 H new ATOM 0 HA THR A 49 51.435 74.331 -66.185 1.00 0.00 H new ATOM 0 HB THR A 49 53.729 74.993 -66.068 1.00 0.00 H new ATOM 0 HG1 THR A 49 53.605 72.118 -66.131 1.00 0.00 H new ATOM 0 HG21 THR A 49 55.373 73.840 -64.621 1.00 0.00 H new ATOM 0 HG22 THR A 49 54.105 74.637 -63.659 1.00 0.00 H new ATOM 0 HG23 THR A 49 54.061 72.875 -63.904 1.00 0.00 H new ATOM 771 N VAL A 50 50.188 72.470 -64.802 1.00 0.00 N ATOM 772 CA VAL A 50 49.584 71.147 -64.445 1.00 0.00 C ATOM 773 C VAL A 50 49.589 70.239 -65.682 1.00 0.00 C ATOM 774 O VAL A 50 50.423 70.378 -66.562 1.00 0.00 O ATOM 775 CB VAL A 50 48.136 71.363 -63.949 1.00 0.00 C ATOM 776 CG1 VAL A 50 48.094 72.540 -62.998 1.00 0.00 C ATOM 777 CG2 VAL A 50 47.209 71.651 -65.124 1.00 0.00 C ATOM 0 H VAL A 50 49.512 73.220 -64.948 1.00 0.00 H new ATOM 0 HA VAL A 50 50.165 70.675 -63.653 1.00 0.00 H new ATOM 0 HB VAL A 50 47.806 70.457 -63.441 1.00 0.00 H new ATOM 0 HG11 VAL A 50 47.072 72.690 -62.650 1.00 0.00 H new ATOM 0 HG12 VAL A 50 48.743 72.342 -62.145 1.00 0.00 H new ATOM 0 HG13 VAL A 50 48.437 73.437 -63.514 1.00 0.00 H new ATOM 0 HG21 VAL A 50 46.193 71.801 -64.758 1.00 0.00 H new ATOM 0 HG22 VAL A 50 47.545 72.550 -65.640 1.00 0.00 H new ATOM 0 HG23 VAL A 50 47.225 70.808 -65.815 1.00 0.00 H new ATOM 787 N THR A 51 48.663 69.321 -65.769 1.00 0.00 N ATOM 788 CA THR A 51 48.604 68.434 -66.956 1.00 0.00 C ATOM 789 C THR A 51 47.171 68.423 -67.496 1.00 0.00 C ATOM 790 O THR A 51 46.267 67.964 -66.834 1.00 0.00 O ATOM 791 CB THR A 51 49.050 67.006 -66.594 1.00 0.00 C ATOM 792 OG1 THR A 51 50.367 67.026 -66.046 1.00 0.00 O ATOM 793 CG2 THR A 51 49.049 66.134 -67.850 1.00 0.00 C ATOM 0 H THR A 51 47.945 69.151 -65.065 1.00 0.00 H new ATOM 0 HA THR A 51 49.283 68.811 -67.721 1.00 0.00 H new ATOM 0 HB THR A 51 48.357 66.599 -65.858 1.00 0.00 H new ATOM 0 HG1 THR A 51 50.702 66.109 -65.966 1.00 0.00 H new ATOM 0 HG21 THR A 51 49.365 65.123 -67.592 1.00 0.00 H new ATOM 0 HG22 THR A 51 48.044 66.103 -68.271 1.00 0.00 H new ATOM 0 HG23 THR A 51 49.737 66.553 -68.584 1.00 0.00 H new ATOM 801 N ILE A 52 46.964 68.933 -68.691 1.00 0.00 N ATOM 802 CA ILE A 52 45.580 68.967 -69.290 1.00 0.00 C ATOM 803 C ILE A 52 45.407 67.790 -70.258 1.00 0.00 C ATOM 804 O ILE A 52 46.237 67.567 -71.128 1.00 0.00 O ATOM 805 CB ILE A 52 45.374 70.289 -70.048 1.00 0.00 C ATOM 806 CG1 ILE A 52 45.685 71.469 -69.120 1.00 0.00 C ATOM 807 CG2 ILE A 52 43.922 70.396 -70.530 1.00 0.00 C ATOM 808 CD1 ILE A 52 44.902 71.323 -67.818 1.00 0.00 C ATOM 0 H ILE A 52 47.695 69.329 -69.282 1.00 0.00 H new ATOM 0 HA ILE A 52 44.843 68.890 -68.491 1.00 0.00 H new ATOM 0 HB ILE A 52 46.043 70.311 -70.908 1.00 0.00 H new ATOM 0 HG12 ILE A 52 46.754 71.506 -68.910 1.00 0.00 H new ATOM 0 HG13 ILE A 52 45.423 72.407 -69.609 1.00 0.00 H new ATOM 0 HG21 ILE A 52 43.785 71.335 -71.066 1.00 0.00 H new ATOM 0 HG22 ILE A 52 43.697 69.562 -71.195 1.00 0.00 H new ATOM 0 HG23 ILE A 52 43.251 70.366 -69.672 1.00 0.00 H new ATOM 0 HD11 ILE A 52 45.127 72.164 -67.162 1.00 0.00 H new ATOM 0 HD12 ILE A 52 43.834 71.308 -68.035 1.00 0.00 H new ATOM 0 HD13 ILE A 52 45.185 70.393 -67.325 1.00 0.00 H new ATOM 820 N LYS A 53 44.350 67.015 -70.108 1.00 0.00 N ATOM 821 CA LYS A 53 44.172 65.834 -71.014 1.00 0.00 C ATOM 822 C LYS A 53 42.730 65.309 -71.057 1.00 0.00 C ATOM 823 O LYS A 53 41.854 65.769 -70.345 1.00 0.00 O ATOM 824 CB LYS A 53 45.058 64.707 -70.497 1.00 0.00 C ATOM 825 CG LYS A 53 44.858 64.522 -68.993 1.00 0.00 C ATOM 826 CD LYS A 53 45.141 63.066 -68.629 1.00 0.00 C ATOM 827 CE LYS A 53 45.824 62.983 -67.264 1.00 0.00 C ATOM 828 NZ LYS A 53 46.025 61.547 -66.925 1.00 0.00 N ATOM 0 H LYS A 53 43.618 67.148 -69.410 1.00 0.00 H new ATOM 0 HA LYS A 53 44.435 66.157 -72.021 1.00 0.00 H new ATOM 0 HB2 LYS A 53 44.821 63.780 -71.019 1.00 0.00 H new ATOM 0 HB3 LYS A 53 46.104 64.932 -70.707 1.00 0.00 H new ATOM 0 HG2 LYS A 53 45.524 65.185 -68.440 1.00 0.00 H new ATOM 0 HG3 LYS A 53 43.839 64.789 -68.713 1.00 0.00 H new ATOM 0 HD2 LYS A 53 44.209 62.501 -68.612 1.00 0.00 H new ATOM 0 HD3 LYS A 53 45.776 62.611 -69.389 1.00 0.00 H new ATOM 0 HE2 LYS A 53 46.781 63.505 -67.286 1.00 0.00 H new ATOM 0 HE3 LYS A 53 45.213 63.470 -66.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 46.474 61.471 -65.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 45.105 61.062 -66.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 46.637 61.104 -67.640 1.00 0.00 H new ATOM 842 N THR A 54 42.518 64.292 -71.882 1.00 0.00 N ATOM 843 CA THR A 54 41.179 63.617 -72.017 1.00 0.00 C ATOM 844 C THR A 54 40.128 64.534 -72.655 1.00 0.00 C ATOM 845 O THR A 54 40.269 65.745 -72.704 1.00 0.00 O ATOM 846 CB THR A 54 40.685 63.124 -70.643 1.00 0.00 C ATOM 847 OG1 THR A 54 40.128 64.201 -69.895 1.00 0.00 O ATOM 848 CG2 THR A 54 41.858 62.516 -69.873 1.00 0.00 C ATOM 0 H THR A 54 43.242 63.896 -72.481 1.00 0.00 H new ATOM 0 HA THR A 54 41.316 62.764 -72.681 1.00 0.00 H new ATOM 0 HB THR A 54 39.912 62.371 -70.795 1.00 0.00 H new ATOM 0 HG1 THR A 54 40.837 64.835 -69.657 1.00 0.00 H new ATOM 0 HG21 THR A 54 41.512 62.166 -68.900 1.00 0.00 H new ATOM 0 HG22 THR A 54 42.267 61.677 -70.436 1.00 0.00 H new ATOM 0 HG23 THR A 54 42.632 63.271 -69.733 1.00 0.00 H new ATOM 856 N ASN A 55 39.067 63.935 -73.147 1.00 0.00 N ATOM 857 CA ASN A 55 37.960 64.703 -73.795 1.00 0.00 C ATOM 858 C ASN A 55 38.490 65.526 -74.983 1.00 0.00 C ATOM 859 O ASN A 55 38.277 66.720 -75.063 1.00 0.00 O ATOM 860 CB ASN A 55 37.303 65.624 -72.757 1.00 0.00 C ATOM 861 CG ASN A 55 35.915 66.051 -73.247 1.00 0.00 C ATOM 862 OD1 ASN A 55 35.697 67.202 -73.552 1.00 0.00 O ATOM 863 ND2 ASN A 55 34.960 65.170 -73.333 1.00 0.00 N ATOM 0 H ASN A 55 38.922 62.926 -73.125 1.00 0.00 H new ATOM 0 HA ASN A 55 37.218 64.002 -74.177 1.00 0.00 H new ATOM 0 HB2 ASN A 55 37.218 65.108 -71.801 1.00 0.00 H new ATOM 0 HB3 ASN A 55 37.926 66.503 -72.591 1.00 0.00 H new ATOM 0 HD21 ASN A 55 34.034 65.451 -73.656 1.00 0.00 H new ATOM 0 HD22 ASN A 55 35.138 64.199 -73.077 1.00 0.00 H new ATOM 870 N ALA A 56 39.175 64.890 -75.907 1.00 0.00 N ATOM 871 CA ALA A 56 39.708 65.617 -77.112 1.00 0.00 C ATOM 872 C ALA A 56 40.931 66.468 -76.748 1.00 0.00 C ATOM 873 O ALA A 56 41.986 66.324 -77.335 1.00 0.00 O ATOM 874 CB ALA A 56 38.613 66.530 -77.682 1.00 0.00 C ATOM 0 H ALA A 56 39.390 63.893 -75.880 1.00 0.00 H new ATOM 0 HA ALA A 56 40.008 64.876 -77.853 1.00 0.00 H new ATOM 0 HB1 ALA A 56 38.997 67.058 -78.555 1.00 0.00 H new ATOM 0 HB2 ALA A 56 37.752 65.928 -77.972 1.00 0.00 H new ATOM 0 HB3 ALA A 56 38.312 67.253 -76.924 1.00 0.00 H new ATOM 880 N CYS A 57 40.784 67.369 -75.801 1.00 0.00 N ATOM 881 CA CYS A 57 41.920 68.266 -75.396 1.00 0.00 C ATOM 882 C CYS A 57 42.205 69.282 -76.524 1.00 0.00 C ATOM 883 O CYS A 57 43.300 69.796 -76.656 1.00 0.00 O ATOM 884 CB CYS A 57 43.160 67.409 -75.102 1.00 0.00 C ATOM 885 SG CYS A 57 44.551 68.457 -74.614 1.00 0.00 S ATOM 0 H CYS A 57 39.917 67.523 -75.286 1.00 0.00 H new ATOM 0 HA CYS A 57 41.657 68.820 -74.495 1.00 0.00 H new ATOM 0 HB2 CYS A 57 42.937 66.697 -74.308 1.00 0.00 H new ATOM 0 HB3 CYS A 57 43.426 66.829 -75.985 1.00 0.00 H new ATOM 890 N HIS A 58 41.207 69.587 -77.325 1.00 0.00 N ATOM 891 CA HIS A 58 41.380 70.574 -78.438 1.00 0.00 C ATOM 892 C HIS A 58 40.009 71.175 -78.779 1.00 0.00 C ATOM 893 O HIS A 58 39.110 70.466 -79.186 1.00 0.00 O ATOM 894 CB HIS A 58 41.951 69.858 -79.670 1.00 0.00 C ATOM 895 CG HIS A 58 43.368 70.299 -79.914 1.00 0.00 C ATOM 896 ND1 HIS A 58 43.689 71.256 -80.861 1.00 0.00 N ATOM 897 CD2 HIS A 58 44.558 69.912 -79.353 1.00 0.00 C ATOM 898 CE1 HIS A 58 45.027 71.408 -80.846 1.00 0.00 C ATOM 899 NE2 HIS A 58 45.605 70.612 -79.944 1.00 0.00 N ATOM 0 H HIS A 58 40.271 69.188 -77.252 1.00 0.00 H new ATOM 0 HA HIS A 58 42.066 71.365 -78.135 1.00 0.00 H new ATOM 0 HB2 HIS A 58 41.919 68.779 -79.521 1.00 0.00 H new ATOM 0 HB3 HIS A 58 41.338 70.077 -80.544 1.00 0.00 H new ATOM 0 HD2 HIS A 58 44.666 69.175 -78.571 1.00 0.00 H new ATOM 0 HE1 HIS A 58 45.566 72.091 -81.486 1.00 0.00 H new ATOM 0 HE2 HIS A 58 46.600 70.534 -79.733 1.00 0.00 H new ATOM 907 N ASN A 59 39.839 72.471 -78.594 1.00 0.00 N ATOM 908 CA ASN A 59 38.514 73.120 -78.879 1.00 0.00 C ATOM 909 C ASN A 59 37.439 72.435 -78.016 1.00 0.00 C ATOM 910 O ASN A 59 36.744 71.535 -78.459 1.00 0.00 O ATOM 911 CB ASN A 59 38.178 72.978 -80.370 1.00 0.00 C ATOM 912 CG ASN A 59 37.000 73.887 -80.717 1.00 0.00 C ATOM 913 OD1 ASN A 59 37.087 75.090 -80.591 1.00 0.00 O ATOM 914 ND2 ASN A 59 35.892 73.362 -81.147 1.00 0.00 N ATOM 0 H ASN A 59 40.563 73.105 -78.257 1.00 0.00 H new ATOM 0 HA ASN A 59 38.553 74.182 -78.637 1.00 0.00 H new ATOM 0 HB2 ASN A 59 39.045 73.242 -80.976 1.00 0.00 H new ATOM 0 HB3 ASN A 59 37.931 71.942 -80.601 1.00 0.00 H new ATOM 0 HD21 ASN A 59 35.099 73.961 -81.377 1.00 0.00 H new ATOM 0 HD22 ASN A 59 35.815 72.351 -81.254 1.00 0.00 H new ATOM 921 N GLY A 60 37.331 72.834 -76.770 1.00 0.00 N ATOM 922 CA GLY A 60 36.347 72.184 -75.849 1.00 0.00 C ATOM 923 C GLY A 60 36.911 70.812 -75.477 1.00 0.00 C ATOM 924 O GLY A 60 36.394 69.791 -75.882 1.00 0.00 O ATOM 0 H GLY A 60 37.883 73.583 -76.352 1.00 0.00 H new ATOM 0 HA2 GLY A 60 36.196 72.792 -74.957 1.00 0.00 H new ATOM 0 HA3 GLY A 60 35.376 72.082 -76.334 1.00 0.00 H new ATOM 928 N GLY A 61 37.997 70.792 -74.738 1.00 0.00 N ATOM 929 CA GLY A 61 38.638 69.491 -74.365 1.00 0.00 C ATOM 930 C GLY A 61 39.040 69.477 -72.885 1.00 0.00 C ATOM 931 O GLY A 61 38.739 70.392 -72.142 1.00 0.00 O ATOM 0 H GLY A 61 38.467 71.622 -74.377 1.00 0.00 H new ATOM 0 HA2 GLY A 61 37.948 68.672 -74.565 1.00 0.00 H new ATOM 0 HA3 GLY A 61 39.519 69.325 -74.986 1.00 0.00 H new ATOM 935 N GLY A 62 39.724 68.435 -72.457 1.00 0.00 N ATOM 936 CA GLY A 62 40.156 68.336 -71.025 1.00 0.00 C ATOM 937 C GLY A 62 38.919 68.220 -70.134 1.00 0.00 C ATOM 938 O GLY A 62 38.344 69.213 -69.735 1.00 0.00 O ATOM 0 H GLY A 62 40.001 67.648 -73.043 1.00 0.00 H new ATOM 0 HA2 GLY A 62 40.801 67.469 -70.886 1.00 0.00 H new ATOM 0 HA3 GLY A 62 40.738 69.214 -70.747 1.00 0.00 H new ATOM 942 N PHE A 63 38.484 67.018 -69.837 1.00 0.00 N ATOM 943 CA PHE A 63 37.258 66.867 -68.997 1.00 0.00 C ATOM 944 C PHE A 63 37.614 66.612 -67.520 1.00 0.00 C ATOM 945 O PHE A 63 37.576 67.524 -66.718 1.00 0.00 O ATOM 946 CB PHE A 63 36.398 65.718 -69.542 1.00 0.00 C ATOM 947 CG PHE A 63 35.132 65.594 -68.724 1.00 0.00 C ATOM 948 CD1 PHE A 63 34.248 66.677 -68.633 1.00 0.00 C ATOM 949 CD2 PHE A 63 34.845 64.400 -68.053 1.00 0.00 C ATOM 950 CE1 PHE A 63 33.079 66.564 -67.872 1.00 0.00 C ATOM 951 CE2 PHE A 63 33.675 64.288 -67.291 1.00 0.00 C ATOM 952 CZ PHE A 63 32.792 65.370 -67.201 1.00 0.00 C ATOM 0 H PHE A 63 38.920 66.146 -70.137 1.00 0.00 H new ATOM 0 HA PHE A 63 36.694 67.799 -69.044 1.00 0.00 H new ATOM 0 HB2 PHE A 63 36.150 65.901 -70.587 1.00 0.00 H new ATOM 0 HB3 PHE A 63 36.958 64.784 -69.506 1.00 0.00 H new ATOM 0 HD1 PHE A 63 34.469 67.599 -69.150 1.00 0.00 H new ATOM 0 HD2 PHE A 63 35.526 63.565 -68.123 1.00 0.00 H new ATOM 0 HE1 PHE A 63 32.398 67.399 -67.803 1.00 0.00 H new ATOM 0 HE2 PHE A 63 33.454 63.366 -66.773 1.00 0.00 H new ATOM 0 HZ PHE A 63 31.890 65.284 -66.614 1.00 0.00 H new ATOM 962 N SER A 64 37.922 65.385 -67.142 1.00 0.00 N ATOM 963 CA SER A 64 38.220 65.112 -65.697 1.00 0.00 C ATOM 964 C SER A 64 39.599 64.479 -65.481 1.00 0.00 C ATOM 965 O SER A 64 39.752 63.623 -64.632 1.00 0.00 O ATOM 966 CB SER A 64 37.137 64.185 -65.125 1.00 0.00 C ATOM 967 OG SER A 64 37.032 64.387 -63.713 1.00 0.00 O ATOM 0 H SER A 64 37.978 64.577 -67.762 1.00 0.00 H new ATOM 0 HA SER A 64 38.225 66.072 -65.180 1.00 0.00 H new ATOM 0 HB2 SER A 64 36.179 64.388 -65.604 1.00 0.00 H new ATOM 0 HB3 SER A 64 37.385 63.145 -65.337 1.00 0.00 H new ATOM 0 HG SER A 64 37.911 64.261 -63.298 1.00 0.00 H new ATOM 973 N GLU A 65 40.615 64.895 -66.200 1.00 0.00 N ATOM 974 CA GLU A 65 41.962 64.309 -65.960 1.00 0.00 C ATOM 975 C GLU A 65 43.006 65.423 -66.023 1.00 0.00 C ATOM 976 O GLU A 65 43.383 65.880 -67.088 1.00 0.00 O ATOM 977 CB GLU A 65 42.243 63.241 -67.006 1.00 0.00 C ATOM 978 CG GLU A 65 41.617 61.916 -66.546 1.00 0.00 C ATOM 979 CD GLU A 65 42.688 61.005 -65.931 1.00 0.00 C ATOM 980 OE1 GLU A 65 43.704 60.780 -66.577 1.00 0.00 O ATOM 981 OE2 GLU A 65 42.477 60.546 -64.822 1.00 0.00 O ATOM 0 H GLU A 65 40.567 65.605 -66.931 1.00 0.00 H new ATOM 0 HA GLU A 65 42.003 63.844 -64.975 1.00 0.00 H new ATOM 0 HB2 GLU A 65 41.829 63.539 -67.969 1.00 0.00 H new ATOM 0 HB3 GLU A 65 43.318 63.122 -67.144 1.00 0.00 H new ATOM 0 HG2 GLU A 65 40.833 62.111 -65.815 1.00 0.00 H new ATOM 0 HG3 GLU A 65 41.146 61.415 -67.392 1.00 0.00 H new ATOM 988 N VAL A 66 43.461 65.877 -64.882 1.00 0.00 N ATOM 989 CA VAL A 66 44.474 66.979 -64.864 1.00 0.00 C ATOM 990 C VAL A 66 45.462 66.758 -63.713 1.00 0.00 C ATOM 991 O VAL A 66 45.075 66.437 -62.606 1.00 0.00 O ATOM 992 CB VAL A 66 43.770 68.340 -64.698 1.00 0.00 C ATOM 993 CG1 VAL A 66 44.800 69.436 -64.411 1.00 0.00 C ATOM 994 CG2 VAL A 66 43.012 68.695 -65.982 1.00 0.00 C ATOM 0 H VAL A 66 43.177 65.534 -63.964 1.00 0.00 H new ATOM 0 HA VAL A 66 45.019 66.976 -65.808 1.00 0.00 H new ATOM 0 HB VAL A 66 43.072 68.269 -63.864 1.00 0.00 H new ATOM 0 HG11 VAL A 66 44.291 70.393 -64.296 1.00 0.00 H new ATOM 0 HG12 VAL A 66 45.338 69.198 -63.493 1.00 0.00 H new ATOM 0 HG13 VAL A 66 45.506 69.498 -65.239 1.00 0.00 H new ATOM 0 HG21 VAL A 66 42.517 69.658 -65.858 1.00 0.00 H new ATOM 0 HG22 VAL A 66 43.713 68.752 -66.814 1.00 0.00 H new ATOM 0 HG23 VAL A 66 42.266 67.927 -66.188 1.00 0.00 H new ATOM 1004 N ILE A 67 46.737 66.935 -63.966 1.00 0.00 N ATOM 1005 CA ILE A 67 47.753 66.734 -62.875 1.00 0.00 C ATOM 1006 C ILE A 67 48.248 68.081 -62.358 1.00 0.00 C ATOM 1007 O ILE A 67 48.768 68.877 -63.099 1.00 0.00 O ATOM 1008 CB ILE A 67 48.928 65.909 -63.388 1.00 0.00 C ATOM 1009 CG1 ILE A 67 48.465 64.476 -63.563 1.00 0.00 C ATOM 1010 CG2 ILE A 67 50.061 65.940 -62.365 1.00 0.00 C ATOM 1011 CD1 ILE A 67 48.777 64.003 -64.984 1.00 0.00 C ATOM 0 H ILE A 67 47.119 67.208 -64.872 1.00 0.00 H new ATOM 0 HA ILE A 67 47.277 66.195 -62.056 1.00 0.00 H new ATOM 0 HB ILE A 67 49.283 66.317 -64.335 1.00 0.00 H new ATOM 0 HG12 ILE A 67 48.962 63.832 -62.838 1.00 0.00 H new ATOM 0 HG13 ILE A 67 47.394 64.404 -63.372 1.00 0.00 H new ATOM 0 HG21 ILE A 67 50.900 65.350 -62.733 1.00 0.00 H new ATOM 0 HG22 ILE A 67 50.382 66.970 -62.209 1.00 0.00 H new ATOM 0 HG23 ILE A 67 49.710 65.523 -61.421 1.00 0.00 H new ATOM 0 HD11 ILE A 67 48.443 62.973 -65.106 1.00 0.00 H new ATOM 0 HD12 ILE A 67 48.259 64.640 -65.701 1.00 0.00 H new ATOM 0 HD13 ILE A 67 49.851 64.059 -65.158 1.00 0.00 H new ATOM 1023 N PHE A 68 48.068 68.336 -61.088 1.00 0.00 N ATOM 1024 CA PHE A 68 48.488 69.653 -60.501 1.00 0.00 C ATOM 1025 C PHE A 68 50.006 69.813 -60.468 1.00 0.00 C ATOM 1026 O PHE A 68 50.743 68.849 -60.255 1.00 0.00 O ATOM 1027 CB PHE A 68 47.949 69.799 -59.073 1.00 0.00 C ATOM 1028 CG PHE A 68 46.502 69.379 -59.018 1.00 0.00 C ATOM 1029 CD1 PHE A 68 45.727 69.356 -60.184 1.00 0.00 C ATOM 1030 CD2 PHE A 68 45.944 68.993 -57.801 1.00 0.00 C ATOM 1031 CE1 PHE A 68 44.399 68.950 -60.132 1.00 0.00 C ATOM 1032 CE2 PHE A 68 44.612 68.587 -57.744 1.00 0.00 C ATOM 1033 CZ PHE A 68 43.834 68.563 -58.910 1.00 0.00 C ATOM 0 H PHE A 68 47.646 67.687 -60.424 1.00 0.00 H new ATOM 0 HA PHE A 68 48.072 70.428 -61.145 1.00 0.00 H new ATOM 0 HB2 PHE A 68 48.539 69.188 -58.389 1.00 0.00 H new ATOM 0 HB3 PHE A 68 48.048 70.833 -58.743 1.00 0.00 H new ATOM 0 HD1 PHE A 68 46.162 69.655 -61.126 1.00 0.00 H new ATOM 0 HD2 PHE A 68 46.543 69.008 -56.903 1.00 0.00 H new ATOM 0 HE1 PHE A 68 43.803 68.933 -61.033 1.00 0.00 H new ATOM 0 HE2 PHE A 68 44.179 68.290 -56.800 1.00 0.00 H new ATOM 0 HZ PHE A 68 42.802 68.247 -58.866 1.00 0.00 H new ATOM 1043 N ARG A 69 50.427 71.061 -60.655 1.00 0.00 N ATOM 1044 CA ARG A 69 51.872 71.486 -60.641 1.00 0.00 C ATOM 1045 C ARG A 69 52.047 72.765 -61.516 1.00 0.00 C ATOM 1046 O ARG A 69 51.056 73.266 -62.041 1.00 0.00 O ATOM 1047 CB ARG A 69 52.789 70.367 -61.164 1.00 0.00 C ATOM 1048 CG ARG A 69 53.511 69.658 -59.995 1.00 0.00 C ATOM 1049 CD ARG A 69 53.906 70.647 -58.882 1.00 0.00 C ATOM 1050 NE ARG A 69 54.530 71.872 -59.461 1.00 0.00 N ATOM 1051 CZ ARG A 69 55.580 71.784 -60.209 1.00 0.00 C ATOM 1052 NH1 ARG A 69 56.636 71.158 -59.782 1.00 0.00 N ATOM 1053 NH2 ARG A 69 55.558 72.314 -61.387 1.00 0.00 N ATOM 1054 OXT ARG A 69 53.168 73.238 -61.635 1.00 0.00 O ATOM 0 H ARG A 69 49.785 71.835 -60.825 1.00 0.00 H new ATOM 0 HA ARG A 69 52.156 71.700 -59.611 1.00 0.00 H new ATOM 0 HB2 ARG A 69 52.201 69.642 -61.727 1.00 0.00 H new ATOM 0 HB3 ARG A 69 53.524 70.785 -61.852 1.00 0.00 H new ATOM 0 HG2 ARG A 69 52.862 68.886 -59.582 1.00 0.00 H new ATOM 0 HG3 ARG A 69 54.404 69.157 -60.370 1.00 0.00 H new ATOM 0 HD2 ARG A 69 53.024 70.921 -58.303 1.00 0.00 H new ATOM 0 HD3 ARG A 69 54.603 70.168 -58.194 1.00 0.00 H new ATOM 0 HE ARG A 69 54.124 72.787 -59.265 1.00 0.00 H new ATOM 0 HH11 ARG A 69 56.637 70.734 -58.854 1.00 0.00 H new ATOM 0 HH12 ARG A 69 57.463 71.090 -60.375 1.00 0.00 H new ATOM 0 HH21 ARG A 69 54.720 72.794 -61.715 1.00 0.00 H new ATOM 0 HH22 ARG A 69 56.379 72.253 -61.989 1.00 0.00 H new