USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1003 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 927 SER OG : rot 76:sc= 0.653 USER MOD Set 1.2: A1026 ASN : amide:sc= -5.14! C(o=-4.5!,f=-4.6!) USER MOD Set 2.1: A1019 GLN : amide:sc= -0.245 X(o=0.99,f=1.1) USER MOD Set 2.2: A1023 CYS SG : rot 82:sc= 1.24 USER MOD Set 3.1: A 962 GLN : amide:sc= 0.574 K(o=1.8,f=-4.5!) USER MOD Set 3.2: A 992 SER OG : rot -102:sc= 1.19 USER MOD Single : A 912 THR OG1 : rot 180:sc= -0.185 USER MOD Single : A 915 GLN : amide:sc= -0.877 X(o=-0.88,f=-0.57) USER MOD Single : A 919 HIS : no HE2:sc= -0.103 K(o=-0.1,f=-0.66) USER MOD Single : A 922 LYS NZ :NH3+ -165:sc=-0.00547 (180deg=-0.179) USER MOD Single : A 923 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.84) USER MOD Single : A 929 THR OG1 : rot 89:sc= 1.23 USER MOD Single : A 930 GLN : amide:sc= -0.114 K(o=-0.11,f=-0.94) USER MOD Single : A 931 THR OG1 : rot 73:sc= 0.97 USER MOD Single : A 936 GLN : amide:sc= -0.0144 X(o=-0.014,f=0) USER MOD Single : A 937 HIS : no HE2:sc= 1.12 K(o=1.1,f=-4.6!) USER MOD Single : A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 943 LYS NZ :NH3+ -170:sc=-0.00397 (180deg=-0.0915) USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 949 GLN : amide:sc= -0.511 X(o=-0.51,f=-0.39) USER MOD Single : A 954 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 955 SER OG : rot 180:sc= 0 USER MOD Single : A 956 CYS SG : rot 180:sc= -1.48 USER MOD Single : A 957 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 968 GLN :FLIP amide:sc= -0.153 F(o=-1.1,f=-0.15) USER MOD Single : A 973 SER OG : rot 78:sc= 0.0909 USER MOD Single : A 974 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.35) USER MOD Single : A 976 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 983 GLN : amide:sc= 0.913 K(o=0.91,f=-1.2) USER MOD Single : A 990 SER OG : rot 69:sc= 0.652 USER MOD Single : A 991 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 995 GLN : amide:sc= -0.076 X(o=-0.076,f=-0.19) USER MOD Single : A 999 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0337) USER MOD Single : A1000 MET CE :methyl 161:sc= -0.963 (180deg=-2.15) USER MOD Single : A1005 LYS NZ :NH3+ -170:sc= -0.0082 (180deg=-0.11) USER MOD Single : A1007 SER OG : rot -37:sc= 0.659 USER MOD Single : A1010 THR OG1 : rot 180:sc=-0.00414 USER MOD Single : A1012 GLN :FLIP amide:sc= -1.63! C(o=-2.3!,f=-1.6!) USER MOD Single : A1014 GLN : amide:sc= -0.0646 K(o=-0.065,f=-1.2) USER MOD Single : A1016 SER OG : rot 180:sc= 0 USER MOD Single : A1018 MET CE :methyl -159:sc= 0 (180deg=-0.199) USER MOD Single : A1021 SER OG : rot 180:sc= 0 USER MOD Single : A1022 GLN :FLIP amide:sc= -0.0208 F(o=-1.4!,f=-0.021) USER MOD Single : A1025 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1029 THR OG1 : rot 74:sc= 0.133 USER MOD Single : A1036 THR OG1 : rot 94:sc= 1.23 USER MOD Single : A1039 GLN : amide:sc= -0.0751 X(o=-0.075,f=-0.37) USER MOD Single : A1040 LYS NZ :NH3+ -131:sc= -0.938 (180deg=-2.67!) USER MOD Single : A1042 GLN : amide:sc= -0.378 X(o=-0.38,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 907 26.847 6.321 12.021 1.00 0.00 N ATOM 2 CA GLY A 907 26.582 6.623 10.595 1.00 0.00 C ATOM 3 C GLY A 907 25.190 7.177 10.380 1.00 0.00 C ATOM 4 O GLY A 907 24.206 6.440 10.444 1.00 0.00 O ATOM 0 HA2 GLY A 907 27.318 7.342 10.234 1.00 0.00 H new ATOM 0 HA3 GLY A 907 26.706 5.716 10.004 1.00 0.00 H new ATOM 10 N ILE A 908 25.101 8.480 10.139 1.00 0.00 N ATOM 11 CA ILE A 908 23.817 9.127 9.898 1.00 0.00 C ATOM 12 C ILE A 908 23.255 8.718 8.542 1.00 0.00 C ATOM 13 O ILE A 908 24.002 8.315 7.645 1.00 0.00 O ATOM 14 CB ILE A 908 23.925 10.667 9.956 1.00 0.00 C ATOM 15 CG1 ILE A 908 24.901 11.182 8.894 1.00 0.00 C ATOM 16 CG2 ILE A 908 24.357 11.113 11.347 1.00 0.00 C ATOM 17 CD1 ILE A 908 24.987 12.691 8.825 1.00 0.00 C ATOM 0 H ILE A 908 25.903 9.109 10.105 1.00 0.00 H new ATOM 0 HA ILE A 908 23.145 8.798 10.691 1.00 0.00 H new ATOM 0 HB ILE A 908 22.943 11.091 9.746 1.00 0.00 H new ATOM 0 HG12 ILE A 908 25.893 10.780 9.100 1.00 0.00 H new ATOM 0 HG13 ILE A 908 24.598 10.800 7.919 1.00 0.00 H new ATOM 0 HG21 ILE A 908 24.429 12.200 11.374 1.00 0.00 H new ATOM 0 HG22 ILE A 908 23.623 10.780 12.080 1.00 0.00 H new ATOM 0 HG23 ILE A 908 25.329 10.679 11.583 1.00 0.00 H new ATOM 0 HD11 ILE A 908 25.697 12.980 8.051 1.00 0.00 H new ATOM 0 HD12 ILE A 908 24.005 13.101 8.588 1.00 0.00 H new ATOM 0 HD13 ILE A 908 25.320 13.081 9.787 1.00 0.00 H new ATOM 29 N ASP A 909 21.947 8.818 8.393 1.00 0.00 N ATOM 30 CA ASP A 909 21.300 8.429 7.150 1.00 0.00 C ATOM 31 C ASP A 909 20.621 9.626 6.491 1.00 0.00 C ATOM 32 O ASP A 909 19.809 10.313 7.108 1.00 0.00 O ATOM 33 CB ASP A 909 20.287 7.290 7.378 1.00 0.00 C ATOM 34 CG ASP A 909 19.110 7.674 8.265 1.00 0.00 C ATOM 35 OD1 ASP A 909 19.220 7.541 9.503 1.00 0.00 O ATOM 36 OD2 ASP A 909 18.064 8.094 7.730 1.00 0.00 O ATOM 0 H ASP A 909 21.312 9.164 9.113 1.00 0.00 H new ATOM 0 HA ASP A 909 22.075 8.060 6.478 1.00 0.00 H new ATOM 0 HB2 ASP A 909 19.907 6.957 6.412 1.00 0.00 H new ATOM 0 HB3 ASP A 909 20.805 6.442 7.826 1.00 0.00 H new ATOM 41 N PRO A 910 20.998 9.923 5.241 1.00 0.00 N ATOM 42 CA PRO A 910 20.310 10.901 4.411 1.00 0.00 C ATOM 43 C PRO A 910 19.189 10.223 3.636 1.00 0.00 C ATOM 44 O PRO A 910 18.678 9.188 4.068 1.00 0.00 O ATOM 45 CB PRO A 910 21.423 11.364 3.474 1.00 0.00 C ATOM 46 CG PRO A 910 22.245 10.140 3.258 1.00 0.00 C ATOM 47 CD PRO A 910 22.151 9.334 4.531 1.00 0.00 C ATOM 0 HA PRO A 910 19.844 11.716 4.964 1.00 0.00 H new ATOM 0 HB2 PRO A 910 21.021 11.746 2.535 1.00 0.00 H new ATOM 0 HB3 PRO A 910 22.011 12.166 3.919 1.00 0.00 H new ATOM 0 HG2 PRO A 910 21.874 9.568 2.408 1.00 0.00 H new ATOM 0 HG3 PRO A 910 23.280 10.401 3.039 1.00 0.00 H new ATOM 0 HD2 PRO A 910 21.994 8.276 4.323 1.00 0.00 H new ATOM 0 HD3 PRO A 910 23.065 9.411 5.121 1.00 0.00 H new ATOM 55 N PHE A 911 18.799 10.776 2.503 1.00 0.00 N ATOM 56 CA PHE A 911 17.840 10.100 1.659 1.00 0.00 C ATOM 57 C PHE A 911 18.495 9.649 0.361 1.00 0.00 C ATOM 58 O PHE A 911 18.858 10.451 -0.500 1.00 0.00 O ATOM 59 CB PHE A 911 16.596 10.959 1.403 1.00 0.00 C ATOM 60 CG PHE A 911 16.825 12.252 0.664 1.00 0.00 C ATOM 61 CD1 PHE A 911 17.325 13.367 1.317 1.00 0.00 C ATOM 62 CD2 PHE A 911 16.517 12.355 -0.684 1.00 0.00 C ATOM 63 CE1 PHE A 911 17.517 14.556 0.639 1.00 0.00 C ATOM 64 CE2 PHE A 911 16.710 13.541 -1.367 1.00 0.00 C ATOM 65 CZ PHE A 911 17.209 14.642 -0.704 1.00 0.00 C ATOM 0 H PHE A 911 19.126 11.676 2.152 1.00 0.00 H new ATOM 0 HA PHE A 911 17.497 9.211 2.188 1.00 0.00 H new ATOM 0 HB2 PHE A 911 15.878 10.364 0.839 1.00 0.00 H new ATOM 0 HB3 PHE A 911 16.134 11.189 2.363 1.00 0.00 H new ATOM 0 HD1 PHE A 911 17.567 13.306 2.368 1.00 0.00 H new ATOM 0 HD2 PHE A 911 16.121 11.497 -1.207 1.00 0.00 H new ATOM 0 HE1 PHE A 911 17.908 15.418 1.160 1.00 0.00 H new ATOM 0 HE2 PHE A 911 16.470 13.605 -2.418 1.00 0.00 H new ATOM 0 HZ PHE A 911 17.359 15.571 -1.235 1.00 0.00 H new ATOM 75 N THR A 912 18.695 8.351 0.263 1.00 0.00 N ATOM 76 CA THR A 912 19.248 7.740 -0.925 1.00 0.00 C ATOM 77 C THR A 912 18.138 7.105 -1.752 1.00 0.00 C ATOM 78 O THR A 912 16.958 7.207 -1.399 1.00 0.00 O ATOM 79 CB THR A 912 20.284 6.667 -0.543 1.00 0.00 C ATOM 80 OG1 THR A 912 19.694 5.731 0.372 1.00 0.00 O ATOM 81 CG2 THR A 912 21.511 7.301 0.096 1.00 0.00 C ATOM 0 H THR A 912 18.478 7.689 1.008 1.00 0.00 H new ATOM 0 HA THR A 912 19.739 8.514 -1.515 1.00 0.00 H new ATOM 0 HB THR A 912 20.595 6.149 -1.450 1.00 0.00 H new ATOM 0 HG1 THR A 912 20.354 5.048 0.612 1.00 0.00 H new ATOM 0 HG21 THR A 912 22.228 6.523 0.357 1.00 0.00 H new ATOM 0 HG22 THR A 912 21.969 7.996 -0.607 1.00 0.00 H new ATOM 0 HG23 THR A 912 21.215 7.839 0.997 1.00 0.00 H new ATOM 89 N LEU A 913 18.514 6.451 -2.842 1.00 0.00 N ATOM 90 CA LEU A 913 17.559 5.754 -3.690 1.00 0.00 C ATOM 91 C LEU A 913 16.785 4.712 -2.896 1.00 0.00 C ATOM 92 O LEU A 913 15.576 4.563 -3.067 1.00 0.00 O ATOM 93 CB LEU A 913 18.281 5.087 -4.864 1.00 0.00 C ATOM 94 CG LEU A 913 18.917 6.053 -5.863 1.00 0.00 C ATOM 95 CD1 LEU A 913 19.702 5.295 -6.919 1.00 0.00 C ATOM 96 CD2 LEU A 913 17.846 6.912 -6.512 1.00 0.00 C ATOM 0 H LEU A 913 19.481 6.389 -3.161 1.00 0.00 H new ATOM 0 HA LEU A 913 16.851 6.487 -4.076 1.00 0.00 H new ATOM 0 HB2 LEU A 913 19.058 4.433 -4.469 1.00 0.00 H new ATOM 0 HB3 LEU A 913 17.571 4.454 -5.395 1.00 0.00 H new ATOM 0 HG LEU A 913 19.609 6.701 -5.326 1.00 0.00 H new ATOM 0 HD11 LEU A 913 20.146 6.002 -7.620 1.00 0.00 H new ATOM 0 HD12 LEU A 913 20.491 4.715 -6.440 1.00 0.00 H new ATOM 0 HD13 LEU A 913 19.033 4.623 -7.457 1.00 0.00 H new ATOM 0 HD21 LEU A 913 18.310 7.597 -7.222 1.00 0.00 H new ATOM 0 HD22 LEU A 913 17.135 6.273 -7.036 1.00 0.00 H new ATOM 0 HD23 LEU A 913 17.324 7.484 -5.745 1.00 0.00 H new ATOM 108 N VAL A 914 17.482 4.013 -2.009 1.00 0.00 N ATOM 109 CA VAL A 914 16.864 2.950 -1.234 1.00 0.00 C ATOM 110 C VAL A 914 16.189 3.504 0.022 1.00 0.00 C ATOM 111 O VAL A 914 15.125 3.037 0.407 1.00 0.00 O ATOM 112 CB VAL A 914 17.882 1.847 -0.851 1.00 0.00 C ATOM 113 CG1 VAL A 914 18.624 1.356 -2.086 1.00 0.00 C ATOM 114 CG2 VAL A 914 18.862 2.323 0.216 1.00 0.00 C ATOM 0 H VAL A 914 18.471 4.164 -1.810 1.00 0.00 H new ATOM 0 HA VAL A 914 16.103 2.497 -1.869 1.00 0.00 H new ATOM 0 HB VAL A 914 17.321 1.015 -0.425 1.00 0.00 H new ATOM 0 HG11 VAL A 914 19.335 0.581 -1.799 1.00 0.00 H new ATOM 0 HG12 VAL A 914 17.910 0.946 -2.801 1.00 0.00 H new ATOM 0 HG13 VAL A 914 19.159 2.188 -2.544 1.00 0.00 H new ATOM 0 HG21 VAL A 914 19.558 1.519 0.455 1.00 0.00 H new ATOM 0 HG22 VAL A 914 19.416 3.184 -0.157 1.00 0.00 H new ATOM 0 HG23 VAL A 914 18.313 2.607 1.114 1.00 0.00 H new ATOM 124 N GLN A 915 16.783 4.534 0.625 1.00 0.00 N ATOM 125 CA GLN A 915 16.256 5.104 1.868 1.00 0.00 C ATOM 126 C GLN A 915 14.813 5.557 1.681 1.00 0.00 C ATOM 127 O GLN A 915 13.993 5.478 2.600 1.00 0.00 O ATOM 128 CB GLN A 915 17.108 6.290 2.319 1.00 0.00 C ATOM 129 CG GLN A 915 16.894 6.683 3.770 1.00 0.00 C ATOM 130 CD GLN A 915 17.138 5.535 4.730 1.00 0.00 C ATOM 131 OE1 GLN A 915 16.221 4.791 5.070 1.00 0.00 O ATOM 132 NE2 GLN A 915 18.374 5.386 5.175 1.00 0.00 N ATOM 0 H GLN A 915 17.626 4.990 0.276 1.00 0.00 H new ATOM 0 HA GLN A 915 16.290 4.329 2.634 1.00 0.00 H new ATOM 0 HB2 GLN A 915 18.160 6.047 2.170 1.00 0.00 H new ATOM 0 HB3 GLN A 915 16.886 7.147 1.684 1.00 0.00 H new ATOM 0 HG2 GLN A 915 17.560 7.508 4.021 1.00 0.00 H new ATOM 0 HG3 GLN A 915 15.874 7.047 3.897 1.00 0.00 H new ATOM 0 HE21 GLN A 915 19.107 6.025 4.868 1.00 0.00 H new ATOM 0 HE22 GLN A 915 18.595 4.632 5.825 1.00 0.00 H new ATOM 141 N ARG A 916 14.515 6.031 0.480 1.00 0.00 N ATOM 142 CA ARG A 916 13.168 6.443 0.129 1.00 0.00 C ATOM 143 C ARG A 916 12.226 5.248 0.125 1.00 0.00 C ATOM 144 O ARG A 916 11.072 5.361 0.527 1.00 0.00 O ATOM 145 CB ARG A 916 13.164 7.120 -1.237 1.00 0.00 C ATOM 146 CG ARG A 916 13.880 8.458 -1.251 1.00 0.00 C ATOM 147 CD ARG A 916 14.001 9.003 -2.661 1.00 0.00 C ATOM 148 NE ARG A 916 12.698 9.124 -3.315 1.00 0.00 N ATOM 149 CZ ARG A 916 12.498 9.770 -4.459 1.00 0.00 C ATOM 150 NH1 ARG A 916 13.508 10.392 -5.059 1.00 0.00 N ATOM 151 NH2 ARG A 916 11.291 9.785 -5.007 1.00 0.00 N ATOM 0 H ARG A 916 15.196 6.139 -0.272 1.00 0.00 H new ATOM 0 HA ARG A 916 12.819 7.155 0.877 1.00 0.00 H new ATOM 0 HB2 ARG A 916 13.634 6.457 -1.964 1.00 0.00 H new ATOM 0 HB3 ARG A 916 12.133 7.265 -1.559 1.00 0.00 H new ATOM 0 HG2 ARG A 916 13.337 9.170 -0.629 1.00 0.00 H new ATOM 0 HG3 ARG A 916 14.873 8.346 -0.815 1.00 0.00 H new ATOM 0 HD2 ARG A 916 14.484 9.980 -2.632 1.00 0.00 H new ATOM 0 HD3 ARG A 916 14.643 8.347 -3.249 1.00 0.00 H new ATOM 0 HE ARG A 916 11.894 8.686 -2.866 1.00 0.00 H new ATOM 0 HH11 ARG A 916 14.438 10.374 -4.641 1.00 0.00 H new ATOM 0 HH12 ARG A 916 13.353 10.887 -5.937 1.00 0.00 H new ATOM 0 HH21 ARG A 916 10.518 9.301 -4.551 1.00 0.00 H new ATOM 0 HH22 ARG A 916 11.136 10.280 -5.885 1.00 0.00 H new ATOM 165 N LEU A 917 12.735 4.102 -0.308 1.00 0.00 N ATOM 166 CA LEU A 917 11.942 2.884 -0.379 1.00 0.00 C ATOM 167 C LEU A 917 11.648 2.356 1.019 1.00 0.00 C ATOM 168 O LEU A 917 10.489 2.132 1.368 1.00 0.00 O ATOM 169 CB LEU A 917 12.671 1.816 -1.197 1.00 0.00 C ATOM 170 CG LEU A 917 11.941 0.478 -1.300 1.00 0.00 C ATOM 171 CD1 LEU A 917 10.653 0.634 -2.088 1.00 0.00 C ATOM 172 CD2 LEU A 917 12.839 -0.563 -1.936 1.00 0.00 C ATOM 0 H LEU A 917 13.701 3.992 -0.617 1.00 0.00 H new ATOM 0 HA LEU A 917 10.999 3.120 -0.871 1.00 0.00 H new ATOM 0 HB2 LEU A 917 12.839 2.201 -2.203 1.00 0.00 H new ATOM 0 HB3 LEU A 917 13.652 1.645 -0.753 1.00 0.00 H new ATOM 0 HG LEU A 917 11.685 0.142 -0.295 1.00 0.00 H new ATOM 0 HD11 LEU A 917 10.146 -0.329 -2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 917 10.005 1.353 -1.587 1.00 0.00 H new ATOM 0 HD13 LEU A 917 10.882 0.990 -3.092 1.00 0.00 H new ATOM 0 HD21 LEU A 917 12.306 -1.511 -2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 917 13.124 -0.236 -2.936 1.00 0.00 H new ATOM 0 HD23 LEU A 917 13.734 -0.692 -1.327 1.00 0.00 H new ATOM 184 N GLU A 918 12.704 2.164 1.809 1.00 0.00 N ATOM 185 CA GLU A 918 12.576 1.727 3.188 1.00 0.00 C ATOM 186 C GLU A 918 11.544 2.567 3.949 1.00 0.00 C ATOM 187 O GLU A 918 10.730 2.032 4.706 1.00 0.00 O ATOM 188 CB GLU A 918 13.938 1.823 3.876 1.00 0.00 C ATOM 189 CG GLU A 918 14.919 0.697 3.548 1.00 0.00 C ATOM 190 CD GLU A 918 15.219 0.498 2.074 1.00 0.00 C ATOM 191 OE1 GLU A 918 14.332 -0.011 1.363 1.00 0.00 O ATOM 192 OE2 GLU A 918 16.312 0.881 1.619 1.00 0.00 O ATOM 0 H GLU A 918 13.667 2.308 1.507 1.00 0.00 H new ATOM 0 HA GLU A 918 12.229 0.694 3.192 1.00 0.00 H new ATOM 0 HB2 GLU A 918 14.398 2.773 3.604 1.00 0.00 H new ATOM 0 HB3 GLU A 918 13.781 1.842 4.954 1.00 0.00 H new ATOM 0 HG2 GLU A 918 15.857 0.893 4.068 1.00 0.00 H new ATOM 0 HG3 GLU A 918 14.521 -0.235 3.949 1.00 0.00 H new ATOM 199 N HIS A 919 11.574 3.880 3.738 1.00 0.00 N ATOM 200 CA HIS A 919 10.632 4.779 4.402 1.00 0.00 C ATOM 201 C HIS A 919 9.242 4.691 3.783 1.00 0.00 C ATOM 202 O HIS A 919 8.238 4.702 4.494 1.00 0.00 O ATOM 203 CB HIS A 919 11.128 6.228 4.360 1.00 0.00 C ATOM 204 CG HIS A 919 12.215 6.521 5.347 1.00 0.00 C ATOM 205 ND1 HIS A 919 13.424 7.075 5.000 1.00 0.00 N ATOM 206 CD2 HIS A 919 12.255 6.348 6.690 1.00 0.00 C ATOM 207 CE1 HIS A 919 14.163 7.230 6.081 1.00 0.00 C ATOM 208 NE2 HIS A 919 13.478 6.798 7.121 1.00 0.00 N ATOM 0 H HIS A 919 12.236 4.344 3.116 1.00 0.00 H new ATOM 0 HA HIS A 919 10.566 4.459 5.442 1.00 0.00 H new ATOM 0 HB2 HIS A 919 11.491 6.449 3.356 1.00 0.00 H new ATOM 0 HB3 HIS A 919 10.288 6.896 4.549 1.00 0.00 H new ATOM 0 HD1 HIS A 919 13.706 7.327 4.053 1.00 0.00 H new ATOM 0 HD2 HIS A 919 11.471 5.933 7.306 1.00 0.00 H new ATOM 0 HE1 HIS A 919 15.161 7.641 6.109 1.00 0.00 H new ATOM 216 N ALA A 920 9.185 4.596 2.459 1.00 0.00 N ATOM 217 CA ALA A 920 7.911 4.543 1.754 1.00 0.00 C ATOM 218 C ALA A 920 7.153 3.265 2.089 1.00 0.00 C ATOM 219 O ALA A 920 5.931 3.271 2.191 1.00 0.00 O ATOM 220 CB ALA A 920 8.117 4.657 0.250 1.00 0.00 C ATOM 0 H ALA A 920 10.005 4.554 1.854 1.00 0.00 H new ATOM 0 HA ALA A 920 7.313 5.392 2.086 1.00 0.00 H new ATOM 0 HB1 ALA A 920 7.151 4.615 -0.254 1.00 0.00 H new ATOM 0 HB2 ALA A 920 8.605 5.604 0.020 1.00 0.00 H new ATOM 0 HB3 ALA A 920 8.742 3.834 -0.095 1.00 0.00 H new ATOM 226 N ALA A 921 7.883 2.174 2.269 1.00 0.00 N ATOM 227 CA ALA A 921 7.273 0.897 2.612 1.00 0.00 C ATOM 228 C ALA A 921 6.587 0.968 3.973 1.00 0.00 C ATOM 229 O ALA A 921 5.495 0.427 4.156 1.00 0.00 O ATOM 230 CB ALA A 921 8.314 -0.206 2.593 1.00 0.00 C ATOM 0 H ALA A 921 8.899 2.147 2.183 1.00 0.00 H new ATOM 0 HA ALA A 921 6.513 0.669 1.865 1.00 0.00 H new ATOM 0 HB1 ALA A 921 7.844 -1.155 2.851 1.00 0.00 H new ATOM 0 HB2 ALA A 921 8.751 -0.277 1.597 1.00 0.00 H new ATOM 0 HB3 ALA A 921 9.097 0.020 3.317 1.00 0.00 H new ATOM 236 N LYS A 922 7.229 1.650 4.921 1.00 0.00 N ATOM 237 CA LYS A 922 6.657 1.854 6.249 1.00 0.00 C ATOM 238 C LYS A 922 5.307 2.555 6.150 1.00 0.00 C ATOM 239 O LYS A 922 4.296 2.070 6.666 1.00 0.00 O ATOM 240 CB LYS A 922 7.589 2.709 7.113 1.00 0.00 C ATOM 241 CG LYS A 922 8.882 2.027 7.513 1.00 0.00 C ATOM 242 CD LYS A 922 9.807 2.996 8.233 1.00 0.00 C ATOM 243 CE LYS A 922 10.982 2.283 8.877 1.00 0.00 C ATOM 244 NZ LYS A 922 10.557 1.440 10.027 1.00 0.00 N ATOM 0 H LYS A 922 8.149 2.071 4.792 1.00 0.00 H new ATOM 0 HA LYS A 922 6.529 0.873 6.707 1.00 0.00 H new ATOM 0 HB2 LYS A 922 7.829 3.623 6.570 1.00 0.00 H new ATOM 0 HB3 LYS A 922 7.055 3.005 8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 922 8.664 1.177 8.160 1.00 0.00 H new ATOM 0 HG3 LYS A 922 9.380 1.634 6.627 1.00 0.00 H new ATOM 0 HD2 LYS A 922 10.176 3.739 7.526 1.00 0.00 H new ATOM 0 HD3 LYS A 922 9.246 3.534 8.997 1.00 0.00 H new ATOM 0 HE2 LYS A 922 11.480 1.660 8.134 1.00 0.00 H new ATOM 0 HE3 LYS A 922 11.711 3.019 9.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 11.390 1.176 10.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 9.891 1.974 10.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 10.092 0.580 9.674 1.00 0.00 H new ATOM 258 N GLN A 923 5.303 3.697 5.472 1.00 0.00 N ATOM 259 CA GLN A 923 4.106 4.520 5.362 1.00 0.00 C ATOM 260 C GLN A 923 3.055 3.848 4.482 1.00 0.00 C ATOM 261 O GLN A 923 1.863 3.962 4.746 1.00 0.00 O ATOM 262 CB GLN A 923 4.461 5.909 4.819 1.00 0.00 C ATOM 263 CG GLN A 923 4.998 5.898 3.398 1.00 0.00 C ATOM 264 CD GLN A 923 5.539 7.241 2.960 1.00 0.00 C ATOM 265 OE1 GLN A 923 6.725 7.528 3.124 1.00 0.00 O ATOM 266 NE2 GLN A 923 4.678 8.077 2.411 1.00 0.00 N ATOM 0 H GLN A 923 6.118 4.074 4.989 1.00 0.00 H new ATOM 0 HA GLN A 923 3.681 4.636 6.359 1.00 0.00 H new ATOM 0 HB2 GLN A 923 3.573 6.540 4.856 1.00 0.00 H new ATOM 0 HB3 GLN A 923 5.204 6.365 5.474 1.00 0.00 H new ATOM 0 HG2 GLN A 923 5.788 5.151 3.320 1.00 0.00 H new ATOM 0 HG3 GLN A 923 4.203 5.593 2.717 1.00 0.00 H new ATOM 0 HE21 GLN A 923 3.703 7.801 2.293 1.00 0.00 H new ATOM 0 HE22 GLN A 923 4.987 8.999 2.105 1.00 0.00 H new ATOM 275 N ALA A 924 3.498 3.130 3.452 1.00 0.00 N ATOM 276 CA ALA A 924 2.581 2.413 2.574 1.00 0.00 C ATOM 277 C ALA A 924 1.840 1.336 3.351 1.00 0.00 C ATOM 278 O ALA A 924 0.626 1.192 3.227 1.00 0.00 O ATOM 279 CB ALA A 924 3.328 1.800 1.399 1.00 0.00 C ATOM 0 H ALA A 924 4.483 3.030 3.207 1.00 0.00 H new ATOM 0 HA ALA A 924 1.854 3.125 2.183 1.00 0.00 H new ATOM 0 HB1 ALA A 924 2.624 1.270 0.757 1.00 0.00 H new ATOM 0 HB2 ALA A 924 3.817 2.589 0.828 1.00 0.00 H new ATOM 0 HB3 ALA A 924 4.078 1.101 1.769 1.00 0.00 H new ATOM 285 N ALA A 925 2.584 0.590 4.165 1.00 0.00 N ATOM 286 CA ALA A 925 1.995 -0.424 5.029 1.00 0.00 C ATOM 287 C ALA A 925 0.985 0.210 5.983 1.00 0.00 C ATOM 288 O ALA A 925 -0.098 -0.330 6.217 1.00 0.00 O ATOM 289 CB ALA A 925 3.087 -1.151 5.807 1.00 0.00 C ATOM 0 H ALA A 925 3.598 0.671 4.242 1.00 0.00 H new ATOM 0 HA ALA A 925 1.470 -1.150 4.409 1.00 0.00 H new ATOM 0 HB1 ALA A 925 2.635 -1.907 6.449 1.00 0.00 H new ATOM 0 HB2 ALA A 925 3.773 -1.631 5.109 1.00 0.00 H new ATOM 0 HB3 ALA A 925 3.635 -0.435 6.419 1.00 0.00 H new ATOM 295 N ALA A 926 1.344 1.374 6.510 1.00 0.00 N ATOM 296 CA ALA A 926 0.476 2.119 7.414 1.00 0.00 C ATOM 297 C ALA A 926 -0.791 2.588 6.699 1.00 0.00 C ATOM 298 O ALA A 926 -1.907 2.330 7.152 1.00 0.00 O ATOM 299 CB ALA A 926 1.229 3.311 7.984 1.00 0.00 C ATOM 0 H ALA A 926 2.239 1.826 6.325 1.00 0.00 H new ATOM 0 HA ALA A 926 0.178 1.458 8.227 1.00 0.00 H new ATOM 0 HB1 ALA A 926 0.576 3.865 8.659 1.00 0.00 H new ATOM 0 HB2 ALA A 926 2.104 2.961 8.531 1.00 0.00 H new ATOM 0 HB3 ALA A 926 1.547 3.963 7.171 1.00 0.00 H new ATOM 305 N SER A 927 -0.601 3.262 5.573 1.00 0.00 N ATOM 306 CA SER A 927 -1.704 3.804 4.791 1.00 0.00 C ATOM 307 C SER A 927 -2.632 2.697 4.294 1.00 0.00 C ATOM 308 O SER A 927 -3.853 2.874 4.236 1.00 0.00 O ATOM 309 CB SER A 927 -1.143 4.603 3.618 1.00 0.00 C ATOM 310 OG SER A 927 -0.343 5.682 4.080 1.00 0.00 O ATOM 0 H SER A 927 0.320 3.448 5.176 1.00 0.00 H new ATOM 0 HA SER A 927 -2.296 4.460 5.429 1.00 0.00 H new ATOM 0 HB2 SER A 927 -0.548 3.951 2.979 1.00 0.00 H new ATOM 0 HB3 SER A 927 -1.961 4.986 3.008 1.00 0.00 H new ATOM 0 HG SER A 927 0.523 5.340 4.386 1.00 0.00 H new ATOM 316 N ALA A 928 -2.057 1.553 3.943 1.00 0.00 N ATOM 317 CA ALA A 928 -2.846 0.399 3.543 1.00 0.00 C ATOM 318 C ALA A 928 -3.727 -0.060 4.693 1.00 0.00 C ATOM 319 O ALA A 928 -4.908 -0.352 4.504 1.00 0.00 O ATOM 320 CB ALA A 928 -1.942 -0.734 3.087 1.00 0.00 C ATOM 0 H ALA A 928 -1.048 1.402 3.928 1.00 0.00 H new ATOM 0 HA ALA A 928 -3.483 0.689 2.707 1.00 0.00 H new ATOM 0 HB1 ALA A 928 -2.551 -1.589 2.792 1.00 0.00 H new ATOM 0 HB2 ALA A 928 -1.344 -0.403 2.238 1.00 0.00 H new ATOM 0 HB3 ALA A 928 -1.282 -1.024 3.904 1.00 0.00 H new ATOM 326 N THR A 929 -3.147 -0.095 5.885 1.00 0.00 N ATOM 327 CA THR A 929 -3.872 -0.479 7.085 1.00 0.00 C ATOM 328 C THR A 929 -5.038 0.480 7.340 1.00 0.00 C ATOM 329 O THR A 929 -6.139 0.054 7.689 1.00 0.00 O ATOM 330 CB THR A 929 -2.933 -0.505 8.309 1.00 0.00 C ATOM 331 OG1 THR A 929 -1.798 -1.341 8.034 1.00 0.00 O ATOM 332 CG2 THR A 929 -3.656 -1.026 9.543 1.00 0.00 C ATOM 0 H THR A 929 -2.168 0.140 6.045 1.00 0.00 H new ATOM 0 HA THR A 929 -4.269 -1.482 6.931 1.00 0.00 H new ATOM 0 HB THR A 929 -2.603 0.515 8.505 1.00 0.00 H new ATOM 0 HG1 THR A 929 -1.091 -0.806 7.617 1.00 0.00 H new ATOM 0 HG21 THR A 929 -2.970 -1.033 10.390 1.00 0.00 H new ATOM 0 HG22 THR A 929 -4.504 -0.379 9.768 1.00 0.00 H new ATOM 0 HG23 THR A 929 -4.012 -2.039 9.355 1.00 0.00 H new ATOM 340 N GLN A 930 -4.792 1.774 7.139 1.00 0.00 N ATOM 341 CA GLN A 930 -5.835 2.786 7.291 1.00 0.00 C ATOM 342 C GLN A 930 -6.977 2.529 6.316 1.00 0.00 C ATOM 343 O GLN A 930 -8.150 2.561 6.689 1.00 0.00 O ATOM 344 CB GLN A 930 -5.279 4.191 7.045 1.00 0.00 C ATOM 345 CG GLN A 930 -4.172 4.603 8.002 1.00 0.00 C ATOM 346 CD GLN A 930 -4.588 4.519 9.457 1.00 0.00 C ATOM 347 OE1 GLN A 930 -5.765 4.658 9.795 1.00 0.00 O ATOM 348 NE2 GLN A 930 -3.621 4.316 10.331 1.00 0.00 N ATOM 0 H GLN A 930 -3.881 2.145 6.871 1.00 0.00 H new ATOM 0 HA GLN A 930 -6.205 2.722 8.314 1.00 0.00 H new ATOM 0 HB2 GLN A 930 -4.900 4.245 6.025 1.00 0.00 H new ATOM 0 HB3 GLN A 930 -6.095 4.910 7.121 1.00 0.00 H new ATOM 0 HG2 GLN A 930 -3.303 3.965 7.840 1.00 0.00 H new ATOM 0 HG3 GLN A 930 -3.864 5.624 7.776 1.00 0.00 H new ATOM 0 HE21 GLN A 930 -2.659 4.206 10.011 1.00 0.00 H new ATOM 0 HE22 GLN A 930 -3.835 4.269 11.327 1.00 0.00 H new ATOM 357 N THR A 931 -6.617 2.260 5.069 1.00 0.00 N ATOM 358 CA THR A 931 -7.597 2.047 4.018 1.00 0.00 C ATOM 359 C THR A 931 -8.408 0.775 4.271 1.00 0.00 C ATOM 360 O THR A 931 -9.615 0.752 4.045 1.00 0.00 O ATOM 361 CB THR A 931 -6.914 1.976 2.639 1.00 0.00 C ATOM 362 OG1 THR A 931 -6.036 3.102 2.482 1.00 0.00 O ATOM 363 CG2 THR A 931 -7.945 1.975 1.517 1.00 0.00 C ATOM 0 H THR A 931 -5.648 2.184 4.761 1.00 0.00 H new ATOM 0 HA THR A 931 -8.280 2.896 4.025 1.00 0.00 H new ATOM 0 HB THR A 931 -6.345 1.048 2.584 1.00 0.00 H new ATOM 0 HG1 THR A 931 -5.240 2.976 3.040 1.00 0.00 H new ATOM 0 HG21 THR A 931 -7.436 1.924 0.555 1.00 0.00 H new ATOM 0 HG22 THR A 931 -8.601 1.111 1.626 1.00 0.00 H new ATOM 0 HG23 THR A 931 -8.537 2.889 1.566 1.00 0.00 H new ATOM 371 N ILE A 932 -7.745 -0.270 4.762 1.00 0.00 N ATOM 372 CA ILE A 932 -8.420 -1.524 5.089 1.00 0.00 C ATOM 373 C ILE A 932 -9.466 -1.309 6.182 1.00 0.00 C ATOM 374 O ILE A 932 -10.596 -1.799 6.083 1.00 0.00 O ATOM 375 CB ILE A 932 -7.415 -2.609 5.544 1.00 0.00 C ATOM 376 CG1 ILE A 932 -6.540 -3.048 4.366 1.00 0.00 C ATOM 377 CG2 ILE A 932 -8.139 -3.807 6.149 1.00 0.00 C ATOM 378 CD1 ILE A 932 -5.521 -4.106 4.726 1.00 0.00 C ATOM 0 H ILE A 932 -6.741 -0.273 4.942 1.00 0.00 H new ATOM 0 HA ILE A 932 -8.914 -1.868 4.180 1.00 0.00 H new ATOM 0 HB ILE A 932 -6.775 -2.180 6.315 1.00 0.00 H new ATOM 0 HG12 ILE A 932 -7.181 -3.429 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 932 -6.021 -2.177 3.966 1.00 0.00 H new ATOM 0 HG21 ILE A 932 -7.409 -4.554 6.460 1.00 0.00 H new ATOM 0 HG22 ILE A 932 -8.718 -3.483 7.014 1.00 0.00 H new ATOM 0 HG23 ILE A 932 -8.808 -4.241 5.406 1.00 0.00 H new ATOM 0 HD11 ILE A 932 -4.939 -4.366 3.842 1.00 0.00 H new ATOM 0 HD12 ILE A 932 -4.855 -3.722 5.499 1.00 0.00 H new ATOM 0 HD13 ILE A 932 -6.034 -4.993 5.097 1.00 0.00 H new ATOM 390 N ALA A 933 -9.085 -0.566 7.213 1.00 0.00 N ATOM 391 CA ALA A 933 -9.987 -0.266 8.318 1.00 0.00 C ATOM 392 C ALA A 933 -11.226 0.467 7.820 1.00 0.00 C ATOM 393 O ALA A 933 -12.356 0.125 8.181 1.00 0.00 O ATOM 394 CB ALA A 933 -9.269 0.560 9.375 1.00 0.00 C ATOM 0 H ALA A 933 -8.155 -0.159 7.307 1.00 0.00 H new ATOM 0 HA ALA A 933 -10.306 -1.207 8.767 1.00 0.00 H new ATOM 0 HB1 ALA A 933 -9.954 0.777 10.195 1.00 0.00 H new ATOM 0 HB2 ALA A 933 -8.414 0.001 9.755 1.00 0.00 H new ATOM 0 HB3 ALA A 933 -8.924 1.495 8.934 1.00 0.00 H new ATOM 400 N ALA A 934 -11.009 1.466 6.974 1.00 0.00 N ATOM 401 CA ALA A 934 -12.102 2.236 6.403 1.00 0.00 C ATOM 402 C ALA A 934 -12.931 1.383 5.447 1.00 0.00 C ATOM 403 O ALA A 934 -14.160 1.436 5.463 1.00 0.00 O ATOM 404 CB ALA A 934 -11.567 3.467 5.689 1.00 0.00 C ATOM 0 H ALA A 934 -10.082 1.761 6.668 1.00 0.00 H new ATOM 0 HA ALA A 934 -12.751 2.559 7.217 1.00 0.00 H new ATOM 0 HB1 ALA A 934 -12.398 4.033 5.267 1.00 0.00 H new ATOM 0 HB2 ALA A 934 -11.025 4.092 6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 934 -10.894 3.160 4.889 1.00 0.00 H new ATOM 410 N ALA A 935 -12.250 0.583 4.632 1.00 0.00 N ATOM 411 CA ALA A 935 -12.907 -0.261 3.637 1.00 0.00 C ATOM 412 C ALA A 935 -13.939 -1.184 4.275 1.00 0.00 C ATOM 413 O ALA A 935 -15.064 -1.299 3.790 1.00 0.00 O ATOM 414 CB ALA A 935 -11.875 -1.077 2.872 1.00 0.00 C ATOM 0 H ALA A 935 -11.233 0.501 4.641 1.00 0.00 H new ATOM 0 HA ALA A 935 -13.432 0.395 2.942 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -12.379 -1.701 2.134 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -11.182 -0.405 2.366 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -11.324 -1.710 3.567 1.00 0.00 H new ATOM 420 N GLN A 936 -13.557 -1.831 5.367 1.00 0.00 N ATOM 421 CA GLN A 936 -14.446 -2.767 6.043 1.00 0.00 C ATOM 422 C GLN A 936 -15.665 -2.058 6.623 1.00 0.00 C ATOM 423 O GLN A 936 -16.788 -2.536 6.490 1.00 0.00 O ATOM 424 CB GLN A 936 -13.704 -3.513 7.151 1.00 0.00 C ATOM 425 CG GLN A 936 -12.614 -4.437 6.638 1.00 0.00 C ATOM 426 CD GLN A 936 -11.968 -5.236 7.750 1.00 0.00 C ATOM 427 OE1 GLN A 936 -12.419 -6.331 8.085 1.00 0.00 O ATOM 428 NE2 GLN A 936 -10.912 -4.697 8.330 1.00 0.00 N ATOM 0 H GLN A 936 -12.641 -1.726 5.803 1.00 0.00 H new ATOM 0 HA GLN A 936 -14.790 -3.485 5.299 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -13.262 -2.787 7.833 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -14.421 -4.097 7.728 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -13.037 -5.120 5.901 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -11.852 -3.848 6.127 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -10.570 -3.787 8.022 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -10.438 -5.191 9.086 1.00 0.00 H new ATOM 437 N HIS A 937 -15.443 -0.905 7.237 1.00 0.00 N ATOM 438 CA HIS A 937 -16.517 -0.190 7.920 1.00 0.00 C ATOM 439 C HIS A 937 -17.427 0.538 6.939 1.00 0.00 C ATOM 440 O HIS A 937 -18.612 0.720 7.203 1.00 0.00 O ATOM 441 CB HIS A 937 -15.943 0.803 8.933 1.00 0.00 C ATOM 442 CG HIS A 937 -15.354 0.154 10.147 1.00 0.00 C ATOM 443 ND1 HIS A 937 -14.011 -0.110 10.287 1.00 0.00 N ATOM 444 CD2 HIS A 937 -15.938 -0.272 11.291 1.00 0.00 C ATOM 445 CE1 HIS A 937 -13.794 -0.671 11.461 1.00 0.00 C ATOM 446 NE2 HIS A 937 -14.947 -0.779 12.094 1.00 0.00 N ATOM 0 H HIS A 937 -14.534 -0.444 7.278 1.00 0.00 H new ATOM 0 HA HIS A 937 -17.116 -0.934 8.445 1.00 0.00 H new ATOM 0 HB2 HIS A 937 -15.175 1.403 8.445 1.00 0.00 H new ATOM 0 HB3 HIS A 937 -16.732 1.487 9.245 1.00 0.00 H new ATOM 0 HD1 HIS A 937 -13.294 0.096 9.591 1.00 0.00 H new ATOM 0 HD2 HIS A 937 -16.990 -0.222 11.529 1.00 0.00 H new ATOM 0 HE1 HIS A 937 -12.834 -0.989 11.840 1.00 0.00 H new ATOM 454 N ALA A 938 -16.876 0.951 5.808 1.00 0.00 N ATOM 455 CA ALA A 938 -17.642 1.707 4.828 1.00 0.00 C ATOM 456 C ALA A 938 -18.320 0.790 3.814 1.00 0.00 C ATOM 457 O ALA A 938 -19.538 0.831 3.650 1.00 0.00 O ATOM 458 CB ALA A 938 -16.748 2.711 4.119 1.00 0.00 C ATOM 0 H ALA A 938 -15.906 0.777 5.546 1.00 0.00 H new ATOM 0 HA ALA A 938 -18.425 2.244 5.363 1.00 0.00 H new ATOM 0 HB1 ALA A 938 -17.335 3.269 3.389 1.00 0.00 H new ATOM 0 HB2 ALA A 938 -16.326 3.401 4.849 1.00 0.00 H new ATOM 0 HB3 ALA A 938 -15.941 2.184 3.609 1.00 0.00 H new ATOM 464 N ALA A 939 -17.533 -0.048 3.151 1.00 0.00 N ATOM 465 CA ALA A 939 -18.047 -0.881 2.069 1.00 0.00 C ATOM 466 C ALA A 939 -18.859 -2.055 2.602 1.00 0.00 C ATOM 467 O ALA A 939 -19.933 -2.362 2.085 1.00 0.00 O ATOM 468 CB ALA A 939 -16.906 -1.384 1.204 1.00 0.00 C ATOM 0 H ALA A 939 -16.538 -0.169 3.342 1.00 0.00 H new ATOM 0 HA ALA A 939 -18.711 -0.264 1.463 1.00 0.00 H new ATOM 0 HB1 ALA A 939 -17.304 -2.004 0.401 1.00 0.00 H new ATOM 0 HB2 ALA A 939 -16.372 -0.535 0.776 1.00 0.00 H new ATOM 0 HB3 ALA A 939 -16.221 -1.974 1.813 1.00 0.00 H new ATOM 474 N SER A 940 -18.347 -2.710 3.633 1.00 0.00 N ATOM 475 CA SER A 940 -19.034 -3.856 4.210 1.00 0.00 C ATOM 476 C SER A 940 -20.032 -3.401 5.270 1.00 0.00 C ATOM 477 O SER A 940 -20.831 -4.203 5.766 1.00 0.00 O ATOM 478 CB SER A 940 -18.025 -4.832 4.820 1.00 0.00 C ATOM 479 OG SER A 940 -17.076 -5.258 3.852 1.00 0.00 O ATOM 0 H SER A 940 -17.465 -2.470 4.085 1.00 0.00 H new ATOM 0 HA SER A 940 -19.578 -4.367 3.415 1.00 0.00 H new ATOM 0 HB2 SER A 940 -17.510 -4.354 5.653 1.00 0.00 H new ATOM 0 HB3 SER A 940 -18.550 -5.697 5.224 1.00 0.00 H new ATOM 0 HG SER A 940 -16.442 -5.879 4.267 1.00 0.00 H new ATOM 485 N ALA A 941 -19.973 -2.107 5.601 1.00 0.00 N ATOM 486 CA ALA A 941 -20.866 -1.489 6.580 1.00 0.00 C ATOM 487 C ALA A 941 -20.601 -2.004 7.996 1.00 0.00 C ATOM 488 O ALA A 941 -20.078 -3.102 8.189 1.00 0.00 O ATOM 489 CB ALA A 941 -22.325 -1.700 6.187 1.00 0.00 C ATOM 0 H ALA A 941 -19.300 -1.458 5.194 1.00 0.00 H new ATOM 0 HA ALA A 941 -20.660 -0.419 6.582 1.00 0.00 H new ATOM 0 HB1 ALA A 941 -22.973 -1.233 6.929 1.00 0.00 H new ATOM 0 HB2 ALA A 941 -22.508 -1.251 5.211 1.00 0.00 H new ATOM 0 HB3 ALA A 941 -22.538 -2.768 6.140 1.00 0.00 H new ATOM 495 N PRO A 942 -20.942 -1.200 9.012 1.00 0.00 N ATOM 496 CA PRO A 942 -20.814 -1.593 10.418 1.00 0.00 C ATOM 497 C PRO A 942 -21.907 -2.568 10.855 1.00 0.00 C ATOM 498 O PRO A 942 -22.079 -2.836 12.045 1.00 0.00 O ATOM 499 CB PRO A 942 -20.940 -0.270 11.189 1.00 0.00 C ATOM 500 CG PRO A 942 -20.982 0.813 10.156 1.00 0.00 C ATOM 501 CD PRO A 942 -21.436 0.172 8.879 1.00 0.00 C ATOM 0 HA PRO A 942 -19.875 -2.115 10.600 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -21.842 -0.260 11.800 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -20.096 -0.131 11.864 1.00 0.00 H new ATOM 0 HG2 PRO A 942 -21.666 1.607 10.455 1.00 0.00 H new ATOM 0 HG3 PRO A 942 -19.999 1.269 10.033 1.00 0.00 H new ATOM 0 HD2 PRO A 942 -22.520 0.203 8.774 1.00 0.00 H new ATOM 0 HD3 PRO A 942 -21.017 0.670 8.005 1.00 0.00 H new ATOM 509 N LYS A 943 -22.641 -3.086 9.881 1.00 0.00 N ATOM 510 CA LYS A 943 -23.691 -4.064 10.130 1.00 0.00 C ATOM 511 C LYS A 943 -23.675 -5.139 9.049 1.00 0.00 C ATOM 512 O LYS A 943 -23.219 -6.260 9.279 1.00 0.00 O ATOM 513 CB LYS A 943 -25.068 -3.394 10.181 1.00 0.00 C ATOM 514 CG LYS A 943 -25.313 -2.572 11.436 1.00 0.00 C ATOM 515 CD LYS A 943 -25.393 -3.456 12.670 1.00 0.00 C ATOM 516 CE LYS A 943 -25.640 -2.643 13.928 1.00 0.00 C ATOM 517 NZ LYS A 943 -24.489 -1.764 14.255 1.00 0.00 N ATOM 0 H LYS A 943 -22.526 -2.841 8.898 1.00 0.00 H new ATOM 0 HA LYS A 943 -23.500 -4.526 11.099 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -25.178 -2.748 9.310 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -25.837 -4.163 10.108 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -24.511 -1.845 11.559 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -26.240 -2.009 11.329 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -26.194 -4.185 12.544 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -24.465 -4.018 12.776 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -26.535 -2.035 13.797 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -25.831 -3.316 14.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -24.622 -1.356 15.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -23.611 -2.321 14.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -24.427 -0.998 13.554 1.00 0.00 H new ATOM 531 N ALA A 944 -24.159 -4.786 7.865 1.00 0.00 N ATOM 532 CA ALA A 944 -24.183 -5.709 6.739 1.00 0.00 C ATOM 533 C ALA A 944 -24.128 -4.955 5.421 1.00 0.00 C ATOM 534 O ALA A 944 -24.692 -3.866 5.293 1.00 0.00 O ATOM 535 CB ALA A 944 -25.425 -6.585 6.789 1.00 0.00 C ATOM 0 H ALA A 944 -24.542 -3.863 7.660 1.00 0.00 H new ATOM 0 HA ALA A 944 -23.302 -6.348 6.810 1.00 0.00 H new ATOM 0 HB1 ALA A 944 -25.423 -7.267 5.939 1.00 0.00 H new ATOM 0 HB2 ALA A 944 -25.428 -7.159 7.715 1.00 0.00 H new ATOM 0 HB3 ALA A 944 -26.315 -5.957 6.749 1.00 0.00 H new ATOM 541 N SER A 945 -23.450 -5.535 4.445 1.00 0.00 N ATOM 542 CA SER A 945 -23.313 -4.922 3.136 1.00 0.00 C ATOM 543 C SER A 945 -24.625 -5.000 2.361 1.00 0.00 C ATOM 544 O SER A 945 -25.465 -5.865 2.625 1.00 0.00 O ATOM 545 CB SER A 945 -22.185 -5.605 2.359 1.00 0.00 C ATOM 546 OG SER A 945 -22.376 -7.009 2.306 1.00 0.00 O ATOM 0 H SER A 945 -22.983 -6.437 4.537 1.00 0.00 H new ATOM 0 HA SER A 945 -23.064 -3.869 3.267 1.00 0.00 H new ATOM 0 HB2 SER A 945 -22.142 -5.203 1.347 1.00 0.00 H new ATOM 0 HB3 SER A 945 -21.228 -5.383 2.831 1.00 0.00 H new ATOM 0 HG SER A 945 -21.643 -7.420 1.803 1.00 0.00 H new ATOM 552 N ALA A 946 -24.801 -4.090 1.417 1.00 0.00 N ATOM 553 CA ALA A 946 -26.014 -4.044 0.618 1.00 0.00 C ATOM 554 C ALA A 946 -25.696 -4.219 -0.862 1.00 0.00 C ATOM 555 O ALA A 946 -25.000 -3.396 -1.463 1.00 0.00 O ATOM 556 CB ALA A 946 -26.750 -2.734 0.858 1.00 0.00 C ATOM 0 H ALA A 946 -24.116 -3.371 1.185 1.00 0.00 H new ATOM 0 HA ALA A 946 -26.660 -4.868 0.922 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -27.657 -2.710 0.254 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -27.014 -2.653 1.912 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -26.107 -1.899 0.579 1.00 0.00 H new ATOM 562 N GLY A 947 -26.205 -5.295 -1.442 1.00 0.00 N ATOM 563 CA GLY A 947 -25.941 -5.584 -2.835 1.00 0.00 C ATOM 564 C GLY A 947 -24.944 -6.711 -2.986 1.00 0.00 C ATOM 565 O GLY A 947 -24.921 -7.627 -2.163 1.00 0.00 O ATOM 0 H GLY A 947 -26.799 -5.976 -0.970 1.00 0.00 H new ATOM 0 HA2 GLY A 947 -26.872 -5.850 -3.336 1.00 0.00 H new ATOM 0 HA3 GLY A 947 -25.559 -4.690 -3.327 1.00 0.00 H new ATOM 569 N PRO A 948 -24.103 -6.678 -4.030 1.00 0.00 N ATOM 570 CA PRO A 948 -23.054 -7.677 -4.226 1.00 0.00 C ATOM 571 C PRO A 948 -21.867 -7.430 -3.298 1.00 0.00 C ATOM 572 O PRO A 948 -21.939 -6.597 -2.390 1.00 0.00 O ATOM 573 CB PRO A 948 -22.649 -7.472 -5.685 1.00 0.00 C ATOM 574 CG PRO A 948 -22.927 -6.032 -5.954 1.00 0.00 C ATOM 575 CD PRO A 948 -24.111 -5.662 -5.098 1.00 0.00 C ATOM 0 HA PRO A 948 -23.390 -8.690 -4.006 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -21.596 -7.708 -5.841 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -23.223 -8.117 -6.350 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -22.062 -5.416 -5.708 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -23.144 -5.869 -7.010 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -24.013 -4.655 -4.693 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -25.040 -5.687 -5.667 1.00 0.00 H new ATOM 583 N GLN A 949 -20.780 -8.157 -3.513 1.00 0.00 N ATOM 584 CA GLN A 949 -19.574 -7.941 -2.734 1.00 0.00 C ATOM 585 C GLN A 949 -18.882 -6.671 -3.225 1.00 0.00 C ATOM 586 O GLN A 949 -18.739 -6.474 -4.432 1.00 0.00 O ATOM 587 CB GLN A 949 -18.631 -9.149 -2.817 1.00 0.00 C ATOM 588 CG GLN A 949 -19.057 -10.339 -1.960 1.00 0.00 C ATOM 589 CD GLN A 949 -20.386 -10.947 -2.380 1.00 0.00 C ATOM 590 OE1 GLN A 949 -20.433 -11.835 -3.234 1.00 0.00 O ATOM 591 NE2 GLN A 949 -21.472 -10.485 -1.777 1.00 0.00 N ATOM 0 H GLN A 949 -20.710 -8.895 -4.214 1.00 0.00 H new ATOM 0 HA GLN A 949 -19.846 -7.821 -1.685 1.00 0.00 H new ATOM 0 HB2 GLN A 949 -18.562 -9.471 -3.856 1.00 0.00 H new ATOM 0 HB3 GLN A 949 -17.632 -8.837 -2.513 1.00 0.00 H new ATOM 0 HG2 GLN A 949 -18.284 -11.106 -2.009 1.00 0.00 H new ATOM 0 HG3 GLN A 949 -19.125 -10.021 -0.920 1.00 0.00 H new ATOM 0 HE21 GLN A 949 -21.392 -9.749 -1.075 1.00 0.00 H new ATOM 0 HE22 GLN A 949 -22.388 -10.865 -2.015 1.00 0.00 H new ATOM 600 N PRO A 950 -18.449 -5.789 -2.306 1.00 0.00 N ATOM 601 CA PRO A 950 -17.960 -4.448 -2.657 1.00 0.00 C ATOM 602 C PRO A 950 -16.538 -4.430 -3.225 1.00 0.00 C ATOM 603 O PRO A 950 -15.900 -3.376 -3.238 1.00 0.00 O ATOM 604 CB PRO A 950 -17.998 -3.684 -1.325 1.00 0.00 C ATOM 605 CG PRO A 950 -18.601 -4.615 -0.321 1.00 0.00 C ATOM 606 CD PRO A 950 -18.404 -6.002 -0.856 1.00 0.00 C ATOM 0 HA PRO A 950 -18.574 -4.015 -3.447 1.00 0.00 H new ATOM 0 HB2 PRO A 950 -16.995 -3.382 -1.022 1.00 0.00 H new ATOM 0 HB3 PRO A 950 -18.591 -2.774 -1.416 1.00 0.00 H new ATOM 0 HG2 PRO A 950 -18.120 -4.502 0.651 1.00 0.00 H new ATOM 0 HG3 PRO A 950 -19.660 -4.400 -0.180 1.00 0.00 H new ATOM 0 HD2 PRO A 950 -17.453 -6.429 -0.537 1.00 0.00 H new ATOM 0 HD3 PRO A 950 -19.187 -6.682 -0.521 1.00 0.00 H new ATOM 614 N LEU A 951 -16.051 -5.586 -3.692 1.00 0.00 N ATOM 615 CA LEU A 951 -14.710 -5.714 -4.296 1.00 0.00 C ATOM 616 C LEU A 951 -13.596 -5.558 -3.257 1.00 0.00 C ATOM 617 O LEU A 951 -12.654 -6.352 -3.228 1.00 0.00 O ATOM 618 CB LEU A 951 -14.502 -4.707 -5.445 1.00 0.00 C ATOM 619 CG LEU A 951 -15.287 -4.976 -6.740 1.00 0.00 C ATOM 620 CD1 LEU A 951 -15.099 -6.412 -7.203 1.00 0.00 C ATOM 621 CD2 LEU A 951 -16.766 -4.654 -6.571 1.00 0.00 C ATOM 0 H LEU A 951 -16.572 -6.462 -3.664 1.00 0.00 H new ATOM 0 HA LEU A 951 -14.655 -6.722 -4.706 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -14.770 -3.715 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -13.440 -4.681 -5.688 1.00 0.00 H new ATOM 0 HG LEU A 951 -14.887 -4.314 -7.509 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -15.665 -6.576 -8.120 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -14.042 -6.598 -7.391 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -15.456 -7.093 -6.430 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -17.291 -4.855 -7.505 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -17.185 -5.274 -5.778 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -16.882 -3.602 -6.309 1.00 0.00 H new ATOM 633 N LEU A 952 -13.716 -4.542 -2.408 1.00 0.00 N ATOM 634 CA LEU A 952 -12.739 -4.266 -1.357 1.00 0.00 C ATOM 635 C LEU A 952 -12.474 -5.484 -0.492 1.00 0.00 C ATOM 636 O LEU A 952 -11.370 -5.663 0.008 1.00 0.00 O ATOM 637 CB LEU A 952 -13.223 -3.121 -0.473 1.00 0.00 C ATOM 638 CG LEU A 952 -13.148 -1.738 -1.105 1.00 0.00 C ATOM 639 CD1 LEU A 952 -13.788 -0.716 -0.192 1.00 0.00 C ATOM 640 CD2 LEU A 952 -11.701 -1.369 -1.387 1.00 0.00 C ATOM 0 H LEU A 952 -14.495 -3.884 -2.429 1.00 0.00 H new ATOM 0 HA LEU A 952 -11.808 -3.989 -1.851 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -14.256 -3.316 -0.186 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -12.633 -3.117 0.444 1.00 0.00 H new ATOM 0 HG LEU A 952 -13.692 -1.749 -2.050 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -13.730 0.270 -0.652 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -14.833 -0.979 -0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -13.263 -0.702 0.763 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -11.660 -0.378 -1.839 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -11.138 -1.366 -0.454 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -11.266 -2.098 -2.071 1.00 0.00 H new ATOM 652 N VAL A 953 -13.491 -6.316 -0.315 1.00 0.00 N ATOM 653 CA VAL A 953 -13.357 -7.517 0.491 1.00 0.00 C ATOM 654 C VAL A 953 -12.258 -8.421 -0.065 1.00 0.00 C ATOM 655 O VAL A 953 -11.434 -8.957 0.676 1.00 0.00 O ATOM 656 CB VAL A 953 -14.687 -8.285 0.576 1.00 0.00 C ATOM 657 CG1 VAL A 953 -15.165 -8.689 -0.797 1.00 0.00 C ATOM 658 CG2 VAL A 953 -14.563 -9.494 1.494 1.00 0.00 C ATOM 0 H VAL A 953 -14.417 -6.180 -0.720 1.00 0.00 H new ATOM 0 HA VAL A 953 -13.080 -7.209 1.499 1.00 0.00 H new ATOM 0 HB VAL A 953 -15.434 -7.618 1.006 1.00 0.00 H new ATOM 0 HG11 VAL A 953 -16.107 -9.230 -0.710 1.00 0.00 H new ATOM 0 HG12 VAL A 953 -15.314 -7.798 -1.407 1.00 0.00 H new ATOM 0 HG13 VAL A 953 -14.420 -9.331 -1.267 1.00 0.00 H new ATOM 0 HG21 VAL A 953 -15.518 -10.019 1.536 1.00 0.00 H new ATOM 0 HG22 VAL A 953 -13.796 -10.166 1.109 1.00 0.00 H new ATOM 0 HG23 VAL A 953 -14.286 -9.164 2.495 1.00 0.00 H new ATOM 668 N GLN A 954 -12.246 -8.550 -1.381 1.00 0.00 N ATOM 669 CA GLN A 954 -11.250 -9.352 -2.074 1.00 0.00 C ATOM 670 C GLN A 954 -9.881 -8.688 -1.988 1.00 0.00 C ATOM 671 O GLN A 954 -8.878 -9.335 -1.682 1.00 0.00 O ATOM 672 CB GLN A 954 -11.634 -9.532 -3.545 1.00 0.00 C ATOM 673 CG GLN A 954 -13.011 -10.133 -3.755 1.00 0.00 C ATOM 674 CD GLN A 954 -13.241 -10.540 -5.195 1.00 0.00 C ATOM 675 OE1 GLN A 954 -12.967 -11.679 -5.580 1.00 0.00 O ATOM 676 NE2 GLN A 954 -13.732 -9.617 -6.005 1.00 0.00 N ATOM 0 H GLN A 954 -12.924 -8.103 -1.998 1.00 0.00 H new ATOM 0 HA GLN A 954 -11.208 -10.329 -1.593 1.00 0.00 H new ATOM 0 HB2 GLN A 954 -11.592 -8.563 -4.042 1.00 0.00 H new ATOM 0 HB3 GLN A 954 -10.893 -10.170 -4.028 1.00 0.00 H new ATOM 0 HG2 GLN A 954 -13.128 -11.003 -3.110 1.00 0.00 H new ATOM 0 HG3 GLN A 954 -13.771 -9.410 -3.457 1.00 0.00 H new ATOM 0 HE21 GLN A 954 -13.946 -8.686 -5.647 1.00 0.00 H new ATOM 0 HE22 GLN A 954 -13.897 -9.836 -6.987 1.00 0.00 H new ATOM 685 N SER A 955 -9.857 -7.389 -2.255 1.00 0.00 N ATOM 686 CA SER A 955 -8.624 -6.620 -2.237 1.00 0.00 C ATOM 687 C SER A 955 -7.989 -6.632 -0.847 1.00 0.00 C ATOM 688 O SER A 955 -6.779 -6.812 -0.712 1.00 0.00 O ATOM 689 CB SER A 955 -8.920 -5.188 -2.671 1.00 0.00 C ATOM 690 OG SER A 955 -9.660 -5.174 -3.881 1.00 0.00 O ATOM 0 H SER A 955 -10.687 -6.843 -2.488 1.00 0.00 H new ATOM 0 HA SER A 955 -7.915 -7.074 -2.929 1.00 0.00 H new ATOM 0 HB2 SER A 955 -9.481 -4.675 -1.890 1.00 0.00 H new ATOM 0 HB3 SER A 955 -7.986 -4.642 -2.804 1.00 0.00 H new ATOM 0 HG SER A 955 -9.842 -4.247 -4.143 1.00 0.00 H new ATOM 696 N CYS A 956 -8.822 -6.468 0.177 1.00 0.00 N ATOM 697 CA CYS A 956 -8.371 -6.446 1.564 1.00 0.00 C ATOM 698 C CYS A 956 -7.542 -7.678 1.897 1.00 0.00 C ATOM 699 O CYS A 956 -6.489 -7.578 2.528 1.00 0.00 O ATOM 700 CB CYS A 956 -9.579 -6.366 2.504 1.00 0.00 C ATOM 701 SG CYS A 956 -9.173 -6.518 4.260 1.00 0.00 S ATOM 0 H CYS A 956 -9.829 -6.347 0.068 1.00 0.00 H new ATOM 0 HA CYS A 956 -7.742 -5.566 1.699 1.00 0.00 H new ATOM 0 HB2 CYS A 956 -10.087 -5.415 2.342 1.00 0.00 H new ATOM 0 HB3 CYS A 956 -10.284 -7.153 2.237 1.00 0.00 H new ATOM 0 HG CYS A 956 -10.262 -6.435 4.966 1.00 0.00 H new ATOM 707 N LYS A 957 -8.011 -8.836 1.451 1.00 0.00 N ATOM 708 CA LYS A 957 -7.341 -10.097 1.733 1.00 0.00 C ATOM 709 C LYS A 957 -5.948 -10.128 1.109 1.00 0.00 C ATOM 710 O LYS A 957 -4.992 -10.597 1.724 1.00 0.00 O ATOM 711 CB LYS A 957 -8.189 -11.261 1.216 1.00 0.00 C ATOM 712 CG LYS A 957 -9.558 -11.332 1.873 1.00 0.00 C ATOM 713 CD LYS A 957 -10.446 -12.386 1.234 1.00 0.00 C ATOM 714 CE LYS A 957 -11.809 -12.429 1.908 1.00 0.00 C ATOM 715 NZ LYS A 957 -12.718 -13.423 1.287 1.00 0.00 N ATOM 0 H LYS A 957 -8.858 -8.927 0.889 1.00 0.00 H new ATOM 0 HA LYS A 957 -7.224 -10.195 2.812 1.00 0.00 H new ATOM 0 HB2 LYS A 957 -8.314 -11.162 0.138 1.00 0.00 H new ATOM 0 HB3 LYS A 957 -7.658 -12.197 1.391 1.00 0.00 H new ATOM 0 HG2 LYS A 957 -9.439 -11.554 2.934 1.00 0.00 H new ATOM 0 HG3 LYS A 957 -10.044 -10.359 1.803 1.00 0.00 H new ATOM 0 HD2 LYS A 957 -10.567 -12.170 0.173 1.00 0.00 H new ATOM 0 HD3 LYS A 957 -9.968 -13.363 1.308 1.00 0.00 H new ATOM 0 HE2 LYS A 957 -11.681 -12.668 2.964 1.00 0.00 H new ATOM 0 HE3 LYS A 957 -12.267 -11.441 1.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 -13.633 -13.414 1.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 -12.863 -13.182 0.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 -12.296 -14.371 1.358 1.00 0.00 H new ATOM 729 N ALA A 958 -5.834 -9.596 -0.098 1.00 0.00 N ATOM 730 CA ALA A 958 -4.561 -9.586 -0.807 1.00 0.00 C ATOM 731 C ALA A 958 -3.632 -8.507 -0.259 1.00 0.00 C ATOM 732 O ALA A 958 -2.414 -8.666 -0.252 1.00 0.00 O ATOM 733 CB ALA A 958 -4.792 -9.388 -2.299 1.00 0.00 C ATOM 0 H ALA A 958 -6.606 -9.166 -0.608 1.00 0.00 H new ATOM 0 HA ALA A 958 -4.077 -10.550 -0.651 1.00 0.00 H new ATOM 0 HB1 ALA A 958 -3.833 -9.382 -2.818 1.00 0.00 H new ATOM 0 HB2 ALA A 958 -5.408 -10.201 -2.683 1.00 0.00 H new ATOM 0 HB3 ALA A 958 -5.300 -8.438 -2.466 1.00 0.00 H new ATOM 739 N VAL A 959 -4.201 -7.406 0.203 1.00 0.00 N ATOM 740 CA VAL A 959 -3.401 -6.346 0.798 1.00 0.00 C ATOM 741 C VAL A 959 -2.855 -6.795 2.150 1.00 0.00 C ATOM 742 O VAL A 959 -1.671 -6.628 2.443 1.00 0.00 O ATOM 743 CB VAL A 959 -4.214 -5.044 0.970 1.00 0.00 C ATOM 744 CG1 VAL A 959 -3.385 -3.970 1.659 1.00 0.00 C ATOM 745 CG2 VAL A 959 -4.707 -4.540 -0.376 1.00 0.00 C ATOM 0 H VAL A 959 -5.204 -7.223 0.179 1.00 0.00 H new ATOM 0 HA VAL A 959 -2.573 -6.139 0.120 1.00 0.00 H new ATOM 0 HB VAL A 959 -5.076 -5.269 1.598 1.00 0.00 H new ATOM 0 HG11 VAL A 959 -3.981 -3.064 1.768 1.00 0.00 H new ATOM 0 HG12 VAL A 959 -3.078 -4.323 2.644 1.00 0.00 H new ATOM 0 HG13 VAL A 959 -2.501 -3.753 1.060 1.00 0.00 H new ATOM 0 HG21 VAL A 959 -5.278 -3.622 -0.234 1.00 0.00 H new ATOM 0 HG22 VAL A 959 -3.854 -4.340 -1.024 1.00 0.00 H new ATOM 0 HG23 VAL A 959 -5.344 -5.295 -0.836 1.00 0.00 H new ATOM 755 N ALA A 960 -3.721 -7.408 2.950 1.00 0.00 N ATOM 756 CA ALA A 960 -3.370 -7.825 4.304 1.00 0.00 C ATOM 757 C ALA A 960 -2.260 -8.876 4.318 1.00 0.00 C ATOM 758 O ALA A 960 -1.569 -9.034 5.324 1.00 0.00 O ATOM 759 CB ALA A 960 -4.598 -8.355 5.026 1.00 0.00 C ATOM 0 H ALA A 960 -4.680 -7.629 2.681 1.00 0.00 H new ATOM 0 HA ALA A 960 -2.992 -6.945 4.824 1.00 0.00 H new ATOM 0 HB1 ALA A 960 -4.322 -8.663 6.035 1.00 0.00 H new ATOM 0 HB2 ALA A 960 -5.355 -7.572 5.079 1.00 0.00 H new ATOM 0 HB3 ALA A 960 -4.999 -9.211 4.482 1.00 0.00 H new ATOM 765 N GLU A 961 -2.085 -9.591 3.210 1.00 0.00 N ATOM 766 CA GLU A 961 -1.052 -10.619 3.131 1.00 0.00 C ATOM 767 C GLU A 961 0.291 -10.011 2.730 1.00 0.00 C ATOM 768 O GLU A 961 1.348 -10.576 3.015 1.00 0.00 O ATOM 769 CB GLU A 961 -1.442 -11.719 2.134 1.00 0.00 C ATOM 770 CG GLU A 961 -1.479 -11.255 0.689 1.00 0.00 C ATOM 771 CD GLU A 961 -1.680 -12.388 -0.294 1.00 0.00 C ATOM 772 OE1 GLU A 961 -2.591 -13.216 -0.076 1.00 0.00 O ATOM 773 OE2 GLU A 961 -0.935 -12.455 -1.296 1.00 0.00 O ATOM 0 H GLU A 961 -2.640 -9.479 2.361 1.00 0.00 H new ATOM 0 HA GLU A 961 -0.956 -11.064 4.121 1.00 0.00 H new ATOM 0 HB2 GLU A 961 -0.734 -12.543 2.223 1.00 0.00 H new ATOM 0 HB3 GLU A 961 -2.423 -12.110 2.405 1.00 0.00 H new ATOM 0 HG2 GLU A 961 -2.283 -10.529 0.567 1.00 0.00 H new ATOM 0 HG3 GLU A 961 -0.547 -10.740 0.455 1.00 0.00 H new ATOM 780 N GLN A 962 0.248 -8.851 2.084 1.00 0.00 N ATOM 781 CA GLN A 962 1.456 -8.238 1.544 1.00 0.00 C ATOM 782 C GLN A 962 1.995 -7.142 2.464 1.00 0.00 C ATOM 783 O GLN A 962 3.175 -6.797 2.398 1.00 0.00 O ATOM 784 CB GLN A 962 1.178 -7.688 0.145 1.00 0.00 C ATOM 785 CG GLN A 962 0.823 -8.773 -0.858 1.00 0.00 C ATOM 786 CD GLN A 962 1.958 -9.754 -1.078 1.00 0.00 C ATOM 787 OE1 GLN A 962 3.131 -9.390 -1.018 1.00 0.00 O ATOM 788 NE2 GLN A 962 1.618 -11.013 -1.314 1.00 0.00 N ATOM 0 H GLN A 962 -0.606 -8.318 1.922 1.00 0.00 H new ATOM 0 HA GLN A 962 2.226 -9.006 1.477 1.00 0.00 H new ATOM 0 HB2 GLN A 962 0.361 -6.969 0.199 1.00 0.00 H new ATOM 0 HB3 GLN A 962 2.056 -7.147 -0.208 1.00 0.00 H new ATOM 0 HG2 GLN A 962 -0.057 -9.313 -0.508 1.00 0.00 H new ATOM 0 HG3 GLN A 962 0.557 -8.311 -1.809 1.00 0.00 H new ATOM 0 HE21 GLN A 962 0.633 -11.276 -1.356 1.00 0.00 H new ATOM 0 HE22 GLN A 962 2.341 -11.719 -1.453 1.00 0.00 H new ATOM 797 N ILE A 963 1.133 -6.609 3.327 1.00 0.00 N ATOM 798 CA ILE A 963 1.548 -5.606 4.313 1.00 0.00 C ATOM 799 C ILE A 963 2.710 -6.113 5.185 1.00 0.00 C ATOM 800 O ILE A 963 3.732 -5.434 5.298 1.00 0.00 O ATOM 801 CB ILE A 963 0.379 -5.162 5.225 1.00 0.00 C ATOM 802 CG1 ILE A 963 -0.697 -4.447 4.407 1.00 0.00 C ATOM 803 CG2 ILE A 963 0.882 -4.259 6.347 1.00 0.00 C ATOM 804 CD1 ILE A 963 -1.893 -4.011 5.226 1.00 0.00 C ATOM 0 H ILE A 963 0.143 -6.853 3.366 1.00 0.00 H new ATOM 0 HA ILE A 963 1.884 -4.743 3.739 1.00 0.00 H new ATOM 0 HB ILE A 963 -0.061 -6.053 5.673 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -0.256 -3.572 3.929 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -1.035 -5.109 3.610 1.00 0.00 H new ATOM 0 HG21 ILE A 963 0.044 -3.959 6.976 1.00 0.00 H new ATOM 0 HG22 ILE A 963 1.612 -4.799 6.949 1.00 0.00 H new ATOM 0 HG23 ILE A 963 1.350 -3.373 5.919 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -2.614 -3.511 4.579 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.359 -4.884 5.683 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.568 -3.323 6.007 1.00 0.00 H new ATOM 816 N PRO A 964 2.584 -7.304 5.816 1.00 0.00 N ATOM 817 CA PRO A 964 3.654 -7.858 6.650 1.00 0.00 C ATOM 818 C PRO A 964 4.952 -8.037 5.873 1.00 0.00 C ATOM 819 O PRO A 964 6.032 -7.804 6.406 1.00 0.00 O ATOM 820 CB PRO A 964 3.110 -9.217 7.112 1.00 0.00 C ATOM 821 CG PRO A 964 1.978 -9.520 6.193 1.00 0.00 C ATOM 822 CD PRO A 964 1.410 -8.192 5.790 1.00 0.00 C ATOM 0 HA PRO A 964 3.901 -7.193 7.478 1.00 0.00 H new ATOM 0 HB2 PRO A 964 3.879 -9.988 7.057 1.00 0.00 H new ATOM 0 HB3 PRO A 964 2.775 -9.175 8.148 1.00 0.00 H new ATOM 0 HG2 PRO A 964 2.321 -10.079 5.322 1.00 0.00 H new ATOM 0 HG3 PRO A 964 1.225 -10.133 6.689 1.00 0.00 H new ATOM 0 HD2 PRO A 964 0.957 -8.232 4.800 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.637 -7.858 6.482 1.00 0.00 H new ATOM 830 N LEU A 965 4.839 -8.420 4.603 1.00 0.00 N ATOM 831 CA LEU A 965 6.010 -8.637 3.763 1.00 0.00 C ATOM 832 C LEU A 965 6.775 -7.337 3.550 1.00 0.00 C ATOM 833 O LEU A 965 8.007 -7.335 3.512 1.00 0.00 O ATOM 834 CB LEU A 965 5.610 -9.252 2.420 1.00 0.00 C ATOM 835 CG LEU A 965 5.070 -10.681 2.507 1.00 0.00 C ATOM 836 CD1 LEU A 965 4.712 -11.205 1.127 1.00 0.00 C ATOM 837 CD2 LEU A 965 6.090 -11.594 3.174 1.00 0.00 C ATOM 0 H LEU A 965 3.948 -8.586 4.135 1.00 0.00 H new ATOM 0 HA LEU A 965 6.667 -9.338 4.278 1.00 0.00 H new ATOM 0 HB2 LEU A 965 4.853 -8.619 1.957 1.00 0.00 H new ATOM 0 HB3 LEU A 965 6.477 -9.245 1.760 1.00 0.00 H new ATOM 0 HG LEU A 965 4.165 -10.669 3.114 1.00 0.00 H new ATOM 0 HD11 LEU A 965 4.330 -12.222 1.212 1.00 0.00 H new ATOM 0 HD12 LEU A 965 3.948 -10.567 0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 965 5.600 -11.202 0.495 1.00 0.00 H new ATOM 0 HD21 LEU A 965 5.691 -12.607 3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 965 7.011 -11.598 2.591 1.00 0.00 H new ATOM 0 HD23 LEU A 965 6.299 -11.232 4.181 1.00 0.00 H new ATOM 849 N LEU A 966 6.042 -6.233 3.427 1.00 0.00 N ATOM 850 CA LEU A 966 6.657 -4.913 3.357 1.00 0.00 C ATOM 851 C LEU A 966 7.512 -4.675 4.590 1.00 0.00 C ATOM 852 O LEU A 966 8.703 -4.407 4.491 1.00 0.00 O ATOM 853 CB LEU A 966 5.597 -3.813 3.281 1.00 0.00 C ATOM 854 CG LEU A 966 4.752 -3.781 2.014 1.00 0.00 C ATOM 855 CD1 LEU A 966 3.699 -2.692 2.131 1.00 0.00 C ATOM 856 CD2 LEU A 966 5.629 -3.552 0.793 1.00 0.00 C ATOM 0 H LEU A 966 5.023 -6.228 3.374 1.00 0.00 H new ATOM 0 HA LEU A 966 7.271 -4.880 2.457 1.00 0.00 H new ATOM 0 HB2 LEU A 966 4.929 -3.921 4.136 1.00 0.00 H new ATOM 0 HB3 LEU A 966 6.095 -2.849 3.385 1.00 0.00 H new ATOM 0 HG LEU A 966 4.254 -4.743 1.894 1.00 0.00 H new ATOM 0 HD11 LEU A 966 3.095 -2.671 1.224 1.00 0.00 H new ATOM 0 HD12 LEU A 966 3.058 -2.896 2.989 1.00 0.00 H new ATOM 0 HD13 LEU A 966 4.187 -1.727 2.265 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.008 -3.532 -0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 966 6.151 -2.601 0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 966 6.357 -4.359 0.712 1.00 0.00 H new ATOM 868 N VAL A 967 6.885 -4.808 5.751 1.00 0.00 N ATOM 869 CA VAL A 967 7.538 -4.523 7.019 1.00 0.00 C ATOM 870 C VAL A 967 8.671 -5.514 7.299 1.00 0.00 C ATOM 871 O VAL A 967 9.708 -5.137 7.845 1.00 0.00 O ATOM 872 CB VAL A 967 6.517 -4.524 8.173 1.00 0.00 C ATOM 873 CG1 VAL A 967 7.186 -4.209 9.502 1.00 0.00 C ATOM 874 CG2 VAL A 967 5.405 -3.522 7.882 1.00 0.00 C ATOM 0 H VAL A 967 5.916 -5.114 5.839 1.00 0.00 H new ATOM 0 HA VAL A 967 7.976 -3.528 6.948 1.00 0.00 H new ATOM 0 HB VAL A 967 6.086 -5.522 8.249 1.00 0.00 H new ATOM 0 HG11 VAL A 967 6.439 -4.217 10.296 1.00 0.00 H new ATOM 0 HG12 VAL A 967 7.948 -4.959 9.713 1.00 0.00 H new ATOM 0 HG13 VAL A 967 7.651 -3.224 9.451 1.00 0.00 H new ATOM 0 HG21 VAL A 967 4.686 -3.528 8.702 1.00 0.00 H new ATOM 0 HG22 VAL A 967 5.832 -2.524 7.780 1.00 0.00 H new ATOM 0 HG23 VAL A 967 4.901 -3.797 6.956 1.00 0.00 H new ATOM 884 N GLN A 968 8.484 -6.774 6.913 1.00 0.00 N ATOM 885 CA GLN A 968 9.552 -7.767 7.011 1.00 0.00 C ATOM 886 C GLN A 968 10.740 -7.329 6.163 1.00 0.00 C ATOM 887 O GLN A 968 11.898 -7.463 6.568 1.00 0.00 O ATOM 888 CB GLN A 968 9.066 -9.148 6.561 1.00 0.00 C ATOM 889 CG GLN A 968 8.070 -9.786 7.516 1.00 0.00 C ATOM 890 CD GLN A 968 8.665 -10.087 8.879 1.00 0.00 C ATOM 891 OE1 GLN A 968 9.947 -10.423 8.913 1.00 0.00 O flip ATOM 892 NE2 GLN A 968 7.973 -10.034 9.895 1.00 0.00 N flip ATOM 0 H GLN A 968 7.608 -7.131 6.531 1.00 0.00 H new ATOM 0 HA GLN A 968 9.857 -7.841 8.055 1.00 0.00 H new ATOM 0 HB2 GLN A 968 8.606 -9.059 5.577 1.00 0.00 H new ATOM 0 HB3 GLN A 968 9.926 -9.809 6.452 1.00 0.00 H new ATOM 0 HG2 GLN A 968 7.215 -9.121 7.638 1.00 0.00 H new ATOM 0 HG3 GLN A 968 7.695 -10.711 7.077 1.00 0.00 H new ATOM 0 HE21 GLN A 968 6.990 -9.771 9.829 1.00 0.00 H new ATOM 0 HE22 GLN A 968 8.383 -10.253 10.803 1.00 0.00 H new ATOM 901 N GLY A 969 10.441 -6.797 4.985 1.00 0.00 N ATOM 902 CA GLY A 969 11.469 -6.228 4.146 1.00 0.00 C ATOM 903 C GLY A 969 12.116 -5.025 4.797 1.00 0.00 C ATOM 904 O GLY A 969 13.339 -4.928 4.857 1.00 0.00 O ATOM 0 H GLY A 969 9.499 -6.751 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 969 12.228 -6.982 3.938 1.00 0.00 H new ATOM 0 HA3 GLY A 969 11.038 -5.936 3.188 1.00 0.00 H new ATOM 908 N VAL A 970 11.289 -4.117 5.309 1.00 0.00 N ATOM 909 CA VAL A 970 11.781 -2.915 5.974 1.00 0.00 C ATOM 910 C VAL A 970 12.716 -3.272 7.125 1.00 0.00 C ATOM 911 O VAL A 970 13.819 -2.747 7.215 1.00 0.00 O ATOM 912 CB VAL A 970 10.633 -2.036 6.514 1.00 0.00 C ATOM 913 CG1 VAL A 970 11.184 -0.779 7.166 1.00 0.00 C ATOM 914 CG2 VAL A 970 9.662 -1.668 5.405 1.00 0.00 C ATOM 0 H VAL A 970 10.272 -4.192 5.276 1.00 0.00 H new ATOM 0 HA VAL A 970 12.325 -2.347 5.219 1.00 0.00 H new ATOM 0 HB VAL A 970 10.094 -2.613 7.265 1.00 0.00 H new ATOM 0 HG11 VAL A 970 10.360 -0.172 7.541 1.00 0.00 H new ATOM 0 HG12 VAL A 970 11.837 -1.055 7.994 1.00 0.00 H new ATOM 0 HG13 VAL A 970 11.751 -0.207 6.432 1.00 0.00 H new ATOM 0 HG21 VAL A 970 8.863 -1.049 5.812 1.00 0.00 H new ATOM 0 HG22 VAL A 970 10.190 -1.115 4.628 1.00 0.00 H new ATOM 0 HG23 VAL A 970 9.236 -2.576 4.978 1.00 0.00 H new ATOM 924 N ARG A 971 12.279 -4.181 7.989 1.00 0.00 N ATOM 925 CA ARG A 971 13.078 -4.590 9.144 1.00 0.00 C ATOM 926 C ARG A 971 14.420 -5.172 8.711 1.00 0.00 C ATOM 927 O ARG A 971 15.439 -4.956 9.367 1.00 0.00 O ATOM 928 CB ARG A 971 12.314 -5.603 9.998 1.00 0.00 C ATOM 929 CG ARG A 971 11.074 -5.022 10.658 1.00 0.00 C ATOM 930 CD ARG A 971 10.341 -6.057 11.495 1.00 0.00 C ATOM 931 NE ARG A 971 9.124 -5.505 12.094 1.00 0.00 N ATOM 932 CZ ARG A 971 8.077 -6.240 12.472 1.00 0.00 C ATOM 933 NH1 ARG A 971 8.123 -7.567 12.392 1.00 0.00 N ATOM 934 NH2 ARG A 971 6.988 -5.647 12.948 1.00 0.00 N ATOM 0 H ARG A 971 11.376 -4.650 7.914 1.00 0.00 H new ATOM 0 HA ARG A 971 13.271 -3.700 9.744 1.00 0.00 H new ATOM 0 HB2 ARG A 971 12.022 -6.447 9.373 1.00 0.00 H new ATOM 0 HB3 ARG A 971 12.979 -5.992 10.769 1.00 0.00 H new ATOM 0 HG2 ARG A 971 11.359 -4.180 11.289 1.00 0.00 H new ATOM 0 HG3 ARG A 971 10.403 -4.633 9.892 1.00 0.00 H new ATOM 0 HD2 ARG A 971 10.084 -6.913 10.872 1.00 0.00 H new ATOM 0 HD3 ARG A 971 11.001 -6.422 12.282 1.00 0.00 H new ATOM 0 HE ARG A 971 9.074 -4.495 12.231 1.00 0.00 H new ATOM 0 HH11 ARG A 971 8.962 -8.028 12.040 1.00 0.00 H new ATOM 0 HH12 ARG A 971 7.319 -8.124 12.683 1.00 0.00 H new ATOM 0 HH21 ARG A 971 6.953 -4.630 13.024 1.00 0.00 H new ATOM 0 HH22 ARG A 971 6.187 -6.208 13.237 1.00 0.00 H new ATOM 948 N GLY A 972 14.419 -5.902 7.603 1.00 0.00 N ATOM 949 CA GLY A 972 15.656 -6.448 7.075 1.00 0.00 C ATOM 950 C GLY A 972 16.536 -5.373 6.469 1.00 0.00 C ATOM 951 O GLY A 972 17.743 -5.339 6.704 1.00 0.00 O ATOM 0 H GLY A 972 13.585 -6.126 7.060 1.00 0.00 H new ATOM 0 HA2 GLY A 972 16.199 -6.954 7.873 1.00 0.00 H new ATOM 0 HA3 GLY A 972 15.428 -7.199 6.319 1.00 0.00 H new ATOM 955 N SER A 973 15.920 -4.482 5.705 1.00 0.00 N ATOM 956 CA SER A 973 16.630 -3.399 5.039 1.00 0.00 C ATOM 957 C SER A 973 17.138 -2.360 6.044 1.00 0.00 C ATOM 958 O SER A 973 18.149 -1.697 5.811 1.00 0.00 O ATOM 959 CB SER A 973 15.707 -2.748 4.005 1.00 0.00 C ATOM 960 OG SER A 973 15.347 -3.675 2.995 1.00 0.00 O ATOM 0 H SER A 973 14.915 -4.489 5.529 1.00 0.00 H new ATOM 0 HA SER A 973 17.503 -3.813 4.535 1.00 0.00 H new ATOM 0 HB2 SER A 973 14.810 -2.373 4.497 1.00 0.00 H new ATOM 0 HB3 SER A 973 16.206 -1.889 3.555 1.00 0.00 H new ATOM 0 HG SER A 973 14.649 -4.274 3.334 1.00 0.00 H new ATOM 966 N GLN A 974 16.434 -2.224 7.162 1.00 0.00 N ATOM 967 CA GLN A 974 16.843 -1.312 8.225 1.00 0.00 C ATOM 968 C GLN A 974 17.986 -1.904 9.037 1.00 0.00 C ATOM 969 O GLN A 974 18.840 -1.178 9.548 1.00 0.00 O ATOM 970 CB GLN A 974 15.666 -0.999 9.148 1.00 0.00 C ATOM 971 CG GLN A 974 14.628 -0.083 8.523 1.00 0.00 C ATOM 972 CD GLN A 974 15.164 1.310 8.272 1.00 0.00 C ATOM 973 OE1 GLN A 974 15.700 1.603 7.204 1.00 0.00 O ATOM 974 NE2 GLN A 974 15.019 2.179 9.256 1.00 0.00 N ATOM 0 H GLN A 974 15.574 -2.736 7.357 1.00 0.00 H new ATOM 0 HA GLN A 974 17.185 -0.388 7.758 1.00 0.00 H new ATOM 0 HB2 GLN A 974 15.185 -1.933 9.439 1.00 0.00 H new ATOM 0 HB3 GLN A 974 16.044 -0.537 10.060 1.00 0.00 H new ATOM 0 HG2 GLN A 974 14.288 -0.513 7.581 1.00 0.00 H new ATOM 0 HG3 GLN A 974 13.759 -0.022 9.178 1.00 0.00 H new ATOM 0 HE21 GLN A 974 14.568 1.894 10.126 1.00 0.00 H new ATOM 0 HE22 GLN A 974 15.358 3.135 9.146 1.00 0.00 H new ATOM 983 N ALA A 975 17.989 -3.222 9.160 1.00 0.00 N ATOM 984 CA ALA A 975 19.041 -3.914 9.885 1.00 0.00 C ATOM 985 C ALA A 975 20.306 -3.996 9.043 1.00 0.00 C ATOM 986 O ALA A 975 21.412 -3.771 9.537 1.00 0.00 O ATOM 987 CB ALA A 975 18.578 -5.304 10.288 1.00 0.00 C ATOM 0 H ALA A 975 17.274 -3.834 8.767 1.00 0.00 H new ATOM 0 HA ALA A 975 19.268 -3.349 10.789 1.00 0.00 H new ATOM 0 HB1 ALA A 975 19.376 -5.810 10.830 1.00 0.00 H new ATOM 0 HB2 ALA A 975 17.699 -5.224 10.928 1.00 0.00 H new ATOM 0 HB3 ALA A 975 18.326 -5.877 9.395 1.00 0.00 H new ATOM 993 N GLN A 976 20.137 -4.311 7.767 1.00 0.00 N ATOM 994 CA GLN A 976 21.266 -4.430 6.863 1.00 0.00 C ATOM 995 C GLN A 976 21.076 -3.563 5.621 1.00 0.00 C ATOM 996 O GLN A 976 20.609 -4.045 4.593 1.00 0.00 O ATOM 997 CB GLN A 976 21.463 -5.885 6.442 1.00 0.00 C ATOM 998 CG GLN A 976 21.789 -6.823 7.591 1.00 0.00 C ATOM 999 CD GLN A 976 21.878 -8.268 7.150 1.00 0.00 C ATOM 1000 OE1 GLN A 976 21.194 -8.689 6.215 1.00 0.00 O ATOM 1001 NE2 GLN A 976 22.729 -9.035 7.808 1.00 0.00 N ATOM 0 H GLN A 976 19.229 -4.488 7.337 1.00 0.00 H new ATOM 0 HA GLN A 976 22.151 -4.084 7.397 1.00 0.00 H new ATOM 0 HB2 GLN A 976 20.557 -6.235 5.947 1.00 0.00 H new ATOM 0 HB3 GLN A 976 22.267 -5.934 5.707 1.00 0.00 H new ATOM 0 HG2 GLN A 976 22.735 -6.525 8.042 1.00 0.00 H new ATOM 0 HG3 GLN A 976 21.024 -6.728 8.362 1.00 0.00 H new ATOM 0 HE21 GLN A 976 23.276 -8.647 8.576 1.00 0.00 H new ATOM 0 HE22 GLN A 976 22.839 -10.015 7.548 1.00 0.00 H new ATOM 1010 N PRO A 977 21.424 -2.268 5.703 1.00 0.00 N ATOM 1011 CA PRO A 977 21.410 -1.373 4.542 1.00 0.00 C ATOM 1012 C PRO A 977 22.588 -1.657 3.614 1.00 0.00 C ATOM 1013 O PRO A 977 22.694 -1.099 2.519 1.00 0.00 O ATOM 1014 CB PRO A 977 21.532 0.018 5.162 1.00 0.00 C ATOM 1015 CG PRO A 977 22.249 -0.204 6.450 1.00 0.00 C ATOM 1016 CD PRO A 977 21.840 -1.568 6.935 1.00 0.00 C ATOM 0 HA PRO A 977 20.516 -1.491 3.930 1.00 0.00 H new ATOM 0 HB2 PRO A 977 22.086 0.694 4.511 1.00 0.00 H new ATOM 0 HB3 PRO A 977 20.552 0.466 5.326 1.00 0.00 H new ATOM 0 HG2 PRO A 977 23.328 -0.150 6.308 1.00 0.00 H new ATOM 0 HG3 PRO A 977 21.985 0.562 7.179 1.00 0.00 H new ATOM 0 HD2 PRO A 977 22.665 -2.082 7.428 1.00 0.00 H new ATOM 0 HD3 PRO A 977 21.025 -1.509 7.656 1.00 0.00 H new ATOM 1024 N ASP A 978 23.476 -2.521 4.086 1.00 0.00 N ATOM 1025 CA ASP A 978 24.631 -2.958 3.316 1.00 0.00 C ATOM 1026 C ASP A 978 24.241 -4.075 2.361 1.00 0.00 C ATOM 1027 O ASP A 978 24.725 -4.136 1.231 1.00 0.00 O ATOM 1028 CB ASP A 978 25.731 -3.450 4.262 1.00 0.00 C ATOM 1029 CG ASP A 978 26.889 -4.106 3.533 1.00 0.00 C ATOM 1030 OD1 ASP A 978 27.825 -3.390 3.126 1.00 0.00 O ATOM 1031 OD2 ASP A 978 26.885 -5.348 3.387 1.00 0.00 O ATOM 0 H ASP A 978 23.415 -2.939 5.015 1.00 0.00 H new ATOM 0 HA ASP A 978 25.002 -2.113 2.736 1.00 0.00 H new ATOM 0 HB2 ASP A 978 26.105 -2.608 4.844 1.00 0.00 H new ATOM 0 HB3 ASP A 978 25.304 -4.161 4.969 1.00 0.00 H new ATOM 1036 N SER A 979 23.348 -4.940 2.823 1.00 0.00 N ATOM 1037 CA SER A 979 22.960 -6.120 2.069 1.00 0.00 C ATOM 1038 C SER A 979 22.081 -5.747 0.881 1.00 0.00 C ATOM 1039 O SER A 979 20.964 -5.261 1.052 1.00 0.00 O ATOM 1040 CB SER A 979 22.220 -7.107 2.978 1.00 0.00 C ATOM 1041 OG SER A 979 21.792 -8.256 2.260 1.00 0.00 O ATOM 0 H SER A 979 22.877 -4.844 3.723 1.00 0.00 H new ATOM 0 HA SER A 979 23.866 -6.592 1.689 1.00 0.00 H new ATOM 0 HB2 SER A 979 22.874 -7.410 3.796 1.00 0.00 H new ATOM 0 HB3 SER A 979 21.357 -6.614 3.426 1.00 0.00 H new ATOM 0 HG SER A 979 21.325 -8.866 2.868 1.00 0.00 H new ATOM 1047 N PRO A 980 22.573 -5.977 -0.344 1.00 0.00 N ATOM 1048 CA PRO A 980 21.800 -5.732 -1.557 1.00 0.00 C ATOM 1049 C PRO A 980 20.567 -6.619 -1.600 1.00 0.00 C ATOM 1050 O PRO A 980 19.510 -6.217 -2.077 1.00 0.00 O ATOM 1051 CB PRO A 980 22.765 -6.092 -2.694 1.00 0.00 C ATOM 1052 CG PRO A 980 24.119 -6.087 -2.071 1.00 0.00 C ATOM 1053 CD PRO A 980 23.917 -6.496 -0.643 1.00 0.00 C ATOM 0 HA PRO A 980 21.439 -4.706 -1.621 1.00 0.00 H new ATOM 0 HB2 PRO A 980 22.529 -7.069 -3.117 1.00 0.00 H new ATOM 0 HB3 PRO A 980 22.703 -5.369 -3.507 1.00 0.00 H new ATOM 0 HG2 PRO A 980 24.787 -6.778 -2.584 1.00 0.00 H new ATOM 0 HG3 PRO A 980 24.574 -5.098 -2.133 1.00 0.00 H new ATOM 0 HD2 PRO A 980 23.970 -7.578 -0.520 1.00 0.00 H new ATOM 0 HD3 PRO A 980 24.673 -6.064 0.013 1.00 0.00 H new ATOM 1061 N SER A 981 20.708 -7.823 -1.060 1.00 0.00 N ATOM 1062 CA SER A 981 19.615 -8.775 -1.015 1.00 0.00 C ATOM 1063 C SER A 981 18.515 -8.296 -0.071 1.00 0.00 C ATOM 1064 O SER A 981 17.345 -8.627 -0.255 1.00 0.00 O ATOM 1065 CB SER A 981 20.138 -10.142 -0.583 1.00 0.00 C ATOM 1066 OG SER A 981 21.180 -10.572 -1.442 1.00 0.00 O ATOM 0 H SER A 981 21.576 -8.161 -0.645 1.00 0.00 H new ATOM 0 HA SER A 981 19.184 -8.860 -2.013 1.00 0.00 H new ATOM 0 HB2 SER A 981 20.503 -10.090 0.443 1.00 0.00 H new ATOM 0 HB3 SER A 981 19.326 -10.869 -0.596 1.00 0.00 H new ATOM 0 HG SER A 981 21.504 -11.449 -1.149 1.00 0.00 H new ATOM 1072 N ALA A 982 18.892 -7.509 0.932 1.00 0.00 N ATOM 1073 CA ALA A 982 17.914 -6.925 1.840 1.00 0.00 C ATOM 1074 C ALA A 982 17.060 -5.908 1.096 1.00 0.00 C ATOM 1075 O ALA A 982 15.833 -6.018 1.067 1.00 0.00 O ATOM 1076 CB ALA A 982 18.602 -6.283 3.034 1.00 0.00 C ATOM 0 H ALA A 982 19.861 -7.263 1.135 1.00 0.00 H new ATOM 0 HA ALA A 982 17.267 -7.718 2.216 1.00 0.00 H new ATOM 0 HB1 ALA A 982 17.852 -5.853 3.698 1.00 0.00 H new ATOM 0 HB2 ALA A 982 19.175 -7.038 3.573 1.00 0.00 H new ATOM 0 HB3 ALA A 982 19.273 -5.497 2.688 1.00 0.00 H new ATOM 1082 N GLN A 983 17.718 -4.932 0.482 1.00 0.00 N ATOM 1083 CA GLN A 983 17.031 -3.932 -0.326 1.00 0.00 C ATOM 1084 C GLN A 983 16.204 -4.586 -1.424 1.00 0.00 C ATOM 1085 O GLN A 983 15.024 -4.281 -1.579 1.00 0.00 O ATOM 1086 CB GLN A 983 18.030 -2.949 -0.940 1.00 0.00 C ATOM 1087 CG GLN A 983 18.167 -1.653 -0.158 1.00 0.00 C ATOM 1088 CD GLN A 983 18.651 -1.862 1.266 1.00 0.00 C ATOM 1089 OE1 GLN A 983 19.407 -2.789 1.550 1.00 0.00 O ATOM 1090 NE2 GLN A 983 18.205 -1.007 2.173 1.00 0.00 N ATOM 0 H GLN A 983 18.730 -4.812 0.529 1.00 0.00 H new ATOM 0 HA GLN A 983 16.358 -3.383 0.333 1.00 0.00 H new ATOM 0 HB2 GLN A 983 19.006 -3.429 -1.005 1.00 0.00 H new ATOM 0 HB3 GLN A 983 17.720 -2.718 -1.959 1.00 0.00 H new ATOM 0 HG2 GLN A 983 18.862 -0.994 -0.678 1.00 0.00 H new ATOM 0 HG3 GLN A 983 17.203 -1.146 -0.136 1.00 0.00 H new ATOM 0 HE21 GLN A 983 17.579 -0.251 1.897 1.00 0.00 H new ATOM 0 HE22 GLN A 983 18.488 -1.104 3.148 1.00 0.00 H new ATOM 1099 N LEU A 984 16.821 -5.500 -2.167 1.00 0.00 N ATOM 1100 CA LEU A 984 16.136 -6.208 -3.249 1.00 0.00 C ATOM 1101 C LEU A 984 14.890 -6.926 -2.742 1.00 0.00 C ATOM 1102 O LEU A 984 13.871 -6.969 -3.432 1.00 0.00 O ATOM 1103 CB LEU A 984 17.079 -7.206 -3.929 1.00 0.00 C ATOM 1104 CG LEU A 984 17.787 -6.691 -5.189 1.00 0.00 C ATOM 1105 CD1 LEU A 984 16.779 -6.445 -6.300 1.00 0.00 C ATOM 1106 CD2 LEU A 984 18.568 -5.418 -4.899 1.00 0.00 C ATOM 0 H LEU A 984 17.797 -5.770 -2.041 1.00 0.00 H new ATOM 0 HA LEU A 984 15.825 -5.463 -3.982 1.00 0.00 H new ATOM 0 HB2 LEU A 984 17.836 -7.513 -3.208 1.00 0.00 H new ATOM 0 HB3 LEU A 984 16.509 -8.097 -4.192 1.00 0.00 H new ATOM 0 HG LEU A 984 18.492 -7.456 -5.513 1.00 0.00 H new ATOM 0 HD11 LEU A 984 17.297 -6.080 -7.187 1.00 0.00 H new ATOM 0 HD12 LEU A 984 16.265 -7.376 -6.538 1.00 0.00 H new ATOM 0 HD13 LEU A 984 16.051 -5.702 -5.973 1.00 0.00 H new ATOM 0 HD21 LEU A 984 19.059 -5.077 -5.810 1.00 0.00 H new ATOM 0 HD22 LEU A 984 17.886 -4.646 -4.543 1.00 0.00 H new ATOM 0 HD23 LEU A 984 19.319 -5.618 -4.135 1.00 0.00 H new ATOM 1118 N ALA A 985 14.968 -7.476 -1.535 1.00 0.00 N ATOM 1119 CA ALA A 985 13.822 -8.137 -0.924 1.00 0.00 C ATOM 1120 C ALA A 985 12.684 -7.148 -0.708 1.00 0.00 C ATOM 1121 O ALA A 985 11.525 -7.453 -0.987 1.00 0.00 O ATOM 1122 CB ALA A 985 14.214 -8.793 0.392 1.00 0.00 C ATOM 0 H ALA A 985 15.812 -7.477 -0.962 1.00 0.00 H new ATOM 0 HA ALA A 985 13.478 -8.916 -1.605 1.00 0.00 H new ATOM 0 HB1 ALA A 985 13.343 -9.280 0.830 1.00 0.00 H new ATOM 0 HB2 ALA A 985 14.992 -9.535 0.211 1.00 0.00 H new ATOM 0 HB3 ALA A 985 14.589 -8.034 1.079 1.00 0.00 H new ATOM 1128 N LEU A 986 13.024 -5.954 -0.230 1.00 0.00 N ATOM 1129 CA LEU A 986 12.028 -4.917 0.000 1.00 0.00 C ATOM 1130 C LEU A 986 11.479 -4.418 -1.337 1.00 0.00 C ATOM 1131 O LEU A 986 10.274 -4.220 -1.488 1.00 0.00 O ATOM 1132 CB LEU A 986 12.627 -3.755 0.799 1.00 0.00 C ATOM 1133 CG LEU A 986 11.703 -3.158 1.871 1.00 0.00 C ATOM 1134 CD1 LEU A 986 12.388 -2.015 2.592 1.00 0.00 C ATOM 1135 CD2 LEU A 986 10.391 -2.688 1.269 1.00 0.00 C ATOM 0 H LEU A 986 13.979 -5.683 0.004 1.00 0.00 H new ATOM 0 HA LEU A 986 11.211 -5.342 0.583 1.00 0.00 H new ATOM 0 HB2 LEU A 986 13.542 -4.099 1.281 1.00 0.00 H new ATOM 0 HB3 LEU A 986 12.910 -2.964 0.104 1.00 0.00 H new ATOM 0 HG LEU A 986 11.482 -3.945 2.592 1.00 0.00 H new ATOM 0 HD11 LEU A 986 11.716 -1.606 3.347 1.00 0.00 H new ATOM 0 HD12 LEU A 986 13.295 -2.380 3.073 1.00 0.00 H new ATOM 0 HD13 LEU A 986 12.646 -1.235 1.875 1.00 0.00 H new ATOM 0 HD21 LEU A 986 9.760 -2.271 2.053 1.00 0.00 H new ATOM 0 HD22 LEU A 986 10.589 -1.924 0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 986 9.881 -3.532 0.803 1.00 0.00 H new ATOM 1147 N ILE A 987 12.370 -4.234 -2.309 1.00 0.00 N ATOM 1148 CA ILE A 987 11.975 -3.822 -3.656 1.00 0.00 C ATOM 1149 C ILE A 987 10.953 -4.800 -4.233 1.00 0.00 C ATOM 1150 O ILE A 987 9.903 -4.395 -4.741 1.00 0.00 O ATOM 1151 CB ILE A 987 13.195 -3.739 -4.608 1.00 0.00 C ATOM 1152 CG1 ILE A 987 14.235 -2.761 -4.056 1.00 0.00 C ATOM 1153 CG2 ILE A 987 12.756 -3.311 -6.004 1.00 0.00 C ATOM 1154 CD1 ILE A 987 15.543 -2.750 -4.817 1.00 0.00 C ATOM 0 H ILE A 987 13.375 -4.364 -2.189 1.00 0.00 H new ATOM 0 HA ILE A 987 11.531 -2.830 -3.575 1.00 0.00 H new ATOM 0 HB ILE A 987 13.647 -4.729 -4.676 1.00 0.00 H new ATOM 0 HG12 ILE A 987 13.813 -1.756 -4.066 1.00 0.00 H new ATOM 0 HG13 ILE A 987 14.436 -3.012 -3.014 1.00 0.00 H new ATOM 0 HG21 ILE A 987 13.626 -3.258 -6.659 1.00 0.00 H new ATOM 0 HG22 ILE A 987 12.047 -4.037 -6.401 1.00 0.00 H new ATOM 0 HG23 ILE A 987 12.281 -2.331 -5.952 1.00 0.00 H new ATOM 0 HD11 ILE A 987 16.223 -2.031 -4.361 1.00 0.00 H new ATOM 0 HD12 ILE A 987 15.991 -3.743 -4.785 1.00 0.00 H new ATOM 0 HD13 ILE A 987 15.358 -2.468 -5.854 1.00 0.00 H new ATOM 1166 N ALA A 988 11.258 -6.087 -4.126 1.00 0.00 N ATOM 1167 CA ALA A 988 10.362 -7.129 -4.606 1.00 0.00 C ATOM 1168 C ALA A 988 9.054 -7.122 -3.823 1.00 0.00 C ATOM 1169 O ALA A 988 7.976 -7.209 -4.406 1.00 0.00 O ATOM 1170 CB ALA A 988 11.033 -8.491 -4.510 1.00 0.00 C ATOM 0 H ALA A 988 12.122 -6.434 -3.710 1.00 0.00 H new ATOM 0 HA ALA A 988 10.133 -6.927 -5.652 1.00 0.00 H new ATOM 0 HB1 ALA A 988 10.350 -9.259 -4.873 1.00 0.00 H new ATOM 0 HB2 ALA A 988 11.938 -8.494 -5.117 1.00 0.00 H new ATOM 0 HB3 ALA A 988 11.292 -8.697 -3.471 1.00 0.00 H new ATOM 1176 N ALA A 989 9.156 -6.997 -2.502 1.00 0.00 N ATOM 1177 CA ALA A 989 7.982 -6.962 -1.637 1.00 0.00 C ATOM 1178 C ALA A 989 7.085 -5.778 -1.974 1.00 0.00 C ATOM 1179 O ALA A 989 5.863 -5.893 -1.966 1.00 0.00 O ATOM 1180 CB ALA A 989 8.402 -6.911 -0.175 1.00 0.00 C ATOM 0 H ALA A 989 10.044 -6.918 -2.007 1.00 0.00 H new ATOM 0 HA ALA A 989 7.411 -7.875 -1.807 1.00 0.00 H new ATOM 0 HB1 ALA A 989 7.515 -6.885 0.458 1.00 0.00 H new ATOM 0 HB2 ALA A 989 8.993 -7.795 0.065 1.00 0.00 H new ATOM 0 HB3 ALA A 989 8.999 -6.016 0.001 1.00 0.00 H new ATOM 1186 N SER A 990 7.702 -4.642 -2.281 1.00 0.00 N ATOM 1187 CA SER A 990 6.963 -3.445 -2.654 1.00 0.00 C ATOM 1188 C SER A 990 6.161 -3.684 -3.928 1.00 0.00 C ATOM 1189 O SER A 990 4.980 -3.357 -3.996 1.00 0.00 O ATOM 1190 CB SER A 990 7.922 -2.269 -2.843 1.00 0.00 C ATOM 1191 OG SER A 990 8.666 -2.028 -1.660 1.00 0.00 O ATOM 0 H SER A 990 8.715 -4.527 -2.278 1.00 0.00 H new ATOM 0 HA SER A 990 6.267 -3.205 -1.850 1.00 0.00 H new ATOM 0 HB2 SER A 990 8.602 -2.478 -3.669 1.00 0.00 H new ATOM 0 HB3 SER A 990 7.359 -1.375 -3.112 1.00 0.00 H new ATOM 0 HG SER A 990 9.295 -2.765 -1.513 1.00 0.00 H new ATOM 1197 N GLN A 991 6.800 -4.277 -4.932 1.00 0.00 N ATOM 1198 CA GLN A 991 6.124 -4.596 -6.185 1.00 0.00 C ATOM 1199 C GLN A 991 5.071 -5.676 -5.962 1.00 0.00 C ATOM 1200 O GLN A 991 4.006 -5.671 -6.588 1.00 0.00 O ATOM 1201 CB GLN A 991 7.136 -5.045 -7.239 1.00 0.00 C ATOM 1202 CG GLN A 991 8.099 -3.945 -7.656 1.00 0.00 C ATOM 1203 CD GLN A 991 9.127 -4.418 -8.663 1.00 0.00 C ATOM 1204 OE1 GLN A 991 8.872 -5.330 -9.449 1.00 0.00 O ATOM 1205 NE2 GLN A 991 10.292 -3.792 -8.655 1.00 0.00 N ATOM 0 H GLN A 991 7.783 -4.546 -4.902 1.00 0.00 H new ATOM 0 HA GLN A 991 5.625 -3.697 -6.547 1.00 0.00 H new ATOM 0 HB2 GLN A 991 7.706 -5.889 -6.849 1.00 0.00 H new ATOM 0 HB3 GLN A 991 6.600 -5.402 -8.119 1.00 0.00 H new ATOM 0 HG2 GLN A 991 7.534 -3.116 -8.082 1.00 0.00 H new ATOM 0 HG3 GLN A 991 8.611 -3.562 -6.773 1.00 0.00 H new ATOM 0 HE21 GLN A 991 10.463 -3.041 -7.986 1.00 0.00 H new ATOM 0 HE22 GLN A 991 11.020 -4.060 -9.317 1.00 0.00 H new ATOM 1214 N SER A 992 5.375 -6.590 -5.052 1.00 0.00 N ATOM 1215 CA SER A 992 4.452 -7.648 -4.670 1.00 0.00 C ATOM 1216 C SER A 992 3.236 -7.062 -3.956 1.00 0.00 C ATOM 1217 O SER A 992 2.163 -7.664 -3.940 1.00 0.00 O ATOM 1218 CB SER A 992 5.168 -8.661 -3.768 1.00 0.00 C ATOM 1219 OG SER A 992 4.308 -9.719 -3.385 1.00 0.00 O ATOM 0 H SER A 992 6.267 -6.619 -4.558 1.00 0.00 H new ATOM 0 HA SER A 992 4.106 -8.158 -5.569 1.00 0.00 H new ATOM 0 HB2 SER A 992 6.034 -9.067 -4.292 1.00 0.00 H new ATOM 0 HB3 SER A 992 5.542 -8.155 -2.878 1.00 0.00 H new ATOM 0 HG SER A 992 3.993 -9.569 -2.469 1.00 0.00 H new ATOM 1225 N PHE A 993 3.413 -5.884 -3.370 1.00 0.00 N ATOM 1226 CA PHE A 993 2.336 -5.189 -2.682 1.00 0.00 C ATOM 1227 C PHE A 993 1.594 -4.261 -3.639 1.00 0.00 C ATOM 1228 O PHE A 993 0.403 -4.008 -3.470 1.00 0.00 O ATOM 1229 CB PHE A 993 2.898 -4.392 -1.502 1.00 0.00 C ATOM 1230 CG PHE A 993 1.856 -3.642 -0.721 1.00 0.00 C ATOM 1231 CD1 PHE A 993 1.083 -4.292 0.223 1.00 0.00 C ATOM 1232 CD2 PHE A 993 1.653 -2.287 -0.930 1.00 0.00 C ATOM 1233 CE1 PHE A 993 0.125 -3.610 0.944 1.00 0.00 C ATOM 1234 CE2 PHE A 993 0.695 -1.598 -0.212 1.00 0.00 C ATOM 1235 CZ PHE A 993 -0.069 -2.260 0.725 1.00 0.00 C ATOM 0 H PHE A 993 4.304 -5.387 -3.359 1.00 0.00 H new ATOM 0 HA PHE A 993 1.630 -5.930 -2.307 1.00 0.00 H new ATOM 0 HB2 PHE A 993 3.419 -5.075 -0.831 1.00 0.00 H new ATOM 0 HB3 PHE A 993 3.638 -3.684 -1.874 1.00 0.00 H new ATOM 0 HD1 PHE A 993 1.231 -5.347 0.398 1.00 0.00 H new ATOM 0 HD2 PHE A 993 2.250 -1.764 -1.662 1.00 0.00 H new ATOM 0 HE1 PHE A 993 -0.472 -4.130 1.678 1.00 0.00 H new ATOM 0 HE2 PHE A 993 0.545 -0.542 -0.384 1.00 0.00 H new ATOM 0 HZ PHE A 993 -0.819 -1.724 1.288 1.00 0.00 H new ATOM 1245 N LEU A 994 2.308 -3.758 -4.644 1.00 0.00 N ATOM 1246 CA LEU A 994 1.733 -2.845 -5.631 1.00 0.00 C ATOM 1247 C LEU A 994 0.493 -3.437 -6.288 1.00 0.00 C ATOM 1248 O LEU A 994 -0.520 -2.755 -6.436 1.00 0.00 O ATOM 1249 CB LEU A 994 2.761 -2.496 -6.708 1.00 0.00 C ATOM 1250 CG LEU A 994 3.922 -1.619 -6.245 1.00 0.00 C ATOM 1251 CD1 LEU A 994 4.961 -1.506 -7.346 1.00 0.00 C ATOM 1252 CD2 LEU A 994 3.422 -0.240 -5.836 1.00 0.00 C ATOM 0 H LEU A 994 3.294 -3.969 -4.797 1.00 0.00 H new ATOM 0 HA LEU A 994 1.443 -1.939 -5.099 1.00 0.00 H new ATOM 0 HB2 LEU A 994 3.167 -3.423 -7.113 1.00 0.00 H new ATOM 0 HB3 LEU A 994 2.248 -1.989 -7.525 1.00 0.00 H new ATOM 0 HG LEU A 994 4.385 -2.084 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 994 5.785 -0.879 -7.006 1.00 0.00 H new ATOM 0 HD12 LEU A 994 5.339 -2.498 -7.593 1.00 0.00 H new ATOM 0 HD13 LEU A 994 4.507 -1.060 -8.231 1.00 0.00 H new ATOM 0 HD21 LEU A 994 4.264 0.370 -5.509 1.00 0.00 H new ATOM 0 HD22 LEU A 994 2.936 0.238 -6.687 1.00 0.00 H new ATOM 0 HD23 LEU A 994 2.707 -0.340 -5.019 1.00 0.00 H new ATOM 1264 N GLN A 995 0.577 -4.706 -6.677 1.00 0.00 N ATOM 1265 CA GLN A 995 -0.551 -5.372 -7.322 1.00 0.00 C ATOM 1266 C GLN A 995 -1.794 -5.376 -6.406 1.00 0.00 C ATOM 1267 O GLN A 995 -2.809 -4.775 -6.761 1.00 0.00 O ATOM 1268 CB GLN A 995 -0.172 -6.795 -7.766 1.00 0.00 C ATOM 1269 CG GLN A 995 -1.310 -7.557 -8.430 1.00 0.00 C ATOM 1270 CD GLN A 995 -1.828 -6.868 -9.678 1.00 0.00 C ATOM 1271 OE1 GLN A 995 -2.736 -6.043 -9.616 1.00 0.00 O ATOM 1272 NE2 GLN A 995 -1.263 -7.214 -10.822 1.00 0.00 N ATOM 0 H GLN A 995 1.405 -5.289 -6.559 1.00 0.00 H new ATOM 0 HA GLN A 995 -0.808 -4.806 -8.218 1.00 0.00 H new ATOM 0 HB2 GLN A 995 0.667 -6.737 -8.459 1.00 0.00 H new ATOM 0 HB3 GLN A 995 0.170 -7.357 -6.897 1.00 0.00 H new ATOM 0 HG2 GLN A 995 -0.968 -8.559 -8.689 1.00 0.00 H new ATOM 0 HG3 GLN A 995 -2.128 -7.673 -7.718 1.00 0.00 H new ATOM 0 HE21 GLN A 995 -0.511 -7.903 -10.832 1.00 0.00 H new ATOM 0 HE22 GLN A 995 -1.579 -6.792 -11.695 1.00 0.00 H new ATOM 1281 N PRO A 996 -1.742 -6.020 -5.214 1.00 0.00 N ATOM 1282 CA PRO A 996 -2.882 -6.046 -4.282 1.00 0.00 C ATOM 1283 C PRO A 996 -3.296 -4.651 -3.823 1.00 0.00 C ATOM 1284 O PRO A 996 -4.486 -4.349 -3.724 1.00 0.00 O ATOM 1285 CB PRO A 996 -2.364 -6.857 -3.091 1.00 0.00 C ATOM 1286 CG PRO A 996 -1.230 -7.649 -3.633 1.00 0.00 C ATOM 1287 CD PRO A 996 -0.598 -6.780 -4.677 1.00 0.00 C ATOM 0 HA PRO A 996 -3.769 -6.470 -4.752 1.00 0.00 H new ATOM 0 HB2 PRO A 996 -2.039 -6.205 -2.280 1.00 0.00 H new ATOM 0 HB3 PRO A 996 -3.141 -7.505 -2.686 1.00 0.00 H new ATOM 0 HG2 PRO A 996 -0.517 -7.901 -2.848 1.00 0.00 H new ATOM 0 HG3 PRO A 996 -1.577 -8.589 -4.062 1.00 0.00 H new ATOM 0 HD2 PRO A 996 0.159 -6.122 -4.250 1.00 0.00 H new ATOM 0 HD3 PRO A 996 -0.107 -7.371 -5.451 1.00 0.00 H new ATOM 1295 N GLY A 997 -2.310 -3.805 -3.545 1.00 0.00 N ATOM 1296 CA GLY A 997 -2.588 -2.451 -3.110 1.00 0.00 C ATOM 1297 C GLY A 997 -3.352 -1.665 -4.153 1.00 0.00 C ATOM 1298 O GLY A 997 -4.361 -1.027 -3.846 1.00 0.00 O ATOM 0 H GLY A 997 -1.319 -4.036 -3.614 1.00 0.00 H new ATOM 0 HA2 GLY A 997 -3.163 -2.479 -2.184 1.00 0.00 H new ATOM 0 HA3 GLY A 997 -1.650 -1.942 -2.888 1.00 0.00 H new ATOM 1302 N GLY A 998 -2.881 -1.732 -5.395 1.00 0.00 N ATOM 1303 CA GLY A 998 -3.543 -1.047 -6.489 1.00 0.00 C ATOM 1304 C GLY A 998 -4.956 -1.547 -6.704 1.00 0.00 C ATOM 1305 O GLY A 998 -5.829 -0.796 -7.151 1.00 0.00 O ATOM 0 H GLY A 998 -2.046 -2.253 -5.663 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -3.565 0.024 -6.285 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -2.967 -1.185 -7.404 1.00 0.00 H new ATOM 1309 N LYS A 999 -5.178 -2.818 -6.386 1.00 0.00 N ATOM 1310 CA LYS A 999 -6.508 -3.406 -6.456 1.00 0.00 C ATOM 1311 C LYS A 999 -7.453 -2.694 -5.499 1.00 0.00 C ATOM 1312 O LYS A 999 -8.556 -2.306 -5.880 1.00 0.00 O ATOM 1313 CB LYS A 999 -6.466 -4.895 -6.107 1.00 0.00 C ATOM 1314 CG LYS A 999 -5.741 -5.755 -7.126 1.00 0.00 C ATOM 1315 CD LYS A 999 -5.602 -7.184 -6.632 1.00 0.00 C ATOM 1316 CE LYS A 999 -4.916 -8.072 -7.656 1.00 0.00 C ATOM 1317 NZ LYS A 999 -5.772 -8.327 -8.844 1.00 0.00 N ATOM 0 H LYS A 999 -4.450 -3.462 -6.076 1.00 0.00 H new ATOM 0 HA LYS A 999 -6.869 -3.291 -7.478 1.00 0.00 H new ATOM 0 HB2 LYS A 999 -5.983 -5.015 -5.138 1.00 0.00 H new ATOM 0 HB3 LYS A 999 -7.487 -5.260 -6.001 1.00 0.00 H new ATOM 0 HG2 LYS A 999 -6.286 -5.744 -8.070 1.00 0.00 H new ATOM 0 HG3 LYS A 999 -4.754 -5.337 -7.323 1.00 0.00 H new ATOM 0 HD2 LYS A 999 -5.032 -7.193 -5.703 1.00 0.00 H new ATOM 0 HD3 LYS A 999 -6.589 -7.587 -6.404 1.00 0.00 H new ATOM 0 HE2 LYS A 999 -3.985 -7.603 -7.975 1.00 0.00 H new ATOM 0 HE3 LYS A 999 -4.651 -9.022 -7.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 999 -5.313 -9.030 -9.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 999 -6.697 -8.689 -8.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 999 -5.906 -7.441 -9.372 1.00 0.00 H new ATOM 1331 N MET A1000 -7.002 -2.495 -4.265 1.00 0.00 N ATOM 1332 CA MET A1000 -7.849 -1.905 -3.241 1.00 0.00 C ATOM 1333 C MET A1000 -8.068 -0.424 -3.516 1.00 0.00 C ATOM 1334 O MET A1000 -9.128 0.112 -3.217 1.00 0.00 O ATOM 1335 CB MET A1000 -7.248 -2.111 -1.848 1.00 0.00 C ATOM 1336 CG MET A1000 -8.214 -1.778 -0.721 1.00 0.00 C ATOM 1337 SD MET A1000 -7.589 -2.239 0.905 1.00 0.00 S ATOM 1338 CE MET A1000 -6.165 -1.166 1.032 1.00 0.00 C ATOM 0 H MET A1000 -6.060 -2.733 -3.953 1.00 0.00 H new ATOM 0 HA MET A1000 -8.816 -2.408 -3.270 1.00 0.00 H new ATOM 0 HB2 MET A1000 -6.927 -3.148 -1.748 1.00 0.00 H new ATOM 0 HB3 MET A1000 -6.357 -1.491 -1.749 1.00 0.00 H new ATOM 0 HG2 MET A1000 -8.423 -0.708 -0.734 1.00 0.00 H new ATOM 0 HG3 MET A1000 -9.160 -2.289 -0.898 1.00 0.00 H new ATOM 0 HE1 MET A1000 -5.870 -1.075 2.077 1.00 0.00 H new ATOM 0 HE2 MET A1000 -5.340 -1.587 0.457 1.00 0.00 H new ATOM 0 HE3 MET A1000 -6.416 -0.181 0.639 1.00 0.00 H new ATOM 1348 N VAL A1001 -7.069 0.229 -4.103 1.00 0.00 N ATOM 1349 CA VAL A1001 -7.208 1.626 -4.505 1.00 0.00 C ATOM 1350 C VAL A1001 -8.327 1.770 -5.532 1.00 0.00 C ATOM 1351 O VAL A1001 -9.210 2.619 -5.393 1.00 0.00 O ATOM 1352 CB VAL A1001 -5.897 2.186 -5.104 1.00 0.00 C ATOM 1353 CG1 VAL A1001 -6.083 3.620 -5.577 1.00 0.00 C ATOM 1354 CG2 VAL A1001 -4.771 2.109 -4.089 1.00 0.00 C ATOM 0 H VAL A1001 -6.159 -0.183 -4.310 1.00 0.00 H new ATOM 0 HA VAL A1001 -7.447 2.197 -3.608 1.00 0.00 H new ATOM 0 HB VAL A1001 -5.633 1.573 -5.966 1.00 0.00 H new ATOM 0 HG11 VAL A1001 -5.146 3.990 -5.994 1.00 0.00 H new ATOM 0 HG12 VAL A1001 -6.859 3.653 -6.342 1.00 0.00 H new ATOM 0 HG13 VAL A1001 -6.377 4.246 -4.734 1.00 0.00 H new ATOM 0 HG21 VAL A1001 -3.857 2.508 -4.529 1.00 0.00 H new ATOM 0 HG22 VAL A1001 -5.035 2.694 -3.208 1.00 0.00 H new ATOM 0 HG23 VAL A1001 -4.612 1.070 -3.800 1.00 0.00 H new ATOM 1364 N ALA A1002 -8.294 0.918 -6.550 1.00 0.00 N ATOM 1365 CA ALA A1002 -9.295 0.947 -7.607 1.00 0.00 C ATOM 1366 C ALA A1002 -10.661 0.531 -7.073 1.00 0.00 C ATOM 1367 O ALA A1002 -11.677 1.153 -7.388 1.00 0.00 O ATOM 1368 CB ALA A1002 -8.876 0.043 -8.758 1.00 0.00 C ATOM 0 H ALA A1002 -7.582 0.197 -6.665 1.00 0.00 H new ATOM 0 HA ALA A1002 -9.372 1.970 -7.976 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -9.634 0.075 -9.540 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -7.923 0.386 -9.162 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -8.770 -0.980 -8.397 1.00 0.00 H new ATOM 1374 N ALA A1003 -10.672 -0.516 -6.255 1.00 0.00 N ATOM 1375 CA ALA A1003 -11.906 -1.021 -5.669 1.00 0.00 C ATOM 1376 C ALA A1003 -12.531 0.003 -4.726 1.00 0.00 C ATOM 1377 O ALA A1003 -13.750 0.152 -4.687 1.00 0.00 O ATOM 1378 CB ALA A1003 -11.651 -2.330 -4.936 1.00 0.00 C ATOM 0 H ALA A1003 -9.836 -1.033 -5.983 1.00 0.00 H new ATOM 0 HA ALA A1003 -12.610 -1.204 -6.480 1.00 0.00 H new ATOM 0 HB1 ALA A1003 -12.584 -2.693 -4.504 1.00 0.00 H new ATOM 0 HB2 ALA A1003 -11.263 -3.070 -5.636 1.00 0.00 H new ATOM 0 HB3 ALA A1003 -10.923 -2.166 -4.141 1.00 0.00 H new ATOM 1384 N ALA A1004 -11.692 0.713 -3.976 1.00 0.00 N ATOM 1385 CA ALA A1004 -12.172 1.732 -3.048 1.00 0.00 C ATOM 1386 C ALA A1004 -12.907 2.834 -3.796 1.00 0.00 C ATOM 1387 O ALA A1004 -14.008 3.223 -3.418 1.00 0.00 O ATOM 1388 CB ALA A1004 -11.019 2.311 -2.237 1.00 0.00 C ATOM 0 H ALA A1004 -10.678 0.601 -3.993 1.00 0.00 H new ATOM 0 HA ALA A1004 -12.871 1.261 -2.357 1.00 0.00 H new ATOM 0 HB1 ALA A1004 -11.400 3.068 -1.552 1.00 0.00 H new ATOM 0 HB2 ALA A1004 -10.539 1.515 -1.667 1.00 0.00 H new ATOM 0 HB3 ALA A1004 -10.292 2.764 -2.911 1.00 0.00 H new ATOM 1394 N LYS A1005 -12.302 3.309 -4.880 1.00 0.00 N ATOM 1395 CA LYS A1005 -12.899 4.360 -5.703 1.00 0.00 C ATOM 1396 C LYS A1005 -14.201 3.887 -6.341 1.00 0.00 C ATOM 1397 O LYS A1005 -15.072 4.691 -6.679 1.00 0.00 O ATOM 1398 CB LYS A1005 -11.924 4.786 -6.800 1.00 0.00 C ATOM 1399 CG LYS A1005 -10.646 5.416 -6.272 1.00 0.00 C ATOM 1400 CD LYS A1005 -9.660 5.693 -7.394 1.00 0.00 C ATOM 1401 CE LYS A1005 -8.385 6.342 -6.878 1.00 0.00 C ATOM 1402 NZ LYS A1005 -8.628 7.703 -6.329 1.00 0.00 N ATOM 0 H LYS A1005 -11.394 2.982 -5.212 1.00 0.00 H new ATOM 0 HA LYS A1005 -13.117 5.209 -5.054 1.00 0.00 H new ATOM 0 HB2 LYS A1005 -11.667 3.915 -7.403 1.00 0.00 H new ATOM 0 HB3 LYS A1005 -12.422 5.496 -7.461 1.00 0.00 H new ATOM 0 HG2 LYS A1005 -10.883 6.346 -5.756 1.00 0.00 H new ATOM 0 HG3 LYS A1005 -10.188 4.753 -5.538 1.00 0.00 H new ATOM 0 HD2 LYS A1005 -9.414 4.760 -7.900 1.00 0.00 H new ATOM 0 HD3 LYS A1005 -10.125 6.344 -8.134 1.00 0.00 H new ATOM 0 HE2 LYS A1005 -7.947 5.713 -6.103 1.00 0.00 H new ATOM 0 HE3 LYS A1005 -7.658 6.403 -7.687 1.00 0.00 H new ATOM 0 HZ1 LYS A1005 -7.718 8.171 -6.147 1.00 0.00 H new ATOM 0 HZ2 LYS A1005 -9.174 8.262 -7.016 1.00 0.00 H new ATOM 0 HZ3 LYS A1005 -9.163 7.628 -5.440 1.00 0.00 H new ATOM 1416 N ALA A1006 -14.327 2.581 -6.503 1.00 0.00 N ATOM 1417 CA ALA A1006 -15.499 1.998 -7.130 1.00 0.00 C ATOM 1418 C ALA A1006 -16.567 1.659 -6.095 1.00 0.00 C ATOM 1419 O ALA A1006 -17.718 1.386 -6.443 1.00 0.00 O ATOM 1420 CB ALA A1006 -15.101 0.764 -7.919 1.00 0.00 C ATOM 0 H ALA A1006 -13.627 1.901 -6.207 1.00 0.00 H new ATOM 0 HA ALA A1006 -15.927 2.731 -7.814 1.00 0.00 H new ATOM 0 HB1 ALA A1006 -15.985 0.331 -8.387 1.00 0.00 H new ATOM 0 HB2 ALA A1006 -14.381 1.041 -8.689 1.00 0.00 H new ATOM 0 HB3 ALA A1006 -14.651 0.033 -7.248 1.00 0.00 H new ATOM 1426 N SER A1007 -16.184 1.678 -4.825 1.00 0.00 N ATOM 1427 CA SER A1007 -17.113 1.397 -3.741 1.00 0.00 C ATOM 1428 C SER A1007 -17.550 2.692 -3.063 1.00 0.00 C ATOM 1429 O SER A1007 -18.298 2.676 -2.087 1.00 0.00 O ATOM 1430 CB SER A1007 -16.472 0.449 -2.720 1.00 0.00 C ATOM 1431 OG SER A1007 -17.396 0.081 -1.710 1.00 0.00 O ATOM 0 H SER A1007 -15.233 1.886 -4.521 1.00 0.00 H new ATOM 0 HA SER A1007 -17.995 0.912 -4.159 1.00 0.00 H new ATOM 0 HB2 SER A1007 -16.109 -0.445 -3.228 1.00 0.00 H new ATOM 0 HB3 SER A1007 -15.606 0.931 -2.266 1.00 0.00 H new ATOM 0 HG SER A1007 -17.968 0.847 -1.495 1.00 0.00 H new ATOM 1437 N VAL A1008 -17.071 3.813 -3.585 1.00 0.00 N ATOM 1438 CA VAL A1008 -17.469 5.121 -3.081 1.00 0.00 C ATOM 1439 C VAL A1008 -18.925 5.446 -3.457 1.00 0.00 C ATOM 1440 O VAL A1008 -19.748 5.687 -2.576 1.00 0.00 O ATOM 1441 CB VAL A1008 -16.516 6.239 -3.581 1.00 0.00 C ATOM 1442 CG1 VAL A1008 -17.037 7.619 -3.203 1.00 0.00 C ATOM 1443 CG2 VAL A1008 -15.117 6.033 -3.019 1.00 0.00 C ATOM 0 H VAL A1008 -16.406 3.843 -4.358 1.00 0.00 H new ATOM 0 HA VAL A1008 -17.399 5.080 -1.994 1.00 0.00 H new ATOM 0 HB VAL A1008 -16.473 6.181 -4.669 1.00 0.00 H new ATOM 0 HG11 VAL A1008 -16.347 8.381 -3.567 1.00 0.00 H new ATOM 0 HG12 VAL A1008 -18.018 7.773 -3.652 1.00 0.00 H new ATOM 0 HG13 VAL A1008 -17.119 7.693 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A1008 -14.460 6.825 -3.379 1.00 0.00 H new ATOM 0 HG22 VAL A1008 -15.155 6.060 -1.930 1.00 0.00 H new ATOM 0 HG23 VAL A1008 -14.732 5.067 -3.345 1.00 0.00 H new ATOM 1453 N PRO A1009 -19.285 5.429 -4.763 1.00 0.00 N ATOM 1454 CA PRO A1009 -20.636 5.799 -5.206 1.00 0.00 C ATOM 1455 C PRO A1009 -21.715 4.841 -4.699 1.00 0.00 C ATOM 1456 O PRO A1009 -22.891 5.197 -4.632 1.00 0.00 O ATOM 1457 CB PRO A1009 -20.551 5.741 -6.735 1.00 0.00 C ATOM 1458 CG PRO A1009 -19.400 4.842 -7.021 1.00 0.00 C ATOM 1459 CD PRO A1009 -18.422 5.061 -5.903 1.00 0.00 C ATOM 0 HA PRO A1009 -20.923 6.776 -4.817 1.00 0.00 H new ATOM 0 HB2 PRO A1009 -21.473 5.352 -7.167 1.00 0.00 H new ATOM 0 HB3 PRO A1009 -20.393 6.732 -7.160 1.00 0.00 H new ATOM 0 HG2 PRO A1009 -19.719 3.800 -7.063 1.00 0.00 H new ATOM 0 HG3 PRO A1009 -18.950 5.077 -7.986 1.00 0.00 H new ATOM 0 HD2 PRO A1009 -17.842 4.162 -5.694 1.00 0.00 H new ATOM 0 HD3 PRO A1009 -17.710 5.852 -6.140 1.00 0.00 H new ATOM 1467 N THR A1010 -21.312 3.635 -4.320 1.00 0.00 N ATOM 1468 CA THR A1010 -22.257 2.632 -3.851 1.00 0.00 C ATOM 1469 C THR A1010 -22.686 2.913 -2.411 1.00 0.00 C ATOM 1470 O THR A1010 -23.627 2.305 -1.898 1.00 0.00 O ATOM 1471 CB THR A1010 -21.656 1.216 -3.954 1.00 0.00 C ATOM 1472 OG1 THR A1010 -20.380 1.176 -3.307 1.00 0.00 O ATOM 1473 CG2 THR A1010 -21.497 0.802 -5.408 1.00 0.00 C ATOM 0 H THR A1010 -20.339 3.329 -4.328 1.00 0.00 H new ATOM 0 HA THR A1010 -23.137 2.685 -4.492 1.00 0.00 H new ATOM 0 HB THR A1010 -22.337 0.521 -3.462 1.00 0.00 H new ATOM 0 HG1 THR A1010 -20.006 0.273 -3.376 1.00 0.00 H new ATOM 0 HG21 THR A1010 -21.071 -0.200 -5.456 1.00 0.00 H new ATOM 0 HG22 THR A1010 -22.472 0.806 -5.896 1.00 0.00 H new ATOM 0 HG23 THR A1010 -20.834 1.503 -5.915 1.00 0.00 H new ATOM 1481 N ILE A1011 -21.997 3.845 -1.767 1.00 0.00 N ATOM 1482 CA ILE A1011 -22.322 4.222 -0.403 1.00 0.00 C ATOM 1483 C ILE A1011 -23.237 5.442 -0.392 1.00 0.00 C ATOM 1484 O ILE A1011 -22.827 6.550 -0.746 1.00 0.00 O ATOM 1485 CB ILE A1011 -21.046 4.516 0.416 1.00 0.00 C ATOM 1486 CG1 ILE A1011 -20.136 3.286 0.431 1.00 0.00 C ATOM 1487 CG2 ILE A1011 -21.405 4.930 1.836 1.00 0.00 C ATOM 1488 CD1 ILE A1011 -18.814 3.516 1.127 1.00 0.00 C ATOM 0 H ILE A1011 -21.209 4.353 -2.170 1.00 0.00 H new ATOM 0 HA ILE A1011 -22.840 3.382 0.059 1.00 0.00 H new ATOM 0 HB ILE A1011 -20.512 5.341 -0.055 1.00 0.00 H new ATOM 0 HG12 ILE A1011 -20.658 2.465 0.923 1.00 0.00 H new ATOM 0 HG13 ILE A1011 -19.946 2.973 -0.596 1.00 0.00 H new ATOM 0 HG21 ILE A1011 -20.493 5.133 2.397 1.00 0.00 H new ATOM 0 HG22 ILE A1011 -22.021 5.828 1.808 1.00 0.00 H new ATOM 0 HG23 ILE A1011 -21.958 4.125 2.321 1.00 0.00 H new ATOM 0 HD11 ILE A1011 -18.223 2.600 1.098 1.00 0.00 H new ATOM 0 HD12 ILE A1011 -18.271 4.315 0.622 1.00 0.00 H new ATOM 0 HD13 ILE A1011 -18.993 3.799 2.164 1.00 0.00 H new ATOM 1500 N GLN A1012 -24.478 5.232 0.026 1.00 0.00 N ATOM 1501 CA GLN A1012 -25.475 6.298 0.065 1.00 0.00 C ATOM 1502 C GLN A1012 -25.360 7.113 1.351 1.00 0.00 C ATOM 1503 O GLN A1012 -26.270 7.857 1.716 1.00 0.00 O ATOM 1504 CB GLN A1012 -26.898 5.728 -0.073 1.00 0.00 C ATOM 1505 CG GLN A1012 -27.352 4.814 1.066 1.00 0.00 C ATOM 1506 CD GLN A1012 -26.661 3.461 1.071 1.00 0.00 C ATOM 1507 OE1 GLN A1012 -25.613 3.323 1.868 1.00 0.00 O flip ATOM 1508 NE2 GLN A1012 -27.091 2.530 0.391 1.00 0.00 N flip ATOM 0 H GLN A1012 -24.822 4.326 0.346 1.00 0.00 H new ATOM 0 HA GLN A1012 -25.281 6.958 -0.781 1.00 0.00 H new ATOM 0 HB2 GLN A1012 -27.598 6.560 -0.150 1.00 0.00 H new ATOM 0 HB3 GLN A1012 -26.959 5.172 -1.009 1.00 0.00 H new ATOM 0 HG2 GLN A1012 -27.165 5.312 2.017 1.00 0.00 H new ATOM 0 HG3 GLN A1012 -28.429 4.663 0.992 1.00 0.00 H new ATOM 0 HE21 GLN A1012 -27.901 2.671 -0.213 1.00 0.00 H new ATOM 0 HE22 GLN A1012 -26.637 1.617 0.431 1.00 0.00 H new ATOM 1517 N ASP A1013 -24.233 6.967 2.032 1.00 0.00 N ATOM 1518 CA ASP A1013 -23.984 7.693 3.271 1.00 0.00 C ATOM 1519 C ASP A1013 -23.170 8.941 3.001 1.00 0.00 C ATOM 1520 O ASP A1013 -23.120 9.857 3.823 1.00 0.00 O ATOM 1521 CB ASP A1013 -23.252 6.806 4.279 1.00 0.00 C ATOM 1522 CG ASP A1013 -24.052 5.583 4.670 1.00 0.00 C ATOM 1523 OD1 ASP A1013 -24.152 4.649 3.847 1.00 0.00 O ATOM 1524 OD2 ASP A1013 -24.593 5.561 5.797 1.00 0.00 O ATOM 0 H ASP A1013 -23.473 6.350 1.747 1.00 0.00 H new ATOM 0 HA ASP A1013 -24.947 7.982 3.692 1.00 0.00 H new ATOM 0 HB2 ASP A1013 -22.299 6.491 3.854 1.00 0.00 H new ATOM 0 HB3 ASP A1013 -23.026 7.388 5.172 1.00 0.00 H new ATOM 1529 N GLN A1014 -22.547 8.958 1.830 1.00 0.00 N ATOM 1530 CA GLN A1014 -21.664 10.045 1.385 1.00 0.00 C ATOM 1531 C GLN A1014 -20.408 10.184 2.256 1.00 0.00 C ATOM 1532 O GLN A1014 -19.293 10.112 1.748 1.00 0.00 O ATOM 1533 CB GLN A1014 -22.406 11.386 1.304 1.00 0.00 C ATOM 1534 CG GLN A1014 -23.316 11.512 0.087 1.00 0.00 C ATOM 1535 CD GLN A1014 -24.631 10.768 0.235 1.00 0.00 C ATOM 1536 OE1 GLN A1014 -25.175 10.650 1.335 1.00 0.00 O ATOM 1537 NE2 GLN A1014 -25.151 10.259 -0.870 1.00 0.00 N ATOM 0 H GLN A1014 -22.638 8.207 1.146 1.00 0.00 H new ATOM 0 HA GLN A1014 -21.338 9.769 0.382 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -23.002 11.516 2.207 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -21.675 12.195 1.285 1.00 0.00 H new ATOM 0 HG2 GLN A1014 -23.523 12.567 -0.095 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -22.791 11.134 -0.790 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -24.670 10.378 -1.762 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -26.033 9.748 -0.830 1.00 0.00 H new ATOM 1546 N ALA A1015 -20.582 10.375 3.556 1.00 0.00 N ATOM 1547 CA ALA A1015 -19.455 10.555 4.466 1.00 0.00 C ATOM 1548 C ALA A1015 -18.587 9.301 4.532 1.00 0.00 C ATOM 1549 O ALA A1015 -17.361 9.385 4.558 1.00 0.00 O ATOM 1550 CB ALA A1015 -19.947 10.937 5.850 1.00 0.00 C ATOM 0 H ALA A1015 -21.496 10.410 4.008 1.00 0.00 H new ATOM 0 HA ALA A1015 -18.838 11.365 4.078 1.00 0.00 H new ATOM 0 HB1 ALA A1015 -19.094 11.067 6.516 1.00 0.00 H new ATOM 0 HB2 ALA A1015 -20.508 11.870 5.792 1.00 0.00 H new ATOM 0 HB3 ALA A1015 -20.593 10.149 6.237 1.00 0.00 H new ATOM 1556 N SER A1016 -19.223 8.139 4.553 1.00 0.00 N ATOM 1557 CA SER A1016 -18.491 6.881 4.525 1.00 0.00 C ATOM 1558 C SER A1016 -17.815 6.692 3.167 1.00 0.00 C ATOM 1559 O SER A1016 -16.795 6.013 3.052 1.00 0.00 O ATOM 1560 CB SER A1016 -19.444 5.720 4.815 1.00 0.00 C ATOM 1561 OG SER A1016 -20.169 5.957 6.011 1.00 0.00 O ATOM 0 H SER A1016 -20.238 8.041 4.589 1.00 0.00 H new ATOM 0 HA SER A1016 -17.718 6.902 5.293 1.00 0.00 H new ATOM 0 HB2 SER A1016 -20.136 5.594 3.983 1.00 0.00 H new ATOM 0 HB3 SER A1016 -18.879 4.792 4.903 1.00 0.00 H new ATOM 0 HG SER A1016 -20.775 5.206 6.181 1.00 0.00 H new ATOM 1567 N ALA A1017 -18.377 7.333 2.149 1.00 0.00 N ATOM 1568 CA ALA A1017 -17.848 7.247 0.796 1.00 0.00 C ATOM 1569 C ALA A1017 -16.622 8.139 0.633 1.00 0.00 C ATOM 1570 O ALA A1017 -15.607 7.720 0.076 1.00 0.00 O ATOM 1571 CB ALA A1017 -18.922 7.625 -0.208 1.00 0.00 C ATOM 0 H ALA A1017 -19.205 7.922 2.238 1.00 0.00 H new ATOM 0 HA ALA A1017 -17.540 6.218 0.610 1.00 0.00 H new ATOM 0 HB1 ALA A1017 -18.516 7.558 -1.217 1.00 0.00 H new ATOM 0 HB2 ALA A1017 -19.767 6.944 -0.110 1.00 0.00 H new ATOM 0 HB3 ALA A1017 -19.255 8.645 -0.018 1.00 0.00 H new ATOM 1577 N MET A1018 -16.715 9.368 1.135 1.00 0.00 N ATOM 1578 CA MET A1018 -15.595 10.301 1.072 1.00 0.00 C ATOM 1579 C MET A1018 -14.444 9.795 1.934 1.00 0.00 C ATOM 1580 O MET A1018 -13.277 10.078 1.664 1.00 0.00 O ATOM 1581 CB MET A1018 -16.028 11.720 1.492 1.00 0.00 C ATOM 1582 CG MET A1018 -16.471 11.868 2.944 1.00 0.00 C ATOM 1583 SD MET A1018 -15.091 11.979 4.107 1.00 0.00 S ATOM 1584 CE MET A1018 -15.966 12.174 5.659 1.00 0.00 C ATOM 0 H MET A1018 -17.550 9.739 1.588 1.00 0.00 H new ATOM 0 HA MET A1018 -15.251 10.361 0.039 1.00 0.00 H new ATOM 0 HB2 MET A1018 -15.197 12.403 1.312 1.00 0.00 H new ATOM 0 HB3 MET A1018 -16.847 12.037 0.846 1.00 0.00 H new ATOM 0 HG2 MET A1018 -17.089 12.761 3.038 1.00 0.00 H new ATOM 0 HG3 MET A1018 -17.097 11.017 3.214 1.00 0.00 H new ATOM 0 HE1 MET A1018 -15.300 12.619 6.399 1.00 0.00 H new ATOM 0 HE2 MET A1018 -16.829 12.823 5.511 1.00 0.00 H new ATOM 0 HE3 MET A1018 -16.301 11.199 6.013 1.00 0.00 H new ATOM 1594 N GLN A1019 -14.786 9.021 2.961 1.00 0.00 N ATOM 1595 CA GLN A1019 -13.788 8.403 3.822 1.00 0.00 C ATOM 1596 C GLN A1019 -12.963 7.401 3.024 1.00 0.00 C ATOM 1597 O GLN A1019 -11.743 7.326 3.176 1.00 0.00 O ATOM 1598 CB GLN A1019 -14.467 7.710 5.008 1.00 0.00 C ATOM 1599 CG GLN A1019 -13.496 7.190 6.058 1.00 0.00 C ATOM 1600 CD GLN A1019 -12.688 8.297 6.707 1.00 0.00 C ATOM 1601 OE1 GLN A1019 -13.102 8.879 7.712 1.00 0.00 O ATOM 1602 NE2 GLN A1019 -11.528 8.598 6.142 1.00 0.00 N ATOM 0 H GLN A1019 -15.750 8.808 3.216 1.00 0.00 H new ATOM 0 HA GLN A1019 -13.125 9.177 4.207 1.00 0.00 H new ATOM 0 HB2 GLN A1019 -15.156 8.411 5.480 1.00 0.00 H new ATOM 0 HB3 GLN A1019 -15.064 6.878 4.636 1.00 0.00 H new ATOM 0 HG2 GLN A1019 -14.052 6.653 6.827 1.00 0.00 H new ATOM 0 HG3 GLN A1019 -12.817 6.473 5.596 1.00 0.00 H new ATOM 0 HE21 GLN A1019 -11.219 8.094 5.311 1.00 0.00 H new ATOM 0 HE22 GLN A1019 -10.943 9.334 6.538 1.00 0.00 H new ATOM 1611 N LEU A1020 -13.639 6.643 2.168 1.00 0.00 N ATOM 1612 CA LEU A1020 -12.976 5.695 1.280 1.00 0.00 C ATOM 1613 C LEU A1020 -12.116 6.416 0.256 1.00 0.00 C ATOM 1614 O LEU A1020 -10.958 6.058 0.046 1.00 0.00 O ATOM 1615 CB LEU A1020 -14.007 4.821 0.561 1.00 0.00 C ATOM 1616 CG LEU A1020 -14.287 3.474 1.221 1.00 0.00 C ATOM 1617 CD1 LEU A1020 -15.384 2.734 0.469 1.00 0.00 C ATOM 1618 CD2 LEU A1020 -13.017 2.641 1.257 1.00 0.00 C ATOM 0 H LEU A1020 -14.654 6.667 2.070 1.00 0.00 H new ATOM 0 HA LEU A1020 -12.333 5.062 1.892 1.00 0.00 H new ATOM 0 HB2 LEU A1020 -14.943 5.375 0.490 1.00 0.00 H new ATOM 0 HB3 LEU A1020 -13.663 4.644 -0.458 1.00 0.00 H new ATOM 0 HG LEU A1020 -14.625 3.646 2.243 1.00 0.00 H new ATOM 0 HD11 LEU A1020 -15.573 1.775 0.951 1.00 0.00 H new ATOM 0 HD12 LEU A1020 -16.297 3.330 0.477 1.00 0.00 H new ATOM 0 HD13 LEU A1020 -15.070 2.566 -0.561 1.00 0.00 H new ATOM 0 HD21 LEU A1020 -13.225 1.681 1.730 1.00 0.00 H new ATOM 0 HD22 LEU A1020 -12.662 2.475 0.240 1.00 0.00 H new ATOM 0 HD23 LEU A1020 -12.252 3.168 1.827 1.00 0.00 H new ATOM 1630 N SER A1021 -12.685 7.437 -0.369 1.00 0.00 N ATOM 1631 CA SER A1021 -11.987 8.199 -1.396 1.00 0.00 C ATOM 1632 C SER A1021 -10.720 8.839 -0.827 1.00 0.00 C ATOM 1633 O SER A1021 -9.671 8.847 -1.470 1.00 0.00 O ATOM 1634 CB SER A1021 -12.919 9.267 -1.975 1.00 0.00 C ATOM 1635 OG SER A1021 -12.357 9.875 -3.125 1.00 0.00 O ATOM 0 H SER A1021 -13.635 7.759 -0.181 1.00 0.00 H new ATOM 0 HA SER A1021 -11.690 7.520 -2.196 1.00 0.00 H new ATOM 0 HB2 SER A1021 -13.877 8.815 -2.232 1.00 0.00 H new ATOM 0 HB3 SER A1021 -13.117 10.027 -1.220 1.00 0.00 H new ATOM 0 HG SER A1021 -12.975 10.551 -3.473 1.00 0.00 H new ATOM 1641 N GLN A1022 -10.819 9.349 0.394 1.00 0.00 N ATOM 1642 CA GLN A1022 -9.678 9.953 1.069 1.00 0.00 C ATOM 1643 C GLN A1022 -8.578 8.920 1.309 1.00 0.00 C ATOM 1644 O GLN A1022 -7.388 9.224 1.212 1.00 0.00 O ATOM 1645 CB GLN A1022 -10.133 10.567 2.393 1.00 0.00 C ATOM 1646 CG GLN A1022 -9.018 11.228 3.185 1.00 0.00 C ATOM 1647 CD GLN A1022 -9.524 11.871 4.459 1.00 0.00 C ATOM 1648 OE1 GLN A1022 -10.759 12.350 4.430 1.00 0.00 O flip ATOM 1649 NE2 GLN A1022 -8.812 11.942 5.459 1.00 0.00 N flip ATOM 0 H GLN A1022 -11.681 9.356 0.939 1.00 0.00 H new ATOM 0 HA GLN A1022 -9.267 10.737 0.432 1.00 0.00 H new ATOM 0 HB2 GLN A1022 -10.908 11.306 2.191 1.00 0.00 H new ATOM 0 HB3 GLN A1022 -10.587 9.788 3.006 1.00 0.00 H new ATOM 0 HG2 GLN A1022 -8.260 10.485 3.432 1.00 0.00 H new ATOM 0 HG3 GLN A1022 -8.534 11.984 2.566 1.00 0.00 H new ATOM 0 HE21 GLN A1022 -7.866 11.561 5.440 1.00 0.00 H new ATOM 0 HE22 GLN A1022 -9.167 12.382 6.308 1.00 0.00 H new ATOM 1658 N CYS A1023 -8.980 7.693 1.611 1.00 0.00 N ATOM 1659 CA CYS A1023 -8.022 6.627 1.854 1.00 0.00 C ATOM 1660 C CYS A1023 -7.420 6.131 0.545 1.00 0.00 C ATOM 1661 O CYS A1023 -6.215 5.900 0.456 1.00 0.00 O ATOM 1662 CB CYS A1023 -8.678 5.480 2.619 1.00 0.00 C ATOM 1663 SG CYS A1023 -9.356 5.971 4.220 1.00 0.00 S ATOM 0 H CYS A1023 -9.958 7.414 1.693 1.00 0.00 H new ATOM 0 HA CYS A1023 -7.214 7.027 2.466 1.00 0.00 H new ATOM 0 HB2 CYS A1023 -9.477 5.058 2.009 1.00 0.00 H new ATOM 0 HB3 CYS A1023 -7.943 4.690 2.772 1.00 0.00 H new ATOM 0 HG CYS A1023 -10.527 6.509 4.049 1.00 0.00 H new ATOM 1669 N ALA A1024 -8.258 5.993 -0.477 1.00 0.00 N ATOM 1670 CA ALA A1024 -7.793 5.597 -1.798 1.00 0.00 C ATOM 1671 C ALA A1024 -6.811 6.624 -2.344 1.00 0.00 C ATOM 1672 O ALA A1024 -5.857 6.279 -3.041 1.00 0.00 O ATOM 1673 CB ALA A1024 -8.971 5.427 -2.748 1.00 0.00 C ATOM 0 H ALA A1024 -9.264 6.150 -0.414 1.00 0.00 H new ATOM 0 HA ALA A1024 -7.279 4.639 -1.712 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -8.606 5.131 -3.731 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -9.641 4.658 -2.363 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -9.511 6.370 -2.831 1.00 0.00 H new ATOM 1679 N LYS A1025 -7.053 7.886 -2.017 1.00 0.00 N ATOM 1680 CA LYS A1025 -6.161 8.968 -2.407 1.00 0.00 C ATOM 1681 C LYS A1025 -4.785 8.797 -1.769 1.00 0.00 C ATOM 1682 O LYS A1025 -3.775 8.703 -2.472 1.00 0.00 O ATOM 1683 CB LYS A1025 -6.753 10.317 -1.993 1.00 0.00 C ATOM 1684 CG LYS A1025 -5.877 11.505 -2.360 1.00 0.00 C ATOM 1685 CD LYS A1025 -6.420 12.803 -1.780 1.00 0.00 C ATOM 1686 CE LYS A1025 -7.821 13.099 -2.283 1.00 0.00 C ATOM 1687 NZ LYS A1025 -8.339 14.390 -1.762 1.00 0.00 N ATOM 0 H LYS A1025 -7.866 8.186 -1.479 1.00 0.00 H new ATOM 0 HA LYS A1025 -6.050 8.938 -3.491 1.00 0.00 H new ATOM 0 HB2 LYS A1025 -7.729 10.436 -2.464 1.00 0.00 H new ATOM 0 HB3 LYS A1025 -6.918 10.317 -0.915 1.00 0.00 H new ATOM 0 HG2 LYS A1025 -4.864 11.338 -1.993 1.00 0.00 H new ATOM 0 HG3 LYS A1025 -5.813 11.589 -3.445 1.00 0.00 H new ATOM 0 HD2 LYS A1025 -6.430 12.740 -0.692 1.00 0.00 H new ATOM 0 HD3 LYS A1025 -5.756 13.626 -2.045 1.00 0.00 H new ATOM 0 HE2 LYS A1025 -7.817 13.123 -3.373 1.00 0.00 H new ATOM 0 HE3 LYS A1025 -8.491 12.293 -1.985 1.00 0.00 H new ATOM 0 HZ1 LYS A1025 -9.298 14.553 -2.130 1.00 0.00 H new ATOM 0 HZ2 LYS A1025 -8.368 14.359 -0.723 1.00 0.00 H new ATOM 0 HZ3 LYS A1025 -7.715 15.163 -2.068 1.00 0.00 H new ATOM 1701 N ASN A1026 -4.747 8.738 -0.441 1.00 0.00 N ATOM 1702 CA ASN A1026 -3.473 8.704 0.271 1.00 0.00 C ATOM 1703 C ASN A1026 -2.723 7.403 -0.008 1.00 0.00 C ATOM 1704 O ASN A1026 -1.495 7.399 -0.088 1.00 0.00 O ATOM 1705 CB ASN A1026 -3.658 8.917 1.785 1.00 0.00 C ATOM 1706 CG ASN A1026 -4.053 7.667 2.550 1.00 0.00 C ATOM 1707 OD1 ASN A1026 -3.204 6.860 2.922 1.00 0.00 O ATOM 1708 ND2 ASN A1026 -5.332 7.523 2.833 1.00 0.00 N ATOM 0 H ASN A1026 -5.572 8.713 0.158 1.00 0.00 H new ATOM 0 HA ASN A1026 -2.871 9.532 -0.104 1.00 0.00 H new ATOM 0 HB2 ASN A1026 -2.728 9.305 2.201 1.00 0.00 H new ATOM 0 HB3 ASN A1026 -4.420 9.680 1.942 1.00 0.00 H new ATOM 0 HD21 ASN A1026 -5.646 6.720 3.378 1.00 0.00 H new ATOM 0 HD22 ASN A1026 -6.007 8.214 2.507 1.00 0.00 H new ATOM 1715 N LEU A1027 -3.459 6.308 -0.181 1.00 0.00 N ATOM 1716 CA LEU A1027 -2.850 5.023 -0.511 1.00 0.00 C ATOM 1717 C LEU A1027 -2.349 5.032 -1.949 1.00 0.00 C ATOM 1718 O LEU A1027 -1.291 4.479 -2.252 1.00 0.00 O ATOM 1719 CB LEU A1027 -3.852 3.881 -0.310 1.00 0.00 C ATOM 1720 CG LEU A1027 -3.322 2.481 -0.636 1.00 0.00 C ATOM 1721 CD1 LEU A1027 -2.175 2.111 0.292 1.00 0.00 C ATOM 1722 CD2 LEU A1027 -4.439 1.453 -0.544 1.00 0.00 C ATOM 0 H LEU A1027 -4.475 6.285 -0.098 1.00 0.00 H new ATOM 0 HA LEU A1027 -2.005 4.862 0.158 1.00 0.00 H new ATOM 0 HB2 LEU A1027 -4.188 3.892 0.727 1.00 0.00 H new ATOM 0 HB3 LEU A1027 -4.727 4.074 -0.930 1.00 0.00 H new ATOM 0 HG LEU A1027 -2.944 2.487 -1.658 1.00 0.00 H new ATOM 0 HD11 LEU A1027 -1.813 1.113 0.044 1.00 0.00 H new ATOM 0 HD12 LEU A1027 -1.365 2.831 0.174 1.00 0.00 H new ATOM 0 HD13 LEU A1027 -2.524 2.124 1.325 1.00 0.00 H new ATOM 0 HD21 LEU A1027 -4.044 0.465 -0.779 1.00 0.00 H new ATOM 0 HD22 LEU A1027 -4.848 1.450 0.466 1.00 0.00 H new ATOM 0 HD23 LEU A1027 -5.227 1.707 -1.254 1.00 0.00 H new ATOM 1734 N GLY A1028 -3.111 5.670 -2.827 1.00 0.00 N ATOM 1735 CA GLY A1028 -2.723 5.775 -4.218 1.00 0.00 C ATOM 1736 C GLY A1028 -1.406 6.502 -4.387 1.00 0.00 C ATOM 1737 O GLY A1028 -0.527 6.050 -5.123 1.00 0.00 O ATOM 0 H GLY A1028 -3.997 6.120 -2.597 1.00 0.00 H new ATOM 0 HA2 GLY A1028 -2.644 4.777 -4.648 1.00 0.00 H new ATOM 0 HA3 GLY A1028 -3.501 6.300 -4.772 1.00 0.00 H new ATOM 1741 N THR A1029 -1.265 7.625 -3.698 1.00 0.00 N ATOM 1742 CA THR A1029 -0.030 8.390 -3.735 1.00 0.00 C ATOM 1743 C THR A1029 1.079 7.655 -2.981 1.00 0.00 C ATOM 1744 O THR A1029 2.251 7.730 -3.356 1.00 0.00 O ATOM 1745 CB THR A1029 -0.229 9.792 -3.134 1.00 0.00 C ATOM 1746 OG1 THR A1029 -1.396 10.397 -3.705 1.00 0.00 O ATOM 1747 CG2 THR A1029 0.982 10.675 -3.393 1.00 0.00 C ATOM 0 H THR A1029 -1.992 8.026 -3.106 1.00 0.00 H new ATOM 0 HA THR A1029 0.262 8.500 -4.779 1.00 0.00 H new ATOM 0 HB THR A1029 -0.354 9.689 -2.056 1.00 0.00 H new ATOM 0 HG1 THR A1029 -2.199 9.976 -3.331 1.00 0.00 H new ATOM 0 HG21 THR A1029 0.814 11.660 -2.957 1.00 0.00 H new ATOM 0 HG22 THR A1029 1.865 10.224 -2.940 1.00 0.00 H new ATOM 0 HG23 THR A1029 1.136 10.775 -4.467 1.00 0.00 H new ATOM 1755 N ALA A1030 0.701 6.925 -1.934 1.00 0.00 N ATOM 1756 CA ALA A1030 1.653 6.116 -1.182 1.00 0.00 C ATOM 1757 C ALA A1030 2.290 5.075 -2.092 1.00 0.00 C ATOM 1758 O ALA A1030 3.510 4.925 -2.125 1.00 0.00 O ATOM 1759 CB ALA A1030 0.971 5.441 -0.001 1.00 0.00 C ATOM 0 H ALA A1030 -0.258 6.878 -1.588 1.00 0.00 H new ATOM 0 HA ALA A1030 2.434 6.771 -0.796 1.00 0.00 H new ATOM 0 HB1 ALA A1030 1.699 4.843 0.546 1.00 0.00 H new ATOM 0 HB2 ALA A1030 0.554 6.200 0.661 1.00 0.00 H new ATOM 0 HB3 ALA A1030 0.170 4.796 -0.363 1.00 0.00 H new ATOM 1765 N LEU A1031 1.454 4.375 -2.846 1.00 0.00 N ATOM 1766 CA LEU A1031 1.929 3.400 -3.819 1.00 0.00 C ATOM 1767 C LEU A1031 2.707 4.091 -4.928 1.00 0.00 C ATOM 1768 O LEU A1031 3.676 3.546 -5.449 1.00 0.00 O ATOM 1769 CB LEU A1031 0.756 2.624 -4.416 1.00 0.00 C ATOM 1770 CG LEU A1031 -0.036 1.779 -3.420 1.00 0.00 C ATOM 1771 CD1 LEU A1031 -1.207 1.108 -4.113 1.00 0.00 C ATOM 1772 CD2 LEU A1031 0.866 0.741 -2.772 1.00 0.00 C ATOM 0 H LEU A1031 0.439 4.465 -2.802 1.00 0.00 H new ATOM 0 HA LEU A1031 2.590 2.701 -3.306 1.00 0.00 H new ATOM 0 HB2 LEU A1031 0.076 3.332 -4.890 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.135 1.971 -5.202 1.00 0.00 H new ATOM 0 HG LEU A1031 -0.425 2.433 -2.639 1.00 0.00 H new ATOM 0 HD11 LEU A1031 -1.762 0.509 -3.391 1.00 0.00 H new ATOM 0 HD12 LEU A1031 -1.864 1.868 -4.536 1.00 0.00 H new ATOM 0 HD13 LEU A1031 -0.837 0.464 -4.911 1.00 0.00 H new ATOM 0 HD21 LEU A1031 0.287 0.147 -2.065 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.280 0.089 -3.541 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.678 1.242 -2.245 1.00 0.00 H new ATOM 1784 N ALA A1032 2.272 5.297 -5.277 1.00 0.00 N ATOM 1785 CA ALA A1032 2.925 6.085 -6.311 1.00 0.00 C ATOM 1786 C ALA A1032 4.386 6.345 -5.958 1.00 0.00 C ATOM 1787 O ALA A1032 5.286 6.015 -6.731 1.00 0.00 O ATOM 1788 CB ALA A1032 2.187 7.400 -6.522 1.00 0.00 C ATOM 0 H ALA A1032 1.463 5.751 -4.854 1.00 0.00 H new ATOM 0 HA ALA A1032 2.897 5.516 -7.240 1.00 0.00 H new ATOM 0 HB1 ALA A1032 2.688 7.978 -7.299 1.00 0.00 H new ATOM 0 HB2 ALA A1032 1.160 7.196 -6.827 1.00 0.00 H new ATOM 0 HB3 ALA A1032 2.183 7.969 -5.592 1.00 0.00 H new ATOM 1794 N GLU A1033 4.622 6.913 -4.782 1.00 0.00 N ATOM 1795 CA GLU A1033 5.978 7.242 -4.366 1.00 0.00 C ATOM 1796 C GLU A1033 6.756 5.981 -3.994 1.00 0.00 C ATOM 1797 O GLU A1033 7.973 5.925 -4.174 1.00 0.00 O ATOM 1798 CB GLU A1033 5.965 8.238 -3.203 1.00 0.00 C ATOM 1799 CG GLU A1033 5.289 7.723 -1.944 1.00 0.00 C ATOM 1800 CD GLU A1033 5.258 8.762 -0.847 1.00 0.00 C ATOM 1801 OE1 GLU A1033 6.333 9.113 -0.323 1.00 0.00 O ATOM 1802 OE2 GLU A1033 4.154 9.229 -0.497 1.00 0.00 O ATOM 0 H GLU A1033 3.898 7.154 -4.105 1.00 0.00 H new ATOM 0 HA GLU A1033 6.484 7.713 -5.209 1.00 0.00 H new ATOM 0 HB2 GLU A1033 6.993 8.512 -2.963 1.00 0.00 H new ATOM 0 HB3 GLU A1033 5.460 9.148 -3.526 1.00 0.00 H new ATOM 0 HG2 GLU A1033 4.270 7.416 -2.180 1.00 0.00 H new ATOM 0 HG3 GLU A1033 5.814 6.837 -1.588 1.00 0.00 H new ATOM 1809 N LEU A1034 6.050 4.973 -3.489 1.00 0.00 N ATOM 1810 CA LEU A1034 6.661 3.681 -3.180 1.00 0.00 C ATOM 1811 C LEU A1034 7.208 3.041 -4.450 1.00 0.00 C ATOM 1812 O LEU A1034 8.369 2.638 -4.507 1.00 0.00 O ATOM 1813 CB LEU A1034 5.637 2.746 -2.523 1.00 0.00 C ATOM 1814 CG LEU A1034 6.143 1.333 -2.207 1.00 0.00 C ATOM 1815 CD1 LEU A1034 7.248 1.380 -1.164 1.00 0.00 C ATOM 1816 CD2 LEU A1034 4.999 0.451 -1.731 1.00 0.00 C ATOM 0 H LEU A1034 5.052 5.025 -3.284 1.00 0.00 H new ATOM 0 HA LEU A1034 7.482 3.846 -2.483 1.00 0.00 H new ATOM 0 HB2 LEU A1034 5.293 3.206 -1.597 1.00 0.00 H new ATOM 0 HB3 LEU A1034 4.771 2.665 -3.180 1.00 0.00 H new ATOM 0 HG LEU A1034 6.553 0.904 -3.121 1.00 0.00 H new ATOM 0 HD11 LEU A1034 7.593 0.368 -0.954 1.00 0.00 H new ATOM 0 HD12 LEU A1034 8.079 1.976 -1.541 1.00 0.00 H new ATOM 0 HD13 LEU A1034 6.865 1.830 -0.248 1.00 0.00 H new ATOM 0 HD21 LEU A1034 5.377 -0.548 -1.511 1.00 0.00 H new ATOM 0 HD22 LEU A1034 4.560 0.879 -0.830 1.00 0.00 H new ATOM 0 HD23 LEU A1034 4.239 0.388 -2.510 1.00 0.00 H new ATOM 1828 N ARG A1035 6.364 2.969 -5.472 1.00 0.00 N ATOM 1829 CA ARG A1035 6.745 2.381 -6.749 1.00 0.00 C ATOM 1830 C ARG A1035 7.871 3.180 -7.391 1.00 0.00 C ATOM 1831 O ARG A1035 8.811 2.608 -7.939 1.00 0.00 O ATOM 1832 CB ARG A1035 5.538 2.322 -7.686 1.00 0.00 C ATOM 1833 CG ARG A1035 5.807 1.585 -8.985 1.00 0.00 C ATOM 1834 CD ARG A1035 4.554 1.505 -9.839 1.00 0.00 C ATOM 1835 NE ARG A1035 4.717 0.600 -10.974 1.00 0.00 N ATOM 1836 CZ ARG A1035 3.750 -0.195 -11.424 1.00 0.00 C ATOM 1837 NH1 ARG A1035 2.541 -0.155 -10.874 1.00 0.00 N ATOM 1838 NH2 ARG A1035 3.984 -1.024 -12.432 1.00 0.00 N ATOM 0 H ARG A1035 5.404 3.313 -5.440 1.00 0.00 H new ATOM 0 HA ARG A1035 7.100 1.366 -6.569 1.00 0.00 H new ATOM 0 HB2 ARG A1035 4.711 1.836 -7.168 1.00 0.00 H new ATOM 0 HB3 ARG A1035 5.218 3.338 -7.915 1.00 0.00 H new ATOM 0 HG2 ARG A1035 6.596 2.094 -9.539 1.00 0.00 H new ATOM 0 HG3 ARG A1035 6.168 0.579 -8.768 1.00 0.00 H new ATOM 0 HD2 ARG A1035 3.719 1.168 -9.225 1.00 0.00 H new ATOM 0 HD3 ARG A1035 4.301 2.500 -10.204 1.00 0.00 H new ATOM 0 HE ARG A1035 5.621 0.576 -11.447 1.00 0.00 H new ATOM 0 HH11 ARG A1035 2.352 0.487 -10.104 1.00 0.00 H new ATOM 0 HH12 ARG A1035 1.802 -0.766 -11.222 1.00 0.00 H new ATOM 0 HH21 ARG A1035 4.907 -1.053 -12.864 1.00 0.00 H new ATOM 0 HH22 ARG A1035 3.241 -1.632 -12.775 1.00 0.00 H new ATOM 1852 N THR A1036 7.779 4.501 -7.306 1.00 0.00 N ATOM 1853 CA THR A1036 8.808 5.372 -7.854 1.00 0.00 C ATOM 1854 C THR A1036 10.137 5.155 -7.129 1.00 0.00 C ATOM 1855 O THR A1036 11.200 5.102 -7.754 1.00 0.00 O ATOM 1856 CB THR A1036 8.398 6.855 -7.754 1.00 0.00 C ATOM 1857 OG1 THR A1036 7.109 7.047 -8.354 1.00 0.00 O ATOM 1858 CG2 THR A1036 9.417 7.748 -8.446 1.00 0.00 C ATOM 0 H THR A1036 7.002 4.992 -6.863 1.00 0.00 H new ATOM 0 HA THR A1036 8.928 5.117 -8.907 1.00 0.00 H new ATOM 0 HB THR A1036 8.356 7.126 -6.699 1.00 0.00 H new ATOM 0 HG1 THR A1036 6.415 6.990 -7.664 1.00 0.00 H new ATOM 0 HG21 THR A1036 9.105 8.789 -8.362 1.00 0.00 H new ATOM 0 HG22 THR A1036 10.391 7.622 -7.974 1.00 0.00 H new ATOM 0 HG23 THR A1036 9.485 7.474 -9.499 1.00 0.00 H new ATOM 1866 N ALA A1037 10.067 5.006 -5.810 1.00 0.00 N ATOM 1867 CA ALA A1037 11.254 4.751 -5.007 1.00 0.00 C ATOM 1868 C ALA A1037 11.861 3.403 -5.368 1.00 0.00 C ATOM 1869 O ALA A1037 13.062 3.306 -5.610 1.00 0.00 O ATOM 1870 CB ALA A1037 10.923 4.809 -3.524 1.00 0.00 C ATOM 0 H ALA A1037 9.200 5.058 -5.276 1.00 0.00 H new ATOM 0 HA ALA A1037 11.987 5.528 -5.222 1.00 0.00 H new ATOM 0 HB1 ALA A1037 11.824 4.616 -2.942 1.00 0.00 H new ATOM 0 HB2 ALA A1037 10.536 5.797 -3.276 1.00 0.00 H new ATOM 0 HB3 ALA A1037 10.171 4.056 -3.289 1.00 0.00 H new ATOM 1876 N ALA A1038 11.016 2.376 -5.428 1.00 0.00 N ATOM 1877 CA ALA A1038 11.458 1.028 -5.773 1.00 0.00 C ATOM 1878 C ALA A1038 12.038 0.981 -7.182 1.00 0.00 C ATOM 1879 O ALA A1038 13.019 0.281 -7.434 1.00 0.00 O ATOM 1880 CB ALA A1038 10.302 0.046 -5.650 1.00 0.00 C ATOM 0 H ALA A1038 10.016 2.453 -5.241 1.00 0.00 H new ATOM 0 HA ALA A1038 12.244 0.743 -5.073 1.00 0.00 H new ATOM 0 HB1 ALA A1038 10.646 -0.955 -5.910 1.00 0.00 H new ATOM 0 HB2 ALA A1038 9.931 0.047 -4.625 1.00 0.00 H new ATOM 0 HB3 ALA A1038 9.500 0.341 -6.327 1.00 0.00 H new ATOM 1886 N GLN A1039 11.432 1.733 -8.093 1.00 0.00 N ATOM 1887 CA GLN A1039 11.895 1.796 -9.472 1.00 0.00 C ATOM 1888 C GLN A1039 13.333 2.302 -9.517 1.00 0.00 C ATOM 1889 O GLN A1039 14.201 1.698 -10.151 1.00 0.00 O ATOM 1890 CB GLN A1039 10.995 2.724 -10.297 1.00 0.00 C ATOM 1891 CG GLN A1039 10.698 2.219 -11.703 1.00 0.00 C ATOM 1892 CD GLN A1039 11.940 1.759 -12.442 1.00 0.00 C ATOM 1893 OE1 GLN A1039 12.308 0.586 -12.385 1.00 0.00 O ATOM 1894 NE2 GLN A1039 12.600 2.677 -13.130 1.00 0.00 N ATOM 0 H GLN A1039 10.614 2.311 -7.899 1.00 0.00 H new ATOM 0 HA GLN A1039 11.852 0.794 -9.898 1.00 0.00 H new ATOM 0 HB2 GLN A1039 10.053 2.863 -9.767 1.00 0.00 H new ATOM 0 HB3 GLN A1039 11.469 3.703 -10.367 1.00 0.00 H new ATOM 0 HG2 GLN A1039 9.990 1.392 -11.644 1.00 0.00 H new ATOM 0 HG3 GLN A1039 10.215 3.012 -12.274 1.00 0.00 H new ATOM 0 HE21 GLN A1039 12.262 3.639 -13.152 1.00 0.00 H new ATOM 0 HE22 GLN A1039 13.447 2.422 -13.638 1.00 0.00 H new ATOM 1903 N LYS A1040 13.585 3.399 -8.815 1.00 0.00 N ATOM 1904 CA LYS A1040 14.910 4.002 -8.802 1.00 0.00 C ATOM 1905 C LYS A1040 15.833 3.272 -7.829 1.00 0.00 C ATOM 1906 O LYS A1040 17.024 3.557 -7.757 1.00 0.00 O ATOM 1907 CB LYS A1040 14.816 5.490 -8.449 1.00 0.00 C ATOM 1908 CG LYS A1040 13.866 6.256 -9.357 1.00 0.00 C ATOM 1909 CD LYS A1040 13.920 7.764 -9.138 1.00 0.00 C ATOM 1910 CE LYS A1040 13.469 8.178 -7.741 1.00 0.00 C ATOM 1911 NZ LYS A1040 14.562 8.071 -6.737 1.00 0.00 N ATOM 0 H LYS A1040 12.891 3.888 -8.249 1.00 0.00 H new ATOM 0 HA LYS A1040 15.337 3.910 -9.801 1.00 0.00 H new ATOM 0 HB2 LYS A1040 14.485 5.593 -7.416 1.00 0.00 H new ATOM 0 HB3 LYS A1040 15.809 5.936 -8.511 1.00 0.00 H new ATOM 0 HG2 LYS A1040 14.109 6.036 -10.397 1.00 0.00 H new ATOM 0 HG3 LYS A1040 12.848 5.906 -9.187 1.00 0.00 H new ATOM 0 HD2 LYS A1040 14.939 8.114 -9.304 1.00 0.00 H new ATOM 0 HD3 LYS A1040 13.290 8.256 -9.878 1.00 0.00 H new ATOM 0 HE2 LYS A1040 13.105 9.205 -7.769 1.00 0.00 H new ATOM 0 HE3 LYS A1040 12.633 7.551 -7.432 1.00 0.00 H new ATOM 0 HZ1 LYS A1040 14.217 7.556 -5.902 1.00 0.00 H new ATOM 0 HZ2 LYS A1040 15.366 7.559 -7.152 1.00 0.00 H new ATOM 0 HZ3 LYS A1040 14.868 9.024 -6.454 1.00 0.00 H new ATOM 1925 N ALA A1041 15.273 2.327 -7.084 1.00 0.00 N ATOM 1926 CA ALA A1041 16.062 1.483 -6.196 1.00 0.00 C ATOM 1927 C ALA A1041 16.575 0.267 -6.950 1.00 0.00 C ATOM 1928 O ALA A1041 17.617 -0.296 -6.615 1.00 0.00 O ATOM 1929 CB ALA A1041 15.238 1.046 -4.996 1.00 0.00 C ATOM 0 H ALA A1041 14.273 2.126 -7.077 1.00 0.00 H new ATOM 0 HA ALA A1041 16.912 2.062 -5.836 1.00 0.00 H new ATOM 0 HB1 ALA A1041 15.847 0.417 -4.346 1.00 0.00 H new ATOM 0 HB2 ALA A1041 14.906 1.925 -4.443 1.00 0.00 H new ATOM 0 HB3 ALA A1041 14.369 0.482 -5.337 1.00 0.00 H new ATOM 1935 N GLN A1042 15.829 -0.134 -7.973 1.00 0.00 N ATOM 1936 CA GLN A1042 16.221 -1.254 -8.815 1.00 0.00 C ATOM 1937 C GLN A1042 17.494 -0.913 -9.582 1.00 0.00 C ATOM 1938 O GLN A1042 18.371 -1.759 -9.769 1.00 0.00 O ATOM 1939 CB GLN A1042 15.100 -1.595 -9.803 1.00 0.00 C ATOM 1940 CG GLN A1042 15.403 -2.820 -10.648 1.00 0.00 C ATOM 1941 CD GLN A1042 14.513 -2.943 -11.870 1.00 0.00 C ATOM 1942 OE1 GLN A1042 14.928 -3.487 -12.898 1.00 0.00 O ATOM 1943 NE2 GLN A1042 13.288 -2.454 -11.777 1.00 0.00 N ATOM 0 H GLN A1042 14.946 0.303 -8.239 1.00 0.00 H new ATOM 0 HA GLN A1042 16.407 -2.118 -8.177 1.00 0.00 H new ATOM 0 HB2 GLN A1042 14.175 -1.762 -9.251 1.00 0.00 H new ATOM 0 HB3 GLN A1042 14.930 -0.741 -10.459 1.00 0.00 H new ATOM 0 HG2 GLN A1042 16.444 -2.783 -10.968 1.00 0.00 H new ATOM 0 HG3 GLN A1042 15.290 -3.713 -10.034 1.00 0.00 H new ATOM 0 HE21 GLN A1042 12.980 -2.011 -10.911 1.00 0.00 H new ATOM 0 HE22 GLN A1042 12.651 -2.520 -12.571 1.00 0.00 H new ATOM 1952 N GLU A1043 17.594 0.343 -9.999 1.00 0.00 N ATOM 1953 CA GLU A1043 18.734 0.813 -10.777 1.00 0.00 C ATOM 1954 C GLU A1043 19.846 1.330 -9.867 1.00 0.00 C ATOM 1955 O GLU A1043 20.818 1.924 -10.336 1.00 0.00 O ATOM 1956 CB GLU A1043 18.290 1.910 -11.744 1.00 0.00 C ATOM 1957 CG GLU A1043 17.605 3.084 -11.067 1.00 0.00 C ATOM 1958 CD GLU A1043 17.054 4.083 -12.059 1.00 0.00 C ATOM 1959 OE1 GLU A1043 15.957 3.844 -12.607 1.00 0.00 O ATOM 1960 OE2 GLU A1043 17.713 5.117 -12.295 1.00 0.00 O ATOM 0 H GLU A1043 16.893 1.060 -9.810 1.00 0.00 H new ATOM 0 HA GLU A1043 19.129 -0.028 -11.347 1.00 0.00 H new ATOM 0 HB2 GLU A1043 19.160 2.275 -12.289 1.00 0.00 H new ATOM 0 HB3 GLU A1043 17.610 1.480 -12.479 1.00 0.00 H new ATOM 0 HG2 GLU A1043 16.794 2.715 -10.439 1.00 0.00 H new ATOM 0 HG3 GLU A1043 18.315 3.584 -10.408 1.00 0.00 H new ATOM 1967 N ALA A1044 19.703 1.098 -8.572 1.00 0.00 N ATOM 1968 CA ALA A1044 20.719 1.497 -7.614 1.00 0.00 C ATOM 1969 C ALA A1044 21.811 0.437 -7.543 1.00 0.00 C ATOM 1970 O ALA A1044 22.917 0.688 -8.069 1.00 0.00 O ATOM 1971 CB ALA A1044 20.104 1.737 -6.242 1.00 0.00 C ATOM 1972 OXT ALA A1044 21.542 -0.656 -6.999 1.00 0.00 O ATOM 0 H ALA A1044 18.892 0.635 -8.161 1.00 0.00 H new ATOM 0 HA ALA A1044 21.165 2.434 -7.946 1.00 0.00 H new ATOM 0 HB1 ALA A1044 20.884 2.035 -5.541 1.00 0.00 H new ATOM 0 HB2 ALA A1044 19.357 2.528 -6.311 1.00 0.00 H new ATOM 0 HB3 ALA A1044 19.630 0.820 -5.890 1.00 0.00 H new TER 1978 ALA A1044