USER MOD reduce.3.24.130724 H: found=0, std=0, add=503, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 506 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 999 HIS : no HD1:sc= 0.537 K(o=1.1,f=-2.4) USER MOD Set 1.2: A1001 SER OG : rot -21:sc= 0.586 USER MOD Set 2.1: A 991 THR OG1 : rot 161:sc= 0.211 USER MOD Set 2.2: A 994 HIS : no HD1:sc= -4.08! C(o=-3.9!,f=-7.6!) USER MOD Set 3.1: A 973 MET CE :methyl 154:sc= 0 (180deg=0) USER MOD Set 3.2: A 975 HIS : no HE2:sc= -0.749 K(o=-0.75,f=-4!) USER MOD Set 4.1: A 962 SER OG : rot 180:sc= 0.319 USER MOD Set 4.2: A 981 GLN : amide:sc= -0.908 K(o=-0.59,f=0.25) USER MOD Single : A 961 LYS NZ :NH3+ 143:sc= -2.34! (180deg=-4.66!) USER MOD Single : A 964 LYS NZ :NH3+ -166:sc= -0.0342 (180deg=-0.273) USER MOD Single : A 965 THR OG1 : rot 180:sc= 0 USER MOD Single : A 971 ASN : amide:sc= -2.07 K(o=-2.1,f=-0.61) USER MOD Single : A 978 THR OG1 : rot 180:sc= -0.144 USER MOD Single : A 984 SER OG : rot 180:sc= 0 USER MOD Single : A 987 THR OG1 : rot 178:sc= -1.03 USER MOD Single : A 988 TYR OH : rot 150:sc= 0 USER MOD Single : A 989 SER OG : rot 180:sc= 0 USER MOD Single : A 992 THR OG1 : rot 180:sc= 0 USER MOD Single : A1000 SER OG : rot -47:sc= 1 USER MOD Single : A1007 SER OG : rot -5:sc= 0.954 USER MOD Single : A1009 ASN : amide:sc= -0.349 K(o=-0.35,f=-3.3!) USER MOD Single : A1010 THR OG1 : rot 180:sc= 0 USER MOD Single : A1012 HIS : no HE2:sc= -2.17 K(o=-2.2,f=-4.3!) USER MOD Single : A1014 SER OG : rot 180:sc= 0 USER MOD Single : A1015 THR OG1 : rot -129:sc= 0.015 USER MOD Single : A1016 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1021 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 957 24.442 6.063 -9.140 1.00 0.00 N ATOM 2 CA GLU A 957 24.979 5.896 -7.764 1.00 0.00 C ATOM 3 C GLU A 957 24.484 4.594 -7.141 1.00 0.00 C ATOM 4 O GLU A 957 25.271 3.815 -6.604 1.00 0.00 O ATOM 5 CB GLU A 957 24.562 7.081 -6.889 1.00 0.00 C ATOM 6 CG GLU A 957 25.108 7.014 -5.471 1.00 0.00 C ATOM 7 CD GLU A 957 26.623 7.012 -5.427 1.00 0.00 C ATOM 8 OE1 GLU A 957 27.242 7.710 -6.258 1.00 0.00 O ATOM 9 OE2 GLU A 957 27.191 6.315 -4.562 1.00 0.00 O ATOM 0 HA GLU A 957 26.067 5.858 -7.825 1.00 0.00 H new ATOM 0 HB2 GLU A 957 24.902 8.005 -7.357 1.00 0.00 H new ATOM 0 HB3 GLU A 957 23.474 7.126 -6.848 1.00 0.00 H new ATOM 0 HG2 GLU A 957 24.733 7.864 -4.901 1.00 0.00 H new ATOM 0 HG3 GLU A 957 24.733 6.114 -4.984 1.00 0.00 H new ATOM 18 N ALA A 958 23.177 4.367 -7.218 1.00 0.00 N ATOM 19 CA ALA A 958 22.577 3.162 -6.658 1.00 0.00 C ATOM 20 C ALA A 958 21.317 2.771 -7.423 1.00 0.00 C ATOM 21 O ALA A 958 20.834 3.522 -8.270 1.00 0.00 O ATOM 22 CB ALA A 958 22.258 3.369 -5.184 1.00 0.00 C ATOM 0 H ALA A 958 22.513 5.001 -7.663 1.00 0.00 H new ATOM 0 HA ALA A 958 23.296 2.348 -6.753 1.00 0.00 H new ATOM 0 HB1 ALA A 958 21.810 2.462 -4.778 1.00 0.00 H new ATOM 0 HB2 ALA A 958 23.176 3.595 -4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 958 21.559 4.198 -5.076 1.00 0.00 H new ATOM 28 N GLU A 959 20.791 1.587 -7.118 1.00 0.00 N ATOM 29 CA GLU A 959 19.589 1.091 -7.780 1.00 0.00 C ATOM 30 C GLU A 959 18.599 0.528 -6.767 1.00 0.00 C ATOM 31 O GLU A 959 17.700 -0.236 -7.120 1.00 0.00 O ATOM 32 CB GLU A 959 19.956 0.021 -8.814 1.00 0.00 C ATOM 33 CG GLU A 959 20.932 -1.027 -8.298 1.00 0.00 C ATOM 34 CD GLU A 959 20.334 -1.911 -7.221 1.00 0.00 C ATOM 35 OE1 GLU A 959 19.716 -2.938 -7.574 1.00 0.00 O ATOM 36 OE2 GLU A 959 20.483 -1.577 -6.027 1.00 0.00 O ATOM 0 H GLU A 959 21.178 0.955 -6.418 1.00 0.00 H new ATOM 0 HA GLU A 959 19.113 1.928 -8.290 1.00 0.00 H new ATOM 0 HB2 GLU A 959 19.045 -0.477 -9.146 1.00 0.00 H new ATOM 0 HB3 GLU A 959 20.389 0.508 -9.688 1.00 0.00 H new ATOM 0 HG2 GLU A 959 21.262 -1.649 -9.130 1.00 0.00 H new ATOM 0 HG3 GLU A 959 21.817 -0.528 -7.902 1.00 0.00 H new ATOM 43 N ALA A 960 18.770 0.912 -5.505 1.00 0.00 N ATOM 44 CA ALA A 960 17.888 0.452 -4.438 1.00 0.00 C ATOM 45 C ALA A 960 16.909 1.546 -4.027 1.00 0.00 C ATOM 46 O ALA A 960 16.789 2.569 -4.703 1.00 0.00 O ATOM 47 CB ALA A 960 18.706 -0.005 -3.240 1.00 0.00 C ATOM 0 H ALA A 960 19.512 1.541 -5.197 1.00 0.00 H new ATOM 0 HA ALA A 960 17.311 -0.393 -4.814 1.00 0.00 H new ATOM 0 HB1 ALA A 960 18.036 -0.346 -2.451 1.00 0.00 H new ATOM 0 HB2 ALA A 960 19.362 -0.823 -3.538 1.00 0.00 H new ATOM 0 HB3 ALA A 960 19.307 0.826 -2.872 1.00 0.00 H new ATOM 53 N LYS A 961 16.213 1.324 -2.913 1.00 0.00 N ATOM 54 CA LYS A 961 15.271 2.304 -2.381 1.00 0.00 C ATOM 55 C LYS A 961 14.101 2.517 -3.343 1.00 0.00 C ATOM 56 O LYS A 961 14.152 2.093 -4.498 1.00 0.00 O ATOM 57 CB LYS A 961 15.983 3.635 -2.112 1.00 0.00 C ATOM 58 CG LYS A 961 15.141 4.639 -1.342 1.00 0.00 C ATOM 59 CD LYS A 961 15.886 5.947 -1.116 1.00 0.00 C ATOM 60 CE LYS A 961 16.928 5.824 -0.014 1.00 0.00 C ATOM 61 NZ LYS A 961 18.055 4.932 -0.402 1.00 0.00 N ATOM 0 H LYS A 961 16.285 0.470 -2.360 1.00 0.00 H new ATOM 0 HA LYS A 961 14.875 1.918 -1.442 1.00 0.00 H new ATOM 0 HB2 LYS A 961 16.899 3.440 -1.554 1.00 0.00 H new ATOM 0 HB3 LYS A 961 16.278 4.077 -3.064 1.00 0.00 H new ATOM 0 HG2 LYS A 961 14.219 4.836 -1.889 1.00 0.00 H new ATOM 0 HG3 LYS A 961 14.856 4.212 -0.380 1.00 0.00 H new ATOM 0 HD2 LYS A 961 16.372 6.253 -2.043 1.00 0.00 H new ATOM 0 HD3 LYS A 961 15.174 6.730 -0.856 1.00 0.00 H new ATOM 0 HE2 LYS A 961 17.317 6.813 0.228 1.00 0.00 H new ATOM 0 HE3 LYS A 961 16.455 5.437 0.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 961 18.945 5.310 -0.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 961 17.891 3.979 -0.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 961 18.118 4.883 -1.439 1.00 0.00 H new ATOM 75 N SER A 962 13.051 3.172 -2.854 1.00 0.00 N ATOM 76 CA SER A 962 11.873 3.462 -3.668 1.00 0.00 C ATOM 77 C SER A 962 11.186 2.175 -4.116 1.00 0.00 C ATOM 78 O SER A 962 11.551 1.586 -5.133 1.00 0.00 O ATOM 79 CB SER A 962 12.258 4.303 -4.887 1.00 0.00 C ATOM 80 OG SER A 962 12.844 5.532 -4.496 1.00 0.00 O ATOM 0 H SER A 962 12.992 3.513 -1.895 1.00 0.00 H new ATOM 0 HA SER A 962 11.173 4.029 -3.054 1.00 0.00 H new ATOM 0 HB2 SER A 962 12.957 3.746 -5.511 1.00 0.00 H new ATOM 0 HB3 SER A 962 11.373 4.496 -5.494 1.00 0.00 H new ATOM 0 HG SER A 962 13.082 6.049 -5.294 1.00 0.00 H new ATOM 86 N CYS A 963 10.182 1.753 -3.353 1.00 0.00 N ATOM 87 CA CYS A 963 9.400 0.570 -3.700 1.00 0.00 C ATOM 88 C CYS A 963 8.442 0.867 -4.848 1.00 0.00 C ATOM 89 O CYS A 963 8.264 2.021 -5.238 1.00 0.00 O ATOM 90 CB CYS A 963 8.617 0.077 -2.482 1.00 0.00 C ATOM 91 SG CYS A 963 9.652 -0.663 -1.178 1.00 0.00 S ATOM 0 H CYS A 963 9.891 2.212 -2.490 1.00 0.00 H new ATOM 0 HA CYS A 963 10.091 -0.210 -4.021 1.00 0.00 H new ATOM 0 HB2 CYS A 963 8.062 0.914 -2.058 1.00 0.00 H new ATOM 0 HB3 CYS A 963 7.883 -0.660 -2.810 1.00 0.00 H new ATOM 96 N LYS A 964 7.831 -0.184 -5.387 1.00 0.00 N ATOM 97 CA LYS A 964 6.898 -0.042 -6.498 1.00 0.00 C ATOM 98 C LYS A 964 5.534 0.432 -6.006 1.00 0.00 C ATOM 99 O LYS A 964 4.818 -0.306 -5.330 1.00 0.00 O ATOM 100 CB LYS A 964 6.748 -1.369 -7.246 1.00 0.00 C ATOM 101 CG LYS A 964 8.008 -1.811 -7.978 1.00 0.00 C ATOM 102 CD LYS A 964 9.078 -2.297 -7.015 1.00 0.00 C ATOM 103 CE LYS A 964 10.326 -2.755 -7.752 1.00 0.00 C ATOM 104 NZ LYS A 964 10.038 -3.872 -8.692 1.00 0.00 N ATOM 0 H LYS A 964 7.966 -1.144 -5.071 1.00 0.00 H new ATOM 0 HA LYS A 964 7.301 0.706 -7.180 1.00 0.00 H new ATOM 0 HB2 LYS A 964 6.461 -2.145 -6.536 1.00 0.00 H new ATOM 0 HB3 LYS A 964 5.934 -1.279 -7.966 1.00 0.00 H new ATOM 0 HG2 LYS A 964 7.761 -2.608 -8.679 1.00 0.00 H new ATOM 0 HG3 LYS A 964 8.398 -0.980 -8.565 1.00 0.00 H new ATOM 0 HD2 LYS A 964 9.337 -1.496 -6.323 1.00 0.00 H new ATOM 0 HD3 LYS A 964 8.685 -3.120 -6.418 1.00 0.00 H new ATOM 0 HE2 LYS A 964 10.750 -1.916 -8.304 1.00 0.00 H new ATOM 0 HE3 LYS A 964 11.078 -3.073 -7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 964 10.931 -4.311 -8.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 964 9.447 -4.583 -8.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 964 9.534 -3.504 -9.524 1.00 0.00 H new ATOM 118 N THR A 965 5.184 1.668 -6.349 1.00 0.00 N ATOM 119 CA THR A 965 3.909 2.244 -5.940 1.00 0.00 C ATOM 120 C THR A 965 2.737 1.415 -6.462 1.00 0.00 C ATOM 121 O THR A 965 2.728 1.003 -7.622 1.00 0.00 O ATOM 122 CB THR A 965 3.760 3.691 -6.443 1.00 0.00 C ATOM 123 OG1 THR A 965 3.764 3.715 -7.877 1.00 0.00 O ATOM 124 CG2 THR A 965 4.887 4.565 -5.916 1.00 0.00 C ATOM 0 H THR A 965 5.767 2.290 -6.910 1.00 0.00 H new ATOM 0 HA THR A 965 3.897 2.241 -4.850 1.00 0.00 H new ATOM 0 HB THR A 965 2.812 4.084 -6.075 1.00 0.00 H new ATOM 0 HG1 THR A 965 3.667 4.639 -8.189 1.00 0.00 H new ATOM 0 HG21 THR A 965 4.761 5.583 -6.285 1.00 0.00 H new ATOM 0 HG22 THR A 965 4.866 4.568 -4.826 1.00 0.00 H new ATOM 0 HG23 THR A 965 5.844 4.171 -6.259 1.00 0.00 H new ATOM 132 N PRO A 966 1.729 1.163 -5.607 1.00 0.00 N ATOM 133 CA PRO A 966 0.539 0.397 -5.991 1.00 0.00 C ATOM 134 C PRO A 966 -0.211 1.040 -7.157 1.00 0.00 C ATOM 135 O PRO A 966 -0.774 2.125 -7.014 1.00 0.00 O ATOM 136 CB PRO A 966 -0.330 0.411 -4.728 1.00 0.00 C ATOM 137 CG PRO A 966 0.612 0.717 -3.614 1.00 0.00 C ATOM 138 CD PRO A 966 1.669 1.605 -4.203 1.00 0.00 C ATOM 0 HA PRO A 966 0.798 -0.606 -6.331 1.00 0.00 H new ATOM 0 HB2 PRO A 966 -1.116 1.163 -4.798 1.00 0.00 H new ATOM 0 HB3 PRO A 966 -0.821 -0.550 -4.576 1.00 0.00 H new ATOM 0 HG2 PRO A 966 0.097 1.215 -2.792 1.00 0.00 H new ATOM 0 HG3 PRO A 966 1.049 -0.196 -3.210 1.00 0.00 H new ATOM 0 HD2 PRO A 966 1.402 2.659 -4.123 1.00 0.00 H new ATOM 0 HD3 PRO A 966 2.628 1.480 -3.699 1.00 0.00 H new ATOM 146 N PRO A 967 -0.223 0.378 -8.328 1.00 0.00 N ATOM 147 CA PRO A 967 -0.904 0.894 -9.520 1.00 0.00 C ATOM 148 C PRO A 967 -2.422 0.776 -9.419 1.00 0.00 C ATOM 149 O PRO A 967 -3.035 -0.051 -10.096 1.00 0.00 O ATOM 150 CB PRO A 967 -0.369 0.002 -10.641 1.00 0.00 C ATOM 151 CG PRO A 967 -0.037 -1.284 -9.970 1.00 0.00 C ATOM 152 CD PRO A 967 0.425 -0.924 -8.584 1.00 0.00 C ATOM 0 HA PRO A 967 -0.714 1.956 -9.673 1.00 0.00 H new ATOM 0 HB2 PRO A 967 -1.114 -0.140 -11.424 1.00 0.00 H new ATOM 0 HB3 PRO A 967 0.510 0.442 -11.113 1.00 0.00 H new ATOM 0 HG2 PRO A 967 -0.907 -1.940 -9.933 1.00 0.00 H new ATOM 0 HG3 PRO A 967 0.742 -1.818 -10.514 1.00 0.00 H new ATOM 0 HD2 PRO A 967 0.121 -1.673 -7.853 1.00 0.00 H new ATOM 0 HD3 PRO A 967 1.511 -0.848 -8.531 1.00 0.00 H new ATOM 160 N ASP A 968 -3.018 1.608 -8.569 1.00 0.00 N ATOM 161 CA ASP A 968 -4.460 1.588 -8.351 1.00 0.00 C ATOM 162 C ASP A 968 -4.952 0.177 -8.029 1.00 0.00 C ATOM 163 O ASP A 968 -5.286 -0.594 -8.928 1.00 0.00 O ATOM 164 CB ASP A 968 -5.186 2.134 -9.580 1.00 0.00 C ATOM 165 CG ASP A 968 -6.690 1.969 -9.490 1.00 0.00 C ATOM 166 OD1 ASP A 968 -7.354 2.872 -8.939 1.00 0.00 O ATOM 167 OD2 ASP A 968 -7.205 0.938 -9.969 1.00 0.00 O ATOM 0 H ASP A 968 -2.521 2.308 -8.018 1.00 0.00 H new ATOM 0 HA ASP A 968 -4.681 2.225 -7.494 1.00 0.00 H new ATOM 0 HB2 ASP A 968 -4.947 3.191 -9.699 1.00 0.00 H new ATOM 0 HB3 ASP A 968 -4.821 1.622 -10.470 1.00 0.00 H new ATOM 172 N PRO A 969 -5.012 -0.171 -6.731 1.00 0.00 N ATOM 173 CA PRO A 969 -5.534 -1.467 -6.277 1.00 0.00 C ATOM 174 C PRO A 969 -6.996 -1.670 -6.658 1.00 0.00 C ATOM 175 O PRO A 969 -7.486 -1.086 -7.624 1.00 0.00 O ATOM 176 CB PRO A 969 -5.388 -1.405 -4.750 1.00 0.00 C ATOM 177 CG PRO A 969 -4.394 -0.322 -4.495 1.00 0.00 C ATOM 178 CD PRO A 969 -4.580 0.671 -5.603 1.00 0.00 C ATOM 0 HA PRO A 969 -4.998 -2.298 -6.736 1.00 0.00 H new ATOM 0 HB2 PRO A 969 -6.342 -1.184 -4.272 1.00 0.00 H new ATOM 0 HB3 PRO A 969 -5.044 -2.358 -4.348 1.00 0.00 H new ATOM 0 HG2 PRO A 969 -4.561 0.141 -3.523 1.00 0.00 H new ATOM 0 HG3 PRO A 969 -3.378 -0.717 -4.490 1.00 0.00 H new ATOM 0 HD2 PRO A 969 -5.328 1.423 -5.350 1.00 0.00 H new ATOM 0 HD3 PRO A 969 -3.656 1.204 -5.827 1.00 0.00 H new ATOM 186 N VAL A 970 -7.688 -2.497 -5.882 1.00 0.00 N ATOM 187 CA VAL A 970 -9.118 -2.722 -6.070 1.00 0.00 C ATOM 188 C VAL A 970 -9.889 -1.399 -6.026 1.00 0.00 C ATOM 189 O VAL A 970 -9.287 -0.326 -5.975 1.00 0.00 O ATOM 190 CB VAL A 970 -9.668 -3.687 -4.993 1.00 0.00 C ATOM 191 CG1 VAL A 970 -9.923 -2.956 -3.684 1.00 0.00 C ATOM 192 CG2 VAL A 970 -10.925 -4.392 -5.482 1.00 0.00 C ATOM 0 H VAL A 970 -7.279 -3.026 -5.112 1.00 0.00 H new ATOM 0 HA VAL A 970 -9.257 -3.175 -7.052 1.00 0.00 H new ATOM 0 HB VAL A 970 -8.910 -4.448 -4.807 1.00 0.00 H new ATOM 0 HG11 VAL A 970 -10.309 -3.658 -2.945 1.00 0.00 H new ATOM 0 HG12 VAL A 970 -8.991 -2.523 -3.321 1.00 0.00 H new ATOM 0 HG13 VAL A 970 -10.652 -2.162 -3.847 1.00 0.00 H new ATOM 0 HG21 VAL A 970 -11.291 -5.064 -4.706 1.00 0.00 H new ATOM 0 HG22 VAL A 970 -11.691 -3.652 -5.711 1.00 0.00 H new ATOM 0 HG23 VAL A 970 -10.695 -4.966 -6.380 1.00 0.00 H new ATOM 202 N ASN A 971 -11.220 -1.480 -6.062 1.00 0.00 N ATOM 203 CA ASN A 971 -12.069 -0.288 -6.092 1.00 0.00 C ATOM 204 C ASN A 971 -11.563 0.779 -5.126 1.00 0.00 C ATOM 205 O ASN A 971 -11.693 1.975 -5.385 1.00 0.00 O ATOM 206 CB ASN A 971 -13.512 -0.656 -5.745 1.00 0.00 C ATOM 207 CG ASN A 971 -14.045 -1.791 -6.598 1.00 0.00 C ATOM 208 OD1 ASN A 971 -14.583 -1.568 -7.682 1.00 0.00 O ATOM 209 ND2 ASN A 971 -13.901 -3.016 -6.107 1.00 0.00 N ATOM 0 H ASN A 971 -11.734 -2.361 -6.071 1.00 0.00 H new ATOM 0 HA ASN A 971 -12.032 0.120 -7.102 1.00 0.00 H new ATOM 0 HB2 ASN A 971 -13.568 -0.939 -4.694 1.00 0.00 H new ATOM 0 HB3 ASN A 971 -14.148 0.220 -5.874 1.00 0.00 H new ATOM 0 HD21 ASN A 971 -14.243 -3.820 -6.633 1.00 0.00 H new ATOM 0 HD22 ASN A 971 -13.448 -3.153 -5.203 1.00 0.00 H new ATOM 216 N GLY A 972 -10.975 0.338 -4.017 1.00 0.00 N ATOM 217 CA GLY A 972 -10.399 1.268 -3.065 1.00 0.00 C ATOM 218 C GLY A 972 -9.149 1.943 -3.594 1.00 0.00 C ATOM 219 O GLY A 972 -8.112 1.301 -3.764 1.00 0.00 O ATOM 0 H GLY A 972 -10.888 -0.646 -3.762 1.00 0.00 H new ATOM 0 HA2 GLY A 972 -11.138 2.028 -2.812 1.00 0.00 H new ATOM 0 HA3 GLY A 972 -10.159 0.737 -2.144 1.00 0.00 H new ATOM 223 N MET A 973 -9.249 3.241 -3.855 1.00 0.00 N ATOM 224 CA MET A 973 -8.122 4.008 -4.372 1.00 0.00 C ATOM 225 C MET A 973 -7.008 4.109 -3.334 1.00 0.00 C ATOM 226 O MET A 973 -7.269 4.170 -2.133 1.00 0.00 O ATOM 227 CB MET A 973 -8.574 5.411 -4.790 1.00 0.00 C ATOM 228 CG MET A 973 -9.037 6.283 -3.633 1.00 0.00 C ATOM 229 SD MET A 973 -10.627 5.767 -2.956 1.00 0.00 S ATOM 230 CE MET A 973 -10.871 7.004 -1.684 1.00 0.00 C ATOM 0 H MET A 973 -10.101 3.785 -3.717 1.00 0.00 H new ATOM 0 HA MET A 973 -7.734 3.485 -5.246 1.00 0.00 H new ATOM 0 HB2 MET A 973 -7.750 5.910 -5.300 1.00 0.00 H new ATOM 0 HB3 MET A 973 -9.387 5.320 -5.511 1.00 0.00 H new ATOM 0 HG2 MET A 973 -8.286 6.258 -2.843 1.00 0.00 H new ATOM 0 HG3 MET A 973 -9.110 7.317 -3.971 1.00 0.00 H new ATOM 0 HE1 MET A 973 -11.938 7.127 -1.496 1.00 0.00 H new ATOM 0 HE2 MET A 973 -10.375 6.686 -0.767 1.00 0.00 H new ATOM 0 HE3 MET A 973 -10.449 7.953 -2.014 1.00 0.00 H new ATOM 240 N VAL A 974 -5.765 4.126 -3.806 1.00 0.00 N ATOM 241 CA VAL A 974 -4.611 4.227 -2.922 1.00 0.00 C ATOM 242 C VAL A 974 -4.151 5.677 -2.784 1.00 0.00 C ATOM 243 O VAL A 974 -4.314 6.479 -3.704 1.00 0.00 O ATOM 244 CB VAL A 974 -3.437 3.367 -3.433 1.00 0.00 C ATOM 245 CG1 VAL A 974 -2.992 3.830 -4.812 1.00 0.00 C ATOM 246 CG2 VAL A 974 -2.277 3.398 -2.450 1.00 0.00 C ATOM 0 H VAL A 974 -5.532 4.071 -4.798 1.00 0.00 H new ATOM 0 HA VAL A 974 -4.922 3.856 -1.946 1.00 0.00 H new ATOM 0 HB VAL A 974 -3.781 2.336 -3.516 1.00 0.00 H new ATOM 0 HG11 VAL A 974 -2.163 3.210 -5.154 1.00 0.00 H new ATOM 0 HG12 VAL A 974 -3.823 3.742 -5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 974 -2.670 4.870 -4.760 1.00 0.00 H new ATOM 0 HG21 VAL A 974 -1.461 2.785 -2.831 1.00 0.00 H new ATOM 0 HG22 VAL A 974 -1.932 4.425 -2.326 1.00 0.00 H new ATOM 0 HG23 VAL A 974 -2.606 3.007 -1.487 1.00 0.00 H new ATOM 256 N HIS A 975 -3.587 6.008 -1.626 1.00 0.00 N ATOM 257 CA HIS A 975 -3.164 7.376 -1.346 1.00 0.00 C ATOM 258 C HIS A 975 -1.699 7.421 -0.924 1.00 0.00 C ATOM 259 O HIS A 975 -1.181 6.470 -0.340 1.00 0.00 O ATOM 260 CB HIS A 975 -4.039 7.988 -0.250 1.00 0.00 C ATOM 261 CG HIS A 975 -5.491 8.056 -0.610 1.00 0.00 C ATOM 262 ND1 HIS A 975 -6.091 9.196 -1.103 1.00 0.00 N ATOM 263 CD2 HIS A 975 -6.465 7.118 -0.545 1.00 0.00 C ATOM 264 CE1 HIS A 975 -7.371 8.956 -1.324 1.00 0.00 C ATOM 265 NE2 HIS A 975 -7.624 7.703 -0.995 1.00 0.00 N ATOM 0 H HIS A 975 -3.413 5.349 -0.868 1.00 0.00 H new ATOM 0 HA HIS A 975 -3.277 7.957 -2.261 1.00 0.00 H new ATOM 0 HB2 HIS A 975 -3.927 7.402 0.662 1.00 0.00 H new ATOM 0 HB3 HIS A 975 -3.680 8.993 -0.030 1.00 0.00 H new ATOM 0 HD1 HIS A 975 -5.620 10.085 -1.271 1.00 0.00 H new ATOM 0 HD2 HIS A 975 -6.352 6.100 -0.203 1.00 0.00 H new ATOM 0 HE1 HIS A 975 -8.089 9.665 -1.709 1.00 0.00 H new ATOM 274 N VAL A 976 -1.042 8.540 -1.213 1.00 0.00 N ATOM 275 CA VAL A 976 0.344 8.744 -0.805 1.00 0.00 C ATOM 276 C VAL A 976 0.440 9.825 0.266 1.00 0.00 C ATOM 277 O VAL A 976 0.114 10.987 0.022 1.00 0.00 O ATOM 278 CB VAL A 976 1.229 9.140 -2.003 1.00 0.00 C ATOM 279 CG1 VAL A 976 2.661 9.392 -1.553 1.00 0.00 C ATOM 280 CG2 VAL A 976 1.183 8.066 -3.079 1.00 0.00 C ATOM 0 H VAL A 976 -1.448 9.321 -1.729 1.00 0.00 H new ATOM 0 HA VAL A 976 0.702 7.798 -0.399 1.00 0.00 H new ATOM 0 HB VAL A 976 0.839 10.065 -2.427 1.00 0.00 H new ATOM 0 HG11 VAL A 976 3.269 9.670 -2.414 1.00 0.00 H new ATOM 0 HG12 VAL A 976 2.676 10.200 -0.822 1.00 0.00 H new ATOM 0 HG13 VAL A 976 3.065 8.486 -1.101 1.00 0.00 H new ATOM 0 HG21 VAL A 976 1.814 8.363 -3.917 1.00 0.00 H new ATOM 0 HG22 VAL A 976 1.545 7.124 -2.668 1.00 0.00 H new ATOM 0 HG23 VAL A 976 0.157 7.940 -3.424 1.00 0.00 H new ATOM 290 N ILE A 977 0.878 9.429 1.458 1.00 0.00 N ATOM 291 CA ILE A 977 0.959 10.348 2.589 1.00 0.00 C ATOM 292 C ILE A 977 1.987 11.447 2.337 1.00 0.00 C ATOM 293 O ILE A 977 1.692 12.632 2.492 1.00 0.00 O ATOM 294 CB ILE A 977 1.323 9.605 3.891 1.00 0.00 C ATOM 295 CG1 ILE A 977 0.290 8.516 4.192 1.00 0.00 C ATOM 296 CG2 ILE A 977 1.425 10.585 5.053 1.00 0.00 C ATOM 297 CD1 ILE A 977 -1.117 9.043 4.381 1.00 0.00 C ATOM 0 H ILE A 977 1.182 8.478 1.666 1.00 0.00 H new ATOM 0 HA ILE A 977 -0.027 10.799 2.700 1.00 0.00 H new ATOM 0 HB ILE A 977 2.294 9.129 3.758 1.00 0.00 H new ATOM 0 HG12 ILE A 977 0.290 7.793 3.377 1.00 0.00 H new ATOM 0 HG13 ILE A 977 0.592 7.981 5.093 1.00 0.00 H new ATOM 0 HG21 ILE A 977 1.682 10.044 5.964 1.00 0.00 H new ATOM 0 HG22 ILE A 977 2.197 11.324 4.839 1.00 0.00 H new ATOM 0 HG23 ILE A 977 0.468 11.089 5.189 1.00 0.00 H new ATOM 0 HD11 ILE A 977 -1.791 8.213 4.591 1.00 0.00 H new ATOM 0 HD12 ILE A 977 -1.134 9.744 5.216 1.00 0.00 H new ATOM 0 HD13 ILE A 977 -1.440 9.552 3.473 1.00 0.00 H new ATOM 309 N THR A 978 3.197 11.047 1.955 1.00 0.00 N ATOM 310 CA THR A 978 4.271 12.001 1.703 1.00 0.00 C ATOM 311 C THR A 978 5.099 11.595 0.489 1.00 0.00 C ATOM 312 O THR A 978 5.113 12.291 -0.527 1.00 0.00 O ATOM 313 CB THR A 978 5.202 12.136 2.924 1.00 0.00 C ATOM 314 OG1 THR A 978 5.722 10.853 3.291 1.00 0.00 O ATOM 315 CG2 THR A 978 4.461 12.745 4.105 1.00 0.00 C ATOM 0 H THR A 978 3.457 10.071 1.814 1.00 0.00 H new ATOM 0 HA THR A 978 3.797 12.963 1.508 1.00 0.00 H new ATOM 0 HB THR A 978 6.026 12.796 2.652 1.00 0.00 H new ATOM 0 HG1 THR A 978 6.314 10.949 4.066 1.00 0.00 H new ATOM 0 HG21 THR A 978 5.138 12.830 4.955 1.00 0.00 H new ATOM 0 HG22 THR A 978 4.094 13.735 3.833 1.00 0.00 H new ATOM 0 HG23 THR A 978 3.619 12.107 4.375 1.00 0.00 H new ATOM 323 N ASP A 979 5.796 10.469 0.602 1.00 0.00 N ATOM 324 CA ASP A 979 6.673 10.001 -0.465 1.00 0.00 C ATOM 325 C ASP A 979 6.662 8.478 -0.552 1.00 0.00 C ATOM 326 O ASP A 979 5.884 7.813 0.133 1.00 0.00 O ATOM 327 CB ASP A 979 8.102 10.498 -0.234 1.00 0.00 C ATOM 328 CG ASP A 979 8.191 12.012 -0.211 1.00 0.00 C ATOM 329 OD1 ASP A 979 8.386 12.611 -1.289 1.00 0.00 O ATOM 330 OD2 ASP A 979 8.066 12.597 0.885 1.00 0.00 O ATOM 0 H ASP A 979 5.770 9.863 1.422 1.00 0.00 H new ATOM 0 HA ASP A 979 6.302 10.404 -1.407 1.00 0.00 H new ATOM 0 HB2 ASP A 979 8.474 10.101 0.710 1.00 0.00 H new ATOM 0 HB3 ASP A 979 8.750 10.111 -1.020 1.00 0.00 H new ATOM 335 N ILE A 980 7.530 7.933 -1.399 1.00 0.00 N ATOM 336 CA ILE A 980 7.624 6.489 -1.575 1.00 0.00 C ATOM 337 C ILE A 980 9.045 6.006 -1.313 1.00 0.00 C ATOM 338 O ILE A 980 9.730 5.526 -2.217 1.00 0.00 O ATOM 339 CB ILE A 980 7.193 6.069 -2.994 1.00 0.00 C ATOM 340 CG1 ILE A 980 5.848 6.708 -3.351 1.00 0.00 C ATOM 341 CG2 ILE A 980 7.113 4.553 -3.102 1.00 0.00 C ATOM 342 CD1 ILE A 980 4.701 6.253 -2.472 1.00 0.00 C ATOM 0 H ILE A 980 8.178 8.471 -1.974 1.00 0.00 H new ATOM 0 HA ILE A 980 6.948 6.029 -0.854 1.00 0.00 H new ATOM 0 HB ILE A 980 7.942 6.421 -3.703 1.00 0.00 H new ATOM 0 HG12 ILE A 980 5.941 7.792 -3.279 1.00 0.00 H new ATOM 0 HG13 ILE A 980 5.611 6.477 -4.390 1.00 0.00 H new ATOM 0 HG21 ILE A 980 6.807 4.276 -4.111 1.00 0.00 H new ATOM 0 HG22 ILE A 980 8.090 4.121 -2.887 1.00 0.00 H new ATOM 0 HG23 ILE A 980 6.384 4.175 -2.385 1.00 0.00 H new ATOM 0 HD11 ILE A 980 3.783 6.749 -2.786 1.00 0.00 H new ATOM 0 HD12 ILE A 980 4.580 5.174 -2.562 1.00 0.00 H new ATOM 0 HD13 ILE A 980 4.914 6.509 -1.434 1.00 0.00 H new ATOM 354 N GLN A 981 9.488 6.149 -0.069 1.00 0.00 N ATOM 355 CA GLN A 981 10.843 5.771 0.310 1.00 0.00 C ATOM 356 C GLN A 981 10.821 4.748 1.440 1.00 0.00 C ATOM 357 O GLN A 981 9.797 4.557 2.095 1.00 0.00 O ATOM 358 CB GLN A 981 11.637 7.007 0.741 1.00 0.00 C ATOM 359 CG GLN A 981 11.404 8.222 -0.144 1.00 0.00 C ATOM 360 CD GLN A 981 11.668 7.946 -1.612 1.00 0.00 C ATOM 361 OE1 GLN A 981 11.042 8.543 -2.489 1.00 0.00 O ATOM 362 NE2 GLN A 981 12.598 7.040 -1.890 1.00 0.00 N ATOM 0 H GLN A 981 8.927 6.525 0.695 1.00 0.00 H new ATOM 0 HA GLN A 981 11.327 5.321 -0.557 1.00 0.00 H new ATOM 0 HB2 GLN A 981 11.371 7.260 1.767 1.00 0.00 H new ATOM 0 HB3 GLN A 981 12.700 6.765 0.738 1.00 0.00 H new ATOM 0 HG2 GLN A 981 10.375 8.561 -0.023 1.00 0.00 H new ATOM 0 HG3 GLN A 981 12.048 9.036 0.189 1.00 0.00 H new ATOM 0 HE21 GLN A 981 13.093 6.569 -1.133 1.00 0.00 H new ATOM 0 HE22 GLN A 981 12.817 6.815 -2.861 1.00 0.00 H new ATOM 371 N VAL A 982 11.958 4.100 1.669 1.00 0.00 N ATOM 372 CA VAL A 982 12.080 3.133 2.753 1.00 0.00 C ATOM 373 C VAL A 982 11.905 3.809 4.110 1.00 0.00 C ATOM 374 O VAL A 982 12.653 4.719 4.465 1.00 0.00 O ATOM 375 CB VAL A 982 13.442 2.408 2.711 1.00 0.00 C ATOM 376 CG1 VAL A 982 14.587 3.409 2.686 1.00 0.00 C ATOM 377 CG2 VAL A 982 13.579 1.455 3.889 1.00 0.00 C ATOM 0 H VAL A 982 12.807 4.227 1.119 1.00 0.00 H new ATOM 0 HA VAL A 982 11.288 2.396 2.616 1.00 0.00 H new ATOM 0 HB VAL A 982 13.488 1.822 1.793 1.00 0.00 H new ATOM 0 HG11 VAL A 982 15.537 2.875 2.657 1.00 0.00 H new ATOM 0 HG12 VAL A 982 14.499 4.041 1.802 1.00 0.00 H new ATOM 0 HG13 VAL A 982 14.547 4.030 3.581 1.00 0.00 H new ATOM 0 HG21 VAL A 982 14.546 0.954 3.841 1.00 0.00 H new ATOM 0 HG22 VAL A 982 13.507 2.016 4.821 1.00 0.00 H new ATOM 0 HG23 VAL A 982 12.783 0.712 3.850 1.00 0.00 H new ATOM 387 N GLY A 983 10.901 3.365 4.860 1.00 0.00 N ATOM 388 CA GLY A 983 10.609 3.971 6.145 1.00 0.00 C ATOM 389 C GLY A 983 9.353 4.821 6.113 1.00 0.00 C ATOM 390 O GLY A 983 8.845 5.231 7.158 1.00 0.00 O ATOM 0 H GLY A 983 10.284 2.595 4.600 1.00 0.00 H new ATOM 0 HA2 GLY A 983 10.495 3.188 6.895 1.00 0.00 H new ATOM 0 HA3 GLY A 983 11.454 4.587 6.453 1.00 0.00 H new ATOM 394 N SER A 984 8.848 5.082 4.911 1.00 0.00 N ATOM 395 CA SER A 984 7.632 5.870 4.746 1.00 0.00 C ATOM 396 C SER A 984 6.407 4.964 4.668 1.00 0.00 C ATOM 397 O SER A 984 6.463 3.876 4.096 1.00 0.00 O ATOM 398 CB SER A 984 7.724 6.733 3.486 1.00 0.00 C ATOM 399 OG SER A 984 8.823 7.624 3.557 1.00 0.00 O ATOM 0 H SER A 984 9.263 4.759 4.037 1.00 0.00 H new ATOM 0 HA SER A 984 7.528 6.520 5.615 1.00 0.00 H new ATOM 0 HB2 SER A 984 7.827 6.093 2.610 1.00 0.00 H new ATOM 0 HB3 SER A 984 6.801 7.299 3.361 1.00 0.00 H new ATOM 0 HG SER A 984 8.861 8.163 2.739 1.00 0.00 H new ATOM 405 N ARG A 985 5.304 5.417 5.256 1.00 0.00 N ATOM 406 CA ARG A 985 4.084 4.620 5.309 1.00 0.00 C ATOM 407 C ARG A 985 2.937 5.328 4.594 1.00 0.00 C ATOM 408 O ARG A 985 2.559 6.442 4.958 1.00 0.00 O ATOM 409 CB ARG A 985 3.699 4.339 6.762 1.00 0.00 C ATOM 410 CG ARG A 985 2.462 3.468 6.907 1.00 0.00 C ATOM 411 CD ARG A 985 2.120 3.228 8.369 1.00 0.00 C ATOM 412 NE ARG A 985 1.816 4.472 9.072 1.00 0.00 N ATOM 413 CZ ARG A 985 1.600 4.546 10.381 1.00 0.00 C ATOM 414 NH1 ARG A 985 1.656 3.452 11.129 1.00 0.00 N ATOM 415 NH2 ARG A 985 1.330 5.716 10.945 1.00 0.00 N ATOM 0 H ARG A 985 5.230 6.331 5.702 1.00 0.00 H new ATOM 0 HA ARG A 985 4.275 3.675 4.800 1.00 0.00 H new ATOM 0 HB2 ARG A 985 4.536 3.853 7.263 1.00 0.00 H new ATOM 0 HB3 ARG A 985 3.528 5.286 7.273 1.00 0.00 H new ATOM 0 HG2 ARG A 985 1.619 3.945 6.408 1.00 0.00 H new ATOM 0 HG3 ARG A 985 2.628 2.513 6.409 1.00 0.00 H new ATOM 0 HD2 ARG A 985 1.264 2.556 8.435 1.00 0.00 H new ATOM 0 HD3 ARG A 985 2.956 2.729 8.860 1.00 0.00 H new ATOM 0 HE ARG A 985 1.767 5.333 8.527 1.00 0.00 H new ATOM 0 HH11 ARG A 985 1.865 2.551 10.700 1.00 0.00 H new ATOM 0 HH12 ARG A 985 1.490 3.512 12.134 1.00 0.00 H new ATOM 0 HH21 ARG A 985 1.288 6.560 10.374 1.00 0.00 H new ATOM 0 HH22 ARG A 985 1.164 5.772 11.950 1.00 0.00 H new ATOM 429 N ILE A 986 2.376 4.666 3.586 1.00 0.00 N ATOM 430 CA ILE A 986 1.204 5.182 2.890 1.00 0.00 C ATOM 431 C ILE A 986 -0.079 4.607 3.485 1.00 0.00 C ATOM 432 O ILE A 986 -0.032 3.762 4.378 1.00 0.00 O ATOM 433 CB ILE A 986 1.253 4.856 1.384 1.00 0.00 C ATOM 434 CG1 ILE A 986 1.237 3.341 1.165 1.00 0.00 C ATOM 435 CG2 ILE A 986 2.490 5.478 0.750 1.00 0.00 C ATOM 436 CD1 ILE A 986 1.179 2.937 -0.293 1.00 0.00 C ATOM 0 H ILE A 986 2.715 3.771 3.234 1.00 0.00 H new ATOM 0 HA ILE A 986 1.209 6.265 3.016 1.00 0.00 H new ATOM 0 HB ILE A 986 0.370 5.280 0.905 1.00 0.00 H new ATOM 0 HG12 ILE A 986 2.129 2.908 1.618 1.00 0.00 H new ATOM 0 HG13 ILE A 986 0.378 2.917 1.685 1.00 0.00 H new ATOM 0 HG21 ILE A 986 2.512 5.240 -0.313 1.00 0.00 H new ATOM 0 HG22 ILE A 986 2.460 6.560 0.879 1.00 0.00 H new ATOM 0 HG23 ILE A 986 3.384 5.080 1.230 1.00 0.00 H new ATOM 0 HD11 ILE A 986 1.171 1.850 -0.369 1.00 0.00 H new ATOM 0 HD12 ILE A 986 0.273 3.340 -0.746 1.00 0.00 H new ATOM 0 HD13 ILE A 986 2.051 3.331 -0.815 1.00 0.00 H new ATOM 448 N THR A 987 -1.221 5.072 2.989 1.00 0.00 N ATOM 449 CA THR A 987 -2.512 4.624 3.499 1.00 0.00 C ATOM 450 C THR A 987 -3.472 4.288 2.362 1.00 0.00 C ATOM 451 O THR A 987 -3.623 5.059 1.415 1.00 0.00 O ATOM 452 CB THR A 987 -3.160 5.691 4.400 1.00 0.00 C ATOM 453 OG1 THR A 987 -3.338 6.910 3.669 1.00 0.00 O ATOM 454 CG2 THR A 987 -2.304 5.953 5.631 1.00 0.00 C ATOM 0 H THR A 987 -1.279 5.758 2.236 1.00 0.00 H new ATOM 0 HA THR A 987 -2.322 3.726 4.086 1.00 0.00 H new ATOM 0 HB THR A 987 -4.131 5.318 4.724 1.00 0.00 H new ATOM 0 HG1 THR A 987 -3.781 7.572 4.240 1.00 0.00 H new ATOM 0 HG21 THR A 987 -2.782 6.710 6.252 1.00 0.00 H new ATOM 0 HG22 THR A 987 -2.196 5.031 6.202 1.00 0.00 H new ATOM 0 HG23 THR A 987 -1.320 6.306 5.322 1.00 0.00 H new ATOM 462 N TYR A 988 -4.127 3.136 2.472 1.00 0.00 N ATOM 463 CA TYR A 988 -5.128 2.726 1.492 1.00 0.00 C ATOM 464 C TYR A 988 -6.528 3.097 1.968 1.00 0.00 C ATOM 465 O TYR A 988 -6.784 3.184 3.169 1.00 0.00 O ATOM 466 CB TYR A 988 -5.042 1.219 1.245 1.00 0.00 C ATOM 467 CG TYR A 988 -3.680 0.753 0.783 1.00 0.00 C ATOM 468 CD1 TYR A 988 -2.680 0.448 1.699 1.00 0.00 C ATOM 469 CD2 TYR A 988 -3.392 0.620 -0.570 1.00 0.00 C ATOM 470 CE1 TYR A 988 -1.433 0.023 1.280 1.00 0.00 C ATOM 471 CE2 TYR A 988 -2.148 0.195 -0.996 1.00 0.00 C ATOM 472 CZ TYR A 988 -1.173 -0.102 -0.068 1.00 0.00 C ATOM 473 OH TYR A 988 0.067 -0.525 -0.488 1.00 0.00 O ATOM 0 H TYR A 988 -3.983 2.469 3.230 1.00 0.00 H new ATOM 0 HA TYR A 988 -4.928 3.250 0.557 1.00 0.00 H new ATOM 0 HB2 TYR A 988 -5.303 0.694 2.164 1.00 0.00 H new ATOM 0 HB3 TYR A 988 -5.784 0.940 0.497 1.00 0.00 H new ATOM 0 HD1 TYR A 988 -2.881 0.545 2.756 1.00 0.00 H new ATOM 0 HD2 TYR A 988 -4.153 0.853 -1.300 1.00 0.00 H new ATOM 0 HE1 TYR A 988 -0.667 -0.210 2.005 1.00 0.00 H new ATOM 0 HE2 TYR A 988 -1.941 0.096 -2.051 1.00 0.00 H new ATOM 0 HH TYR A 988 -0.022 -1.007 -1.337 1.00 0.00 H new ATOM 483 N SER A 989 -7.433 3.320 1.019 1.00 0.00 N ATOM 484 CA SER A 989 -8.800 3.712 1.345 1.00 0.00 C ATOM 485 C SER A 989 -9.786 3.170 0.315 1.00 0.00 C ATOM 486 O SER A 989 -9.561 3.279 -0.890 1.00 0.00 O ATOM 487 CB SER A 989 -8.911 5.236 1.419 1.00 0.00 C ATOM 488 OG SER A 989 -8.043 5.763 2.408 1.00 0.00 O ATOM 0 H SER A 989 -7.245 3.236 0.020 1.00 0.00 H new ATOM 0 HA SER A 989 -9.049 3.287 2.317 1.00 0.00 H new ATOM 0 HB2 SER A 989 -8.668 5.669 0.449 1.00 0.00 H new ATOM 0 HB3 SER A 989 -9.939 5.518 1.645 1.00 0.00 H new ATOM 0 HG SER A 989 -8.131 6.739 2.435 1.00 0.00 H new ATOM 494 N CYS A 990 -10.880 2.590 0.800 1.00 0.00 N ATOM 495 CA CYS A 990 -11.913 2.052 -0.079 1.00 0.00 C ATOM 496 C CYS A 990 -12.892 3.142 -0.504 1.00 0.00 C ATOM 497 O CYS A 990 -12.833 4.268 -0.009 1.00 0.00 O ATOM 498 CB CYS A 990 -12.666 0.916 0.614 1.00 0.00 C ATOM 499 SG CYS A 990 -11.670 -0.590 0.867 1.00 0.00 S ATOM 0 H CYS A 990 -11.074 2.481 1.795 1.00 0.00 H new ATOM 0 HA CYS A 990 -11.424 1.661 -0.971 1.00 0.00 H new ATOM 0 HB2 CYS A 990 -13.024 1.269 1.581 1.00 0.00 H new ATOM 0 HB3 CYS A 990 -13.545 0.662 0.022 1.00 0.00 H new ATOM 504 N THR A 991 -13.781 2.803 -1.432 1.00 0.00 N ATOM 505 CA THR A 991 -14.724 3.763 -1.978 1.00 0.00 C ATOM 506 C THR A 991 -15.655 4.305 -0.902 1.00 0.00 C ATOM 507 O THR A 991 -15.493 5.433 -0.434 1.00 0.00 O ATOM 508 CB THR A 991 -15.557 3.128 -3.103 1.00 0.00 C ATOM 509 OG1 THR A 991 -16.095 1.873 -2.671 1.00 0.00 O ATOM 510 CG2 THR A 991 -14.713 2.922 -4.351 1.00 0.00 C ATOM 0 H THR A 991 -13.865 1.864 -1.821 1.00 0.00 H new ATOM 0 HA THR A 991 -14.143 4.591 -2.383 1.00 0.00 H new ATOM 0 HB THR A 991 -16.375 3.807 -3.344 1.00 0.00 H new ATOM 0 HG1 THR A 991 -16.848 1.624 -3.247 1.00 0.00 H new ATOM 0 HG21 THR A 991 -15.324 2.471 -5.133 1.00 0.00 H new ATOM 0 HG22 THR A 991 -14.333 3.884 -4.696 1.00 0.00 H new ATOM 0 HG23 THR A 991 -13.876 2.263 -4.120 1.00 0.00 H new ATOM 518 N THR A 992 -16.632 3.497 -0.519 1.00 0.00 N ATOM 519 CA THR A 992 -17.615 3.902 0.478 1.00 0.00 C ATOM 520 C THR A 992 -17.587 2.972 1.688 1.00 0.00 C ATOM 521 O THR A 992 -18.482 2.145 1.872 1.00 0.00 O ATOM 522 CB THR A 992 -19.039 3.921 -0.114 1.00 0.00 C ATOM 523 OG1 THR A 992 -19.059 4.703 -1.313 1.00 0.00 O ATOM 524 CG2 THR A 992 -20.035 4.494 0.884 1.00 0.00 C ATOM 0 H THR A 992 -16.767 2.554 -0.884 1.00 0.00 H new ATOM 0 HA THR A 992 -17.349 4.910 0.795 1.00 0.00 H new ATOM 0 HB THR A 992 -19.326 2.895 -0.342 1.00 0.00 H new ATOM 0 HG1 THR A 992 -19.966 4.709 -1.684 1.00 0.00 H new ATOM 0 HG21 THR A 992 -21.032 4.497 0.443 1.00 0.00 H new ATOM 0 HG22 THR A 992 -20.039 3.882 1.786 1.00 0.00 H new ATOM 0 HG23 THR A 992 -19.748 5.514 1.139 1.00 0.00 H new ATOM 532 N GLY A 993 -16.558 3.124 2.517 1.00 0.00 N ATOM 533 CA GLY A 993 -16.471 2.355 3.746 1.00 0.00 C ATOM 534 C GLY A 993 -16.520 0.858 3.509 1.00 0.00 C ATOM 535 O GLY A 993 -17.588 0.247 3.576 1.00 0.00 O ATOM 0 H GLY A 993 -15.782 3.767 2.359 1.00 0.00 H new ATOM 0 HA2 GLY A 993 -15.544 2.606 4.261 1.00 0.00 H new ATOM 0 HA3 GLY A 993 -17.290 2.640 4.406 1.00 0.00 H new ATOM 539 N HIS A 994 -15.361 0.263 3.243 1.00 0.00 N ATOM 540 CA HIS A 994 -15.267 -1.180 3.064 1.00 0.00 C ATOM 541 C HIS A 994 -14.186 -1.768 3.966 1.00 0.00 C ATOM 542 O HIS A 994 -13.093 -1.214 4.081 1.00 0.00 O ATOM 543 CB HIS A 994 -14.967 -1.520 1.602 1.00 0.00 C ATOM 544 CG HIS A 994 -15.986 -0.994 0.641 1.00 0.00 C ATOM 545 ND1 HIS A 994 -17.324 -0.871 0.953 1.00 0.00 N ATOM 546 CD2 HIS A 994 -15.858 -0.554 -0.634 1.00 0.00 C ATOM 547 CE1 HIS A 994 -17.974 -0.381 -0.088 1.00 0.00 C ATOM 548 NE2 HIS A 994 -17.108 -0.179 -1.062 1.00 0.00 N ATOM 0 H HIS A 994 -14.475 0.759 3.147 1.00 0.00 H new ATOM 0 HA HIS A 994 -16.227 -1.617 3.339 1.00 0.00 H new ATOM 0 HB2 HIS A 994 -13.989 -1.117 1.338 1.00 0.00 H new ATOM 0 HB3 HIS A 994 -14.905 -2.603 1.495 1.00 0.00 H new ATOM 0 HD2 HIS A 994 -14.944 -0.507 -1.207 1.00 0.00 H new ATOM 0 HE1 HIS A 994 -19.034 -0.180 -0.133 1.00 0.00 H new ATOM 0 HE2 HIS A 994 -17.331 0.195 -1.984 1.00 0.00 H new ATOM 557 N ARG A 995 -14.501 -2.888 4.607 1.00 0.00 N ATOM 558 CA ARG A 995 -13.568 -3.534 5.523 1.00 0.00 C ATOM 559 C ARG A 995 -12.407 -4.167 4.761 1.00 0.00 C ATOM 560 O ARG A 995 -12.597 -5.121 4.005 1.00 0.00 O ATOM 561 CB ARG A 995 -14.289 -4.597 6.356 1.00 0.00 C ATOM 562 CG ARG A 995 -13.394 -5.292 7.370 1.00 0.00 C ATOM 563 CD ARG A 995 -12.870 -4.321 8.416 1.00 0.00 C ATOM 564 NE ARG A 995 -13.953 -3.681 9.158 1.00 0.00 N ATOM 565 CZ ARG A 995 -13.759 -2.763 10.102 1.00 0.00 C ATOM 566 NH1 ARG A 995 -12.529 -2.380 10.418 1.00 0.00 N ATOM 567 NH2 ARG A 995 -14.797 -2.228 10.731 1.00 0.00 N ATOM 0 H ARG A 995 -15.396 -3.368 4.509 1.00 0.00 H new ATOM 0 HA ARG A 995 -13.167 -2.771 6.191 1.00 0.00 H new ATOM 0 HB2 ARG A 995 -15.123 -4.130 6.881 1.00 0.00 H new ATOM 0 HB3 ARG A 995 -14.712 -5.345 5.686 1.00 0.00 H new ATOM 0 HG2 ARG A 995 -13.951 -6.090 7.861 1.00 0.00 H new ATOM 0 HG3 ARG A 995 -12.555 -5.760 6.855 1.00 0.00 H new ATOM 0 HD2 ARG A 995 -12.219 -4.852 9.110 1.00 0.00 H new ATOM 0 HD3 ARG A 995 -12.262 -3.557 7.930 1.00 0.00 H new ATOM 0 HE ARG A 995 -14.912 -3.953 8.941 1.00 0.00 H new ATOM 0 HH11 ARG A 995 -11.728 -2.789 9.937 1.00 0.00 H new ATOM 0 HH12 ARG A 995 -12.384 -1.676 11.142 1.00 0.00 H new ATOM 0 HH21 ARG A 995 -15.744 -2.520 10.491 1.00 0.00 H new ATOM 0 HH22 ARG A 995 -14.648 -1.525 11.454 1.00 0.00 H new ATOM 581 N LEU A 996 -11.208 -3.635 4.969 1.00 0.00 N ATOM 582 CA LEU A 996 -10.016 -4.150 4.319 1.00 0.00 C ATOM 583 C LEU A 996 -9.680 -5.550 4.823 1.00 0.00 C ATOM 584 O LEU A 996 -9.633 -5.793 6.030 1.00 0.00 O ATOM 585 CB LEU A 996 -8.841 -3.207 4.572 1.00 0.00 C ATOM 586 CG LEU A 996 -8.891 -1.887 3.798 1.00 0.00 C ATOM 587 CD1 LEU A 996 -7.782 -0.956 4.265 1.00 0.00 C ATOM 588 CD2 LEU A 996 -8.780 -2.139 2.302 1.00 0.00 C ATOM 0 H LEU A 996 -11.039 -2.842 5.588 1.00 0.00 H new ATOM 0 HA LEU A 996 -10.207 -4.211 3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 996 -8.797 -2.984 5.638 1.00 0.00 H new ATOM 0 HB3 LEU A 996 -7.917 -3.726 4.316 1.00 0.00 H new ATOM 0 HG LEU A 996 -9.851 -1.409 3.995 1.00 0.00 H new ATOM 0 HD11 LEU A 996 -7.831 -0.022 3.705 1.00 0.00 H new ATOM 0 HD12 LEU A 996 -7.905 -0.749 5.328 1.00 0.00 H new ATOM 0 HD13 LEU A 996 -6.815 -1.429 4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 996 -8.818 -1.189 1.769 1.00 0.00 H new ATOM 0 HD22 LEU A 996 -7.836 -2.639 2.086 1.00 0.00 H new ATOM 0 HD23 LEU A 996 -9.607 -2.770 1.977 1.00 0.00 H new ATOM 600 N ILE A 997 -9.437 -6.467 3.891 1.00 0.00 N ATOM 601 CA ILE A 997 -9.046 -7.827 4.239 1.00 0.00 C ATOM 602 C ILE A 997 -7.531 -7.935 4.354 1.00 0.00 C ATOM 603 O ILE A 997 -6.933 -8.956 4.013 1.00 0.00 O ATOM 604 CB ILE A 997 -9.552 -8.841 3.196 1.00 0.00 C ATOM 605 CG1 ILE A 997 -10.966 -8.474 2.745 1.00 0.00 C ATOM 606 CG2 ILE A 997 -9.528 -10.252 3.769 1.00 0.00 C ATOM 607 CD1 ILE A 997 -11.178 -8.625 1.257 1.00 0.00 C ATOM 0 H ILE A 997 -9.504 -6.292 2.888 1.00 0.00 H new ATOM 0 HA ILE A 997 -9.501 -8.061 5.201 1.00 0.00 H new ATOM 0 HB ILE A 997 -8.890 -8.809 2.331 1.00 0.00 H new ATOM 0 HG12 ILE A 997 -11.683 -9.103 3.273 1.00 0.00 H new ATOM 0 HG13 ILE A 997 -11.175 -7.443 3.032 1.00 0.00 H new ATOM 0 HG21 ILE A 997 -9.889 -10.956 3.019 1.00 0.00 H new ATOM 0 HG22 ILE A 997 -8.508 -10.513 4.051 1.00 0.00 H new ATOM 0 HG23 ILE A 997 -10.170 -10.299 4.648 1.00 0.00 H new ATOM 0 HD11 ILE A 997 -12.202 -8.348 1.005 1.00 0.00 H new ATOM 0 HD12 ILE A 997 -10.485 -7.975 0.723 1.00 0.00 H new ATOM 0 HD13 ILE A 997 -11.000 -9.661 0.967 1.00 0.00 H new ATOM 619 N GLY A 998 -6.920 -6.862 4.836 1.00 0.00 N ATOM 620 CA GLY A 998 -5.477 -6.823 4.978 1.00 0.00 C ATOM 621 C GLY A 998 -5.020 -5.751 5.946 1.00 0.00 C ATOM 622 O GLY A 998 -5.233 -5.863 7.153 1.00 0.00 O ATOM 0 H GLY A 998 -7.400 -6.013 5.133 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -5.122 -7.794 5.322 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -5.023 -6.645 4.003 1.00 0.00 H new ATOM 626 N HIS A 999 -4.391 -4.709 5.414 1.00 0.00 N ATOM 627 CA HIS A 999 -3.908 -3.605 6.236 1.00 0.00 C ATOM 628 C HIS A 999 -4.200 -2.264 5.572 1.00 0.00 C ATOM 629 O HIS A 999 -4.092 -2.128 4.352 1.00 0.00 O ATOM 630 CB HIS A 999 -2.406 -3.748 6.480 1.00 0.00 C ATOM 631 CG HIS A 999 -1.998 -3.446 7.887 1.00 0.00 C ATOM 632 ND1 HIS A 999 -1.560 -2.204 8.296 1.00 0.00 N ATOM 633 CD2 HIS A 999 -1.964 -4.237 8.984 1.00 0.00 C ATOM 634 CE1 HIS A 999 -1.274 -2.245 9.586 1.00 0.00 C ATOM 635 NE2 HIS A 999 -1.511 -3.466 10.026 1.00 0.00 N ATOM 0 H HIS A 999 -4.203 -4.605 4.417 1.00 0.00 H new ATOM 0 HA HIS A 999 -4.432 -3.638 7.191 1.00 0.00 H new ATOM 0 HB2 HIS A 999 -2.101 -4.765 6.232 1.00 0.00 H new ATOM 0 HB3 HIS A 999 -1.871 -3.081 5.804 1.00 0.00 H new ATOM 0 HD2 HIS A 999 -2.241 -5.280 9.031 1.00 0.00 H new ATOM 0 HE1 HIS A 999 -0.909 -1.420 10.179 1.00 0.00 H new ATOM 0 HE2 HIS A 999 -1.379 -3.786 10.986 1.00 0.00 H new ATOM 644 N SER A1000 -4.565 -1.274 6.379 1.00 0.00 N ATOM 645 CA SER A1000 -4.861 0.060 5.869 1.00 0.00 C ATOM 646 C SER A1000 -3.593 0.904 5.780 1.00 0.00 C ATOM 647 O SER A1000 -3.643 2.130 5.879 1.00 0.00 O ATOM 648 CB SER A1000 -5.891 0.753 6.763 1.00 0.00 C ATOM 649 OG SER A1000 -6.247 2.023 6.245 1.00 0.00 O ATOM 0 H SER A1000 -4.663 -1.370 7.390 1.00 0.00 H new ATOM 0 HA SER A1000 -5.274 -0.045 4.866 1.00 0.00 H new ATOM 0 HB2 SER A1000 -6.781 0.129 6.848 1.00 0.00 H new ATOM 0 HB3 SER A1000 -5.485 0.868 7.768 1.00 0.00 H new ATOM 0 HG SER A1000 -5.436 2.516 6.000 1.00 0.00 H new ATOM 655 N SER A1001 -2.456 0.239 5.590 1.00 0.00 N ATOM 656 CA SER A1001 -1.174 0.929 5.481 1.00 0.00 C ATOM 657 C SER A1001 -0.084 -0.019 4.992 1.00 0.00 C ATOM 658 O SER A1001 -0.286 -1.232 4.924 1.00 0.00 O ATOM 659 CB SER A1001 -0.776 1.530 6.830 1.00 0.00 C ATOM 660 OG SER A1001 -0.645 0.523 7.819 1.00 0.00 O ATOM 0 H SER A1001 -2.397 -0.776 5.508 1.00 0.00 H new ATOM 0 HA SER A1001 -1.285 1.732 4.753 1.00 0.00 H new ATOM 0 HB2 SER A1001 0.166 2.068 6.728 1.00 0.00 H new ATOM 0 HB3 SER A1001 -1.526 2.256 7.143 1.00 0.00 H new ATOM 0 HG SER A1001 -1.151 -0.271 7.546 1.00 0.00 H new ATOM 666 N ALA A1002 1.075 0.542 4.656 1.00 0.00 N ATOM 667 CA ALA A1002 2.206 -0.251 4.190 1.00 0.00 C ATOM 668 C ALA A1002 3.503 0.547 4.264 1.00 0.00 C ATOM 669 O ALA A1002 3.488 1.777 4.233 1.00 0.00 O ATOM 670 CB ALA A1002 1.962 -0.733 2.767 1.00 0.00 C ATOM 0 H ALA A1002 1.254 1.545 4.698 1.00 0.00 H new ATOM 0 HA ALA A1002 2.305 -1.117 4.844 1.00 0.00 H new ATOM 0 HB1 ALA A1002 2.814 -1.324 2.432 1.00 0.00 H new ATOM 0 HB2 ALA A1002 1.062 -1.347 2.740 1.00 0.00 H new ATOM 0 HB3 ALA A1002 1.835 0.126 2.109 1.00 0.00 H new ATOM 676 N GLU A1003 4.625 -0.161 4.363 1.00 0.00 N ATOM 677 CA GLU A1003 5.932 0.483 4.447 1.00 0.00 C ATOM 678 C GLU A1003 6.916 -0.148 3.467 1.00 0.00 C ATOM 679 O GLU A1003 7.016 -1.371 3.372 1.00 0.00 O ATOM 680 CB GLU A1003 6.480 0.387 5.872 1.00 0.00 C ATOM 681 CG GLU A1003 5.637 1.124 6.899 1.00 0.00 C ATOM 682 CD GLU A1003 6.194 1.004 8.304 1.00 0.00 C ATOM 683 OE1 GLU A1003 5.817 0.048 9.014 1.00 0.00 O ATOM 684 OE2 GLU A1003 7.008 1.868 8.696 1.00 0.00 O ATOM 0 H GLU A1003 4.655 -1.180 4.387 1.00 0.00 H new ATOM 0 HA GLU A1003 5.809 1.533 4.182 1.00 0.00 H new ATOM 0 HB2 GLU A1003 6.548 -0.663 6.156 1.00 0.00 H new ATOM 0 HB3 GLU A1003 7.493 0.788 5.890 1.00 0.00 H new ATOM 0 HG2 GLU A1003 5.576 2.177 6.625 1.00 0.00 H new ATOM 0 HG3 GLU A1003 4.621 0.730 6.880 1.00 0.00 H new ATOM 691 N CYS A1004 7.644 0.698 2.743 1.00 0.00 N ATOM 692 CA CYS A1004 8.641 0.228 1.787 1.00 0.00 C ATOM 693 C CYS A1004 9.768 -0.513 2.499 1.00 0.00 C ATOM 694 O CYS A1004 10.698 0.102 3.019 1.00 0.00 O ATOM 695 CB CYS A1004 9.210 1.407 0.994 1.00 0.00 C ATOM 696 SG CYS A1004 10.469 0.939 -0.238 1.00 0.00 S ATOM 0 H CYS A1004 7.562 1.713 2.801 1.00 0.00 H new ATOM 0 HA CYS A1004 8.154 -0.463 1.099 1.00 0.00 H new ATOM 0 HB2 CYS A1004 8.392 1.917 0.485 1.00 0.00 H new ATOM 0 HB3 CYS A1004 9.647 2.122 1.691 1.00 0.00 H new ATOM 701 N ILE A1005 9.669 -1.839 2.529 1.00 0.00 N ATOM 702 CA ILE A1005 10.636 -2.662 3.246 1.00 0.00 C ATOM 703 C ILE A1005 11.672 -3.259 2.297 1.00 0.00 C ATOM 704 O ILE A1005 11.657 -2.995 1.095 1.00 0.00 O ATOM 705 CB ILE A1005 9.943 -3.803 4.014 1.00 0.00 C ATOM 706 CG1 ILE A1005 9.084 -4.643 3.065 1.00 0.00 C ATOM 707 CG2 ILE A1005 9.099 -3.239 5.148 1.00 0.00 C ATOM 708 CD1 ILE A1005 8.465 -5.859 3.719 1.00 0.00 C ATOM 0 H ILE A1005 8.929 -2.366 2.065 1.00 0.00 H new ATOM 0 HA ILE A1005 11.138 -2.006 3.957 1.00 0.00 H new ATOM 0 HB ILE A1005 10.708 -4.450 4.443 1.00 0.00 H new ATOM 0 HG12 ILE A1005 8.290 -4.017 2.658 1.00 0.00 H new ATOM 0 HG13 ILE A1005 9.698 -4.967 2.224 1.00 0.00 H new ATOM 0 HG21 ILE A1005 8.615 -4.056 5.682 1.00 0.00 H new ATOM 0 HG22 ILE A1005 9.737 -2.684 5.835 1.00 0.00 H new ATOM 0 HG23 ILE A1005 8.339 -2.572 4.740 1.00 0.00 H new ATOM 0 HD11 ILE A1005 7.871 -6.404 2.985 1.00 0.00 H new ATOM 0 HD12 ILE A1005 9.253 -6.507 4.102 1.00 0.00 H new ATOM 0 HD13 ILE A1005 7.824 -5.543 4.542 1.00 0.00 H new ATOM 720 N LEU A1006 12.579 -4.054 2.858 1.00 0.00 N ATOM 721 CA LEU A1006 13.689 -4.625 2.100 1.00 0.00 C ATOM 722 C LEU A1006 14.484 -3.543 1.378 1.00 0.00 C ATOM 723 O LEU A1006 14.288 -2.350 1.613 1.00 0.00 O ATOM 724 CB LEU A1006 13.186 -5.661 1.090 1.00 0.00 C ATOM 725 CG LEU A1006 12.391 -6.833 1.679 1.00 0.00 C ATOM 726 CD1 LEU A1006 12.450 -8.034 0.749 1.00 0.00 C ATOM 727 CD2 LEU A1006 12.904 -7.206 3.064 1.00 0.00 C ATOM 0 H LEU A1006 12.566 -4.319 3.843 1.00 0.00 H new ATOM 0 HA LEU A1006 14.348 -5.119 2.814 1.00 0.00 H new ATOM 0 HB2 LEU A1006 12.559 -5.153 0.357 1.00 0.00 H new ATOM 0 HB3 LEU A1006 14.044 -6.062 0.551 1.00 0.00 H new ATOM 0 HG LEU A1006 11.352 -6.518 1.780 1.00 0.00 H new ATOM 0 HD11 LEU A1006 11.881 -8.857 1.181 1.00 0.00 H new ATOM 0 HD12 LEU A1006 12.024 -7.767 -0.218 1.00 0.00 H new ATOM 0 HD13 LEU A1006 13.488 -8.341 0.616 1.00 0.00 H new ATOM 0 HD21 LEU A1006 12.321 -8.040 3.456 1.00 0.00 H new ATOM 0 HD22 LEU A1006 13.953 -7.496 2.998 1.00 0.00 H new ATOM 0 HD23 LEU A1006 12.806 -6.350 3.731 1.00 0.00 H new ATOM 739 N SER A1007 15.402 -3.976 0.519 1.00 0.00 N ATOM 740 CA SER A1007 16.372 -3.075 -0.099 1.00 0.00 C ATOM 741 C SER A1007 17.184 -3.803 -1.166 1.00 0.00 C ATOM 742 O SER A1007 16.977 -4.991 -1.416 1.00 0.00 O ATOM 743 CB SER A1007 17.319 -2.496 0.957 1.00 0.00 C ATOM 744 OG SER A1007 16.645 -1.598 1.820 1.00 0.00 O ATOM 0 H SER A1007 15.495 -4.951 0.233 1.00 0.00 H new ATOM 0 HA SER A1007 15.819 -2.261 -0.568 1.00 0.00 H new ATOM 0 HB2 SER A1007 17.754 -3.307 1.541 1.00 0.00 H new ATOM 0 HB3 SER A1007 18.143 -1.980 0.465 1.00 0.00 H new ATOM 0 HG SER A1007 15.722 -1.478 1.512 1.00 0.00 H new ATOM 750 N GLY A1008 18.121 -3.086 -1.781 1.00 0.00 N ATOM 751 CA GLY A1008 19.008 -3.697 -2.754 1.00 0.00 C ATOM 752 C GLY A1008 18.270 -4.219 -3.971 1.00 0.00 C ATOM 753 O GLY A1008 17.530 -3.479 -4.620 1.00 0.00 O ATOM 0 H GLY A1008 18.281 -2.091 -1.622 1.00 0.00 H new ATOM 0 HA2 GLY A1008 19.752 -2.966 -3.071 1.00 0.00 H new ATOM 0 HA3 GLY A1008 19.548 -4.518 -2.282 1.00 0.00 H new ATOM 757 N ASN A1009 18.479 -5.494 -4.285 1.00 0.00 N ATOM 758 CA ASN A1009 17.859 -6.106 -5.454 1.00 0.00 C ATOM 759 C ASN A1009 16.375 -6.362 -5.212 1.00 0.00 C ATOM 760 O ASN A1009 15.648 -6.766 -6.119 1.00 0.00 O ATOM 761 CB ASN A1009 18.563 -7.419 -5.805 1.00 0.00 C ATOM 762 CG ASN A1009 20.022 -7.217 -6.164 1.00 0.00 C ATOM 763 OD1 ASN A1009 20.676 -6.300 -5.667 1.00 0.00 O ATOM 764 ND2 ASN A1009 20.541 -8.076 -7.035 1.00 0.00 N ATOM 0 H ASN A1009 19.073 -6.123 -3.745 1.00 0.00 H new ATOM 0 HA ASN A1009 17.959 -5.413 -6.290 1.00 0.00 H new ATOM 0 HB2 ASN A1009 18.491 -8.103 -4.960 1.00 0.00 H new ATOM 0 HB3 ASN A1009 18.048 -7.891 -6.642 1.00 0.00 H new ATOM 0 HD21 ASN A1009 21.518 -7.990 -7.316 1.00 0.00 H new ATOM 0 HD22 ASN A1009 19.963 -8.822 -7.422 1.00 0.00 H new ATOM 771 N THR A1010 15.931 -6.122 -3.982 1.00 0.00 N ATOM 772 CA THR A1010 14.532 -6.315 -3.624 1.00 0.00 C ATOM 773 C THR A1010 13.943 -5.043 -3.018 1.00 0.00 C ATOM 774 O THR A1010 14.679 -4.142 -2.617 1.00 0.00 O ATOM 775 CB THR A1010 14.363 -7.478 -2.627 1.00 0.00 C ATOM 776 OG1 THR A1010 15.207 -8.573 -3.006 1.00 0.00 O ATOM 777 CG2 THR A1010 12.917 -7.948 -2.583 1.00 0.00 C ATOM 0 H THR A1010 16.521 -5.794 -3.217 1.00 0.00 H new ATOM 0 HA THR A1010 13.997 -6.558 -4.542 1.00 0.00 H new ATOM 0 HB THR A1010 14.646 -7.121 -1.637 1.00 0.00 H new ATOM 0 HG1 THR A1010 15.096 -9.308 -2.367 1.00 0.00 H new ATOM 0 HG21 THR A1010 12.823 -8.769 -1.872 1.00 0.00 H new ATOM 0 HG22 THR A1010 12.276 -7.123 -2.272 1.00 0.00 H new ATOM 0 HG23 THR A1010 12.615 -8.289 -3.573 1.00 0.00 H new ATOM 785 N ALA A1011 12.615 -4.967 -2.987 1.00 0.00 N ATOM 786 CA ALA A1011 11.917 -3.737 -2.622 1.00 0.00 C ATOM 787 C ALA A1011 10.415 -3.890 -2.825 1.00 0.00 C ATOM 788 O ALA A1011 9.951 -4.122 -3.941 1.00 0.00 O ATOM 789 CB ALA A1011 12.437 -2.562 -3.440 1.00 0.00 C ATOM 0 H ALA A1011 11.998 -5.747 -3.212 1.00 0.00 H new ATOM 0 HA ALA A1011 12.108 -3.541 -1.567 1.00 0.00 H new ATOM 0 HB1 ALA A1011 11.905 -1.655 -3.153 1.00 0.00 H new ATOM 0 HB2 ALA A1011 13.503 -2.432 -3.253 1.00 0.00 H new ATOM 0 HB3 ALA A1011 12.276 -2.757 -4.500 1.00 0.00 H new ATOM 795 N HIS A1012 9.659 -3.772 -1.738 1.00 0.00 N ATOM 796 CA HIS A1012 8.219 -3.986 -1.787 1.00 0.00 C ATOM 797 C HIS A1012 7.553 -3.494 -0.506 1.00 0.00 C ATOM 798 O HIS A1012 8.228 -3.140 0.459 1.00 0.00 O ATOM 799 CB HIS A1012 7.914 -5.470 -1.997 1.00 0.00 C ATOM 800 CG HIS A1012 8.351 -6.340 -0.859 1.00 0.00 C ATOM 801 ND1 HIS A1012 7.491 -7.183 -0.187 1.00 0.00 N ATOM 802 CD2 HIS A1012 9.564 -6.499 -0.275 1.00 0.00 C ATOM 803 CE1 HIS A1012 8.153 -7.822 0.760 1.00 0.00 C ATOM 804 NE2 HIS A1012 9.412 -7.426 0.727 1.00 0.00 N ATOM 0 H HIS A1012 10.020 -3.530 -0.815 1.00 0.00 H new ATOM 0 HA HIS A1012 7.818 -3.416 -2.625 1.00 0.00 H new ATOM 0 HB2 HIS A1012 6.841 -5.594 -2.147 1.00 0.00 H new ATOM 0 HB3 HIS A1012 8.405 -5.807 -2.910 1.00 0.00 H new ATOM 0 HD1 HIS A1012 6.498 -7.295 -0.390 1.00 0.00 H new ATOM 0 HD2 HIS A1012 10.478 -5.992 -0.547 1.00 0.00 H new ATOM 0 HE1 HIS A1012 7.736 -8.545 1.445 1.00 0.00 H new ATOM 813 N TRP A1013 6.223 -3.480 -0.505 1.00 0.00 N ATOM 814 CA TRP A1013 5.466 -3.065 0.670 1.00 0.00 C ATOM 815 C TRP A1013 5.128 -4.266 1.548 1.00 0.00 C ATOM 816 O TRP A1013 4.909 -5.369 1.046 1.00 0.00 O ATOM 817 CB TRP A1013 4.182 -2.347 0.249 1.00 0.00 C ATOM 818 CG TRP A1013 4.432 -1.139 -0.603 1.00 0.00 C ATOM 819 CD1 TRP A1013 4.493 -1.094 -1.965 1.00 0.00 C ATOM 820 CD2 TRP A1013 4.658 0.201 -0.147 1.00 0.00 C ATOM 821 NE1 TRP A1013 4.743 0.189 -2.385 1.00 0.00 N ATOM 822 CE2 TRP A1013 4.848 1.002 -1.287 1.00 0.00 C ATOM 823 CE3 TRP A1013 4.718 0.800 1.115 1.00 0.00 C ATOM 824 CZ2 TRP A1013 5.092 2.372 -1.205 1.00 0.00 C ATOM 825 CZ3 TRP A1013 4.960 2.159 1.196 1.00 0.00 C ATOM 826 CH2 TRP A1013 5.145 2.931 0.042 1.00 0.00 C ATOM 0 H TRP A1013 5.649 -3.751 -1.303 1.00 0.00 H new ATOM 0 HA TRP A1013 6.084 -2.377 1.247 1.00 0.00 H new ATOM 0 HB2 TRP A1013 3.547 -3.044 -0.298 1.00 0.00 H new ATOM 0 HB3 TRP A1013 3.632 -2.047 1.141 1.00 0.00 H new ATOM 0 HD1 TRP A1013 4.363 -1.944 -2.618 1.00 0.00 H new ATOM 0 HE1 TRP A1013 4.835 0.488 -3.356 1.00 0.00 H new ATOM 0 HE3 TRP A1013 4.578 0.212 2.010 1.00 0.00 H new ATOM 0 HZ2 TRP A1013 5.234 2.970 -2.093 1.00 0.00 H new ATOM 0 HZ3 TRP A1013 5.007 2.633 2.165 1.00 0.00 H new ATOM 0 HH2 TRP A1013 5.333 3.990 0.139 1.00 0.00 H new ATOM 837 N SER A1014 5.116 -4.050 2.860 1.00 0.00 N ATOM 838 CA SER A1014 4.953 -5.140 3.818 1.00 0.00 C ATOM 839 C SER A1014 3.716 -5.975 3.499 1.00 0.00 C ATOM 840 O SER A1014 3.825 -7.127 3.076 1.00 0.00 O ATOM 841 CB SER A1014 4.855 -4.586 5.240 1.00 0.00 C ATOM 842 OG SER A1014 6.021 -3.861 5.587 1.00 0.00 O ATOM 0 H SER A1014 5.217 -3.128 3.285 1.00 0.00 H new ATOM 0 HA SER A1014 5.829 -5.785 3.744 1.00 0.00 H new ATOM 0 HB2 SER A1014 3.982 -3.938 5.322 1.00 0.00 H new ATOM 0 HB3 SER A1014 4.710 -5.406 5.944 1.00 0.00 H new ATOM 0 HG SER A1014 5.932 -3.516 6.500 1.00 0.00 H new ATOM 848 N THR A1015 2.542 -5.391 3.715 1.00 0.00 N ATOM 849 CA THR A1015 1.285 -6.103 3.520 1.00 0.00 C ATOM 850 C THR A1015 0.875 -6.107 2.051 1.00 0.00 C ATOM 851 O THR A1015 1.009 -5.100 1.354 1.00 0.00 O ATOM 852 CB THR A1015 0.154 -5.479 4.358 1.00 0.00 C ATOM 853 OG1 THR A1015 -0.045 -4.113 3.974 1.00 0.00 O ATOM 854 CG2 THR A1015 0.480 -5.551 5.843 1.00 0.00 C ATOM 0 H THR A1015 2.435 -4.425 4.026 1.00 0.00 H new ATOM 0 HA THR A1015 1.448 -7.130 3.849 1.00 0.00 H new ATOM 0 HB THR A1015 -0.760 -6.044 4.174 1.00 0.00 H new ATOM 0 HG1 THR A1015 -0.032 -3.544 4.772 1.00 0.00 H new ATOM 0 HG21 THR A1015 -0.333 -5.104 6.416 1.00 0.00 H new ATOM 0 HG22 THR A1015 0.602 -6.593 6.139 1.00 0.00 H new ATOM 0 HG23 THR A1015 1.404 -5.007 6.039 1.00 0.00 H new ATOM 862 N LYS A1016 0.374 -7.249 1.589 1.00 0.00 N ATOM 863 CA LYS A1016 -0.067 -7.393 0.205 1.00 0.00 C ATOM 864 C LYS A1016 -1.142 -6.362 -0.135 1.00 0.00 C ATOM 865 O LYS A1016 -1.840 -5.873 0.753 1.00 0.00 O ATOM 866 CB LYS A1016 -0.602 -8.809 -0.041 1.00 0.00 C ATOM 867 CG LYS A1016 -1.936 -9.093 0.635 1.00 0.00 C ATOM 868 CD LYS A1016 -1.793 -9.207 2.144 1.00 0.00 C ATOM 869 CE LYS A1016 -3.130 -9.489 2.810 1.00 0.00 C ATOM 870 NZ LYS A1016 -3.001 -9.599 4.290 1.00 0.00 N ATOM 0 H LYS A1016 0.263 -8.091 2.155 1.00 0.00 H new ATOM 0 HA LYS A1016 0.793 -7.221 -0.443 1.00 0.00 H new ATOM 0 HB2 LYS A1016 -0.710 -8.964 -1.114 1.00 0.00 H new ATOM 0 HB3 LYS A1016 0.134 -9.531 0.313 1.00 0.00 H new ATOM 0 HG2 LYS A1016 -2.641 -8.297 0.396 1.00 0.00 H new ATOM 0 HG3 LYS A1016 -2.354 -10.018 0.239 1.00 0.00 H new ATOM 0 HD2 LYS A1016 -1.090 -10.004 2.385 1.00 0.00 H new ATOM 0 HD3 LYS A1016 -1.375 -8.282 2.542 1.00 0.00 H new ATOM 0 HE2 LYS A1016 -3.833 -8.693 2.565 1.00 0.00 H new ATOM 0 HE3 LYS A1016 -3.546 -10.415 2.412 1.00 0.00 H new ATOM 0 HZ1 LYS A1016 -3.934 -9.792 4.706 1.00 0.00 H new ATOM 0 HZ2 LYS A1016 -2.350 -10.375 4.525 1.00 0.00 H new ATOM 0 HZ3 LYS A1016 -2.628 -8.707 4.673 1.00 0.00 H new ATOM 884 N PRO A1017 -1.290 -6.021 -1.431 1.00 0.00 N ATOM 885 CA PRO A1017 -2.289 -5.050 -1.886 1.00 0.00 C ATOM 886 C PRO A1017 -3.669 -5.306 -1.283 1.00 0.00 C ATOM 887 O PRO A1017 -4.345 -6.267 -1.649 1.00 0.00 O ATOM 888 CB PRO A1017 -2.319 -5.263 -3.399 1.00 0.00 C ATOM 889 CG PRO A1017 -0.950 -5.745 -3.735 1.00 0.00 C ATOM 890 CD PRO A1017 -0.491 -6.557 -2.552 1.00 0.00 C ATOM 0 HA PRO A1017 -2.036 -4.033 -1.587 1.00 0.00 H new ATOM 0 HB2 PRO A1017 -3.077 -5.993 -3.682 1.00 0.00 H new ATOM 0 HB3 PRO A1017 -2.555 -4.338 -3.925 1.00 0.00 H new ATOM 0 HG2 PRO A1017 -0.961 -6.350 -4.642 1.00 0.00 H new ATOM 0 HG3 PRO A1017 -0.276 -4.908 -3.918 1.00 0.00 H new ATOM 0 HD2 PRO A1017 -0.673 -7.621 -2.701 1.00 0.00 H new ATOM 0 HD3 PRO A1017 0.578 -6.439 -2.375 1.00 0.00 H new ATOM 898 N PRO A1018 -4.097 -4.448 -0.338 1.00 0.00 N ATOM 899 CA PRO A1018 -5.372 -4.620 0.369 1.00 0.00 C ATOM 900 C PRO A1018 -6.562 -4.669 -0.582 1.00 0.00 C ATOM 901 O PRO A1018 -6.498 -4.157 -1.701 1.00 0.00 O ATOM 902 CB PRO A1018 -5.459 -3.381 1.266 1.00 0.00 C ATOM 903 CG PRO A1018 -4.053 -2.914 1.415 1.00 0.00 C ATOM 904 CD PRO A1018 -3.369 -3.252 0.123 1.00 0.00 C ATOM 0 HA PRO A1018 -5.405 -5.562 0.917 1.00 0.00 H new ATOM 0 HB2 PRO A1018 -6.085 -2.611 0.816 1.00 0.00 H new ATOM 0 HB3 PRO A1018 -5.899 -3.624 2.233 1.00 0.00 H new ATOM 0 HG2 PRO A1018 -4.016 -1.842 1.608 1.00 0.00 H new ATOM 0 HG3 PRO A1018 -3.565 -3.406 2.256 1.00 0.00 H new ATOM 0 HD2 PRO A1018 -3.439 -2.436 -0.596 1.00 0.00 H new ATOM 0 HD3 PRO A1018 -2.309 -3.457 0.270 1.00 0.00 H new ATOM 912 N ILE A1019 -7.650 -5.282 -0.127 1.00 0.00 N ATOM 913 CA ILE A1019 -8.872 -5.366 -0.919 1.00 0.00 C ATOM 914 C ILE A1019 -10.069 -4.865 -0.117 1.00 0.00 C ATOM 915 O ILE A1019 -10.005 -4.753 1.106 1.00 0.00 O ATOM 916 CB ILE A1019 -9.144 -6.810 -1.384 1.00 0.00 C ATOM 917 CG1 ILE A1019 -7.847 -7.474 -1.853 1.00 0.00 C ATOM 918 CG2 ILE A1019 -10.183 -6.822 -2.498 1.00 0.00 C ATOM 919 CD1 ILE A1019 -8.006 -8.935 -2.214 1.00 0.00 C ATOM 0 H ILE A1019 -7.710 -5.729 0.788 1.00 0.00 H new ATOM 0 HA ILE A1019 -8.731 -4.735 -1.797 1.00 0.00 H new ATOM 0 HB ILE A1019 -9.536 -7.378 -0.540 1.00 0.00 H new ATOM 0 HG12 ILE A1019 -7.466 -6.934 -2.720 1.00 0.00 H new ATOM 0 HG13 ILE A1019 -7.098 -7.383 -1.066 1.00 0.00 H new ATOM 0 HG21 ILE A1019 -10.364 -7.849 -2.816 1.00 0.00 H new ATOM 0 HG22 ILE A1019 -11.113 -6.386 -2.133 1.00 0.00 H new ATOM 0 HG23 ILE A1019 -9.817 -6.240 -3.344 1.00 0.00 H new ATOM 0 HD11 ILE A1019 -7.046 -9.337 -2.537 1.00 0.00 H new ATOM 0 HD12 ILE A1019 -8.357 -9.489 -1.343 1.00 0.00 H new ATOM 0 HD13 ILE A1019 -8.731 -9.033 -3.022 1.00 0.00 H new ATOM 931 N CYS A1020 -11.157 -4.558 -0.815 1.00 0.00 N ATOM 932 CA CYS A1020 -12.352 -4.024 -0.173 1.00 0.00 C ATOM 933 C CYS A1020 -13.465 -5.066 -0.139 1.00 0.00 C ATOM 934 O CYS A1020 -14.061 -5.386 -1.167 1.00 0.00 O ATOM 935 CB CYS A1020 -12.830 -2.768 -0.905 1.00 0.00 C ATOM 936 SG CYS A1020 -11.592 -1.433 -0.980 1.00 0.00 S ATOM 0 H CYS A1020 -11.236 -4.670 -1.826 1.00 0.00 H new ATOM 0 HA CYS A1020 -12.097 -3.762 0.854 1.00 0.00 H new ATOM 0 HB2 CYS A1020 -13.117 -3.040 -1.921 1.00 0.00 H new ATOM 0 HB3 CYS A1020 -13.725 -2.391 -0.411 1.00 0.00 H new ATOM 941 N GLN A1021 -13.735 -5.595 1.050 1.00 0.00 N ATOM 942 CA GLN A1021 -14.749 -6.630 1.217 1.00 0.00 C ATOM 943 C GLN A1021 -16.147 -6.068 0.982 1.00 0.00 C ATOM 944 O GLN A1021 -17.072 -6.807 0.644 1.00 0.00 O ATOM 945 CB GLN A1021 -14.657 -7.236 2.620 1.00 0.00 C ATOM 946 CG GLN A1021 -15.634 -8.379 2.855 1.00 0.00 C ATOM 947 CD GLN A1021 -15.523 -8.963 4.249 1.00 0.00 C ATOM 948 OE1 GLN A1021 -16.202 -8.519 5.177 1.00 0.00 O ATOM 949 NE2 GLN A1021 -14.664 -9.963 4.406 1.00 0.00 N ATOM 0 H GLN A1021 -13.265 -5.323 1.913 1.00 0.00 H new ATOM 0 HA GLN A1021 -14.565 -7.409 0.477 1.00 0.00 H new ATOM 0 HB2 GLN A1021 -13.642 -7.597 2.785 1.00 0.00 H new ATOM 0 HB3 GLN A1021 -14.841 -6.454 3.357 1.00 0.00 H new ATOM 0 HG2 GLN A1021 -16.651 -8.021 2.695 1.00 0.00 H new ATOM 0 HG3 GLN A1021 -15.453 -9.164 2.121 1.00 0.00 H new ATOM 0 HE21 GLN A1021 -14.122 -10.299 3.610 1.00 0.00 H new ATOM 0 HE22 GLN A1021 -14.546 -10.395 5.322 1.00 0.00 H new ATOM 958 N ARG A1022 -16.291 -4.757 1.167 1.00 0.00 N ATOM 959 CA ARG A1022 -17.581 -4.090 1.003 1.00 0.00 C ATOM 960 C ARG A1022 -18.593 -4.592 2.030 1.00 0.00 C ATOM 961 O ARG A1022 -18.978 -5.761 2.020 1.00 0.00 O ATOM 962 CB ARG A1022 -18.121 -4.304 -0.414 1.00 0.00 C ATOM 963 CG ARG A1022 -19.457 -3.621 -0.664 1.00 0.00 C ATOM 964 CD ARG A1022 -19.962 -3.884 -2.073 1.00 0.00 C ATOM 965 NE ARG A1022 -20.164 -5.309 -2.325 1.00 0.00 N ATOM 966 CZ ARG A1022 -20.578 -5.801 -3.488 1.00 0.00 C ATOM 967 NH1 ARG A1022 -20.834 -4.987 -4.504 1.00 0.00 N ATOM 968 NH2 ARG A1022 -20.736 -7.109 -3.638 1.00 0.00 N ATOM 0 H ARG A1022 -15.528 -4.134 1.431 1.00 0.00 H new ATOM 0 HA ARG A1022 -17.428 -3.023 1.165 1.00 0.00 H new ATOM 0 HB2 ARG A1022 -17.391 -3.931 -1.133 1.00 0.00 H new ATOM 0 HB3 ARG A1022 -18.229 -5.373 -0.595 1.00 0.00 H new ATOM 0 HG2 ARG A1022 -20.190 -3.978 0.059 1.00 0.00 H new ATOM 0 HG3 ARG A1022 -19.353 -2.547 -0.508 1.00 0.00 H new ATOM 0 HD2 ARG A1022 -20.901 -3.352 -2.227 1.00 0.00 H new ATOM 0 HD3 ARG A1022 -19.248 -3.486 -2.794 1.00 0.00 H new ATOM 0 HE ARG A1022 -19.977 -5.963 -1.565 1.00 0.00 H new ATOM 0 HH11 ARG A1022 -20.713 -3.980 -4.394 1.00 0.00 H new ATOM 0 HH12 ARG A1022 -21.152 -5.368 -5.395 1.00 0.00 H new ATOM 0 HH21 ARG A1022 -20.540 -7.739 -2.860 1.00 0.00 H new ATOM 0 HH22 ARG A1022 -21.054 -7.485 -4.531 1.00 0.00 H new ATOM 982 N ILE A1023 -19.021 -3.697 2.915 1.00 0.00 N ATOM 983 CA ILE A1023 -19.977 -4.048 3.959 1.00 0.00 C ATOM 984 C ILE A1023 -21.413 -3.719 3.540 1.00 0.00 C ATOM 985 O ILE A1023 -22.294 -4.576 3.625 1.00 0.00 O ATOM 986 CB ILE A1023 -19.654 -3.331 5.287 1.00 0.00 C ATOM 987 CG1 ILE A1023 -18.215 -3.629 5.716 1.00 0.00 C ATOM 988 CG2 ILE A1023 -20.636 -3.755 6.370 1.00 0.00 C ATOM 989 CD1 ILE A1023 -17.774 -2.861 6.943 1.00 0.00 C ATOM 0 H ILE A1023 -18.720 -2.722 2.930 1.00 0.00 H new ATOM 0 HA ILE A1023 -19.892 -5.124 4.110 1.00 0.00 H new ATOM 0 HB ILE A1023 -19.752 -2.256 5.137 1.00 0.00 H new ATOM 0 HG12 ILE A1023 -18.118 -4.697 5.912 1.00 0.00 H new ATOM 0 HG13 ILE A1023 -17.543 -3.394 4.890 1.00 0.00 H new ATOM 0 HG21 ILE A1023 -20.395 -3.241 7.301 1.00 0.00 H new ATOM 0 HG22 ILE A1023 -21.650 -3.496 6.064 1.00 0.00 H new ATOM 0 HG23 ILE A1023 -20.567 -4.832 6.522 1.00 0.00 H new ATOM 0 HD11 ILE A1023 -16.745 -3.124 7.186 1.00 0.00 H new ATOM 0 HD12 ILE A1023 -17.838 -1.791 6.745 1.00 0.00 H new ATOM 0 HD13 ILE A1023 -18.421 -3.114 7.783 1.00 0.00 H new ATOM 1001 N PRO A1024 -21.677 -2.475 3.085 1.00 0.00 N ATOM 1002 CA PRO A1024 -23.020 -2.063 2.662 1.00 0.00 C ATOM 1003 C PRO A1024 -23.588 -2.969 1.573 1.00 0.00 C ATOM 1004 O PRO A1024 -23.295 -2.721 0.385 1.00 0.00 O ATOM 1005 CB PRO A1024 -22.814 -0.644 2.122 1.00 0.00 C ATOM 1006 CG PRO A1024 -21.568 -0.164 2.779 1.00 0.00 C ATOM 1007 CD PRO A1024 -20.699 -1.377 2.947 1.00 0.00 C ATOM 1008 OXT PRO A1024 -24.322 -3.918 1.917 1.00 0.00 O ATOM 0 HA PRO A1024 -23.735 -2.118 3.483 1.00 0.00 H new ATOM 0 HB2 PRO A1024 -22.714 -0.645 1.037 1.00 0.00 H new ATOM 0 HB3 PRO A1024 -23.661 -0.002 2.364 1.00 0.00 H new ATOM 0 HG2 PRO A1024 -21.071 0.591 2.170 1.00 0.00 H new ATOM 0 HG3 PRO A1024 -21.787 0.297 3.742 1.00 0.00 H new ATOM 0 HD2 PRO A1024 -20.045 -1.526 2.088 1.00 0.00 H new ATOM 0 HD3 PRO A1024 -20.059 -1.295 3.825 1.00 0.00 H new TER 1016 PRO A1024