USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=26 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 991 GLN : amide:sc= 0.215 K(o=0.46,f=-0.78) USER MOD Set 1.2: A1042 GLN : amide:sc= 0.25 K(o=0.46,f=-1.4) USER MOD Set 2.1: A1022 GLN : amide:sc= -1.67! C(o=-1.7!,f=-7.3!) USER MOD Set 2.2: A1025 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A1019 GLN : amide:sc= 0.581 K(o=1.1,f=-0.65) USER MOD Set 3.2: A1023 CYS SG : rot 77:sc= 0.527 USER MOD Set 4.1: A 922 LYS NZ :NH3+ 153:sc= 1.03 (180deg=0) USER MOD Set 4.2: A 974 GLN : amide:sc= 0.135 K(o=1.2,f=-4.9!) USER MOD Set 5.1: A 962 GLN : amide:sc= 0.737 K(o=0.55,f=-2.6) USER MOD Set 5.2: A 992 SER OG : rot 102:sc= -0.187 USER MOD Set 6.1: A 954 GLN : amide:sc= 0.0968 X(o=0.2,f=-0.19) USER MOD Set 6.2: A 955 SER OG : rot -12:sc= 0.102 USER MOD Set 7.1: A 943 LYS NZ :NH3+ -162:sc= -0.492! (180deg=-2.8!) USER MOD Set 7.2: A1010 THR OG1 : rot -31:sc= 1.42 USER MOD Single : A 912 THR OG1 : rot 180:sc= -0.174 USER MOD Single : A 915 GLN : amide:sc= -0.982 K(o=-0.98,f=-0.041) USER MOD Single : A 919 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 923 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 927 SER OG : rot -90:sc= 0 USER MOD Single : A 929 THR OG1 : rot 72:sc= 0.88 USER MOD Single : A 930 GLN : amide:sc= -0.0756 X(o=-0.076,f=-0.094) USER MOD Single : A 931 THR OG1 : rot 71:sc= 1.05 USER MOD Single : A 936 GLN : amide:sc= -0.26 K(o=-0.26,f=-1.1) USER MOD Single : A 937 HIS : no HD1:sc= -1.29 K(o=-1.3,f=0.39) USER MOD Single : A 940 SER OG : rot 180:sc= 0 USER MOD Single : A 945 SER OG : rot 180:sc= 0 USER MOD Single : A 949 GLN : amide:sc= -0.642 K(o=-0.64,f=-3.3!) USER MOD Single : A 956 CYS SG : rot -43:sc= 0.77 USER MOD Single : A 957 LYS NZ :NH3+ -166:sc= -0.0571 (180deg=-0.291) USER MOD Single : A 968 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 973 SER OG : rot -77:sc= -0.845 USER MOD Single : A 976 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 979 SER OG : rot 170:sc= 0 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 983 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 990 SER OG : rot 82:sc= 1.23 USER MOD Single : A 995 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 999 LYS NZ :NH3+ -171:sc=-0.000248 (180deg=-0.0811) USER MOD Single : A1000 MET CE :methyl 152:sc= -1.58 (180deg=-2.94) USER MOD Single : A1005 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1007 SER OG : rot 75:sc= 1.27 USER MOD Single : A1012 GLN : amide:sc= -1.67! C(o=-1.7!,f=-6.9!) USER MOD Single : A1014 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1016 SER OG : rot 101:sc= 1.24 USER MOD Single : A1018 MET CE :methyl 134:sc= -0.364 (180deg=-3.58!) USER MOD Single : A1021 SER OG : rot 180:sc= 0 USER MOD Single : A1026 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A1029 THR OG1 : rot 74:sc= 1.08 USER MOD Single : A1036 THR OG1 : rot 83:sc= 0.866 USER MOD Single : A1039 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A1040 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 907 19.605 21.993 -1.899 1.00 0.00 N ATOM 2 CA GLY A 907 19.491 21.598 -0.474 1.00 0.00 C ATOM 3 C GLY A 907 18.728 20.300 -0.289 1.00 0.00 C ATOM 4 O GLY A 907 18.120 20.076 0.761 1.00 0.00 O ATOM 0 HA2 GLY A 907 20.489 21.492 -0.049 1.00 0.00 H new ATOM 0 HA3 GLY A 907 18.991 22.392 0.081 1.00 0.00 H new ATOM 10 N ILE A 908 18.753 19.443 -1.299 1.00 0.00 N ATOM 11 CA ILE A 908 18.041 18.175 -1.238 1.00 0.00 C ATOM 12 C ILE A 908 18.892 17.124 -0.532 1.00 0.00 C ATOM 13 O ILE A 908 20.103 17.045 -0.749 1.00 0.00 O ATOM 14 CB ILE A 908 17.648 17.677 -2.653 1.00 0.00 C ATOM 15 CG1 ILE A 908 16.914 16.334 -2.570 1.00 0.00 C ATOM 16 CG2 ILE A 908 18.875 17.564 -3.551 1.00 0.00 C ATOM 17 CD1 ILE A 908 16.480 15.793 -3.915 1.00 0.00 C ATOM 0 H ILE A 908 19.258 19.602 -2.170 1.00 0.00 H new ATOM 0 HA ILE A 908 17.124 18.335 -0.670 1.00 0.00 H new ATOM 0 HB ILE A 908 16.973 18.411 -3.093 1.00 0.00 H new ATOM 0 HG12 ILE A 908 17.564 15.604 -2.087 1.00 0.00 H new ATOM 0 HG13 ILE A 908 16.036 16.449 -1.934 1.00 0.00 H new ATOM 0 HG21 ILE A 908 18.573 17.213 -4.538 1.00 0.00 H new ATOM 0 HG22 ILE A 908 19.350 18.541 -3.643 1.00 0.00 H new ATOM 0 HG23 ILE A 908 19.581 16.857 -3.115 1.00 0.00 H new ATOM 0 HD11 ILE A 908 15.968 14.841 -3.776 1.00 0.00 H new ATOM 0 HD12 ILE A 908 15.804 16.503 -4.392 1.00 0.00 H new ATOM 0 HD13 ILE A 908 17.355 15.645 -4.547 1.00 0.00 H new ATOM 29 N ASP A 909 18.271 16.342 0.339 1.00 0.00 N ATOM 30 CA ASP A 909 18.978 15.280 1.037 1.00 0.00 C ATOM 31 C ASP A 909 19.092 14.060 0.133 1.00 0.00 C ATOM 32 O ASP A 909 18.092 13.590 -0.413 1.00 0.00 O ATOM 33 CB ASP A 909 18.260 14.909 2.336 1.00 0.00 C ATOM 34 CG ASP A 909 19.108 14.026 3.230 1.00 0.00 C ATOM 35 OD1 ASP A 909 20.085 14.538 3.817 1.00 0.00 O ATOM 36 OD2 ASP A 909 18.798 12.826 3.369 1.00 0.00 O ATOM 0 H ASP A 909 17.283 16.423 0.578 1.00 0.00 H new ATOM 0 HA ASP A 909 19.976 15.635 1.292 1.00 0.00 H new ATOM 0 HB2 ASP A 909 17.994 15.819 2.874 1.00 0.00 H new ATOM 0 HB3 ASP A 909 17.328 14.395 2.100 1.00 0.00 H new ATOM 41 N PRO A 910 20.313 13.547 -0.066 1.00 0.00 N ATOM 42 CA PRO A 910 20.545 12.390 -0.927 1.00 0.00 C ATOM 43 C PRO A 910 20.079 11.084 -0.287 1.00 0.00 C ATOM 44 O PRO A 910 20.861 10.375 0.354 1.00 0.00 O ATOM 45 CB PRO A 910 22.060 12.391 -1.126 1.00 0.00 C ATOM 46 CG PRO A 910 22.603 13.060 0.091 1.00 0.00 C ATOM 47 CD PRO A 910 21.563 14.057 0.528 1.00 0.00 C ATOM 0 HA PRO A 910 19.985 12.456 -1.860 1.00 0.00 H new ATOM 0 HB2 PRO A 910 22.447 11.377 -1.226 1.00 0.00 H new ATOM 0 HB3 PRO A 910 22.340 12.929 -2.032 1.00 0.00 H new ATOM 0 HG2 PRO A 910 22.799 12.333 0.879 1.00 0.00 H new ATOM 0 HG3 PRO A 910 23.549 13.556 -0.128 1.00 0.00 H new ATOM 0 HD2 PRO A 910 21.495 14.114 1.614 1.00 0.00 H new ATOM 0 HD3 PRO A 910 21.795 15.060 0.170 1.00 0.00 H new ATOM 55 N PHE A 911 18.794 10.794 -0.426 1.00 0.00 N ATOM 56 CA PHE A 911 18.232 9.545 0.066 1.00 0.00 C ATOM 57 C PHE A 911 18.645 8.397 -0.839 1.00 0.00 C ATOM 58 O PHE A 911 18.656 8.538 -2.064 1.00 0.00 O ATOM 59 CB PHE A 911 16.704 9.615 0.124 1.00 0.00 C ATOM 60 CG PHE A 911 16.162 10.641 1.079 1.00 0.00 C ATOM 61 CD1 PHE A 911 16.110 10.381 2.438 1.00 0.00 C ATOM 62 CD2 PHE A 911 15.695 11.861 0.615 1.00 0.00 C ATOM 63 CE1 PHE A 911 15.605 11.320 3.317 1.00 0.00 C ATOM 64 CE2 PHE A 911 15.188 12.803 1.489 1.00 0.00 C ATOM 65 CZ PHE A 911 15.143 12.532 2.843 1.00 0.00 C ATOM 0 H PHE A 911 18.118 11.410 -0.878 1.00 0.00 H new ATOM 0 HA PHE A 911 18.614 9.378 1.073 1.00 0.00 H new ATOM 0 HB2 PHE A 911 16.325 9.831 -0.875 1.00 0.00 H new ATOM 0 HB3 PHE A 911 16.319 8.635 0.406 1.00 0.00 H new ATOM 0 HD1 PHE A 911 16.468 9.434 2.815 1.00 0.00 H new ATOM 0 HD2 PHE A 911 15.728 12.078 -0.443 1.00 0.00 H new ATOM 0 HE1 PHE A 911 15.572 11.106 4.375 1.00 0.00 H new ATOM 0 HE2 PHE A 911 14.827 13.750 1.115 1.00 0.00 H new ATOM 0 HZ PHE A 911 14.747 13.266 3.529 1.00 0.00 H new ATOM 75 N THR A 912 18.992 7.267 -0.243 1.00 0.00 N ATOM 76 CA THR A 912 19.312 6.081 -1.014 1.00 0.00 C ATOM 77 C THR A 912 18.028 5.465 -1.564 1.00 0.00 C ATOM 78 O THR A 912 16.930 5.773 -1.089 1.00 0.00 O ATOM 79 CB THR A 912 20.062 5.035 -0.162 1.00 0.00 C ATOM 80 OG1 THR A 912 19.233 4.594 0.916 1.00 0.00 O ATOM 81 CG2 THR A 912 21.352 5.615 0.398 1.00 0.00 C ATOM 0 H THR A 912 19.058 7.148 0.768 1.00 0.00 H new ATOM 0 HA THR A 912 19.965 6.380 -1.834 1.00 0.00 H new ATOM 0 HB THR A 912 20.307 4.189 -0.805 1.00 0.00 H new ATOM 0 HG1 THR A 912 19.717 3.929 1.450 1.00 0.00 H new ATOM 0 HG21 THR A 912 21.862 4.859 0.995 1.00 0.00 H new ATOM 0 HG22 THR A 912 21.998 5.926 -0.423 1.00 0.00 H new ATOM 0 HG23 THR A 912 21.122 6.477 1.024 1.00 0.00 H new ATOM 89 N LEU A 913 18.160 4.602 -2.559 1.00 0.00 N ATOM 90 CA LEU A 913 17.004 3.945 -3.153 1.00 0.00 C ATOM 91 C LEU A 913 16.286 3.092 -2.114 1.00 0.00 C ATOM 92 O LEU A 913 15.056 3.042 -2.077 1.00 0.00 O ATOM 93 CB LEU A 913 17.431 3.080 -4.338 1.00 0.00 C ATOM 94 CG LEU A 913 18.023 3.847 -5.522 1.00 0.00 C ATOM 95 CD1 LEU A 913 18.597 2.882 -6.543 1.00 0.00 C ATOM 96 CD2 LEU A 913 16.970 4.731 -6.170 1.00 0.00 C ATOM 0 H LEU A 913 19.055 4.340 -2.973 1.00 0.00 H new ATOM 0 HA LEU A 913 16.318 4.713 -3.511 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.166 2.354 -3.991 1.00 0.00 H new ATOM 0 HB3 LEU A 913 16.566 2.516 -4.687 1.00 0.00 H new ATOM 0 HG LEU A 913 18.826 4.483 -5.150 1.00 0.00 H new ATOM 0 HD11 LEU A 913 19.014 3.443 -7.379 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.382 2.285 -6.078 1.00 0.00 H new ATOM 0 HD13 LEU A 913 17.807 2.224 -6.906 1.00 0.00 H new ATOM 0 HD21 LEU A 913 17.412 5.268 -7.010 1.00 0.00 H new ATOM 0 HD22 LEU A 913 16.146 4.113 -6.527 1.00 0.00 H new ATOM 0 HD23 LEU A 913 16.596 5.447 -5.438 1.00 0.00 H new ATOM 108 N VAL A 914 17.060 2.439 -1.257 1.00 0.00 N ATOM 109 CA VAL A 914 16.486 1.612 -0.206 1.00 0.00 C ATOM 110 C VAL A 914 15.898 2.467 0.915 1.00 0.00 C ATOM 111 O VAL A 914 14.888 2.096 1.501 1.00 0.00 O ATOM 112 CB VAL A 914 17.505 0.606 0.375 1.00 0.00 C ATOM 113 CG1 VAL A 914 17.919 -0.400 -0.687 1.00 0.00 C ATOM 114 CG2 VAL A 914 18.724 1.318 0.940 1.00 0.00 C ATOM 0 H VAL A 914 18.080 2.466 -1.269 1.00 0.00 H new ATOM 0 HA VAL A 914 15.683 1.040 -0.671 1.00 0.00 H new ATOM 0 HB VAL A 914 17.022 0.073 1.194 1.00 0.00 H new ATOM 0 HG11 VAL A 914 18.637 -1.102 -0.263 1.00 0.00 H new ATOM 0 HG12 VAL A 914 17.041 -0.944 -1.034 1.00 0.00 H new ATOM 0 HG13 VAL A 914 18.376 0.124 -1.526 1.00 0.00 H new ATOM 0 HG21 VAL A 914 19.422 0.583 1.341 1.00 0.00 H new ATOM 0 HG22 VAL A 914 19.212 1.887 0.149 1.00 0.00 H new ATOM 0 HG23 VAL A 914 18.414 1.995 1.736 1.00 0.00 H new ATOM 124 N GLN A 915 16.510 3.620 1.192 1.00 0.00 N ATOM 125 CA GLN A 915 15.982 4.542 2.200 1.00 0.00 C ATOM 126 C GLN A 915 14.614 5.055 1.770 1.00 0.00 C ATOM 127 O GLN A 915 13.723 5.265 2.596 1.00 0.00 O ATOM 128 CB GLN A 915 16.939 5.719 2.416 1.00 0.00 C ATOM 129 CG GLN A 915 16.492 6.693 3.495 1.00 0.00 C ATOM 130 CD GLN A 915 16.446 6.075 4.882 1.00 0.00 C ATOM 131 OE1 GLN A 915 15.628 6.457 5.717 1.00 0.00 O ATOM 132 NE2 GLN A 915 17.333 5.125 5.146 1.00 0.00 N ATOM 0 H GLN A 915 17.366 3.936 0.736 1.00 0.00 H new ATOM 0 HA GLN A 915 15.883 4.002 3.142 1.00 0.00 H new ATOM 0 HB2 GLN A 915 17.923 5.330 2.678 1.00 0.00 H new ATOM 0 HB3 GLN A 915 17.050 6.260 1.476 1.00 0.00 H new ATOM 0 HG2 GLN A 915 17.170 7.546 3.508 1.00 0.00 H new ATOM 0 HG3 GLN A 915 15.503 7.075 3.242 1.00 0.00 H new ATOM 0 HE21 GLN A 915 17.997 4.833 4.428 1.00 0.00 H new ATOM 0 HE22 GLN A 915 17.351 4.686 6.067 1.00 0.00 H new ATOM 141 N ARG A 916 14.459 5.258 0.467 1.00 0.00 N ATOM 142 CA ARG A 916 13.169 5.624 -0.095 1.00 0.00 C ATOM 143 C ARG A 916 12.162 4.521 0.180 1.00 0.00 C ATOM 144 O ARG A 916 11.061 4.779 0.658 1.00 0.00 O ATOM 145 CB ARG A 916 13.273 5.860 -1.600 1.00 0.00 C ATOM 146 CG ARG A 916 14.135 7.047 -1.981 1.00 0.00 C ATOM 147 CD ARG A 916 14.092 7.296 -3.478 1.00 0.00 C ATOM 148 NE ARG A 916 12.724 7.503 -3.952 1.00 0.00 N ATOM 149 CZ ARG A 916 12.401 8.173 -5.056 1.00 0.00 C ATOM 150 NH1 ARG A 916 13.343 8.758 -5.786 1.00 0.00 N ATOM 151 NH2 ARG A 916 11.127 8.281 -5.410 1.00 0.00 N ATOM 0 H ARG A 916 15.211 5.175 -0.217 1.00 0.00 H new ATOM 0 HA ARG A 916 12.840 6.551 0.375 1.00 0.00 H new ATOM 0 HB2 ARG A 916 13.678 4.964 -2.070 1.00 0.00 H new ATOM 0 HB3 ARG A 916 12.271 6.007 -2.004 1.00 0.00 H new ATOM 0 HG2 ARG A 916 13.791 7.935 -1.451 1.00 0.00 H new ATOM 0 HG3 ARG A 916 15.164 6.868 -1.668 1.00 0.00 H new ATOM 0 HD2 ARG A 916 14.697 8.170 -3.719 1.00 0.00 H new ATOM 0 HD3 ARG A 916 14.534 6.448 -4.001 1.00 0.00 H new ATOM 0 HE ARG A 916 11.965 7.106 -3.398 1.00 0.00 H new ATOM 0 HH11 ARG A 916 14.321 8.696 -5.502 1.00 0.00 H new ATOM 0 HH12 ARG A 916 13.089 9.270 -6.631 1.00 0.00 H new ATOM 0 HH21 ARG A 916 10.400 7.852 -4.837 1.00 0.00 H new ATOM 0 HH22 ARG A 916 10.874 8.793 -6.255 1.00 0.00 H new ATOM 165 N LEU A 917 12.564 3.288 -0.113 1.00 0.00 N ATOM 166 CA LEU A 917 11.733 2.122 0.152 1.00 0.00 C ATOM 167 C LEU A 917 11.375 2.041 1.630 1.00 0.00 C ATOM 168 O LEU A 917 10.214 1.843 1.976 1.00 0.00 O ATOM 169 CB LEU A 917 12.454 0.845 -0.281 1.00 0.00 C ATOM 170 CG LEU A 917 12.585 0.653 -1.789 1.00 0.00 C ATOM 171 CD1 LEU A 917 13.455 -0.553 -2.102 1.00 0.00 C ATOM 172 CD2 LEU A 917 11.212 0.493 -2.417 1.00 0.00 C ATOM 0 H LEU A 917 13.466 3.072 -0.537 1.00 0.00 H new ATOM 0 HA LEU A 917 10.813 2.222 -0.424 1.00 0.00 H new ATOM 0 HB2 LEU A 917 13.452 0.844 0.157 1.00 0.00 H new ATOM 0 HB3 LEU A 917 11.923 -0.012 0.134 1.00 0.00 H new ATOM 0 HG LEU A 917 13.063 1.537 -2.211 1.00 0.00 H new ATOM 0 HD11 LEU A 917 13.536 -0.673 -3.182 1.00 0.00 H new ATOM 0 HD12 LEU A 917 14.448 -0.405 -1.678 1.00 0.00 H new ATOM 0 HD13 LEU A 917 13.006 -1.448 -1.671 1.00 0.00 H new ATOM 0 HD21 LEU A 917 11.318 0.357 -3.493 1.00 0.00 H new ATOM 0 HD22 LEU A 917 10.715 -0.377 -1.988 1.00 0.00 H new ATOM 0 HD23 LEU A 917 10.616 1.384 -2.221 1.00 0.00 H new ATOM 184 N GLU A 918 12.380 2.206 2.488 1.00 0.00 N ATOM 185 CA GLU A 918 12.179 2.208 3.932 1.00 0.00 C ATOM 186 C GLU A 918 11.064 3.171 4.326 1.00 0.00 C ATOM 187 O GLU A 918 10.061 2.773 4.914 1.00 0.00 O ATOM 188 CB GLU A 918 13.468 2.613 4.655 1.00 0.00 C ATOM 189 CG GLU A 918 14.604 1.610 4.527 1.00 0.00 C ATOM 190 CD GLU A 918 15.882 2.103 5.178 1.00 0.00 C ATOM 191 OE1 GLU A 918 15.849 2.453 6.379 1.00 0.00 O ATOM 192 OE2 GLU A 918 16.925 2.160 4.491 1.00 0.00 O ATOM 0 H GLU A 918 13.350 2.341 2.202 1.00 0.00 H new ATOM 0 HA GLU A 918 11.899 1.197 4.226 1.00 0.00 H new ATOM 0 HB2 GLU A 918 13.803 3.574 4.264 1.00 0.00 H new ATOM 0 HB3 GLU A 918 13.246 2.759 5.712 1.00 0.00 H new ATOM 0 HG2 GLU A 918 14.306 0.667 4.984 1.00 0.00 H new ATOM 0 HG3 GLU A 918 14.790 1.408 3.472 1.00 0.00 H new ATOM 199 N HIS A 919 11.238 4.438 3.971 1.00 0.00 N ATOM 200 CA HIS A 919 10.304 5.485 4.367 1.00 0.00 C ATOM 201 C HIS A 919 8.938 5.303 3.703 1.00 0.00 C ATOM 202 O HIS A 919 7.901 5.488 4.343 1.00 0.00 O ATOM 203 CB HIS A 919 10.884 6.860 4.024 1.00 0.00 C ATOM 204 CG HIS A 919 10.080 8.009 4.555 1.00 0.00 C ATOM 205 ND1 HIS A 919 10.037 8.339 5.891 1.00 0.00 N ATOM 206 CD2 HIS A 919 9.286 8.905 3.925 1.00 0.00 C ATOM 207 CE1 HIS A 919 9.255 9.387 6.061 1.00 0.00 C ATOM 208 NE2 HIS A 919 8.789 9.749 4.884 1.00 0.00 N ATOM 0 H HIS A 919 12.022 4.767 3.407 1.00 0.00 H new ATOM 0 HA HIS A 919 10.157 5.414 5.445 1.00 0.00 H new ATOM 0 HB2 HIS A 919 11.897 6.925 4.420 1.00 0.00 H new ATOM 0 HB3 HIS A 919 10.959 6.952 2.940 1.00 0.00 H new ATOM 0 HD2 HIS A 919 9.082 8.947 2.865 1.00 0.00 H new ATOM 0 HE1 HIS A 919 9.035 9.866 7.004 1.00 0.00 H new ATOM 0 HE2 HIS A 919 8.159 10.533 4.713 1.00 0.00 H new ATOM 216 N ALA A 920 8.942 4.937 2.428 1.00 0.00 N ATOM 217 CA ALA A 920 7.703 4.787 1.672 1.00 0.00 C ATOM 218 C ALA A 920 6.893 3.598 2.168 1.00 0.00 C ATOM 219 O ALA A 920 5.683 3.705 2.358 1.00 0.00 O ATOM 220 CB ALA A 920 7.994 4.644 0.185 1.00 0.00 C ATOM 0 H ALA A 920 9.788 4.738 1.895 1.00 0.00 H new ATOM 0 HA ALA A 920 7.110 5.688 1.827 1.00 0.00 H new ATOM 0 HB1 ALA A 920 7.057 4.533 -0.360 1.00 0.00 H new ATOM 0 HB2 ALA A 920 8.518 5.531 -0.170 1.00 0.00 H new ATOM 0 HB3 ALA A 920 8.616 3.765 0.019 1.00 0.00 H new ATOM 226 N ALA A 921 7.564 2.472 2.394 1.00 0.00 N ATOM 227 CA ALA A 921 6.892 1.253 2.836 1.00 0.00 C ATOM 228 C ALA A 921 6.220 1.449 4.187 1.00 0.00 C ATOM 229 O ALA A 921 5.162 0.880 4.448 1.00 0.00 O ATOM 230 CB ALA A 921 7.869 0.091 2.892 1.00 0.00 C ATOM 0 H ALA A 921 8.573 2.378 2.278 1.00 0.00 H new ATOM 0 HA ALA A 921 6.116 1.020 2.107 1.00 0.00 H new ATOM 0 HB1 ALA A 921 7.348 -0.807 3.224 1.00 0.00 H new ATOM 0 HB2 ALA A 921 8.290 -0.079 1.901 1.00 0.00 H new ATOM 0 HB3 ALA A 921 8.672 0.324 3.592 1.00 0.00 H new ATOM 236 N LYS A 922 6.829 2.268 5.037 1.00 0.00 N ATOM 237 CA LYS A 922 6.272 2.559 6.354 1.00 0.00 C ATOM 238 C LYS A 922 4.891 3.196 6.229 1.00 0.00 C ATOM 239 O LYS A 922 3.925 2.732 6.844 1.00 0.00 O ATOM 240 CB LYS A 922 7.195 3.495 7.137 1.00 0.00 C ATOM 241 CG LYS A 922 8.547 2.891 7.467 1.00 0.00 C ATOM 242 CD LYS A 922 9.478 3.921 8.080 1.00 0.00 C ATOM 243 CE LYS A 922 10.860 3.342 8.330 1.00 0.00 C ATOM 244 NZ LYS A 922 11.795 4.353 8.887 1.00 0.00 N ATOM 0 H LYS A 922 7.709 2.743 4.838 1.00 0.00 H new ATOM 0 HA LYS A 922 6.181 1.615 6.892 1.00 0.00 H new ATOM 0 HB2 LYS A 922 7.347 4.407 6.559 1.00 0.00 H new ATOM 0 HB3 LYS A 922 6.701 3.784 8.065 1.00 0.00 H new ATOM 0 HG2 LYS A 922 8.416 2.059 8.159 1.00 0.00 H new ATOM 0 HG3 LYS A 922 8.997 2.485 6.561 1.00 0.00 H new ATOM 0 HD2 LYS A 922 9.558 4.782 7.416 1.00 0.00 H new ATOM 0 HD3 LYS A 922 9.057 4.280 9.019 1.00 0.00 H new ATOM 0 HE2 LYS A 922 10.782 2.502 9.020 1.00 0.00 H new ATOM 0 HE3 LYS A 922 11.263 2.951 7.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 12.526 3.876 9.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 12.245 4.875 8.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 11.269 5.017 9.491 1.00 0.00 H new ATOM 258 N GLN A 923 4.795 4.249 5.421 1.00 0.00 N ATOM 259 CA GLN A 923 3.537 4.968 5.270 1.00 0.00 C ATOM 260 C GLN A 923 2.586 4.222 4.338 1.00 0.00 C ATOM 261 O GLN A 923 1.371 4.309 4.492 1.00 0.00 O ATOM 262 CB GLN A 923 3.767 6.400 4.770 1.00 0.00 C ATOM 263 CG GLN A 923 4.408 6.495 3.397 1.00 0.00 C ATOM 264 CD GLN A 923 4.562 7.927 2.931 1.00 0.00 C ATOM 265 OE1 GLN A 923 5.577 8.572 3.191 1.00 0.00 O ATOM 266 NE2 GLN A 923 3.552 8.441 2.247 1.00 0.00 N ATOM 0 H GLN A 923 5.567 4.619 4.866 1.00 0.00 H new ATOM 0 HA GLN A 923 3.075 5.026 6.256 1.00 0.00 H new ATOM 0 HB2 GLN A 923 2.810 6.921 4.746 1.00 0.00 H new ATOM 0 HB3 GLN A 923 4.397 6.925 5.488 1.00 0.00 H new ATOM 0 HG2 GLN A 923 5.387 6.016 3.422 1.00 0.00 H new ATOM 0 HG3 GLN A 923 3.802 5.944 2.677 1.00 0.00 H new ATOM 0 HE21 GLN A 923 2.727 7.874 2.052 1.00 0.00 H new ATOM 0 HE22 GLN A 923 3.599 9.404 1.915 1.00 0.00 H new ATOM 275 N ALA A 924 3.137 3.479 3.382 1.00 0.00 N ATOM 276 CA ALA A 924 2.318 2.671 2.487 1.00 0.00 C ATOM 277 C ALA A 924 1.615 1.572 3.272 1.00 0.00 C ATOM 278 O ALA A 924 0.417 1.347 3.104 1.00 0.00 O ATOM 279 CB ALA A 924 3.161 2.077 1.367 1.00 0.00 C ATOM 0 H ALA A 924 4.140 3.420 3.209 1.00 0.00 H new ATOM 0 HA ALA A 924 1.564 3.314 2.033 1.00 0.00 H new ATOM 0 HB1 ALA A 924 2.527 1.478 0.713 1.00 0.00 H new ATOM 0 HB2 ALA A 924 3.620 2.881 0.791 1.00 0.00 H new ATOM 0 HB3 ALA A 924 3.940 1.446 1.794 1.00 0.00 H new ATOM 285 N ALA A 925 2.365 0.907 4.147 1.00 0.00 N ATOM 286 CA ALA A 925 1.815 -0.134 5.004 1.00 0.00 C ATOM 287 C ALA A 925 0.758 0.447 5.943 1.00 0.00 C ATOM 288 O ALA A 925 -0.270 -0.181 6.214 1.00 0.00 O ATOM 289 CB ALA A 925 2.931 -0.806 5.800 1.00 0.00 C ATOM 0 H ALA A 925 3.362 1.074 4.280 1.00 0.00 H new ATOM 0 HA ALA A 925 1.336 -0.885 4.376 1.00 0.00 H new ATOM 0 HB1 ALA A 925 2.507 -1.582 6.437 1.00 0.00 H new ATOM 0 HB2 ALA A 925 3.650 -1.253 5.113 1.00 0.00 H new ATOM 0 HB3 ALA A 925 3.434 -0.063 6.419 1.00 0.00 H new ATOM 295 N ALA A 926 1.011 1.659 6.424 1.00 0.00 N ATOM 296 CA ALA A 926 0.082 2.344 7.311 1.00 0.00 C ATOM 297 C ALA A 926 -1.183 2.759 6.565 1.00 0.00 C ATOM 298 O ALA A 926 -2.295 2.444 6.987 1.00 0.00 O ATOM 299 CB ALA A 926 0.753 3.556 7.938 1.00 0.00 C ATOM 0 H ALA A 926 1.857 2.189 6.212 1.00 0.00 H new ATOM 0 HA ALA A 926 -0.207 1.653 8.103 1.00 0.00 H new ATOM 0 HB1 ALA A 926 0.049 4.060 8.599 1.00 0.00 H new ATOM 0 HB2 ALA A 926 1.623 3.235 8.511 1.00 0.00 H new ATOM 0 HB3 ALA A 926 1.070 4.243 7.153 1.00 0.00 H new ATOM 305 N SER A 927 -1.003 3.444 5.441 1.00 0.00 N ATOM 306 CA SER A 927 -2.123 3.923 4.642 1.00 0.00 C ATOM 307 C SER A 927 -2.968 2.755 4.138 1.00 0.00 C ATOM 308 O SER A 927 -4.194 2.859 4.044 1.00 0.00 O ATOM 309 CB SER A 927 -1.617 4.762 3.464 1.00 0.00 C ATOM 310 OG SER A 927 -2.691 5.377 2.772 1.00 0.00 O ATOM 0 H SER A 927 -0.086 3.681 5.062 1.00 0.00 H new ATOM 0 HA SER A 927 -2.750 4.551 5.275 1.00 0.00 H new ATOM 0 HB2 SER A 927 -0.930 5.526 3.827 1.00 0.00 H new ATOM 0 HB3 SER A 927 -1.055 4.128 2.778 1.00 0.00 H new ATOM 0 HG SER A 927 -3.003 4.783 2.058 1.00 0.00 H new ATOM 316 N ALA A 928 -2.314 1.641 3.825 1.00 0.00 N ATOM 317 CA ALA A 928 -3.017 0.435 3.417 1.00 0.00 C ATOM 318 C ALA A 928 -3.954 -0.023 4.522 1.00 0.00 C ATOM 319 O ALA A 928 -5.117 -0.325 4.272 1.00 0.00 O ATOM 320 CB ALA A 928 -2.034 -0.667 3.073 1.00 0.00 C ATOM 0 H ALA A 928 -1.298 1.551 3.847 1.00 0.00 H new ATOM 0 HA ALA A 928 -3.604 0.662 2.527 1.00 0.00 H new ATOM 0 HB1 ALA A 928 -2.580 -1.560 2.770 1.00 0.00 H new ATOM 0 HB2 ALA A 928 -1.392 -0.340 2.255 1.00 0.00 H new ATOM 0 HB3 ALA A 928 -1.422 -0.894 3.946 1.00 0.00 H new ATOM 326 N THR A 929 -3.440 -0.042 5.745 1.00 0.00 N ATOM 327 CA THR A 929 -4.230 -0.417 6.907 1.00 0.00 C ATOM 328 C THR A 929 -5.447 0.500 7.049 1.00 0.00 C ATOM 329 O THR A 929 -6.550 0.042 7.349 1.00 0.00 O ATOM 330 CB THR A 929 -3.378 -0.357 8.192 1.00 0.00 C ATOM 331 OG1 THR A 929 -2.212 -1.184 8.043 1.00 0.00 O ATOM 332 CG2 THR A 929 -4.175 -0.818 9.403 1.00 0.00 C ATOM 0 H THR A 929 -2.472 0.200 5.957 1.00 0.00 H new ATOM 0 HA THR A 929 -4.573 -1.441 6.762 1.00 0.00 H new ATOM 0 HB THR A 929 -3.079 0.679 8.351 1.00 0.00 H new ATOM 0 HG1 THR A 929 -1.584 -0.756 7.424 1.00 0.00 H new ATOM 0 HG21 THR A 929 -3.548 -0.765 10.293 1.00 0.00 H new ATOM 0 HG22 THR A 929 -5.045 -0.174 9.533 1.00 0.00 H new ATOM 0 HG23 THR A 929 -4.504 -1.846 9.252 1.00 0.00 H new ATOM 340 N GLN A 930 -5.237 1.792 6.806 1.00 0.00 N ATOM 341 CA GLN A 930 -6.317 2.769 6.873 1.00 0.00 C ATOM 342 C GLN A 930 -7.350 2.507 5.782 1.00 0.00 C ATOM 343 O GLN A 930 -8.555 2.527 6.034 1.00 0.00 O ATOM 344 CB GLN A 930 -5.766 4.191 6.733 1.00 0.00 C ATOM 345 CG GLN A 930 -4.714 4.550 7.770 1.00 0.00 C ATOM 346 CD GLN A 930 -5.195 4.335 9.189 1.00 0.00 C ATOM 347 OE1 GLN A 930 -5.019 3.258 9.759 1.00 0.00 O ATOM 348 NE2 GLN A 930 -5.805 5.353 9.771 1.00 0.00 N ATOM 0 H GLN A 930 -4.328 2.185 6.561 1.00 0.00 H new ATOM 0 HA GLN A 930 -6.800 2.670 7.845 1.00 0.00 H new ATOM 0 HB2 GLN A 930 -5.336 4.307 5.738 1.00 0.00 H new ATOM 0 HB3 GLN A 930 -6.592 4.899 6.807 1.00 0.00 H new ATOM 0 HG2 GLN A 930 -3.821 3.949 7.599 1.00 0.00 H new ATOM 0 HG3 GLN A 930 -4.425 5.593 7.643 1.00 0.00 H new ATOM 0 HE21 GLN A 930 -5.931 6.229 9.264 1.00 0.00 H new ATOM 0 HE22 GLN A 930 -6.149 5.262 10.727 1.00 0.00 H new ATOM 357 N THR A 931 -6.868 2.242 4.574 1.00 0.00 N ATOM 358 CA THR A 931 -7.746 2.001 3.439 1.00 0.00 C ATOM 359 C THR A 931 -8.544 0.714 3.637 1.00 0.00 C ATOM 360 O THR A 931 -9.741 0.671 3.358 1.00 0.00 O ATOM 361 CB THR A 931 -6.950 1.925 2.120 1.00 0.00 C ATOM 362 OG1 THR A 931 -6.035 3.027 2.039 1.00 0.00 O ATOM 363 CG2 THR A 931 -7.885 1.959 0.919 1.00 0.00 C ATOM 0 H THR A 931 -5.873 2.189 4.356 1.00 0.00 H new ATOM 0 HA THR A 931 -8.437 2.842 3.376 1.00 0.00 H new ATOM 0 HB THR A 931 -6.399 0.985 2.109 1.00 0.00 H new ATOM 0 HG1 THR A 931 -5.314 2.902 2.691 1.00 0.00 H new ATOM 0 HG21 THR A 931 -7.300 1.904 0.001 1.00 0.00 H new ATOM 0 HG22 THR A 931 -8.568 1.111 0.965 1.00 0.00 H new ATOM 0 HG23 THR A 931 -8.457 2.887 0.930 1.00 0.00 H new ATOM 371 N ILE A 932 -7.881 -0.327 4.134 1.00 0.00 N ATOM 372 CA ILE A 932 -8.555 -1.589 4.425 1.00 0.00 C ATOM 373 C ILE A 932 -9.606 -1.388 5.511 1.00 0.00 C ATOM 374 O ILE A 932 -10.728 -1.887 5.404 1.00 0.00 O ATOM 375 CB ILE A 932 -7.560 -2.689 4.865 1.00 0.00 C ATOM 376 CG1 ILE A 932 -6.564 -2.989 3.742 1.00 0.00 C ATOM 377 CG2 ILE A 932 -8.305 -3.959 5.262 1.00 0.00 C ATOM 378 CD1 ILE A 932 -5.534 -4.039 4.104 1.00 0.00 C ATOM 0 H ILE A 932 -6.883 -0.322 4.343 1.00 0.00 H new ATOM 0 HA ILE A 932 -9.035 -1.919 3.504 1.00 0.00 H new ATOM 0 HB ILE A 932 -7.009 -2.325 5.732 1.00 0.00 H new ATOM 0 HG12 ILE A 932 -7.113 -3.321 2.861 1.00 0.00 H new ATOM 0 HG13 ILE A 932 -6.050 -2.068 3.469 1.00 0.00 H new ATOM 0 HG21 ILE A 932 -7.588 -4.721 5.568 1.00 0.00 H new ATOM 0 HG22 ILE A 932 -8.979 -3.741 6.090 1.00 0.00 H new ATOM 0 HG23 ILE A 932 -8.881 -4.324 4.412 1.00 0.00 H new ATOM 0 HD11 ILE A 932 -4.864 -4.198 3.259 1.00 0.00 H new ATOM 0 HD12 ILE A 932 -4.958 -3.702 4.966 1.00 0.00 H new ATOM 0 HD13 ILE A 932 -6.038 -4.974 4.348 1.00 0.00 H new ATOM 390 N ALA A 933 -9.247 -0.629 6.544 1.00 0.00 N ATOM 391 CA ALA A 933 -10.171 -0.327 7.632 1.00 0.00 C ATOM 392 C ALA A 933 -11.415 0.367 7.097 1.00 0.00 C ATOM 393 O ALA A 933 -12.536 0.048 7.490 1.00 0.00 O ATOM 394 CB ALA A 933 -9.493 0.536 8.686 1.00 0.00 C ATOM 0 H ALA A 933 -8.322 -0.212 6.649 1.00 0.00 H new ATOM 0 HA ALA A 933 -10.472 -1.266 8.097 1.00 0.00 H new ATOM 0 HB1 ALA A 933 -10.198 0.751 9.489 1.00 0.00 H new ATOM 0 HB2 ALA A 933 -8.632 0.005 9.092 1.00 0.00 H new ATOM 0 HB3 ALA A 933 -9.163 1.471 8.233 1.00 0.00 H new ATOM 400 N ALA A 934 -11.210 1.313 6.192 1.00 0.00 N ATOM 401 CA ALA A 934 -12.316 2.017 5.564 1.00 0.00 C ATOM 402 C ALA A 934 -13.119 1.075 4.675 1.00 0.00 C ATOM 403 O ALA A 934 -14.344 1.076 4.713 1.00 0.00 O ATOM 404 CB ALA A 934 -11.801 3.203 4.762 1.00 0.00 C ATOM 0 H ALA A 934 -10.287 1.610 5.877 1.00 0.00 H new ATOM 0 HA ALA A 934 -12.977 2.390 6.347 1.00 0.00 H new ATOM 0 HB1 ALA A 934 -12.641 3.720 4.298 1.00 0.00 H new ATOM 0 HB2 ALA A 934 -11.274 3.889 5.425 1.00 0.00 H new ATOM 0 HB3 ALA A 934 -11.119 2.850 3.988 1.00 0.00 H new ATOM 410 N ALA A 935 -12.415 0.254 3.898 1.00 0.00 N ATOM 411 CA ALA A 935 -13.047 -0.656 2.944 1.00 0.00 C ATOM 412 C ALA A 935 -13.915 -1.705 3.637 1.00 0.00 C ATOM 413 O ALA A 935 -15.019 -2.000 3.178 1.00 0.00 O ATOM 414 CB ALA A 935 -11.990 -1.334 2.087 1.00 0.00 C ATOM 0 H ALA A 935 -11.396 0.200 3.911 1.00 0.00 H new ATOM 0 HA ALA A 935 -13.702 -0.059 2.309 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -12.473 -2.009 1.380 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -11.426 -0.579 1.540 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -11.312 -1.901 2.726 1.00 0.00 H new ATOM 420 N GLN A 936 -13.424 -2.261 4.738 1.00 0.00 N ATOM 421 CA GLN A 936 -14.177 -3.271 5.480 1.00 0.00 C ATOM 422 C GLN A 936 -15.458 -2.677 6.057 1.00 0.00 C ATOM 423 O GLN A 936 -16.458 -3.375 6.229 1.00 0.00 O ATOM 424 CB GLN A 936 -13.330 -3.871 6.602 1.00 0.00 C ATOM 425 CG GLN A 936 -12.127 -4.655 6.107 1.00 0.00 C ATOM 426 CD GLN A 936 -11.331 -5.270 7.239 1.00 0.00 C ATOM 427 OE1 GLN A 936 -10.421 -4.647 7.783 1.00 0.00 O ATOM 428 NE2 GLN A 936 -11.666 -6.498 7.600 1.00 0.00 N ATOM 0 H GLN A 936 -12.513 -2.033 5.137 1.00 0.00 H new ATOM 0 HA GLN A 936 -14.442 -4.065 4.782 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -12.986 -3.068 7.254 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -13.956 -4.527 7.207 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -12.463 -5.443 5.433 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -11.480 -3.995 5.529 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -12.428 -6.980 7.123 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -11.163 -6.963 8.356 1.00 0.00 H new ATOM 437 N HIS A 937 -15.428 -1.382 6.339 1.00 0.00 N ATOM 438 CA HIS A 937 -16.596 -0.690 6.868 1.00 0.00 C ATOM 439 C HIS A 937 -17.355 0.004 5.744 1.00 0.00 C ATOM 440 O HIS A 937 -18.360 0.672 5.976 1.00 0.00 O ATOM 441 CB HIS A 937 -16.190 0.326 7.940 1.00 0.00 C ATOM 442 CG HIS A 937 -15.681 -0.298 9.206 1.00 0.00 C ATOM 443 ND1 HIS A 937 -16.433 -0.388 10.357 1.00 0.00 N ATOM 444 CD2 HIS A 937 -14.482 -0.856 9.501 1.00 0.00 C ATOM 445 CE1 HIS A 937 -15.718 -0.968 11.301 1.00 0.00 C ATOM 446 NE2 HIS A 937 -14.533 -1.264 10.807 1.00 0.00 N ATOM 0 H HIS A 937 -14.608 -0.789 6.211 1.00 0.00 H new ATOM 0 HA HIS A 937 -17.250 -1.430 7.329 1.00 0.00 H new ATOM 0 HB2 HIS A 937 -15.419 0.980 7.533 1.00 0.00 H new ATOM 0 HB3 HIS A 937 -17.049 0.954 8.176 1.00 0.00 H new ATOM 0 HD2 HIS A 937 -13.642 -0.960 8.830 1.00 0.00 H new ATOM 0 HE1 HIS A 937 -16.048 -1.167 12.310 1.00 0.00 H new ATOM 0 HE2 HIS A 937 -13.777 -1.723 11.315 1.00 0.00 H new ATOM 454 N ALA A 938 -16.879 -0.180 4.521 1.00 0.00 N ATOM 455 CA ALA A 938 -17.489 0.439 3.355 1.00 0.00 C ATOM 456 C ALA A 938 -18.481 -0.511 2.702 1.00 0.00 C ATOM 457 O ALA A 938 -18.995 -0.249 1.615 1.00 0.00 O ATOM 458 CB ALA A 938 -16.421 0.860 2.361 1.00 0.00 C ATOM 0 H ALA A 938 -16.065 -0.758 4.311 1.00 0.00 H new ATOM 0 HA ALA A 938 -18.030 1.328 3.679 1.00 0.00 H new ATOM 0 HB1 ALA A 938 -16.893 1.322 1.494 1.00 0.00 H new ATOM 0 HB2 ALA A 938 -15.748 1.576 2.832 1.00 0.00 H new ATOM 0 HB3 ALA A 938 -15.855 -0.015 2.043 1.00 0.00 H new ATOM 464 N ALA A 939 -18.761 -1.612 3.381 1.00 0.00 N ATOM 465 CA ALA A 939 -19.741 -2.569 2.901 1.00 0.00 C ATOM 466 C ALA A 939 -21.139 -2.151 3.335 1.00 0.00 C ATOM 467 O ALA A 939 -22.096 -2.919 3.231 1.00 0.00 O ATOM 468 CB ALA A 939 -19.414 -3.967 3.408 1.00 0.00 C ATOM 0 H ALA A 939 -18.322 -1.864 4.267 1.00 0.00 H new ATOM 0 HA ALA A 939 -19.708 -2.587 1.812 1.00 0.00 H new ATOM 0 HB1 ALA A 939 -20.159 -4.672 3.038 1.00 0.00 H new ATOM 0 HB2 ALA A 939 -18.427 -4.262 3.051 1.00 0.00 H new ATOM 0 HB3 ALA A 939 -19.421 -3.970 4.498 1.00 0.00 H new ATOM 474 N SER A 940 -21.244 -0.919 3.812 1.00 0.00 N ATOM 475 CA SER A 940 -22.503 -0.363 4.245 1.00 0.00 C ATOM 476 C SER A 940 -23.438 -0.206 3.051 1.00 0.00 C ATOM 477 O SER A 940 -23.004 0.173 1.954 1.00 0.00 O ATOM 478 CB SER A 940 -22.267 0.989 4.928 1.00 0.00 C ATOM 479 OG SER A 940 -23.443 1.459 5.562 1.00 0.00 O ATOM 0 H SER A 940 -20.453 -0.282 3.907 1.00 0.00 H new ATOM 0 HA SER A 940 -22.968 -1.038 4.963 1.00 0.00 H new ATOM 0 HB2 SER A 940 -21.469 0.892 5.664 1.00 0.00 H new ATOM 0 HB3 SER A 940 -21.933 1.718 4.190 1.00 0.00 H new ATOM 0 HG SER A 940 -23.261 2.322 5.990 1.00 0.00 H new ATOM 485 N ALA A 941 -24.706 -0.524 3.287 1.00 0.00 N ATOM 486 CA ALA A 941 -25.757 -0.471 2.271 1.00 0.00 C ATOM 487 C ALA A 941 -25.550 -1.543 1.203 1.00 0.00 C ATOM 488 O ALA A 941 -24.615 -1.461 0.398 1.00 0.00 O ATOM 489 CB ALA A 941 -25.850 0.911 1.634 1.00 0.00 C ATOM 0 H ALA A 941 -25.040 -0.830 4.201 1.00 0.00 H new ATOM 0 HA ALA A 941 -26.703 -0.672 2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 941 -26.641 0.914 0.884 1.00 0.00 H new ATOM 0 HB2 ALA A 941 -26.075 1.651 2.402 1.00 0.00 H new ATOM 0 HB3 ALA A 941 -24.900 1.158 1.160 1.00 0.00 H new ATOM 495 N PRO A 942 -26.418 -2.573 1.196 1.00 0.00 N ATOM 496 CA PRO A 942 -26.379 -3.640 0.194 1.00 0.00 C ATOM 497 C PRO A 942 -26.309 -3.073 -1.215 1.00 0.00 C ATOM 498 O PRO A 942 -27.235 -2.397 -1.675 1.00 0.00 O ATOM 499 CB PRO A 942 -27.693 -4.388 0.417 1.00 0.00 C ATOM 500 CG PRO A 942 -28.015 -4.152 1.850 1.00 0.00 C ATOM 501 CD PRO A 942 -27.507 -2.772 2.168 1.00 0.00 C ATOM 0 HA PRO A 942 -25.502 -4.279 0.295 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -28.481 -4.010 -0.235 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -27.586 -5.452 0.204 1.00 0.00 H new ATOM 0 HG2 PRO A 942 -29.089 -4.222 2.025 1.00 0.00 H new ATOM 0 HG3 PRO A 942 -27.539 -4.899 2.485 1.00 0.00 H new ATOM 0 HD2 PRO A 942 -28.289 -2.021 2.054 1.00 0.00 H new ATOM 0 HD3 PRO A 942 -27.146 -2.704 3.194 1.00 0.00 H new ATOM 509 N LYS A 943 -25.202 -3.329 -1.883 1.00 0.00 N ATOM 510 CA LYS A 943 -24.921 -2.709 -3.164 1.00 0.00 C ATOM 511 C LYS A 943 -25.021 -3.726 -4.292 1.00 0.00 C ATOM 512 O LYS A 943 -24.989 -4.937 -4.049 1.00 0.00 O ATOM 513 CB LYS A 943 -23.535 -2.054 -3.122 1.00 0.00 C ATOM 514 CG LYS A 943 -22.419 -2.992 -2.677 1.00 0.00 C ATOM 515 CD LYS A 943 -21.149 -2.234 -2.303 1.00 0.00 C ATOM 516 CE LYS A 943 -21.220 -1.622 -0.903 1.00 0.00 C ATOM 517 NZ LYS A 943 -22.233 -0.533 -0.793 1.00 0.00 N ATOM 0 H LYS A 943 -24.476 -3.968 -1.557 1.00 0.00 H new ATOM 0 HA LYS A 943 -25.665 -1.937 -3.360 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -23.297 -1.667 -4.113 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -23.569 -1.200 -2.446 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -22.757 -3.577 -1.822 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -22.197 -3.697 -3.478 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -20.297 -2.912 -2.357 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -20.974 -1.443 -3.033 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -21.456 -2.405 -0.182 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -20.240 -1.227 -0.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -22.036 0.040 0.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -22.187 0.070 -1.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -23.183 -0.949 -0.716 1.00 0.00 H new ATOM 531 N ALA A 944 -25.153 -3.233 -5.515 1.00 0.00 N ATOM 532 CA ALA A 944 -25.315 -4.096 -6.676 1.00 0.00 C ATOM 533 C ALA A 944 -23.982 -4.695 -7.109 1.00 0.00 C ATOM 534 O ALA A 944 -23.345 -4.217 -8.048 1.00 0.00 O ATOM 535 CB ALA A 944 -25.958 -3.332 -7.824 1.00 0.00 C ATOM 0 H ALA A 944 -25.151 -2.236 -5.729 1.00 0.00 H new ATOM 0 HA ALA A 944 -25.974 -4.917 -6.394 1.00 0.00 H new ATOM 0 HB1 ALA A 944 -26.071 -3.993 -8.683 1.00 0.00 H new ATOM 0 HB2 ALA A 944 -26.938 -2.968 -7.515 1.00 0.00 H new ATOM 0 HB3 ALA A 944 -25.326 -2.487 -8.097 1.00 0.00 H new ATOM 541 N SER A 945 -23.556 -5.724 -6.396 1.00 0.00 N ATOM 542 CA SER A 945 -22.324 -6.422 -6.708 1.00 0.00 C ATOM 543 C SER A 945 -22.346 -7.792 -6.041 1.00 0.00 C ATOM 544 O SER A 945 -22.003 -7.928 -4.867 1.00 0.00 O ATOM 545 CB SER A 945 -21.109 -5.609 -6.238 1.00 0.00 C ATOM 546 OG SER A 945 -19.901 -6.090 -6.811 1.00 0.00 O ATOM 0 H SER A 945 -24.054 -6.097 -5.588 1.00 0.00 H new ATOM 0 HA SER A 945 -22.242 -6.548 -7.788 1.00 0.00 H new ATOM 0 HB2 SER A 945 -21.247 -4.561 -6.505 1.00 0.00 H new ATOM 0 HB3 SER A 945 -21.039 -5.654 -5.151 1.00 0.00 H new ATOM 0 HG SER A 945 -19.149 -5.549 -6.492 1.00 0.00 H new ATOM 552 N ALA A 946 -22.803 -8.791 -6.784 1.00 0.00 N ATOM 553 CA ALA A 946 -22.912 -10.146 -6.262 1.00 0.00 C ATOM 554 C ALA A 946 -21.539 -10.783 -6.096 1.00 0.00 C ATOM 555 O ALA A 946 -20.668 -10.640 -6.956 1.00 0.00 O ATOM 556 CB ALA A 946 -23.784 -10.991 -7.174 1.00 0.00 C ATOM 0 H ALA A 946 -23.105 -8.688 -7.753 1.00 0.00 H new ATOM 0 HA ALA A 946 -23.378 -10.095 -5.278 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -23.858 -12.002 -6.773 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -24.780 -10.551 -7.235 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -23.342 -11.027 -8.169 1.00 0.00 H new ATOM 562 N GLY A 947 -21.353 -11.479 -4.985 1.00 0.00 N ATOM 563 CA GLY A 947 -20.088 -12.127 -4.714 1.00 0.00 C ATOM 564 C GLY A 947 -19.562 -11.774 -3.339 1.00 0.00 C ATOM 565 O GLY A 947 -19.691 -10.629 -2.904 1.00 0.00 O ATOM 0 H GLY A 947 -22.061 -11.607 -4.262 1.00 0.00 H new ATOM 0 HA2 GLY A 947 -20.209 -13.208 -4.791 1.00 0.00 H new ATOM 0 HA3 GLY A 947 -19.359 -11.833 -5.469 1.00 0.00 H new ATOM 569 N PRO A 948 -18.971 -12.743 -2.621 1.00 0.00 N ATOM 570 CA PRO A 948 -18.414 -12.511 -1.284 1.00 0.00 C ATOM 571 C PRO A 948 -17.255 -11.533 -1.316 1.00 0.00 C ATOM 572 O PRO A 948 -16.938 -10.873 -0.326 1.00 0.00 O ATOM 573 CB PRO A 948 -17.937 -13.894 -0.827 1.00 0.00 C ATOM 574 CG PRO A 948 -18.600 -14.865 -1.745 1.00 0.00 C ATOM 575 CD PRO A 948 -18.807 -14.140 -3.044 1.00 0.00 C ATOM 0 HA PRO A 948 -19.151 -12.071 -0.612 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -16.852 -13.975 -0.887 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -18.214 -14.082 0.210 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -17.981 -15.751 -1.888 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -19.550 -15.204 -1.333 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -17.956 -14.261 -3.714 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -19.685 -14.507 -3.575 1.00 0.00 H new ATOM 583 N GLN A 949 -16.633 -11.457 -2.466 1.00 0.00 N ATOM 584 CA GLN A 949 -15.552 -10.517 -2.701 1.00 0.00 C ATOM 585 C GLN A 949 -15.878 -9.656 -3.914 1.00 0.00 C ATOM 586 O GLN A 949 -15.433 -9.945 -5.024 1.00 0.00 O ATOM 587 CB GLN A 949 -14.225 -11.248 -2.920 1.00 0.00 C ATOM 588 CG GLN A 949 -13.886 -12.245 -1.825 1.00 0.00 C ATOM 589 CD GLN A 949 -12.549 -12.923 -2.043 1.00 0.00 C ATOM 590 OE1 GLN A 949 -11.620 -12.331 -2.592 1.00 0.00 O ATOM 591 NE2 GLN A 949 -12.446 -14.175 -1.627 1.00 0.00 N ATOM 0 H GLN A 949 -16.858 -12.043 -3.270 1.00 0.00 H new ATOM 0 HA GLN A 949 -15.448 -9.883 -1.820 1.00 0.00 H new ATOM 0 HB2 GLN A 949 -14.262 -11.771 -3.876 1.00 0.00 H new ATOM 0 HB3 GLN A 949 -13.423 -10.513 -2.990 1.00 0.00 H new ATOM 0 HG2 GLN A 949 -13.876 -11.732 -0.863 1.00 0.00 H new ATOM 0 HG3 GLN A 949 -14.668 -13.002 -1.774 1.00 0.00 H new ATOM 0 HE21 GLN A 949 -13.240 -14.630 -1.176 1.00 0.00 H new ATOM 0 HE22 GLN A 949 -11.572 -14.685 -1.757 1.00 0.00 H new ATOM 600 N PRO A 950 -16.694 -8.605 -3.722 1.00 0.00 N ATOM 601 CA PRO A 950 -17.100 -7.715 -4.813 1.00 0.00 C ATOM 602 C PRO A 950 -15.892 -7.072 -5.484 1.00 0.00 C ATOM 603 O PRO A 950 -15.705 -7.180 -6.695 1.00 0.00 O ATOM 604 CB PRO A 950 -17.970 -6.654 -4.126 1.00 0.00 C ATOM 605 CG PRO A 950 -17.665 -6.772 -2.672 1.00 0.00 C ATOM 606 CD PRO A 950 -17.290 -8.206 -2.438 1.00 0.00 C ATOM 0 HA PRO A 950 -17.629 -8.247 -5.604 1.00 0.00 H new ATOM 0 HB2 PRO A 950 -17.737 -5.656 -4.496 1.00 0.00 H new ATOM 0 HB3 PRO A 950 -19.028 -6.828 -4.321 1.00 0.00 H new ATOM 0 HG2 PRO A 950 -16.850 -6.105 -2.390 1.00 0.00 H new ATOM 0 HG3 PRO A 950 -18.529 -6.492 -2.069 1.00 0.00 H new ATOM 0 HD2 PRO A 950 -16.583 -8.309 -1.615 1.00 0.00 H new ATOM 0 HD3 PRO A 950 -18.159 -8.815 -2.190 1.00 0.00 H new ATOM 614 N LEU A 951 -15.068 -6.419 -4.677 1.00 0.00 N ATOM 615 CA LEU A 951 -13.835 -5.821 -5.158 1.00 0.00 C ATOM 616 C LEU A 951 -12.975 -5.407 -3.973 1.00 0.00 C ATOM 617 O LEU A 951 -11.833 -5.842 -3.845 1.00 0.00 O ATOM 618 CB LEU A 951 -14.128 -4.625 -6.048 1.00 0.00 C ATOM 619 CG LEU A 951 -12.962 -4.194 -6.926 1.00 0.00 C ATOM 620 CD1 LEU A 951 -12.347 -5.390 -7.641 1.00 0.00 C ATOM 621 CD2 LEU A 951 -13.449 -3.184 -7.926 1.00 0.00 C ATOM 0 H LEU A 951 -15.235 -6.290 -3.679 1.00 0.00 H new ATOM 0 HA LEU A 951 -13.294 -6.556 -5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -14.979 -4.862 -6.686 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -14.425 -3.785 -5.420 1.00 0.00 H new ATOM 0 HG LEU A 951 -12.190 -3.749 -6.298 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -11.516 -5.055 -8.262 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -11.984 -6.107 -6.905 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -13.100 -5.865 -8.269 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -12.619 -2.870 -8.559 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -14.228 -3.630 -8.544 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -13.853 -2.318 -7.401 1.00 0.00 H new ATOM 633 N LEU A 952 -13.553 -4.584 -3.097 1.00 0.00 N ATOM 634 CA LEU A 952 -12.887 -4.162 -1.861 1.00 0.00 C ATOM 635 C LEU A 952 -12.313 -5.353 -1.103 1.00 0.00 C ATOM 636 O LEU A 952 -11.099 -5.486 -0.975 1.00 0.00 O ATOM 637 CB LEU A 952 -13.864 -3.415 -0.948 1.00 0.00 C ATOM 638 CG LEU A 952 -14.292 -2.029 -1.428 1.00 0.00 C ATOM 639 CD1 LEU A 952 -15.342 -1.449 -0.494 1.00 0.00 C ATOM 640 CD2 LEU A 952 -13.089 -1.103 -1.514 1.00 0.00 C ATOM 0 H LEU A 952 -14.487 -4.193 -3.221 1.00 0.00 H new ATOM 0 HA LEU A 952 -12.071 -3.498 -2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -14.757 -4.028 -0.823 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -13.407 -3.313 0.036 1.00 0.00 H new ATOM 0 HG LEU A 952 -14.726 -2.124 -2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -15.638 -0.461 -0.848 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -16.213 -2.104 -0.475 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -14.929 -1.366 0.511 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -13.411 -0.120 -1.857 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -12.629 -1.011 -0.530 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -12.364 -1.513 -2.216 1.00 0.00 H new ATOM 652 N VAL A 953 -13.202 -6.223 -0.623 1.00 0.00 N ATOM 653 CA VAL A 953 -12.812 -7.384 0.177 1.00 0.00 C ATOM 654 C VAL A 953 -11.729 -8.208 -0.522 1.00 0.00 C ATOM 655 O VAL A 953 -10.789 -8.678 0.114 1.00 0.00 O ATOM 656 CB VAL A 953 -14.027 -8.292 0.471 1.00 0.00 C ATOM 657 CG1 VAL A 953 -13.638 -9.441 1.389 1.00 0.00 C ATOM 658 CG2 VAL A 953 -15.167 -7.484 1.075 1.00 0.00 C ATOM 0 H VAL A 953 -14.207 -6.144 -0.777 1.00 0.00 H new ATOM 0 HA VAL A 953 -12.414 -7.000 1.116 1.00 0.00 H new ATOM 0 HB VAL A 953 -14.369 -8.715 -0.473 1.00 0.00 H new ATOM 0 HG11 VAL A 953 -14.511 -10.065 1.581 1.00 0.00 H new ATOM 0 HG12 VAL A 953 -12.861 -10.040 0.913 1.00 0.00 H new ATOM 0 HG13 VAL A 953 -13.263 -9.043 2.332 1.00 0.00 H new ATOM 0 HG21 VAL A 953 -16.013 -8.142 1.275 1.00 0.00 H new ATOM 0 HG22 VAL A 953 -14.835 -7.027 2.007 1.00 0.00 H new ATOM 0 HG23 VAL A 953 -15.470 -6.704 0.376 1.00 0.00 H new ATOM 668 N GLN A 954 -11.863 -8.351 -1.836 1.00 0.00 N ATOM 669 CA GLN A 954 -10.909 -9.112 -2.634 1.00 0.00 C ATOM 670 C GLN A 954 -9.510 -8.510 -2.530 1.00 0.00 C ATOM 671 O GLN A 954 -8.549 -9.199 -2.181 1.00 0.00 O ATOM 672 CB GLN A 954 -11.374 -9.150 -4.094 1.00 0.00 C ATOM 673 CG GLN A 954 -10.405 -9.834 -5.046 1.00 0.00 C ATOM 674 CD GLN A 954 -9.638 -8.852 -5.915 1.00 0.00 C ATOM 675 OE1 GLN A 954 -8.545 -8.404 -5.563 1.00 0.00 O ATOM 676 NE2 GLN A 954 -10.219 -8.499 -7.051 1.00 0.00 N ATOM 0 H GLN A 954 -12.629 -7.946 -2.374 1.00 0.00 H new ATOM 0 HA GLN A 954 -10.862 -10.131 -2.249 1.00 0.00 H new ATOM 0 HB2 GLN A 954 -12.335 -9.663 -4.143 1.00 0.00 H new ATOM 0 HB3 GLN A 954 -11.540 -8.128 -4.436 1.00 0.00 H new ATOM 0 HG2 GLN A 954 -9.698 -10.431 -4.470 1.00 0.00 H new ATOM 0 HG3 GLN A 954 -10.957 -10.523 -5.685 1.00 0.00 H new ATOM 0 HE21 GLN A 954 -11.125 -8.894 -7.305 1.00 0.00 H new ATOM 0 HE22 GLN A 954 -9.761 -7.832 -7.672 1.00 0.00 H new ATOM 685 N SER A 955 -9.408 -7.222 -2.810 1.00 0.00 N ATOM 686 CA SER A 955 -8.126 -6.544 -2.796 1.00 0.00 C ATOM 687 C SER A 955 -7.584 -6.412 -1.372 1.00 0.00 C ATOM 688 O SER A 955 -6.379 -6.535 -1.151 1.00 0.00 O ATOM 689 CB SER A 955 -8.257 -5.176 -3.456 1.00 0.00 C ATOM 690 OG SER A 955 -8.764 -5.306 -4.772 1.00 0.00 O ATOM 0 H SER A 955 -10.200 -6.625 -3.050 1.00 0.00 H new ATOM 0 HA SER A 955 -7.412 -7.142 -3.362 1.00 0.00 H new ATOM 0 HB2 SER A 955 -8.920 -4.543 -2.866 1.00 0.00 H new ATOM 0 HB3 SER A 955 -7.285 -4.684 -3.482 1.00 0.00 H new ATOM 0 HG SER A 955 -8.742 -6.249 -5.040 1.00 0.00 H new ATOM 696 N CYS A 956 -8.478 -6.188 -0.409 1.00 0.00 N ATOM 697 CA CYS A 956 -8.085 -6.075 0.994 1.00 0.00 C ATOM 698 C CYS A 956 -7.383 -7.342 1.473 1.00 0.00 C ATOM 699 O CYS A 956 -6.458 -7.278 2.282 1.00 0.00 O ATOM 700 CB CYS A 956 -9.303 -5.792 1.877 1.00 0.00 C ATOM 701 SG CYS A 956 -10.083 -4.191 1.570 1.00 0.00 S ATOM 0 H CYS A 956 -9.479 -6.081 -0.575 1.00 0.00 H new ATOM 0 HA CYS A 956 -7.388 -5.241 1.074 1.00 0.00 H new ATOM 0 HB2 CYS A 956 -10.041 -6.579 1.722 1.00 0.00 H new ATOM 0 HB3 CYS A 956 -8.999 -5.841 2.923 1.00 0.00 H new ATOM 0 HG CYS A 956 -9.165 -3.282 1.427 1.00 0.00 H new ATOM 707 N LYS A 957 -7.823 -8.492 0.972 1.00 0.00 N ATOM 708 CA LYS A 957 -7.199 -9.760 1.324 1.00 0.00 C ATOM 709 C LYS A 957 -5.748 -9.793 0.866 1.00 0.00 C ATOM 710 O LYS A 957 -4.855 -10.161 1.627 1.00 0.00 O ATOM 711 CB LYS A 957 -7.958 -10.930 0.700 1.00 0.00 C ATOM 712 CG LYS A 957 -9.331 -11.158 1.301 1.00 0.00 C ATOM 713 CD LYS A 957 -10.027 -12.339 0.648 1.00 0.00 C ATOM 714 CE LYS A 957 -11.375 -12.618 1.290 1.00 0.00 C ATOM 715 NZ LYS A 957 -11.249 -12.961 2.730 1.00 0.00 N ATOM 0 H LYS A 957 -8.606 -8.571 0.324 1.00 0.00 H new ATOM 0 HA LYS A 957 -7.231 -9.855 2.409 1.00 0.00 H new ATOM 0 HB2 LYS A 957 -8.065 -10.752 -0.370 1.00 0.00 H new ATOM 0 HB3 LYS A 957 -7.366 -11.838 0.815 1.00 0.00 H new ATOM 0 HG2 LYS A 957 -9.237 -11.335 2.372 1.00 0.00 H new ATOM 0 HG3 LYS A 957 -9.938 -10.261 1.178 1.00 0.00 H new ATOM 0 HD2 LYS A 957 -10.164 -12.139 -0.415 1.00 0.00 H new ATOM 0 HD3 LYS A 957 -9.395 -13.224 0.727 1.00 0.00 H new ATOM 0 HE2 LYS A 957 -12.016 -11.743 1.181 1.00 0.00 H new ATOM 0 HE3 LYS A 957 -11.864 -13.438 0.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 -12.143 -13.370 3.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 -10.482 -13.652 2.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 -11.033 -12.101 3.274 1.00 0.00 H new ATOM 729 N ALA A 958 -5.522 -9.393 -0.378 1.00 0.00 N ATOM 730 CA ALA A 958 -4.186 -9.403 -0.953 1.00 0.00 C ATOM 731 C ALA A 958 -3.289 -8.373 -0.271 1.00 0.00 C ATOM 732 O ALA A 958 -2.154 -8.674 0.102 1.00 0.00 O ATOM 733 CB ALA A 958 -4.259 -9.141 -2.448 1.00 0.00 C ATOM 0 H ALA A 958 -6.250 -9.057 -1.009 1.00 0.00 H new ATOM 0 HA ALA A 958 -3.749 -10.388 -0.789 1.00 0.00 H new ATOM 0 HB1 ALA A 958 -3.253 -9.151 -2.869 1.00 0.00 H new ATOM 0 HB2 ALA A 958 -4.859 -9.916 -2.924 1.00 0.00 H new ATOM 0 HB3 ALA A 958 -4.717 -8.168 -2.625 1.00 0.00 H new ATOM 739 N VAL A 959 -3.813 -7.165 -0.092 1.00 0.00 N ATOM 740 CA VAL A 959 -3.052 -6.080 0.519 1.00 0.00 C ATOM 741 C VAL A 959 -2.631 -6.431 1.945 1.00 0.00 C ATOM 742 O VAL A 959 -1.484 -6.207 2.331 1.00 0.00 O ATOM 743 CB VAL A 959 -3.857 -4.761 0.535 1.00 0.00 C ATOM 744 CG1 VAL A 959 -3.071 -3.652 1.215 1.00 0.00 C ATOM 745 CG2 VAL A 959 -4.237 -4.348 -0.877 1.00 0.00 C ATOM 0 H VAL A 959 -4.764 -6.912 -0.362 1.00 0.00 H new ATOM 0 HA VAL A 959 -2.160 -5.941 -0.092 1.00 0.00 H new ATOM 0 HB VAL A 959 -4.770 -4.932 1.105 1.00 0.00 H new ATOM 0 HG11 VAL A 959 -3.660 -2.735 1.213 1.00 0.00 H new ATOM 0 HG12 VAL A 959 -2.851 -3.940 2.243 1.00 0.00 H new ATOM 0 HG13 VAL A 959 -2.138 -3.485 0.677 1.00 0.00 H new ATOM 0 HG21 VAL A 959 -4.803 -3.417 -0.844 1.00 0.00 H new ATOM 0 HG22 VAL A 959 -3.333 -4.202 -1.469 1.00 0.00 H new ATOM 0 HG23 VAL A 959 -4.847 -5.128 -1.332 1.00 0.00 H new ATOM 755 N ALA A 960 -3.552 -7.004 2.715 1.00 0.00 N ATOM 756 CA ALA A 960 -3.293 -7.318 4.118 1.00 0.00 C ATOM 757 C ALA A 960 -2.150 -8.314 4.280 1.00 0.00 C ATOM 758 O ALA A 960 -1.478 -8.332 5.309 1.00 0.00 O ATOM 759 CB ALA A 960 -4.549 -7.850 4.787 1.00 0.00 C ATOM 0 H ALA A 960 -4.485 -7.261 2.391 1.00 0.00 H new ATOM 0 HA ALA A 960 -2.994 -6.390 4.605 1.00 0.00 H new ATOM 0 HB1 ALA A 960 -4.336 -8.078 5.831 1.00 0.00 H new ATOM 0 HB2 ALA A 960 -5.336 -7.098 4.733 1.00 0.00 H new ATOM 0 HB3 ALA A 960 -4.877 -8.756 4.277 1.00 0.00 H new ATOM 765 N GLU A 961 -1.926 -9.136 3.264 1.00 0.00 N ATOM 766 CA GLU A 961 -0.842 -10.110 3.303 1.00 0.00 C ATOM 767 C GLU A 961 0.489 -9.445 2.961 1.00 0.00 C ATOM 768 O GLU A 961 1.552 -9.899 3.385 1.00 0.00 O ATOM 769 CB GLU A 961 -1.117 -11.253 2.323 1.00 0.00 C ATOM 770 CG GLU A 961 -2.408 -12.010 2.596 1.00 0.00 C ATOM 771 CD GLU A 961 -2.429 -12.669 3.960 1.00 0.00 C ATOM 772 OE1 GLU A 961 -1.656 -13.624 4.181 1.00 0.00 O ATOM 773 OE2 GLU A 961 -3.207 -12.219 4.831 1.00 0.00 O ATOM 0 H GLU A 961 -2.477 -9.149 2.406 1.00 0.00 H new ATOM 0 HA GLU A 961 -0.784 -10.515 4.313 1.00 0.00 H new ATOM 0 HB2 GLU A 961 -1.153 -10.849 1.311 1.00 0.00 H new ATOM 0 HB3 GLU A 961 -0.283 -11.954 2.357 1.00 0.00 H new ATOM 0 HG2 GLU A 961 -3.250 -11.322 2.518 1.00 0.00 H new ATOM 0 HG3 GLU A 961 -2.546 -12.771 1.828 1.00 0.00 H new ATOM 780 N GLN A 962 0.420 -8.359 2.207 1.00 0.00 N ATOM 781 CA GLN A 962 1.616 -7.670 1.741 1.00 0.00 C ATOM 782 C GLN A 962 2.111 -6.654 2.767 1.00 0.00 C ATOM 783 O GLN A 962 3.302 -6.334 2.808 1.00 0.00 O ATOM 784 CB GLN A 962 1.329 -6.973 0.413 1.00 0.00 C ATOM 785 CG GLN A 962 0.896 -7.920 -0.695 1.00 0.00 C ATOM 786 CD GLN A 962 1.937 -8.977 -1.007 1.00 0.00 C ATOM 787 OE1 GLN A 962 3.138 -8.751 -0.859 1.00 0.00 O ATOM 788 NE2 GLN A 962 1.482 -10.137 -1.451 1.00 0.00 N ATOM 0 H GLN A 962 -0.456 -7.933 1.903 1.00 0.00 H new ATOM 0 HA GLN A 962 2.400 -8.414 1.601 1.00 0.00 H new ATOM 0 HB2 GLN A 962 0.549 -6.227 0.566 1.00 0.00 H new ATOM 0 HB3 GLN A 962 2.223 -6.439 0.093 1.00 0.00 H new ATOM 0 HG2 GLN A 962 -0.035 -8.408 -0.406 1.00 0.00 H new ATOM 0 HG3 GLN A 962 0.688 -7.345 -1.597 1.00 0.00 H new ATOM 0 HE21 GLN A 962 0.478 -10.283 -1.559 1.00 0.00 H new ATOM 0 HE22 GLN A 962 2.135 -10.885 -1.685 1.00 0.00 H new ATOM 797 N ILE A 963 1.196 -6.155 3.596 1.00 0.00 N ATOM 798 CA ILE A 963 1.535 -5.167 4.625 1.00 0.00 C ATOM 799 C ILE A 963 2.692 -5.640 5.522 1.00 0.00 C ATOM 800 O ILE A 963 3.704 -4.945 5.637 1.00 0.00 O ATOM 801 CB ILE A 963 0.310 -4.805 5.501 1.00 0.00 C ATOM 802 CG1 ILE A 963 -0.792 -4.178 4.644 1.00 0.00 C ATOM 803 CG2 ILE A 963 0.714 -3.855 6.624 1.00 0.00 C ATOM 804 CD1 ILE A 963 -2.052 -3.855 5.417 1.00 0.00 C ATOM 0 H ILE A 963 0.211 -6.418 3.577 1.00 0.00 H new ATOM 0 HA ILE A 963 1.858 -4.273 4.091 1.00 0.00 H new ATOM 0 HB ILE A 963 -0.075 -5.722 5.948 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -0.411 -3.264 4.189 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -1.040 -4.860 3.830 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -0.160 -3.613 7.228 1.00 0.00 H new ATOM 0 HG22 ILE A 963 1.467 -4.332 7.251 1.00 0.00 H new ATOM 0 HG23 ILE A 963 1.124 -2.940 6.197 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -2.788 -3.414 4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.458 -4.769 5.850 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.819 -3.149 6.214 1.00 0.00 H new ATOM 816 N PRO A 964 2.579 -6.826 6.167 1.00 0.00 N ATOM 817 CA PRO A 964 3.646 -7.349 7.028 1.00 0.00 C ATOM 818 C PRO A 964 4.941 -7.596 6.257 1.00 0.00 C ATOM 819 O PRO A 964 6.031 -7.497 6.818 1.00 0.00 O ATOM 820 CB PRO A 964 3.082 -8.668 7.567 1.00 0.00 C ATOM 821 CG PRO A 964 1.986 -9.034 6.630 1.00 0.00 C ATOM 822 CD PRO A 964 1.419 -7.735 6.135 1.00 0.00 C ATOM 0 HA PRO A 964 3.909 -6.641 7.814 1.00 0.00 H new ATOM 0 HB2 PRO A 964 3.849 -9.442 7.597 1.00 0.00 H new ATOM 0 HB3 PRO A 964 2.708 -8.550 8.584 1.00 0.00 H new ATOM 0 HG2 PRO A 964 2.363 -9.636 5.803 1.00 0.00 H new ATOM 0 HG3 PRO A 964 1.223 -9.627 7.134 1.00 0.00 H new ATOM 0 HD2 PRO A 964 1.011 -7.831 5.129 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.611 -7.379 6.774 1.00 0.00 H new ATOM 830 N LEU A 965 4.817 -7.897 4.968 1.00 0.00 N ATOM 831 CA LEU A 965 5.980 -8.158 4.129 1.00 0.00 C ATOM 832 C LEU A 965 6.781 -6.885 3.903 1.00 0.00 C ATOM 833 O LEU A 965 8.014 -6.910 3.920 1.00 0.00 O ATOM 834 CB LEU A 965 5.556 -8.769 2.793 1.00 0.00 C ATOM 835 CG LEU A 965 5.047 -10.206 2.879 1.00 0.00 C ATOM 836 CD1 LEU A 965 4.619 -10.705 1.508 1.00 0.00 C ATOM 837 CD2 LEU A 965 6.124 -11.108 3.466 1.00 0.00 C ATOM 0 H LEU A 965 3.923 -7.966 4.482 1.00 0.00 H new ATOM 0 HA LEU A 965 6.617 -8.874 4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 965 4.774 -8.147 2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 965 6.405 -8.739 2.110 1.00 0.00 H new ATOM 0 HG LEU A 965 4.177 -10.229 3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 965 4.259 -11.731 1.590 1.00 0.00 H new ATOM 0 HD12 LEU A 965 3.821 -10.070 1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 965 5.469 -10.672 0.827 1.00 0.00 H new ATOM 0 HD21 LEU A 965 5.751 -12.131 3.523 1.00 0.00 H new ATOM 0 HD22 LEU A 965 7.009 -11.080 2.830 1.00 0.00 H new ATOM 0 HD23 LEU A 965 6.384 -10.761 4.466 1.00 0.00 H new ATOM 849 N LEU A 966 6.076 -5.778 3.694 1.00 0.00 N ATOM 850 CA LEU A 966 6.718 -4.474 3.586 1.00 0.00 C ATOM 851 C LEU A 966 7.538 -4.193 4.831 1.00 0.00 C ATOM 852 O LEU A 966 8.750 -4.006 4.764 1.00 0.00 O ATOM 853 CB LEU A 966 5.681 -3.362 3.426 1.00 0.00 C ATOM 854 CG LEU A 966 4.908 -3.347 2.114 1.00 0.00 C ATOM 855 CD1 LEU A 966 3.913 -2.203 2.131 1.00 0.00 C ATOM 856 CD2 LEU A 966 5.858 -3.217 0.933 1.00 0.00 C ATOM 0 H LEU A 966 5.061 -5.758 3.596 1.00 0.00 H new ATOM 0 HA LEU A 966 7.362 -4.494 2.707 1.00 0.00 H new ATOM 0 HB2 LEU A 966 4.965 -3.441 4.244 1.00 0.00 H new ATOM 0 HB3 LEU A 966 6.187 -2.403 3.536 1.00 0.00 H new ATOM 0 HG LEU A 966 4.369 -4.288 2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 966 3.358 -2.190 1.193 1.00 0.00 H new ATOM 0 HD12 LEU A 966 3.219 -2.336 2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 966 4.445 -1.259 2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 966 5.286 -3.208 0.005 1.00 0.00 H new ATOM 0 HD22 LEU A 966 6.422 -2.288 1.020 1.00 0.00 H new ATOM 0 HD23 LEU A 966 6.548 -4.061 0.926 1.00 0.00 H new ATOM 868 N VAL A 967 6.859 -4.195 5.970 1.00 0.00 N ATOM 869 CA VAL A 967 7.477 -3.862 7.242 1.00 0.00 C ATOM 870 C VAL A 967 8.599 -4.840 7.589 1.00 0.00 C ATOM 871 O VAL A 967 9.620 -4.441 8.149 1.00 0.00 O ATOM 872 CB VAL A 967 6.424 -3.828 8.367 1.00 0.00 C ATOM 873 CG1 VAL A 967 7.058 -3.468 9.702 1.00 0.00 C ATOM 874 CG2 VAL A 967 5.320 -2.839 8.012 1.00 0.00 C ATOM 0 H VAL A 967 5.868 -4.427 6.036 1.00 0.00 H new ATOM 0 HA VAL A 967 7.916 -2.869 7.147 1.00 0.00 H new ATOM 0 HB VAL A 967 5.991 -4.823 8.465 1.00 0.00 H new ATOM 0 HG11 VAL A 967 6.291 -3.452 10.476 1.00 0.00 H new ATOM 0 HG12 VAL A 967 7.815 -4.209 9.957 1.00 0.00 H new ATOM 0 HG13 VAL A 967 7.523 -2.485 9.631 1.00 0.00 H new ATOM 0 HG21 VAL A 967 4.579 -2.819 8.811 1.00 0.00 H new ATOM 0 HG22 VAL A 967 5.748 -1.844 7.890 1.00 0.00 H new ATOM 0 HG23 VAL A 967 4.843 -3.145 7.081 1.00 0.00 H new ATOM 884 N GLN A 968 8.422 -6.110 7.233 1.00 0.00 N ATOM 885 CA GLN A 968 9.466 -7.112 7.434 1.00 0.00 C ATOM 886 C GLN A 968 10.732 -6.695 6.695 1.00 0.00 C ATOM 887 O GLN A 968 11.843 -6.799 7.224 1.00 0.00 O ATOM 888 CB GLN A 968 9.005 -8.486 6.942 1.00 0.00 C ATOM 889 CG GLN A 968 10.023 -9.589 7.181 1.00 0.00 C ATOM 890 CD GLN A 968 9.566 -10.932 6.652 1.00 0.00 C ATOM 891 OE1 GLN A 968 9.835 -11.288 5.504 1.00 0.00 O ATOM 892 NE2 GLN A 968 8.860 -11.683 7.479 1.00 0.00 N ATOM 0 H GLN A 968 7.568 -6.469 6.805 1.00 0.00 H new ATOM 0 HA GLN A 968 9.675 -7.182 8.501 1.00 0.00 H new ATOM 0 HB2 GLN A 968 8.073 -8.748 7.442 1.00 0.00 H new ATOM 0 HB3 GLN A 968 8.789 -8.427 5.875 1.00 0.00 H new ATOM 0 HG2 GLN A 968 10.965 -9.317 6.705 1.00 0.00 H new ATOM 0 HG3 GLN A 968 10.218 -9.672 8.250 1.00 0.00 H new ATOM 0 HE21 GLN A 968 8.658 -11.352 8.423 1.00 0.00 H new ATOM 0 HE22 GLN A 968 8.517 -12.594 7.174 1.00 0.00 H new ATOM 901 N GLY A 969 10.551 -6.210 5.472 1.00 0.00 N ATOM 902 CA GLY A 969 11.668 -5.706 4.700 1.00 0.00 C ATOM 903 C GLY A 969 12.249 -4.441 5.302 1.00 0.00 C ATOM 904 O GLY A 969 13.464 -4.254 5.309 1.00 0.00 O ATOM 0 H GLY A 969 9.648 -6.157 5.001 1.00 0.00 H new ATOM 0 HA2 GLY A 969 12.443 -6.470 4.643 1.00 0.00 H new ATOM 0 HA3 GLY A 969 11.342 -5.506 3.679 1.00 0.00 H new ATOM 908 N VAL A 970 11.376 -3.577 5.816 1.00 0.00 N ATOM 909 CA VAL A 970 11.800 -2.319 6.431 1.00 0.00 C ATOM 910 C VAL A 970 12.684 -2.580 7.654 1.00 0.00 C ATOM 911 O VAL A 970 13.667 -1.878 7.885 1.00 0.00 O ATOM 912 CB VAL A 970 10.588 -1.449 6.854 1.00 0.00 C ATOM 913 CG1 VAL A 970 11.049 -0.103 7.386 1.00 0.00 C ATOM 914 CG2 VAL A 970 9.624 -1.249 5.694 1.00 0.00 C ATOM 0 H VAL A 970 10.367 -3.725 5.819 1.00 0.00 H new ATOM 0 HA VAL A 970 12.372 -1.776 5.678 1.00 0.00 H new ATOM 0 HB VAL A 970 10.064 -1.979 7.649 1.00 0.00 H new ATOM 0 HG11 VAL A 970 10.182 0.490 7.676 1.00 0.00 H new ATOM 0 HG12 VAL A 970 11.691 -0.255 8.253 1.00 0.00 H new ATOM 0 HG13 VAL A 970 11.605 0.424 6.611 1.00 0.00 H new ATOM 0 HG21 VAL A 970 8.784 -0.635 6.020 1.00 0.00 H new ATOM 0 HG22 VAL A 970 10.140 -0.751 4.874 1.00 0.00 H new ATOM 0 HG23 VAL A 970 9.256 -2.218 5.356 1.00 0.00 H new ATOM 924 N ARG A 971 12.339 -3.608 8.425 1.00 0.00 N ATOM 925 CA ARG A 971 13.117 -3.959 9.611 1.00 0.00 C ATOM 926 C ARG A 971 14.520 -4.415 9.220 1.00 0.00 C ATOM 927 O ARG A 971 15.488 -4.164 9.940 1.00 0.00 O ATOM 928 CB ARG A 971 12.432 -5.064 10.418 1.00 0.00 C ATOM 929 CG ARG A 971 11.008 -4.742 10.831 1.00 0.00 C ATOM 930 CD ARG A 971 10.436 -5.814 11.748 1.00 0.00 C ATOM 931 NE ARG A 971 10.632 -7.166 11.217 1.00 0.00 N ATOM 932 CZ ARG A 971 9.768 -8.167 11.385 1.00 0.00 C ATOM 933 NH1 ARG A 971 8.590 -7.941 11.955 1.00 0.00 N ATOM 934 NH2 ARG A 971 10.075 -9.385 10.958 1.00 0.00 N ATOM 0 H ARG A 971 11.533 -4.209 8.252 1.00 0.00 H new ATOM 0 HA ARG A 971 13.187 -3.065 10.230 1.00 0.00 H new ATOM 0 HB2 ARG A 971 12.429 -5.980 9.828 1.00 0.00 H new ATOM 0 HB3 ARG A 971 13.022 -5.263 11.313 1.00 0.00 H new ATOM 0 HG2 ARG A 971 10.985 -3.778 11.338 1.00 0.00 H new ATOM 0 HG3 ARG A 971 10.383 -4.650 9.943 1.00 0.00 H new ATOM 0 HD2 ARG A 971 10.908 -5.740 12.728 1.00 0.00 H new ATOM 0 HD3 ARG A 971 9.371 -5.634 11.892 1.00 0.00 H new ATOM 0 HE ARG A 971 11.483 -7.353 10.686 1.00 0.00 H new ATOM 0 HH11 ARG A 971 8.345 -7.000 12.265 1.00 0.00 H new ATOM 0 HH12 ARG A 971 7.930 -8.708 12.083 1.00 0.00 H new ATOM 0 HH21 ARG A 971 10.971 -9.555 10.502 1.00 0.00 H new ATOM 0 HH22 ARG A 971 9.415 -10.152 11.086 1.00 0.00 H new ATOM 948 N GLY A 972 14.623 -5.079 8.076 1.00 0.00 N ATOM 949 CA GLY A 972 15.908 -5.562 7.611 1.00 0.00 C ATOM 950 C GLY A 972 16.755 -4.457 7.012 1.00 0.00 C ATOM 951 O GLY A 972 17.950 -4.361 7.292 1.00 0.00 O ATOM 0 H GLY A 972 13.838 -5.292 7.461 1.00 0.00 H new ATOM 0 HA2 GLY A 972 16.445 -6.018 8.443 1.00 0.00 H new ATOM 0 HA3 GLY A 972 15.753 -6.342 6.866 1.00 0.00 H new ATOM 955 N SER A 973 16.128 -3.610 6.210 1.00 0.00 N ATOM 956 CA SER A 973 16.827 -2.539 5.515 1.00 0.00 C ATOM 957 C SER A 973 17.383 -1.497 6.486 1.00 0.00 C ATOM 958 O SER A 973 18.473 -0.967 6.276 1.00 0.00 O ATOM 959 CB SER A 973 15.885 -1.886 4.508 1.00 0.00 C ATOM 960 OG SER A 973 14.575 -1.787 5.037 1.00 0.00 O ATOM 0 H SER A 973 15.126 -3.645 6.023 1.00 0.00 H new ATOM 0 HA SER A 973 17.678 -2.972 4.990 1.00 0.00 H new ATOM 0 HB2 SER A 973 16.254 -0.893 4.249 1.00 0.00 H new ATOM 0 HB3 SER A 973 15.867 -2.470 3.588 1.00 0.00 H new ATOM 0 HG SER A 973 14.137 -2.663 4.993 1.00 0.00 H new ATOM 966 N GLN A 974 16.638 -1.212 7.552 1.00 0.00 N ATOM 967 CA GLN A 974 17.092 -0.262 8.565 1.00 0.00 C ATOM 968 C GLN A 974 18.345 -0.768 9.276 1.00 0.00 C ATOM 969 O GLN A 974 19.094 0.014 9.862 1.00 0.00 O ATOM 970 CB GLN A 974 15.990 0.014 9.588 1.00 0.00 C ATOM 971 CG GLN A 974 14.874 0.899 9.057 1.00 0.00 C ATOM 972 CD GLN A 974 13.836 1.228 10.111 1.00 0.00 C ATOM 973 OE1 GLN A 974 13.247 2.309 10.099 1.00 0.00 O ATOM 974 NE2 GLN A 974 13.593 0.301 11.024 1.00 0.00 N ATOM 0 H GLN A 974 15.723 -1.623 7.736 1.00 0.00 H new ATOM 0 HA GLN A 974 17.337 0.668 8.052 1.00 0.00 H new ATOM 0 HB2 GLN A 974 15.565 -0.934 9.916 1.00 0.00 H new ATOM 0 HB3 GLN A 974 16.431 0.487 10.466 1.00 0.00 H new ATOM 0 HG2 GLN A 974 15.302 1.825 8.673 1.00 0.00 H new ATOM 0 HG3 GLN A 974 14.388 0.400 8.218 1.00 0.00 H new ATOM 0 HE21 GLN A 974 14.102 -0.583 11.001 1.00 0.00 H new ATOM 0 HE22 GLN A 974 12.897 0.471 11.750 1.00 0.00 H new ATOM 983 N ALA A 975 18.568 -2.071 9.226 1.00 0.00 N ATOM 984 CA ALA A 975 19.756 -2.661 9.820 1.00 0.00 C ATOM 985 C ALA A 975 20.872 -2.770 8.787 1.00 0.00 C ATOM 986 O ALA A 975 21.992 -2.312 9.012 1.00 0.00 O ATOM 987 CB ALA A 975 19.437 -4.025 10.405 1.00 0.00 C ATOM 0 H ALA A 975 17.941 -2.741 8.780 1.00 0.00 H new ATOM 0 HA ALA A 975 20.096 -2.012 10.627 1.00 0.00 H new ATOM 0 HB1 ALA A 975 20.338 -4.452 10.845 1.00 0.00 H new ATOM 0 HB2 ALA A 975 18.671 -3.921 11.174 1.00 0.00 H new ATOM 0 HB3 ALA A 975 19.072 -4.683 9.616 1.00 0.00 H new ATOM 993 N GLN A 976 20.555 -3.368 7.649 1.00 0.00 N ATOM 994 CA GLN A 976 21.523 -3.536 6.577 1.00 0.00 C ATOM 995 C GLN A 976 20.936 -3.077 5.246 1.00 0.00 C ATOM 996 O GLN A 976 20.237 -3.829 4.576 1.00 0.00 O ATOM 997 CB GLN A 976 21.962 -4.998 6.464 1.00 0.00 C ATOM 998 CG GLN A 976 22.711 -5.519 7.678 1.00 0.00 C ATOM 999 CD GLN A 976 23.042 -6.993 7.556 1.00 0.00 C ATOM 1000 OE1 GLN A 976 24.089 -7.368 7.032 1.00 0.00 O ATOM 1001 NE2 GLN A 976 22.151 -7.839 8.041 1.00 0.00 N ATOM 0 H GLN A 976 19.630 -3.747 7.444 1.00 0.00 H new ATOM 0 HA GLN A 976 22.392 -2.923 6.815 1.00 0.00 H new ATOM 0 HB2 GLN A 976 21.081 -5.619 6.301 1.00 0.00 H new ATOM 0 HB3 GLN A 976 22.597 -5.108 5.585 1.00 0.00 H new ATOM 0 HG2 GLN A 976 23.632 -4.951 7.806 1.00 0.00 H new ATOM 0 HG3 GLN A 976 22.109 -5.356 8.572 1.00 0.00 H new ATOM 0 HE21 GLN A 976 21.294 -7.488 8.468 1.00 0.00 H new ATOM 0 HE22 GLN A 976 22.320 -8.844 7.988 1.00 0.00 H new ATOM 1010 N PRO A 977 21.193 -1.824 4.858 1.00 0.00 N ATOM 1011 CA PRO A 977 20.747 -1.299 3.568 1.00 0.00 C ATOM 1012 C PRO A 977 21.635 -1.767 2.419 1.00 0.00 C ATOM 1013 O PRO A 977 21.359 -1.488 1.251 1.00 0.00 O ATOM 1014 CB PRO A 977 20.861 0.214 3.752 1.00 0.00 C ATOM 1015 CG PRO A 977 21.955 0.394 4.747 1.00 0.00 C ATOM 1016 CD PRO A 977 21.909 -0.808 5.654 1.00 0.00 C ATOM 0 HA PRO A 977 19.744 -1.637 3.308 1.00 0.00 H new ATOM 0 HB2 PRO A 977 21.097 0.710 2.811 1.00 0.00 H new ATOM 0 HB3 PRO A 977 19.925 0.641 4.112 1.00 0.00 H new ATOM 0 HG2 PRO A 977 22.923 0.469 4.251 1.00 0.00 H new ATOM 0 HG3 PRO A 977 21.816 1.314 5.315 1.00 0.00 H new ATOM 0 HD2 PRO A 977 22.910 -1.144 5.924 1.00 0.00 H new ATOM 0 HD3 PRO A 977 21.386 -0.587 6.584 1.00 0.00 H new ATOM 1024 N ASP A 978 22.701 -2.483 2.759 1.00 0.00 N ATOM 1025 CA ASP A 978 23.677 -2.926 1.771 1.00 0.00 C ATOM 1026 C ASP A 978 23.558 -4.416 1.491 1.00 0.00 C ATOM 1027 O ASP A 978 24.297 -4.958 0.667 1.00 0.00 O ATOM 1028 CB ASP A 978 25.100 -2.616 2.239 1.00 0.00 C ATOM 1029 CG ASP A 978 25.374 -1.133 2.342 1.00 0.00 C ATOM 1030 OD1 ASP A 978 25.008 -0.526 3.369 1.00 0.00 O ATOM 1031 OD2 ASP A 978 25.954 -0.565 1.395 1.00 0.00 O ATOM 0 H ASP A 978 22.911 -2.770 3.715 1.00 0.00 H new ATOM 0 HA ASP A 978 23.467 -2.381 0.851 1.00 0.00 H new ATOM 0 HB2 ASP A 978 25.267 -3.080 3.211 1.00 0.00 H new ATOM 0 HB3 ASP A 978 25.811 -3.065 1.546 1.00 0.00 H new ATOM 1036 N SER A 979 22.648 -5.089 2.178 1.00 0.00 N ATOM 1037 CA SER A 979 22.470 -6.514 1.980 1.00 0.00 C ATOM 1038 C SER A 979 21.392 -6.774 0.934 1.00 0.00 C ATOM 1039 O SER A 979 20.287 -6.233 1.019 1.00 0.00 O ATOM 1040 CB SER A 979 22.117 -7.195 3.303 1.00 0.00 C ATOM 1041 OG SER A 979 20.991 -6.587 3.905 1.00 0.00 O ATOM 0 H SER A 979 22.027 -4.673 2.872 1.00 0.00 H new ATOM 0 HA SER A 979 23.407 -6.936 1.617 1.00 0.00 H new ATOM 0 HB2 SER A 979 21.914 -8.252 3.129 1.00 0.00 H new ATOM 0 HB3 SER A 979 22.969 -7.142 3.981 1.00 0.00 H new ATOM 0 HG SER A 979 20.688 -7.134 4.659 1.00 0.00 H new ATOM 1047 N PRO A 980 21.704 -7.603 -0.076 1.00 0.00 N ATOM 1048 CA PRO A 980 20.762 -7.927 -1.150 1.00 0.00 C ATOM 1049 C PRO A 980 19.472 -8.532 -0.612 1.00 0.00 C ATOM 1050 O PRO A 980 18.396 -8.316 -1.163 1.00 0.00 O ATOM 1051 CB PRO A 980 21.518 -8.947 -2.005 1.00 0.00 C ATOM 1052 CG PRO A 980 22.956 -8.725 -1.688 1.00 0.00 C ATOM 1053 CD PRO A 980 23.000 -8.282 -0.253 1.00 0.00 C ATOM 0 HA PRO A 980 20.457 -7.040 -1.706 1.00 0.00 H new ATOM 0 HB2 PRO A 980 21.214 -9.966 -1.765 1.00 0.00 H new ATOM 0 HB3 PRO A 980 21.320 -8.797 -3.066 1.00 0.00 H new ATOM 0 HG2 PRO A 980 23.533 -9.639 -1.832 1.00 0.00 H new ATOM 0 HG3 PRO A 980 23.388 -7.969 -2.343 1.00 0.00 H new ATOM 0 HD2 PRO A 980 23.109 -9.127 0.427 1.00 0.00 H new ATOM 0 HD3 PRO A 980 23.837 -7.610 -0.064 1.00 0.00 H new ATOM 1061 N SER A 981 19.591 -9.274 0.481 1.00 0.00 N ATOM 1062 CA SER A 981 18.443 -9.899 1.117 1.00 0.00 C ATOM 1063 C SER A 981 17.436 -8.846 1.578 1.00 0.00 C ATOM 1064 O SER A 981 16.244 -8.957 1.299 1.00 0.00 O ATOM 1065 CB SER A 981 18.910 -10.746 2.301 1.00 0.00 C ATOM 1066 OG SER A 981 19.919 -11.659 1.893 1.00 0.00 O ATOM 0 H SER A 981 20.479 -9.458 0.947 1.00 0.00 H new ATOM 0 HA SER A 981 17.947 -10.542 0.390 1.00 0.00 H new ATOM 0 HB2 SER A 981 19.294 -10.099 3.089 1.00 0.00 H new ATOM 0 HB3 SER A 981 18.065 -11.292 2.720 1.00 0.00 H new ATOM 0 HG SER A 981 20.208 -12.192 2.663 1.00 0.00 H new ATOM 1072 N ALA A 982 17.927 -7.812 2.255 1.00 0.00 N ATOM 1073 CA ALA A 982 17.064 -6.746 2.748 1.00 0.00 C ATOM 1074 C ALA A 982 16.546 -5.892 1.597 1.00 0.00 C ATOM 1075 O ALA A 982 15.397 -5.448 1.608 1.00 0.00 O ATOM 1076 CB ALA A 982 17.806 -5.885 3.758 1.00 0.00 C ATOM 0 H ALA A 982 18.916 -7.691 2.474 1.00 0.00 H new ATOM 0 HA ALA A 982 16.208 -7.203 3.244 1.00 0.00 H new ATOM 0 HB1 ALA A 982 17.147 -5.094 4.116 1.00 0.00 H new ATOM 0 HB2 ALA A 982 18.122 -6.502 4.599 1.00 0.00 H new ATOM 0 HB3 ALA A 982 18.681 -5.441 3.284 1.00 0.00 H new ATOM 1082 N GLN A 983 17.400 -5.676 0.601 1.00 0.00 N ATOM 1083 CA GLN A 983 17.009 -4.927 -0.586 1.00 0.00 C ATOM 1084 C GLN A 983 15.865 -5.627 -1.305 1.00 0.00 C ATOM 1085 O GLN A 983 14.808 -5.038 -1.524 1.00 0.00 O ATOM 1086 CB GLN A 983 18.191 -4.757 -1.541 1.00 0.00 C ATOM 1087 CG GLN A 983 19.282 -3.846 -1.008 1.00 0.00 C ATOM 1088 CD GLN A 983 20.429 -3.690 -1.981 1.00 0.00 C ATOM 1089 OE1 GLN A 983 21.377 -4.474 -1.981 1.00 0.00 O ATOM 1090 NE2 GLN A 983 20.351 -2.669 -2.817 1.00 0.00 N ATOM 0 H GLN A 983 18.364 -6.008 0.593 1.00 0.00 H new ATOM 0 HA GLN A 983 16.678 -3.940 -0.263 1.00 0.00 H new ATOM 0 HB2 GLN A 983 18.619 -5.737 -1.752 1.00 0.00 H new ATOM 0 HB3 GLN A 983 17.827 -4.357 -2.488 1.00 0.00 H new ATOM 0 HG2 GLN A 983 18.858 -2.866 -0.790 1.00 0.00 H new ATOM 0 HG3 GLN A 983 19.659 -4.247 -0.067 1.00 0.00 H new ATOM 0 HE21 GLN A 983 19.547 -2.043 -2.783 1.00 0.00 H new ATOM 0 HE22 GLN A 983 21.095 -2.508 -3.496 1.00 0.00 H new ATOM 1099 N LEU A 984 16.071 -6.893 -1.649 1.00 0.00 N ATOM 1100 CA LEU A 984 15.056 -7.666 -2.353 1.00 0.00 C ATOM 1101 C LEU A 984 13.811 -7.844 -1.494 1.00 0.00 C ATOM 1102 O LEU A 984 12.698 -7.909 -2.017 1.00 0.00 O ATOM 1103 CB LEU A 984 15.601 -9.032 -2.788 1.00 0.00 C ATOM 1104 CG LEU A 984 16.300 -9.062 -4.155 1.00 0.00 C ATOM 1105 CD1 LEU A 984 15.336 -8.645 -5.255 1.00 0.00 C ATOM 1106 CD2 LEU A 984 17.534 -8.172 -4.162 1.00 0.00 C ATOM 0 H LEU A 984 16.931 -7.405 -1.452 1.00 0.00 H new ATOM 0 HA LEU A 984 14.781 -7.107 -3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 984 16.305 -9.380 -2.032 1.00 0.00 H new ATOM 0 HB3 LEU A 984 14.776 -9.744 -2.806 1.00 0.00 H new ATOM 0 HG LEU A 984 16.624 -10.085 -4.344 1.00 0.00 H new ATOM 0 HD11 LEU A 984 15.848 -8.672 -6.217 1.00 0.00 H new ATOM 0 HD12 LEU A 984 14.489 -9.331 -5.276 1.00 0.00 H new ATOM 0 HD13 LEU A 984 14.979 -7.633 -5.062 1.00 0.00 H new ATOM 0 HD21 LEU A 984 18.007 -8.214 -5.143 1.00 0.00 H new ATOM 0 HD22 LEU A 984 17.243 -7.145 -3.943 1.00 0.00 H new ATOM 0 HD23 LEU A 984 18.237 -8.519 -3.405 1.00 0.00 H new ATOM 1118 N ALA A 985 13.998 -7.905 -0.178 1.00 0.00 N ATOM 1119 CA ALA A 985 12.877 -7.985 0.750 1.00 0.00 C ATOM 1120 C ALA A 985 11.949 -6.791 0.567 1.00 0.00 C ATOM 1121 O ALA A 985 10.728 -6.934 0.579 1.00 0.00 O ATOM 1122 CB ALA A 985 13.373 -8.055 2.188 1.00 0.00 C ATOM 0 H ALA A 985 14.915 -7.900 0.268 1.00 0.00 H new ATOM 0 HA ALA A 985 12.319 -8.896 0.535 1.00 0.00 H new ATOM 0 HB1 ALA A 985 12.520 -8.114 2.864 1.00 0.00 H new ATOM 0 HB2 ALA A 985 13.999 -8.939 2.314 1.00 0.00 H new ATOM 0 HB3 ALA A 985 13.956 -7.162 2.416 1.00 0.00 H new ATOM 1128 N LEU A 986 12.536 -5.616 0.388 1.00 0.00 N ATOM 1129 CA LEU A 986 11.767 -4.413 0.114 1.00 0.00 C ATOM 1130 C LEU A 986 11.264 -4.407 -1.322 1.00 0.00 C ATOM 1131 O LEU A 986 10.064 -4.325 -1.564 1.00 0.00 O ATOM 1132 CB LEU A 986 12.608 -3.162 0.362 1.00 0.00 C ATOM 1133 CG LEU A 986 12.786 -2.768 1.826 1.00 0.00 C ATOM 1134 CD1 LEU A 986 13.706 -1.566 1.934 1.00 0.00 C ATOM 1135 CD2 LEU A 986 11.436 -2.463 2.458 1.00 0.00 C ATOM 0 H LEU A 986 13.545 -5.471 0.428 1.00 0.00 H new ATOM 0 HA LEU A 986 10.912 -4.408 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 986 13.594 -3.315 -0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 986 12.150 -2.327 -0.168 1.00 0.00 H new ATOM 0 HG LEU A 986 13.238 -3.602 2.363 1.00 0.00 H new ATOM 0 HD11 LEU A 986 13.826 -1.293 2.982 1.00 0.00 H new ATOM 0 HD12 LEU A 986 14.679 -1.813 1.509 1.00 0.00 H new ATOM 0 HD13 LEU A 986 13.274 -0.727 1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 986 11.578 -2.183 3.502 1.00 0.00 H new ATOM 0 HD22 LEU A 986 10.961 -1.640 1.923 1.00 0.00 H new ATOM 0 HD23 LEU A 986 10.800 -3.347 2.402 1.00 0.00 H new ATOM 1147 N ILE A 987 12.199 -4.511 -2.261 1.00 0.00 N ATOM 1148 CA ILE A 987 11.900 -4.399 -3.689 1.00 0.00 C ATOM 1149 C ILE A 987 10.769 -5.335 -4.116 1.00 0.00 C ATOM 1150 O ILE A 987 9.784 -4.896 -4.713 1.00 0.00 O ATOM 1151 CB ILE A 987 13.157 -4.696 -4.539 1.00 0.00 C ATOM 1152 CG1 ILE A 987 14.270 -3.698 -4.206 1.00 0.00 C ATOM 1153 CG2 ILE A 987 12.824 -4.649 -6.022 1.00 0.00 C ATOM 1154 CD1 ILE A 987 15.615 -4.055 -4.805 1.00 0.00 C ATOM 0 H ILE A 987 13.185 -4.675 -2.056 1.00 0.00 H new ATOM 0 HA ILE A 987 11.576 -3.372 -3.860 1.00 0.00 H new ATOM 0 HB ILE A 987 13.507 -5.700 -4.300 1.00 0.00 H new ATOM 0 HG12 ILE A 987 13.976 -2.710 -4.560 1.00 0.00 H new ATOM 0 HG13 ILE A 987 14.372 -3.631 -3.123 1.00 0.00 H new ATOM 0 HG21 ILE A 987 13.721 -4.861 -6.603 1.00 0.00 H new ATOM 0 HG22 ILE A 987 12.061 -5.395 -6.247 1.00 0.00 H new ATOM 0 HG23 ILE A 987 12.450 -3.658 -6.280 1.00 0.00 H new ATOM 0 HD11 ILE A 987 16.350 -3.301 -4.524 1.00 0.00 H new ATOM 0 HD12 ILE A 987 15.933 -5.028 -4.431 1.00 0.00 H new ATOM 0 HD13 ILE A 987 15.531 -4.093 -5.891 1.00 0.00 H new ATOM 1166 N ALA A 988 10.901 -6.615 -3.790 1.00 0.00 N ATOM 1167 CA ALA A 988 9.925 -7.611 -4.213 1.00 0.00 C ATOM 1168 C ALA A 988 8.581 -7.388 -3.532 1.00 0.00 C ATOM 1169 O ALA A 988 7.538 -7.414 -4.185 1.00 0.00 O ATOM 1170 CB ALA A 988 10.439 -9.015 -3.934 1.00 0.00 C ATOM 0 H ALA A 988 11.672 -6.987 -3.236 1.00 0.00 H new ATOM 0 HA ALA A 988 9.779 -7.502 -5.288 1.00 0.00 H new ATOM 0 HB1 ALA A 988 9.697 -9.745 -4.257 1.00 0.00 H new ATOM 0 HB2 ALA A 988 11.368 -9.177 -4.480 1.00 0.00 H new ATOM 0 HB3 ALA A 988 10.621 -9.130 -2.865 1.00 0.00 H new ATOM 1176 N ALA A 989 8.609 -7.151 -2.224 1.00 0.00 N ATOM 1177 CA ALA A 989 7.382 -6.970 -1.455 1.00 0.00 C ATOM 1178 C ALA A 989 6.660 -5.690 -1.860 1.00 0.00 C ATOM 1179 O ALA A 989 5.434 -5.634 -1.851 1.00 0.00 O ATOM 1180 CB ALA A 989 7.677 -6.961 0.038 1.00 0.00 C ATOM 0 H ALA A 989 9.466 -7.080 -1.675 1.00 0.00 H new ATOM 0 HA ALA A 989 6.727 -7.813 -1.675 1.00 0.00 H new ATOM 0 HB1 ALA A 989 6.748 -6.825 0.592 1.00 0.00 H new ATOM 0 HB2 ALA A 989 8.135 -7.908 0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 989 8.360 -6.144 0.269 1.00 0.00 H new ATOM 1186 N SER A 990 7.423 -4.669 -2.223 1.00 0.00 N ATOM 1187 CA SER A 990 6.839 -3.419 -2.682 1.00 0.00 C ATOM 1188 C SER A 990 6.075 -3.641 -3.983 1.00 0.00 C ATOM 1189 O SER A 990 4.958 -3.163 -4.142 1.00 0.00 O ATOM 1190 CB SER A 990 7.921 -2.356 -2.880 1.00 0.00 C ATOM 1191 OG SER A 990 8.617 -2.110 -1.670 1.00 0.00 O ATOM 0 H SER A 990 8.443 -4.682 -2.209 1.00 0.00 H new ATOM 0 HA SER A 990 6.145 -3.065 -1.920 1.00 0.00 H new ATOM 0 HB2 SER A 990 8.622 -2.684 -3.647 1.00 0.00 H new ATOM 0 HB3 SER A 990 7.467 -1.432 -3.237 1.00 0.00 H new ATOM 0 HG SER A 990 9.305 -2.796 -1.543 1.00 0.00 H new ATOM 1197 N GLN A 991 6.672 -4.399 -4.897 1.00 0.00 N ATOM 1198 CA GLN A 991 6.035 -4.688 -6.176 1.00 0.00 C ATOM 1199 C GLN A 991 4.781 -5.534 -5.985 1.00 0.00 C ATOM 1200 O GLN A 991 3.764 -5.313 -6.650 1.00 0.00 O ATOM 1201 CB GLN A 991 7.008 -5.395 -7.119 1.00 0.00 C ATOM 1202 CG GLN A 991 8.185 -4.530 -7.535 1.00 0.00 C ATOM 1203 CD GLN A 991 9.080 -5.216 -8.545 1.00 0.00 C ATOM 1204 OE1 GLN A 991 8.624 -6.035 -9.343 1.00 0.00 O ATOM 1205 NE2 GLN A 991 10.360 -4.887 -8.521 1.00 0.00 N ATOM 0 H GLN A 991 7.592 -4.822 -4.776 1.00 0.00 H new ATOM 0 HA GLN A 991 5.744 -3.738 -6.623 1.00 0.00 H new ATOM 0 HB2 GLN A 991 7.383 -6.296 -6.633 1.00 0.00 H new ATOM 0 HB3 GLN A 991 6.469 -5.715 -8.011 1.00 0.00 H new ATOM 0 HG2 GLN A 991 7.814 -3.596 -7.958 1.00 0.00 H new ATOM 0 HG3 GLN A 991 8.770 -4.270 -6.653 1.00 0.00 H new ATOM 0 HE21 GLN A 991 10.698 -4.204 -7.844 1.00 0.00 H new ATOM 0 HE22 GLN A 991 11.009 -5.317 -9.180 1.00 0.00 H new ATOM 1214 N SER A 992 4.848 -6.487 -5.061 1.00 0.00 N ATOM 1215 CA SER A 992 3.726 -7.347 -4.773 1.00 0.00 C ATOM 1216 C SER A 992 2.684 -6.616 -3.929 1.00 0.00 C ATOM 1217 O SER A 992 1.609 -7.141 -3.666 1.00 0.00 O ATOM 1218 CB SER A 992 4.218 -8.605 -4.058 1.00 0.00 C ATOM 1219 OG SER A 992 4.982 -8.288 -2.908 1.00 0.00 O ATOM 0 H SER A 992 5.678 -6.677 -4.500 1.00 0.00 H new ATOM 0 HA SER A 992 3.249 -7.634 -5.710 1.00 0.00 H new ATOM 0 HB2 SER A 992 3.364 -9.218 -3.770 1.00 0.00 H new ATOM 0 HB3 SER A 992 4.821 -9.201 -4.743 1.00 0.00 H new ATOM 0 HG SER A 992 4.433 -8.412 -2.106 1.00 0.00 H new ATOM 1225 N PHE A 993 3.019 -5.404 -3.507 1.00 0.00 N ATOM 1226 CA PHE A 993 2.106 -4.566 -2.743 1.00 0.00 C ATOM 1227 C PHE A 993 1.451 -3.532 -3.657 1.00 0.00 C ATOM 1228 O PHE A 993 0.265 -3.233 -3.526 1.00 0.00 O ATOM 1229 CB PHE A 993 2.869 -3.873 -1.609 1.00 0.00 C ATOM 1230 CG PHE A 993 2.033 -2.959 -0.763 1.00 0.00 C ATOM 1231 CD1 PHE A 993 1.233 -3.468 0.244 1.00 0.00 C ATOM 1232 CD2 PHE A 993 2.046 -1.593 -0.977 1.00 0.00 C ATOM 1233 CE1 PHE A 993 0.456 -2.630 1.019 1.00 0.00 C ATOM 1234 CE2 PHE A 993 1.273 -0.749 -0.205 1.00 0.00 C ATOM 1235 CZ PHE A 993 0.495 -1.266 0.808 1.00 0.00 C ATOM 0 H PHE A 993 3.928 -4.976 -3.684 1.00 0.00 H new ATOM 0 HA PHE A 993 1.322 -5.189 -2.312 1.00 0.00 H new ATOM 0 HB2 PHE A 993 3.313 -4.635 -0.968 1.00 0.00 H new ATOM 0 HB3 PHE A 993 3.690 -3.299 -2.038 1.00 0.00 H new ATOM 0 HD1 PHE A 993 1.216 -4.532 0.426 1.00 0.00 H new ATOM 0 HD2 PHE A 993 2.668 -1.181 -1.758 1.00 0.00 H new ATOM 0 HE1 PHE A 993 -0.181 -3.041 1.789 1.00 0.00 H new ATOM 0 HE2 PHE A 993 1.278 0.314 -0.395 1.00 0.00 H new ATOM 0 HZ PHE A 993 -0.084 -0.605 1.436 1.00 0.00 H new ATOM 1245 N LEU A 994 2.242 -3.005 -4.589 1.00 0.00 N ATOM 1246 CA LEU A 994 1.775 -2.004 -5.549 1.00 0.00 C ATOM 1247 C LEU A 994 0.544 -2.482 -6.308 1.00 0.00 C ATOM 1248 O LEU A 994 -0.446 -1.757 -6.427 1.00 0.00 O ATOM 1249 CB LEU A 994 2.881 -1.682 -6.555 1.00 0.00 C ATOM 1250 CG LEU A 994 4.139 -1.038 -5.974 1.00 0.00 C ATOM 1251 CD1 LEU A 994 5.241 -1.015 -7.016 1.00 0.00 C ATOM 1252 CD2 LEU A 994 3.838 0.366 -5.477 1.00 0.00 C ATOM 0 H LEU A 994 3.224 -3.259 -4.701 1.00 0.00 H new ATOM 0 HA LEU A 994 1.510 -1.112 -4.982 1.00 0.00 H new ATOM 0 HB2 LEU A 994 3.168 -2.605 -7.060 1.00 0.00 H new ATOM 0 HB3 LEU A 994 2.473 -1.016 -7.315 1.00 0.00 H new ATOM 0 HG LEU A 994 4.477 -1.632 -5.125 1.00 0.00 H new ATOM 0 HD11 LEU A 994 6.133 -0.554 -6.592 1.00 0.00 H new ATOM 0 HD12 LEU A 994 5.471 -2.035 -7.325 1.00 0.00 H new ATOM 0 HD13 LEU A 994 4.912 -0.440 -7.881 1.00 0.00 H new ATOM 0 HD21 LEU A 994 4.745 0.809 -5.067 1.00 0.00 H new ATOM 0 HD22 LEU A 994 3.479 0.976 -6.306 1.00 0.00 H new ATOM 0 HD23 LEU A 994 3.073 0.321 -4.702 1.00 0.00 H new ATOM 1264 N GLN A 995 0.616 -3.703 -6.824 1.00 0.00 N ATOM 1265 CA GLN A 995 -0.452 -4.233 -7.663 1.00 0.00 C ATOM 1266 C GLN A 995 -1.779 -4.363 -6.899 1.00 0.00 C ATOM 1267 O GLN A 995 -2.764 -3.729 -7.281 1.00 0.00 O ATOM 1268 CB GLN A 995 -0.035 -5.564 -8.297 1.00 0.00 C ATOM 1269 CG GLN A 995 -1.103 -6.158 -9.197 1.00 0.00 C ATOM 1270 CD GLN A 995 -0.586 -7.293 -10.053 1.00 0.00 C ATOM 1271 OE1 GLN A 995 -0.629 -8.457 -9.655 1.00 0.00 O ATOM 1272 NE2 GLN A 995 -0.089 -6.959 -11.230 1.00 0.00 N ATOM 0 H GLN A 995 1.398 -4.342 -6.678 1.00 0.00 H new ATOM 0 HA GLN A 995 -0.624 -3.515 -8.465 1.00 0.00 H new ATOM 0 HB2 GLN A 995 0.876 -5.414 -8.876 1.00 0.00 H new ATOM 0 HB3 GLN A 995 0.203 -6.277 -7.507 1.00 0.00 H new ATOM 0 HG2 GLN A 995 -1.929 -6.519 -8.584 1.00 0.00 H new ATOM 0 HG3 GLN A 995 -1.504 -5.376 -9.842 1.00 0.00 H new ATOM 0 HE21 GLN A 995 -0.074 -5.981 -11.518 1.00 0.00 H new ATOM 0 HE22 GLN A 995 0.280 -7.679 -11.851 1.00 0.00 H new ATOM 1281 N PRO A 996 -1.849 -5.161 -5.806 1.00 0.00 N ATOM 1282 CA PRO A 996 -3.094 -5.320 -5.045 1.00 0.00 C ATOM 1283 C PRO A 996 -3.530 -4.019 -4.381 1.00 0.00 C ATOM 1284 O PRO A 996 -4.723 -3.757 -4.232 1.00 0.00 O ATOM 1285 CB PRO A 996 -2.753 -6.371 -3.990 1.00 0.00 C ATOM 1286 CG PRO A 996 -1.275 -6.319 -3.862 1.00 0.00 C ATOM 1287 CD PRO A 996 -0.755 -5.962 -5.227 1.00 0.00 C ATOM 0 HA PRO A 996 -3.925 -5.610 -5.688 1.00 0.00 H new ATOM 0 HB2 PRO A 996 -3.240 -6.150 -3.040 1.00 0.00 H new ATOM 0 HB3 PRO A 996 -3.088 -7.362 -4.297 1.00 0.00 H new ATOM 0 HG2 PRO A 996 -0.973 -5.577 -3.123 1.00 0.00 H new ATOM 0 HG3 PRO A 996 -0.878 -7.279 -3.531 1.00 0.00 H new ATOM 0 HD2 PRO A 996 0.173 -5.393 -5.168 1.00 0.00 H new ATOM 0 HD3 PRO A 996 -0.547 -6.850 -5.824 1.00 0.00 H new ATOM 1295 N GLY A 997 -2.555 -3.207 -3.991 1.00 0.00 N ATOM 1296 CA GLY A 997 -2.853 -1.917 -3.408 1.00 0.00 C ATOM 1297 C GLY A 997 -3.586 -1.028 -4.389 1.00 0.00 C ATOM 1298 O GLY A 997 -4.607 -0.429 -4.052 1.00 0.00 O ATOM 0 H GLY A 997 -1.561 -3.422 -4.069 1.00 0.00 H new ATOM 0 HA2 GLY A 997 -3.459 -2.051 -2.512 1.00 0.00 H new ATOM 0 HA3 GLY A 997 -1.927 -1.433 -3.097 1.00 0.00 H new ATOM 1302 N GLY A 998 -3.070 -0.964 -5.613 1.00 0.00 N ATOM 1303 CA GLY A 998 -3.703 -0.179 -6.655 1.00 0.00 C ATOM 1304 C GLY A 998 -5.086 -0.691 -6.990 1.00 0.00 C ATOM 1305 O GLY A 998 -5.991 0.095 -7.288 1.00 0.00 O ATOM 0 H GLY A 998 -2.219 -1.446 -5.902 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -3.769 0.861 -6.336 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -3.082 -0.198 -7.551 1.00 0.00 H new ATOM 1309 N LYS A 999 -5.249 -2.013 -6.939 1.00 0.00 N ATOM 1310 CA LYS A 999 -6.555 -2.631 -7.127 1.00 0.00 C ATOM 1311 C LYS A 999 -7.536 -2.101 -6.094 1.00 0.00 C ATOM 1312 O LYS A 999 -8.664 -1.742 -6.424 1.00 0.00 O ATOM 1313 CB LYS A 999 -6.469 -4.154 -6.998 1.00 0.00 C ATOM 1314 CG LYS A 999 -5.606 -4.830 -8.047 1.00 0.00 C ATOM 1315 CD LYS A 999 -5.630 -6.342 -7.882 1.00 0.00 C ATOM 1316 CE LYS A 999 -4.739 -7.038 -8.897 1.00 0.00 C ATOM 1317 NZ LYS A 999 -5.191 -6.815 -10.294 1.00 0.00 N ATOM 0 H LYS A 999 -4.491 -2.674 -6.769 1.00 0.00 H new ATOM 0 HA LYS A 999 -6.900 -2.382 -8.130 1.00 0.00 H new ATOM 0 HB2 LYS A 999 -6.077 -4.400 -6.011 1.00 0.00 H new ATOM 0 HB3 LYS A 999 -7.476 -4.567 -7.054 1.00 0.00 H new ATOM 0 HG2 LYS A 999 -5.962 -4.564 -9.042 1.00 0.00 H new ATOM 0 HG3 LYS A 999 -4.581 -4.468 -7.968 1.00 0.00 H new ATOM 0 HD2 LYS A 999 -5.305 -6.602 -6.875 1.00 0.00 H new ATOM 0 HD3 LYS A 999 -6.653 -6.703 -7.990 1.00 0.00 H new ATOM 0 HE2 LYS A 999 -3.716 -6.677 -8.787 1.00 0.00 H new ATOM 0 HE3 LYS A 999 -4.723 -8.108 -8.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 999 -4.649 -7.428 -10.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 999 -6.203 -7.041 -10.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 999 -5.038 -5.820 -10.554 1.00 0.00 H new ATOM 1331 N MET A1000 -7.092 -2.040 -4.845 1.00 0.00 N ATOM 1332 CA MET A1000 -7.947 -1.599 -3.756 1.00 0.00 C ATOM 1333 C MET A1000 -8.222 -0.104 -3.850 1.00 0.00 C ATOM 1334 O MET A1000 -9.282 0.358 -3.440 1.00 0.00 O ATOM 1335 CB MET A1000 -7.328 -1.945 -2.401 1.00 0.00 C ATOM 1336 CG MET A1000 -8.295 -1.774 -1.239 1.00 0.00 C ATOM 1337 SD MET A1000 -7.613 -2.347 0.329 1.00 0.00 S ATOM 1338 CE MET A1000 -6.230 -1.230 0.515 1.00 0.00 C ATOM 0 H MET A1000 -6.144 -2.291 -4.563 1.00 0.00 H new ATOM 0 HA MET A1000 -8.897 -2.127 -3.843 1.00 0.00 H new ATOM 0 HB2 MET A1000 -6.975 -2.976 -2.423 1.00 0.00 H new ATOM 0 HB3 MET A1000 -6.456 -1.313 -2.235 1.00 0.00 H new ATOM 0 HG2 MET A1000 -8.565 -0.722 -1.149 1.00 0.00 H new ATOM 0 HG3 MET A1000 -9.213 -2.322 -1.453 1.00 0.00 H new ATOM 0 HE1 MET A1000 -6.014 -1.092 1.574 1.00 0.00 H new ATOM 0 HE2 MET A1000 -5.355 -1.649 0.018 1.00 0.00 H new ATOM 0 HE3 MET A1000 -6.477 -0.268 0.066 1.00 0.00 H new ATOM 1348 N VAL A1001 -7.273 0.654 -4.393 1.00 0.00 N ATOM 1349 CA VAL A1001 -7.494 2.075 -4.648 1.00 0.00 C ATOM 1350 C VAL A1001 -8.633 2.249 -5.646 1.00 0.00 C ATOM 1351 O VAL A1001 -9.542 3.058 -5.444 1.00 0.00 O ATOM 1352 CB VAL A1001 -6.227 2.775 -5.191 1.00 0.00 C ATOM 1353 CG1 VAL A1001 -6.502 4.242 -5.489 1.00 0.00 C ATOM 1354 CG2 VAL A1001 -5.075 2.646 -4.208 1.00 0.00 C ATOM 0 H VAL A1001 -6.351 0.312 -4.663 1.00 0.00 H new ATOM 0 HA VAL A1001 -7.750 2.540 -3.696 1.00 0.00 H new ATOM 0 HB VAL A1001 -5.946 2.281 -6.121 1.00 0.00 H new ATOM 0 HG11 VAL A1001 -5.595 4.712 -5.870 1.00 0.00 H new ATOM 0 HG12 VAL A1001 -7.292 4.320 -6.236 1.00 0.00 H new ATOM 0 HG13 VAL A1001 -6.816 4.746 -4.575 1.00 0.00 H new ATOM 0 HG21 VAL A1001 -4.195 3.146 -4.612 1.00 0.00 H new ATOM 0 HG22 VAL A1001 -5.352 3.108 -3.260 1.00 0.00 H new ATOM 0 HG23 VAL A1001 -4.851 1.592 -4.046 1.00 0.00 H new ATOM 1364 N ALA A1002 -8.586 1.460 -6.714 1.00 0.00 N ATOM 1365 CA ALA A1002 -9.631 1.472 -7.727 1.00 0.00 C ATOM 1366 C ALA A1002 -10.943 0.971 -7.140 1.00 0.00 C ATOM 1367 O ALA A1002 -12.005 1.561 -7.362 1.00 0.00 O ATOM 1368 CB ALA A1002 -9.217 0.616 -8.915 1.00 0.00 C ATOM 0 H ALA A1002 -7.830 0.801 -6.900 1.00 0.00 H new ATOM 0 HA ALA A1002 -9.777 2.496 -8.070 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -10.006 0.632 -9.667 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -8.297 1.012 -9.346 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -9.051 -0.409 -8.584 1.00 0.00 H new ATOM 1374 N ALA A1003 -10.853 -0.116 -6.380 1.00 0.00 N ATOM 1375 CA ALA A1003 -12.002 -0.702 -5.706 1.00 0.00 C ATOM 1376 C ALA A1003 -12.662 0.305 -4.779 1.00 0.00 C ATOM 1377 O ALA A1003 -13.886 0.445 -4.769 1.00 0.00 O ATOM 1378 CB ALA A1003 -11.573 -1.931 -4.918 1.00 0.00 C ATOM 0 H ALA A1003 -9.979 -0.615 -6.215 1.00 0.00 H new ATOM 0 HA ALA A1003 -12.728 -0.996 -6.464 1.00 0.00 H new ATOM 0 HB1 ALA A1003 -12.439 -2.363 -4.417 1.00 0.00 H new ATOM 0 HB2 ALA A1003 -11.143 -2.667 -5.597 1.00 0.00 H new ATOM 0 HB3 ALA A1003 -10.829 -1.645 -4.174 1.00 0.00 H new ATOM 1384 N ALA A1004 -11.840 1.000 -4.002 1.00 0.00 N ATOM 1385 CA ALA A1004 -12.318 1.985 -3.047 1.00 0.00 C ATOM 1386 C ALA A1004 -13.170 3.045 -3.736 1.00 0.00 C ATOM 1387 O ALA A1004 -14.338 3.231 -3.399 1.00 0.00 O ATOM 1388 CB ALA A1004 -11.138 2.626 -2.324 1.00 0.00 C ATOM 0 H ALA A1004 -10.826 0.895 -4.018 1.00 0.00 H new ATOM 0 HA ALA A1004 -12.946 1.480 -2.313 1.00 0.00 H new ATOM 0 HB1 ALA A1004 -11.506 3.363 -1.610 1.00 0.00 H new ATOM 0 HB2 ALA A1004 -10.575 1.858 -1.795 1.00 0.00 H new ATOM 0 HB3 ALA A1004 -10.489 3.116 -3.050 1.00 0.00 H new ATOM 1394 N LYS A1005 -12.591 3.700 -4.733 1.00 0.00 N ATOM 1395 CA LYS A1005 -13.266 4.781 -5.443 1.00 0.00 C ATOM 1396 C LYS A1005 -14.545 4.304 -6.124 1.00 0.00 C ATOM 1397 O LYS A1005 -15.535 5.033 -6.176 1.00 0.00 O ATOM 1398 CB LYS A1005 -12.328 5.388 -6.482 1.00 0.00 C ATOM 1399 CG LYS A1005 -11.100 6.042 -5.873 1.00 0.00 C ATOM 1400 CD LYS A1005 -10.149 6.552 -6.941 1.00 0.00 C ATOM 1401 CE LYS A1005 -8.932 7.221 -6.322 1.00 0.00 C ATOM 1402 NZ LYS A1005 -7.943 7.633 -7.351 1.00 0.00 N ATOM 0 H LYS A1005 -11.649 3.501 -5.071 1.00 0.00 H new ATOM 0 HA LYS A1005 -13.541 5.535 -4.706 1.00 0.00 H new ATOM 0 HB2 LYS A1005 -12.010 4.608 -7.174 1.00 0.00 H new ATOM 0 HB3 LYS A1005 -12.874 6.129 -7.066 1.00 0.00 H new ATOM 0 HG2 LYS A1005 -11.407 6.870 -5.234 1.00 0.00 H new ATOM 0 HG3 LYS A1005 -10.582 5.324 -5.237 1.00 0.00 H new ATOM 0 HD2 LYS A1005 -9.829 5.723 -7.572 1.00 0.00 H new ATOM 0 HD3 LYS A1005 -10.669 7.261 -7.585 1.00 0.00 H new ATOM 0 HE2 LYS A1005 -9.249 8.095 -5.752 1.00 0.00 H new ATOM 0 HE3 LYS A1005 -8.460 6.536 -5.618 1.00 0.00 H new ATOM 0 HZ1 LYS A1005 -7.129 8.085 -6.888 1.00 0.00 H new ATOM 0 HZ2 LYS A1005 -7.621 6.796 -7.878 1.00 0.00 H new ATOM 0 HZ3 LYS A1005 -8.386 8.307 -8.008 1.00 0.00 H new ATOM 1416 N ALA A1006 -14.525 3.078 -6.627 1.00 0.00 N ATOM 1417 CA ALA A1006 -15.657 2.537 -7.369 1.00 0.00 C ATOM 1418 C ALA A1006 -16.778 2.072 -6.439 1.00 0.00 C ATOM 1419 O ALA A1006 -17.919 1.903 -6.869 1.00 0.00 O ATOM 1420 CB ALA A1006 -15.196 1.395 -8.262 1.00 0.00 C ATOM 0 H ALA A1006 -13.736 2.438 -6.535 1.00 0.00 H new ATOM 0 HA ALA A1006 -16.062 3.337 -7.989 1.00 0.00 H new ATOM 0 HB1 ALA A1006 -16.048 0.997 -8.813 1.00 0.00 H new ATOM 0 HB2 ALA A1006 -14.449 1.762 -8.966 1.00 0.00 H new ATOM 0 HB3 ALA A1006 -14.760 0.607 -7.648 1.00 0.00 H new ATOM 1426 N SER A1007 -16.459 1.869 -5.169 1.00 0.00 N ATOM 1427 CA SER A1007 -17.448 1.401 -4.207 1.00 0.00 C ATOM 1428 C SER A1007 -18.100 2.570 -3.466 1.00 0.00 C ATOM 1429 O SER A1007 -19.231 2.455 -2.993 1.00 0.00 O ATOM 1430 CB SER A1007 -16.799 0.437 -3.214 1.00 0.00 C ATOM 1431 OG SER A1007 -16.184 -0.651 -3.890 1.00 0.00 O ATOM 0 H SER A1007 -15.528 2.020 -4.781 1.00 0.00 H new ATOM 0 HA SER A1007 -18.231 0.876 -4.754 1.00 0.00 H new ATOM 0 HB2 SER A1007 -16.055 0.968 -2.619 1.00 0.00 H new ATOM 0 HB3 SER A1007 -17.552 0.061 -2.521 1.00 0.00 H new ATOM 0 HG SER A1007 -15.347 -0.350 -4.301 1.00 0.00 H new ATOM 1437 N VAL A1008 -17.390 3.696 -3.393 1.00 0.00 N ATOM 1438 CA VAL A1008 -17.874 4.894 -2.696 1.00 0.00 C ATOM 1439 C VAL A1008 -19.311 5.290 -3.095 1.00 0.00 C ATOM 1440 O VAL A1008 -20.160 5.470 -2.221 1.00 0.00 O ATOM 1441 CB VAL A1008 -16.928 6.100 -2.918 1.00 0.00 C ATOM 1442 CG1 VAL A1008 -17.516 7.376 -2.331 1.00 0.00 C ATOM 1443 CG2 VAL A1008 -15.559 5.826 -2.314 1.00 0.00 C ATOM 0 H VAL A1008 -16.467 3.806 -3.812 1.00 0.00 H new ATOM 0 HA VAL A1008 -17.885 4.630 -1.639 1.00 0.00 H new ATOM 0 HB VAL A1008 -16.815 6.240 -3.993 1.00 0.00 H new ATOM 0 HG11 VAL A1008 -16.830 8.205 -2.502 1.00 0.00 H new ATOM 0 HG12 VAL A1008 -18.471 7.591 -2.810 1.00 0.00 H new ATOM 0 HG13 VAL A1008 -17.669 7.247 -1.260 1.00 0.00 H new ATOM 0 HG21 VAL A1008 -14.909 6.685 -2.481 1.00 0.00 H new ATOM 0 HG22 VAL A1008 -15.662 5.651 -1.243 1.00 0.00 H new ATOM 0 HG23 VAL A1008 -15.123 4.945 -2.785 1.00 0.00 H new ATOM 1453 N PRO A1009 -19.622 5.425 -4.407 1.00 0.00 N ATOM 1454 CA PRO A1009 -20.954 5.868 -4.862 1.00 0.00 C ATOM 1455 C PRO A1009 -22.100 4.966 -4.393 1.00 0.00 C ATOM 1456 O PRO A1009 -23.252 5.396 -4.340 1.00 0.00 O ATOM 1457 CB PRO A1009 -20.850 5.832 -6.392 1.00 0.00 C ATOM 1458 CG PRO A1009 -19.671 4.972 -6.687 1.00 0.00 C ATOM 1459 CD PRO A1009 -18.721 5.186 -5.549 1.00 0.00 C ATOM 0 HA PRO A1009 -21.193 6.849 -4.450 1.00 0.00 H new ATOM 0 HB2 PRO A1009 -21.756 5.423 -6.838 1.00 0.00 H new ATOM 0 HB3 PRO A1009 -20.718 6.834 -6.801 1.00 0.00 H new ATOM 0 HG2 PRO A1009 -19.960 3.924 -6.764 1.00 0.00 H new ATOM 0 HG3 PRO A1009 -19.213 5.247 -7.637 1.00 0.00 H new ATOM 0 HD2 PRO A1009 -18.084 4.317 -5.386 1.00 0.00 H new ATOM 0 HD3 PRO A1009 -18.062 6.035 -5.728 1.00 0.00 H new ATOM 1467 N THR A1010 -21.787 3.724 -4.041 1.00 0.00 N ATOM 1468 CA THR A1010 -22.815 2.773 -3.636 1.00 0.00 C ATOM 1469 C THR A1010 -23.049 2.828 -2.127 1.00 0.00 C ATOM 1470 O THR A1010 -23.943 2.165 -1.598 1.00 0.00 O ATOM 1471 CB THR A1010 -22.444 1.329 -4.028 1.00 0.00 C ATOM 1472 OG1 THR A1010 -21.340 0.870 -3.233 1.00 0.00 O ATOM 1473 CG2 THR A1010 -22.077 1.243 -5.502 1.00 0.00 C ATOM 0 H THR A1010 -20.837 3.354 -4.028 1.00 0.00 H new ATOM 0 HA THR A1010 -23.727 3.059 -4.160 1.00 0.00 H new ATOM 0 HB THR A1010 -23.313 0.696 -3.846 1.00 0.00 H new ATOM 0 HG1 THR A1010 -20.763 1.629 -3.005 1.00 0.00 H new ATOM 0 HG21 THR A1010 -21.819 0.214 -5.753 1.00 0.00 H new ATOM 0 HG22 THR A1010 -22.925 1.563 -6.107 1.00 0.00 H new ATOM 0 HG23 THR A1010 -21.223 1.890 -5.703 1.00 0.00 H new ATOM 1481 N ILE A1011 -22.231 3.607 -1.439 1.00 0.00 N ATOM 1482 CA ILE A1011 -22.331 3.733 0.004 1.00 0.00 C ATOM 1483 C ILE A1011 -23.151 4.961 0.357 1.00 0.00 C ATOM 1484 O ILE A1011 -22.814 6.077 -0.041 1.00 0.00 O ATOM 1485 CB ILE A1011 -20.937 3.832 0.650 1.00 0.00 C ATOM 1486 CG1 ILE A1011 -20.059 2.675 0.173 1.00 0.00 C ATOM 1487 CG2 ILE A1011 -21.044 3.823 2.170 1.00 0.00 C ATOM 1488 CD1 ILE A1011 -18.618 2.787 0.606 1.00 0.00 C ATOM 0 H ILE A1011 -21.487 4.164 -1.860 1.00 0.00 H new ATOM 0 HA ILE A1011 -22.823 2.841 0.392 1.00 0.00 H new ATOM 0 HB ILE A1011 -20.480 4.774 0.347 1.00 0.00 H new ATOM 0 HG12 ILE A1011 -20.471 1.739 0.550 1.00 0.00 H new ATOM 0 HG13 ILE A1011 -20.099 2.625 -0.915 1.00 0.00 H new ATOM 0 HG21 ILE A1011 -20.047 3.894 2.605 1.00 0.00 H new ATOM 0 HG22 ILE A1011 -21.644 4.672 2.498 1.00 0.00 H new ATOM 0 HG23 ILE A1011 -21.517 2.897 2.496 1.00 0.00 H new ATOM 0 HD11 ILE A1011 -18.058 1.931 0.230 1.00 0.00 H new ATOM 0 HD12 ILE A1011 -18.188 3.706 0.206 1.00 0.00 H new ATOM 0 HD13 ILE A1011 -18.566 2.806 1.695 1.00 0.00 H new ATOM 1500 N GLN A1012 -24.231 4.758 1.093 1.00 0.00 N ATOM 1501 CA GLN A1012 -25.127 5.853 1.430 1.00 0.00 C ATOM 1502 C GLN A1012 -24.623 6.587 2.666 1.00 0.00 C ATOM 1503 O GLN A1012 -24.957 7.753 2.892 1.00 0.00 O ATOM 1504 CB GLN A1012 -26.550 5.339 1.649 1.00 0.00 C ATOM 1505 CG GLN A1012 -27.096 4.504 0.492 1.00 0.00 C ATOM 1506 CD GLN A1012 -27.159 5.253 -0.834 1.00 0.00 C ATOM 1507 OE1 GLN A1012 -26.348 6.138 -1.116 1.00 0.00 O ATOM 1508 NE2 GLN A1012 -28.129 4.902 -1.659 1.00 0.00 N ATOM 0 H GLN A1012 -24.508 3.850 1.467 1.00 0.00 H new ATOM 0 HA GLN A1012 -25.146 6.554 0.595 1.00 0.00 H new ATOM 0 HB2 GLN A1012 -26.572 4.739 2.558 1.00 0.00 H new ATOM 0 HB3 GLN A1012 -27.211 6.190 1.813 1.00 0.00 H new ATOM 0 HG2 GLN A1012 -26.471 3.619 0.369 1.00 0.00 H new ATOM 0 HG3 GLN A1012 -28.096 4.155 0.749 1.00 0.00 H new ATOM 0 HE21 GLN A1012 -28.783 4.165 -1.394 1.00 0.00 H new ATOM 0 HE22 GLN A1012 -28.224 5.368 -2.562 1.00 0.00 H new ATOM 1517 N ASP A1013 -23.826 5.893 3.466 1.00 0.00 N ATOM 1518 CA ASP A1013 -23.175 6.508 4.615 1.00 0.00 C ATOM 1519 C ASP A1013 -22.060 7.427 4.145 1.00 0.00 C ATOM 1520 O ASP A1013 -21.063 6.971 3.580 1.00 0.00 O ATOM 1521 CB ASP A1013 -22.606 5.449 5.559 1.00 0.00 C ATOM 1522 CG ASP A1013 -21.941 6.073 6.768 1.00 0.00 C ATOM 1523 OD1 ASP A1013 -22.653 6.476 7.706 1.00 0.00 O ATOM 1524 OD2 ASP A1013 -20.696 6.143 6.791 1.00 0.00 O ATOM 0 H ASP A1013 -23.614 4.903 3.341 1.00 0.00 H new ATOM 0 HA ASP A1013 -23.922 7.086 5.159 1.00 0.00 H new ATOM 0 HB2 ASP A1013 -23.407 4.786 5.886 1.00 0.00 H new ATOM 0 HB3 ASP A1013 -21.883 4.835 5.023 1.00 0.00 H new ATOM 1529 N GLN A1014 -22.241 8.720 4.374 1.00 0.00 N ATOM 1530 CA GLN A1014 -21.300 9.726 3.898 1.00 0.00 C ATOM 1531 C GLN A1014 -19.915 9.510 4.488 1.00 0.00 C ATOM 1532 O GLN A1014 -18.924 9.483 3.762 1.00 0.00 O ATOM 1533 CB GLN A1014 -21.784 11.127 4.265 1.00 0.00 C ATOM 1534 CG GLN A1014 -23.198 11.434 3.808 1.00 0.00 C ATOM 1535 CD GLN A1014 -23.604 12.851 4.148 1.00 0.00 C ATOM 1536 OE1 GLN A1014 -24.112 13.117 5.236 1.00 0.00 O ATOM 1537 NE2 GLN A1014 -23.386 13.767 3.221 1.00 0.00 N ATOM 0 H GLN A1014 -23.035 9.099 4.889 1.00 0.00 H new ATOM 0 HA GLN A1014 -21.241 9.629 2.814 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -21.729 11.247 5.347 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -21.105 11.860 3.829 1.00 0.00 H new ATOM 0 HG2 GLN A1014 -23.273 11.283 2.731 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -23.891 10.735 4.276 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -22.962 13.502 2.332 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -23.642 14.739 3.394 1.00 0.00 H new ATOM 1546 N ALA A1015 -19.861 9.341 5.802 1.00 0.00 N ATOM 1547 CA ALA A1015 -18.598 9.246 6.524 1.00 0.00 C ATOM 1548 C ALA A1015 -17.704 8.137 5.975 1.00 0.00 C ATOM 1549 O ALA A1015 -16.541 8.378 5.642 1.00 0.00 O ATOM 1550 CB ALA A1015 -18.859 9.028 8.004 1.00 0.00 C ATOM 0 H ALA A1015 -20.687 9.266 6.396 1.00 0.00 H new ATOM 0 HA ALA A1015 -18.068 10.188 6.384 1.00 0.00 H new ATOM 0 HB1 ALA A1015 -17.909 8.958 8.535 1.00 0.00 H new ATOM 0 HB2 ALA A1015 -19.435 9.865 8.399 1.00 0.00 H new ATOM 0 HB3 ALA A1015 -19.420 8.104 8.142 1.00 0.00 H new ATOM 1556 N SER A1016 -18.246 6.932 5.874 1.00 0.00 N ATOM 1557 CA SER A1016 -17.480 5.787 5.404 1.00 0.00 C ATOM 1558 C SER A1016 -17.080 5.956 3.941 1.00 0.00 C ATOM 1559 O SER A1016 -15.975 5.586 3.546 1.00 0.00 O ATOM 1560 CB SER A1016 -18.287 4.507 5.600 1.00 0.00 C ATOM 1561 OG SER A1016 -18.750 4.416 6.938 1.00 0.00 O ATOM 0 H SER A1016 -19.215 6.722 6.112 1.00 0.00 H new ATOM 0 HA SER A1016 -16.564 5.719 5.990 1.00 0.00 H new ATOM 0 HB2 SER A1016 -19.134 4.494 4.914 1.00 0.00 H new ATOM 0 HB3 SER A1016 -17.670 3.640 5.362 1.00 0.00 H new ATOM 0 HG SER A1016 -19.693 4.680 6.977 1.00 0.00 H new ATOM 1567 N ALA A1017 -17.971 6.540 3.146 1.00 0.00 N ATOM 1568 CA ALA A1017 -17.689 6.793 1.739 1.00 0.00 C ATOM 1569 C ALA A1017 -16.555 7.806 1.587 1.00 0.00 C ATOM 1570 O ALA A1017 -15.642 7.621 0.780 1.00 0.00 O ATOM 1571 CB ALA A1017 -18.942 7.283 1.028 1.00 0.00 C ATOM 0 H ALA A1017 -18.894 6.847 3.453 1.00 0.00 H new ATOM 0 HA ALA A1017 -17.372 5.857 1.279 1.00 0.00 H new ATOM 0 HB1 ALA A1017 -18.716 7.468 -0.022 1.00 0.00 H new ATOM 0 HB2 ALA A1017 -19.723 6.526 1.103 1.00 0.00 H new ATOM 0 HB3 ALA A1017 -19.286 8.207 1.493 1.00 0.00 H new ATOM 1577 N MET A1018 -16.617 8.871 2.383 1.00 0.00 N ATOM 1578 CA MET A1018 -15.585 9.905 2.372 1.00 0.00 C ATOM 1579 C MET A1018 -14.251 9.330 2.824 1.00 0.00 C ATOM 1580 O MET A1018 -13.225 9.540 2.178 1.00 0.00 O ATOM 1581 CB MET A1018 -15.974 11.070 3.290 1.00 0.00 C ATOM 1582 CG MET A1018 -17.241 11.795 2.868 1.00 0.00 C ATOM 1583 SD MET A1018 -17.699 13.115 4.007 1.00 0.00 S ATOM 1584 CE MET A1018 -19.228 13.684 3.268 1.00 0.00 C ATOM 0 H MET A1018 -17.374 9.041 3.046 1.00 0.00 H new ATOM 0 HA MET A1018 -15.491 10.274 1.351 1.00 0.00 H new ATOM 0 HB2 MET A1018 -16.105 10.692 4.304 1.00 0.00 H new ATOM 0 HB3 MET A1018 -15.152 11.785 3.320 1.00 0.00 H new ATOM 0 HG2 MET A1018 -17.101 12.213 1.871 1.00 0.00 H new ATOM 0 HG3 MET A1018 -18.060 11.078 2.801 1.00 0.00 H new ATOM 0 HE1 MET A1018 -19.985 13.803 4.044 1.00 0.00 H new ATOM 0 HE2 MET A1018 -19.060 14.641 2.775 1.00 0.00 H new ATOM 0 HE3 MET A1018 -19.572 12.954 2.535 1.00 0.00 H new ATOM 1594 N GLN A1019 -14.279 8.592 3.930 1.00 0.00 N ATOM 1595 CA GLN A1019 -13.072 7.996 4.492 1.00 0.00 C ATOM 1596 C GLN A1019 -12.431 7.032 3.497 1.00 0.00 C ATOM 1597 O GLN A1019 -11.217 7.051 3.298 1.00 0.00 O ATOM 1598 CB GLN A1019 -13.403 7.256 5.792 1.00 0.00 C ATOM 1599 CG GLN A1019 -12.178 6.759 6.541 1.00 0.00 C ATOM 1600 CD GLN A1019 -11.326 7.893 7.078 1.00 0.00 C ATOM 1601 OE1 GLN A1019 -11.837 8.957 7.433 1.00 0.00 O ATOM 1602 NE2 GLN A1019 -10.023 7.682 7.130 1.00 0.00 N ATOM 0 H GLN A1019 -15.129 8.392 4.457 1.00 0.00 H new ATOM 0 HA GLN A1019 -12.364 8.797 4.706 1.00 0.00 H new ATOM 0 HB2 GLN A1019 -13.971 7.920 6.443 1.00 0.00 H new ATOM 0 HB3 GLN A1019 -14.047 6.407 5.563 1.00 0.00 H new ATOM 0 HG2 GLN A1019 -12.495 6.124 7.368 1.00 0.00 H new ATOM 0 HG3 GLN A1019 -11.576 6.140 5.876 1.00 0.00 H new ATOM 0 HE21 GLN A1019 -9.639 6.787 6.827 1.00 0.00 H new ATOM 0 HE22 GLN A1019 -9.401 8.414 7.473 1.00 0.00 H new ATOM 1611 N LEU A1020 -13.261 6.206 2.872 1.00 0.00 N ATOM 1612 CA LEU A1020 -12.797 5.230 1.892 1.00 0.00 C ATOM 1613 C LEU A1020 -12.037 5.912 0.758 1.00 0.00 C ATOM 1614 O LEU A1020 -10.939 5.495 0.390 1.00 0.00 O ATOM 1615 CB LEU A1020 -13.993 4.454 1.330 1.00 0.00 C ATOM 1616 CG LEU A1020 -13.657 3.400 0.275 1.00 0.00 C ATOM 1617 CD1 LEU A1020 -12.737 2.340 0.853 1.00 0.00 C ATOM 1618 CD2 LEU A1020 -14.929 2.765 -0.263 1.00 0.00 C ATOM 0 H LEU A1020 -14.269 6.193 3.028 1.00 0.00 H new ATOM 0 HA LEU A1020 -12.116 4.539 2.389 1.00 0.00 H new ATOM 0 HB2 LEU A1020 -14.507 3.964 2.157 1.00 0.00 H new ATOM 0 HB3 LEU A1020 -14.695 5.166 0.896 1.00 0.00 H new ATOM 0 HG LEU A1020 -13.139 3.890 -0.549 1.00 0.00 H new ATOM 0 HD11 LEU A1020 -12.509 1.599 0.087 1.00 0.00 H new ATOM 0 HD12 LEU A1020 -11.812 2.807 1.193 1.00 0.00 H new ATOM 0 HD13 LEU A1020 -13.228 1.852 1.695 1.00 0.00 H new ATOM 0 HD21 LEU A1020 -14.673 2.017 -1.013 1.00 0.00 H new ATOM 0 HD22 LEU A1020 -15.472 2.289 0.554 1.00 0.00 H new ATOM 0 HD23 LEU A1020 -15.556 3.533 -0.716 1.00 0.00 H new ATOM 1630 N SER A1021 -12.623 6.974 0.225 1.00 0.00 N ATOM 1631 CA SER A1021 -12.024 7.710 -0.876 1.00 0.00 C ATOM 1632 C SER A1021 -10.748 8.420 -0.425 1.00 0.00 C ATOM 1633 O SER A1021 -9.763 8.483 -1.166 1.00 0.00 O ATOM 1634 CB SER A1021 -13.033 8.720 -1.426 1.00 0.00 C ATOM 1635 OG SER A1021 -12.488 9.478 -2.495 1.00 0.00 O ATOM 0 H SER A1021 -13.519 7.346 0.541 1.00 0.00 H new ATOM 0 HA SER A1021 -11.755 7.007 -1.664 1.00 0.00 H new ATOM 0 HB2 SER A1021 -13.924 8.194 -1.770 1.00 0.00 H new ATOM 0 HB3 SER A1021 -13.348 9.392 -0.627 1.00 0.00 H new ATOM 0 HG SER A1021 -13.160 10.112 -2.823 1.00 0.00 H new ATOM 1641 N GLN A1022 -10.768 8.943 0.794 1.00 0.00 N ATOM 1642 CA GLN A1022 -9.642 9.699 1.322 1.00 0.00 C ATOM 1643 C GLN A1022 -8.421 8.803 1.506 1.00 0.00 C ATOM 1644 O GLN A1022 -7.320 9.140 1.061 1.00 0.00 O ATOM 1645 CB GLN A1022 -10.020 10.357 2.650 1.00 0.00 C ATOM 1646 CG GLN A1022 -8.997 11.366 3.145 1.00 0.00 C ATOM 1647 CD GLN A1022 -8.910 12.605 2.271 1.00 0.00 C ATOM 1648 OE1 GLN A1022 -9.156 12.556 1.062 1.00 0.00 O ATOM 1649 NE2 GLN A1022 -8.556 13.725 2.874 1.00 0.00 N ATOM 0 H GLN A1022 -11.555 8.857 1.437 1.00 0.00 H new ATOM 0 HA GLN A1022 -9.388 10.477 0.602 1.00 0.00 H new ATOM 0 HB2 GLN A1022 -10.983 10.855 2.537 1.00 0.00 H new ATOM 0 HB3 GLN A1022 -10.148 9.582 3.406 1.00 0.00 H new ATOM 0 HG2 GLN A1022 -9.252 11.664 4.162 1.00 0.00 H new ATOM 0 HG3 GLN A1022 -8.017 10.890 3.188 1.00 0.00 H new ATOM 0 HE21 GLN A1022 -8.361 13.726 3.875 1.00 0.00 H new ATOM 0 HE22 GLN A1022 -8.478 14.590 2.339 1.00 0.00 H new ATOM 1658 N CYS A1023 -8.620 7.662 2.154 1.00 0.00 N ATOM 1659 CA CYS A1023 -7.540 6.709 2.372 1.00 0.00 C ATOM 1660 C CYS A1023 -7.000 6.189 1.043 1.00 0.00 C ATOM 1661 O CYS A1023 -5.791 6.014 0.882 1.00 0.00 O ATOM 1662 CB CYS A1023 -8.022 5.549 3.244 1.00 0.00 C ATOM 1663 SG CYS A1023 -8.530 6.040 4.908 1.00 0.00 S ATOM 0 H CYS A1023 -9.520 7.374 2.538 1.00 0.00 H new ATOM 0 HA CYS A1023 -6.730 7.222 2.891 1.00 0.00 H new ATOM 0 HB2 CYS A1023 -8.861 5.060 2.749 1.00 0.00 H new ATOM 0 HB3 CYS A1023 -7.224 4.811 3.322 1.00 0.00 H new ATOM 0 HG CYS A1023 -9.709 6.586 4.858 1.00 0.00 H new ATOM 1669 N ALA A1024 -7.900 5.973 0.085 1.00 0.00 N ATOM 1670 CA ALA A1024 -7.516 5.503 -1.239 1.00 0.00 C ATOM 1671 C ALA A1024 -6.566 6.487 -1.913 1.00 0.00 C ATOM 1672 O ALA A1024 -5.604 6.085 -2.567 1.00 0.00 O ATOM 1673 CB ALA A1024 -8.747 5.284 -2.105 1.00 0.00 C ATOM 0 H ALA A1024 -8.903 6.117 0.205 1.00 0.00 H new ATOM 0 HA ALA A1024 -6.997 4.552 -1.121 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -8.441 4.933 -3.090 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -9.392 4.539 -1.639 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -9.292 6.223 -2.207 1.00 0.00 H new ATOM 1679 N LYS A1025 -6.832 7.777 -1.737 1.00 0.00 N ATOM 1680 CA LYS A1025 -5.983 8.816 -2.306 1.00 0.00 C ATOM 1681 C LYS A1025 -4.589 8.775 -1.681 1.00 0.00 C ATOM 1682 O LYS A1025 -3.579 8.930 -2.372 1.00 0.00 O ATOM 1683 CB LYS A1025 -6.616 10.196 -2.103 1.00 0.00 C ATOM 1684 CG LYS A1025 -5.786 11.336 -2.672 1.00 0.00 C ATOM 1685 CD LYS A1025 -6.479 12.679 -2.503 1.00 0.00 C ATOM 1686 CE LYS A1025 -6.742 13.003 -1.041 1.00 0.00 C ATOM 1687 NZ LYS A1025 -7.323 14.359 -0.876 1.00 0.00 N ATOM 0 H LYS A1025 -7.629 8.127 -1.205 1.00 0.00 H new ATOM 0 HA LYS A1025 -5.887 8.631 -3.376 1.00 0.00 H new ATOM 0 HB2 LYS A1025 -7.601 10.207 -2.569 1.00 0.00 H new ATOM 0 HB3 LYS A1025 -6.766 10.364 -1.037 1.00 0.00 H new ATOM 0 HG2 LYS A1025 -4.816 11.363 -2.175 1.00 0.00 H new ATOM 0 HG3 LYS A1025 -5.597 11.155 -3.730 1.00 0.00 H new ATOM 0 HD2 LYS A1025 -5.863 13.463 -2.943 1.00 0.00 H new ATOM 0 HD3 LYS A1025 -7.423 12.671 -3.048 1.00 0.00 H new ATOM 0 HE2 LYS A1025 -7.422 12.262 -0.620 1.00 0.00 H new ATOM 0 HE3 LYS A1025 -5.810 12.935 -0.480 1.00 0.00 H new ATOM 0 HZ1 LYS A1025 -7.489 14.545 0.134 1.00 0.00 H new ATOM 0 HZ2 LYS A1025 -6.663 15.068 -1.255 1.00 0.00 H new ATOM 0 HZ3 LYS A1025 -8.225 14.415 -1.391 1.00 0.00 H new ATOM 1701 N ASN A1026 -4.540 8.551 -0.374 1.00 0.00 N ATOM 1702 CA ASN A1026 -3.267 8.441 0.333 1.00 0.00 C ATOM 1703 C ASN A1026 -2.501 7.221 -0.153 1.00 0.00 C ATOM 1704 O ASN A1026 -1.309 7.298 -0.455 1.00 0.00 O ATOM 1705 CB ASN A1026 -3.480 8.332 1.846 1.00 0.00 C ATOM 1706 CG ASN A1026 -4.179 9.537 2.436 1.00 0.00 C ATOM 1707 OD1 ASN A1026 -4.070 10.652 1.922 1.00 0.00 O ATOM 1708 ND2 ASN A1026 -4.884 9.325 3.535 1.00 0.00 N ATOM 0 H ASN A1026 -5.363 8.442 0.218 1.00 0.00 H new ATOM 0 HA ASN A1026 -2.693 9.344 0.125 1.00 0.00 H new ATOM 0 HB2 ASN A1026 -4.066 7.438 2.061 1.00 0.00 H new ATOM 0 HB3 ASN A1026 -2.514 8.205 2.335 1.00 0.00 H new ATOM 0 HD21 ASN A1026 -5.364 10.101 3.991 1.00 0.00 H new ATOM 0 HD22 ASN A1026 -4.948 8.385 3.927 1.00 0.00 H new ATOM 1715 N LEU A1027 -3.204 6.099 -0.232 1.00 0.00 N ATOM 1716 CA LEU A1027 -2.627 4.840 -0.681 1.00 0.00 C ATOM 1717 C LEU A1027 -2.123 4.955 -2.119 1.00 0.00 C ATOM 1718 O LEU A1027 -1.015 4.522 -2.429 1.00 0.00 O ATOM 1719 CB LEU A1027 -3.676 3.730 -0.569 1.00 0.00 C ATOM 1720 CG LEU A1027 -3.208 2.330 -0.964 1.00 0.00 C ATOM 1721 CD1 LEU A1027 -2.061 1.873 -0.074 1.00 0.00 C ATOM 1722 CD2 LEU A1027 -4.370 1.352 -0.882 1.00 0.00 C ATOM 0 H LEU A1027 -4.192 6.037 0.014 1.00 0.00 H new ATOM 0 HA LEU A1027 -1.775 4.596 -0.047 1.00 0.00 H new ATOM 0 HB2 LEU A1027 -4.033 3.696 0.460 1.00 0.00 H new ATOM 0 HB3 LEU A1027 -4.528 3.997 -1.194 1.00 0.00 H new ATOM 0 HG LEU A1027 -2.845 2.361 -1.991 1.00 0.00 H new ATOM 0 HD11 LEU A1027 -1.744 0.874 -0.373 1.00 0.00 H new ATOM 0 HD12 LEU A1027 -1.224 2.565 -0.175 1.00 0.00 H new ATOM 0 HD13 LEU A1027 -2.392 1.853 0.964 1.00 0.00 H new ATOM 0 HD21 LEU A1027 -4.028 0.356 -1.165 1.00 0.00 H new ATOM 0 HD22 LEU A1027 -4.754 1.328 0.138 1.00 0.00 H new ATOM 0 HD23 LEU A1027 -5.162 1.670 -1.560 1.00 0.00 H new ATOM 1734 N GLY A1028 -2.934 5.560 -2.981 1.00 0.00 N ATOM 1735 CA GLY A1028 -2.560 5.735 -4.372 1.00 0.00 C ATOM 1736 C GLY A1028 -1.278 6.531 -4.534 1.00 0.00 C ATOM 1737 O GLY A1028 -0.443 6.210 -5.380 1.00 0.00 O ATOM 0 H GLY A1028 -3.851 5.935 -2.738 1.00 0.00 H new ATOM 0 HA2 GLY A1028 -2.438 4.757 -4.838 1.00 0.00 H new ATOM 0 HA3 GLY A1028 -3.367 6.241 -4.901 1.00 0.00 H new ATOM 1741 N THR A1029 -1.116 7.559 -3.714 1.00 0.00 N ATOM 1742 CA THR A1029 0.081 8.384 -3.762 1.00 0.00 C ATOM 1743 C THR A1029 1.254 7.673 -3.084 1.00 0.00 C ATOM 1744 O THR A1029 2.410 7.832 -3.486 1.00 0.00 O ATOM 1745 CB THR A1029 -0.160 9.744 -3.086 1.00 0.00 C ATOM 1746 OG1 THR A1029 -1.413 10.287 -3.525 1.00 0.00 O ATOM 1747 CG2 THR A1029 0.956 10.722 -3.417 1.00 0.00 C ATOM 0 H THR A1029 -1.797 7.841 -3.009 1.00 0.00 H new ATOM 0 HA THR A1029 0.325 8.553 -4.811 1.00 0.00 H new ATOM 0 HB THR A1029 -0.179 9.590 -2.007 1.00 0.00 H new ATOM 0 HG1 THR A1029 -2.148 9.802 -3.095 1.00 0.00 H new ATOM 0 HG21 THR A1029 0.761 11.676 -2.927 1.00 0.00 H new ATOM 0 HG22 THR A1029 1.907 10.321 -3.066 1.00 0.00 H new ATOM 0 HG23 THR A1029 1.001 10.871 -4.496 1.00 0.00 H new ATOM 1755 N ALA A1030 0.947 6.881 -2.060 1.00 0.00 N ATOM 1756 CA ALA A1030 1.954 6.082 -1.376 1.00 0.00 C ATOM 1757 C ALA A1030 2.583 5.091 -2.347 1.00 0.00 C ATOM 1758 O ALA A1030 3.803 4.927 -2.392 1.00 0.00 O ATOM 1759 CB ALA A1030 1.334 5.350 -0.194 1.00 0.00 C ATOM 0 H ALA A1030 0.004 6.777 -1.686 1.00 0.00 H new ATOM 0 HA ALA A1030 2.734 6.744 -1.000 1.00 0.00 H new ATOM 0 HB1 ALA A1030 2.098 4.757 0.308 1.00 0.00 H new ATOM 0 HB2 ALA A1030 0.919 6.075 0.506 1.00 0.00 H new ATOM 0 HB3 ALA A1030 0.540 4.693 -0.549 1.00 0.00 H new ATOM 1765 N LEU A1031 1.734 4.448 -3.137 1.00 0.00 N ATOM 1766 CA LEU A1031 2.187 3.506 -4.149 1.00 0.00 C ATOM 1767 C LEU A1031 2.987 4.223 -5.225 1.00 0.00 C ATOM 1768 O LEU A1031 3.954 3.685 -5.751 1.00 0.00 O ATOM 1769 CB LEU A1031 0.991 2.797 -4.782 1.00 0.00 C ATOM 1770 CG LEU A1031 0.099 2.039 -3.803 1.00 0.00 C ATOM 1771 CD1 LEU A1031 -1.094 1.447 -4.526 1.00 0.00 C ATOM 1772 CD2 LEU A1031 0.887 0.953 -3.091 1.00 0.00 C ATOM 0 H LEU A1031 0.721 4.563 -3.095 1.00 0.00 H new ATOM 0 HA LEU A1031 2.828 2.767 -3.668 1.00 0.00 H new ATOM 0 HB2 LEU A1031 0.385 3.536 -5.305 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.358 2.097 -5.533 1.00 0.00 H new ATOM 0 HG LEU A1031 -0.266 2.741 -3.053 1.00 0.00 H new ATOM 0 HD11 LEU A1031 -1.721 0.909 -3.814 1.00 0.00 H new ATOM 0 HD12 LEU A1031 -1.673 2.247 -4.988 1.00 0.00 H new ATOM 0 HD13 LEU A1031 -0.747 0.758 -5.297 1.00 0.00 H new ATOM 0 HD21 LEU A1031 0.233 0.424 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.282 0.250 -3.824 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.712 1.404 -2.539 1.00 0.00 H new ATOM 1784 N ALA A1032 2.580 5.450 -5.528 1.00 0.00 N ATOM 1785 CA ALA A1032 3.230 6.259 -6.552 1.00 0.00 C ATOM 1786 C ALA A1032 4.731 6.390 -6.292 1.00 0.00 C ATOM 1787 O ALA A1032 5.551 6.170 -7.187 1.00 0.00 O ATOM 1788 CB ALA A1032 2.576 7.635 -6.609 1.00 0.00 C ATOM 0 H ALA A1032 1.792 5.911 -5.072 1.00 0.00 H new ATOM 0 HA ALA A1032 3.107 5.760 -7.513 1.00 0.00 H new ATOM 0 HB1 ALA A1032 3.063 8.238 -7.375 1.00 0.00 H new ATOM 0 HB2 ALA A1032 1.519 7.526 -6.851 1.00 0.00 H new ATOM 0 HB3 ALA A1032 2.677 8.126 -5.641 1.00 0.00 H new ATOM 1794 N GLU A1033 5.091 6.728 -5.062 1.00 0.00 N ATOM 1795 CA GLU A1033 6.491 6.923 -4.713 1.00 0.00 C ATOM 1796 C GLU A1033 7.187 5.595 -4.421 1.00 0.00 C ATOM 1797 O GLU A1033 8.367 5.427 -4.733 1.00 0.00 O ATOM 1798 CB GLU A1033 6.616 7.880 -3.529 1.00 0.00 C ATOM 1799 CG GLU A1033 5.738 7.524 -2.342 1.00 0.00 C ATOM 1800 CD GLU A1033 5.735 8.613 -1.296 1.00 0.00 C ATOM 1801 OE1 GLU A1033 6.749 8.757 -0.578 1.00 0.00 O ATOM 1802 OE2 GLU A1033 4.714 9.310 -1.165 1.00 0.00 O ATOM 0 H GLU A1033 4.437 6.872 -4.293 1.00 0.00 H new ATOM 0 HA GLU A1033 6.992 7.369 -5.572 1.00 0.00 H new ATOM 0 HB2 GLU A1033 7.656 7.902 -3.203 1.00 0.00 H new ATOM 0 HB3 GLU A1033 6.365 8.887 -3.863 1.00 0.00 H new ATOM 0 HG2 GLU A1033 4.719 7.347 -2.685 1.00 0.00 H new ATOM 0 HG3 GLU A1033 6.090 6.594 -1.896 1.00 0.00 H new ATOM 1809 N LEU A1034 6.457 4.654 -3.833 1.00 0.00 N ATOM 1810 CA LEU A1034 7.001 3.330 -3.546 1.00 0.00 C ATOM 1811 C LEU A1034 7.374 2.615 -4.845 1.00 0.00 C ATOM 1812 O LEU A1034 8.427 1.984 -4.942 1.00 0.00 O ATOM 1813 CB LEU A1034 5.981 2.501 -2.763 1.00 0.00 C ATOM 1814 CG LEU A1034 6.451 1.111 -2.333 1.00 0.00 C ATOM 1815 CD1 LEU A1034 7.601 1.218 -1.341 1.00 0.00 C ATOM 1816 CD2 LEU A1034 5.296 0.324 -1.733 1.00 0.00 C ATOM 0 H LEU A1034 5.487 4.782 -3.545 1.00 0.00 H new ATOM 0 HA LEU A1034 7.901 3.446 -2.942 1.00 0.00 H new ATOM 0 HB2 LEU A1034 5.693 3.059 -1.872 1.00 0.00 H new ATOM 0 HB3 LEU A1034 5.085 2.389 -3.373 1.00 0.00 H new ATOM 0 HG LEU A1034 6.810 0.579 -3.214 1.00 0.00 H new ATOM 0 HD11 LEU A1034 7.922 0.219 -1.047 1.00 0.00 H new ATOM 0 HD12 LEU A1034 8.435 1.744 -1.806 1.00 0.00 H new ATOM 0 HD13 LEU A1034 7.271 1.768 -0.459 1.00 0.00 H new ATOM 0 HD21 LEU A1034 5.646 -0.663 -1.432 1.00 0.00 H new ATOM 0 HD22 LEU A1034 4.909 0.853 -0.862 1.00 0.00 H new ATOM 0 HD23 LEU A1034 4.504 0.217 -2.475 1.00 0.00 H new ATOM 1828 N ARG A1035 6.505 2.739 -5.838 1.00 0.00 N ATOM 1829 CA ARG A1035 6.720 2.149 -7.155 1.00 0.00 C ATOM 1830 C ARG A1035 8.005 2.676 -7.782 1.00 0.00 C ATOM 1831 O ARG A1035 8.854 1.904 -8.229 1.00 0.00 O ATOM 1832 CB ARG A1035 5.530 2.472 -8.056 1.00 0.00 C ATOM 1833 CG ARG A1035 5.630 1.917 -9.467 1.00 0.00 C ATOM 1834 CD ARG A1035 4.460 2.387 -10.318 1.00 0.00 C ATOM 1835 NE ARG A1035 3.173 2.052 -9.707 1.00 0.00 N ATOM 1836 CZ ARG A1035 2.225 2.943 -9.417 1.00 0.00 C ATOM 1837 NH1 ARG A1035 2.402 4.227 -9.687 1.00 0.00 N ATOM 1838 NH2 ARG A1035 1.096 2.541 -8.855 1.00 0.00 N ATOM 0 H ARG A1035 5.628 3.253 -5.754 1.00 0.00 H new ATOM 0 HA ARG A1035 6.814 1.069 -7.044 1.00 0.00 H new ATOM 0 HB2 ARG A1035 4.624 2.083 -7.591 1.00 0.00 H new ATOM 0 HB3 ARG A1035 5.419 3.555 -8.114 1.00 0.00 H new ATOM 0 HG2 ARG A1035 6.568 2.236 -9.922 1.00 0.00 H new ATOM 0 HG3 ARG A1035 5.646 0.828 -9.434 1.00 0.00 H new ATOM 0 HD2 ARG A1035 4.525 3.466 -10.460 1.00 0.00 H new ATOM 0 HD3 ARG A1035 4.523 1.931 -11.306 1.00 0.00 H new ATOM 0 HE ARG A1035 2.989 1.073 -9.489 1.00 0.00 H new ATOM 0 HH11 ARG A1035 3.270 4.542 -10.121 1.00 0.00 H new ATOM 0 HH12 ARG A1035 1.671 4.901 -9.461 1.00 0.00 H new ATOM 0 HH21 ARG A1035 0.954 1.553 -8.646 1.00 0.00 H new ATOM 0 HH22 ARG A1035 0.368 3.219 -8.631 1.00 0.00 H new ATOM 1852 N THR A1036 8.137 3.994 -7.799 1.00 0.00 N ATOM 1853 CA THR A1036 9.294 4.650 -8.388 1.00 0.00 C ATOM 1854 C THR A1036 10.585 4.233 -7.678 1.00 0.00 C ATOM 1855 O THR A1036 11.641 4.100 -8.304 1.00 0.00 O ATOM 1856 CB THR A1036 9.134 6.181 -8.320 1.00 0.00 C ATOM 1857 OG1 THR A1036 7.837 6.554 -8.812 1.00 0.00 O ATOM 1858 CG2 THR A1036 10.206 6.885 -9.140 1.00 0.00 C ATOM 0 H THR A1036 7.448 4.636 -7.407 1.00 0.00 H new ATOM 0 HA THR A1036 9.358 4.341 -9.431 1.00 0.00 H new ATOM 0 HB THR A1036 9.241 6.486 -7.279 1.00 0.00 H new ATOM 0 HG1 THR A1036 7.176 6.461 -8.095 1.00 0.00 H new ATOM 0 HG21 THR A1036 10.066 7.964 -9.072 1.00 0.00 H new ATOM 0 HG22 THR A1036 11.191 6.622 -8.754 1.00 0.00 H new ATOM 0 HG23 THR A1036 10.130 6.574 -10.182 1.00 0.00 H new ATOM 1866 N ALA A1037 10.487 4.008 -6.376 1.00 0.00 N ATOM 1867 CA ALA A1037 11.639 3.610 -5.584 1.00 0.00 C ATOM 1868 C ALA A1037 12.032 2.166 -5.871 1.00 0.00 C ATOM 1869 O ALA A1037 13.176 1.889 -6.227 1.00 0.00 O ATOM 1870 CB ALA A1037 11.349 3.798 -4.102 1.00 0.00 C ATOM 0 H ALA A1037 9.620 4.095 -5.846 1.00 0.00 H new ATOM 0 HA ALA A1037 12.478 4.247 -5.863 1.00 0.00 H new ATOM 0 HB1 ALA A1037 12.220 3.496 -3.520 1.00 0.00 H new ATOM 0 HB2 ALA A1037 11.126 4.847 -3.905 1.00 0.00 H new ATOM 0 HB3 ALA A1037 10.493 3.186 -3.818 1.00 0.00 H new ATOM 1876 N ALA A1038 11.070 1.256 -5.741 1.00 0.00 N ATOM 1877 CA ALA A1038 11.329 -0.173 -5.903 1.00 0.00 C ATOM 1878 C ALA A1038 11.823 -0.505 -7.306 1.00 0.00 C ATOM 1879 O ALA A1038 12.681 -1.370 -7.480 1.00 0.00 O ATOM 1880 CB ALA A1038 10.078 -0.979 -5.590 1.00 0.00 C ATOM 0 H ALA A1038 10.100 1.484 -5.523 1.00 0.00 H new ATOM 0 HA ALA A1038 12.117 -0.441 -5.199 1.00 0.00 H new ATOM 0 HB1 ALA A1038 10.289 -2.041 -5.716 1.00 0.00 H new ATOM 0 HB2 ALA A1038 9.771 -0.789 -4.562 1.00 0.00 H new ATOM 0 HB3 ALA A1038 9.277 -0.685 -6.268 1.00 0.00 H new ATOM 1886 N GLN A1039 11.279 0.186 -8.299 1.00 0.00 N ATOM 1887 CA GLN A1039 11.648 -0.057 -9.686 1.00 0.00 C ATOM 1888 C GLN A1039 13.126 0.243 -9.917 1.00 0.00 C ATOM 1889 O GLN A1039 13.859 -0.582 -10.465 1.00 0.00 O ATOM 1890 CB GLN A1039 10.787 0.793 -10.625 1.00 0.00 C ATOM 1891 CG GLN A1039 11.066 0.538 -12.095 1.00 0.00 C ATOM 1892 CD GLN A1039 10.183 1.358 -13.012 1.00 0.00 C ATOM 1893 OE1 GLN A1039 9.776 2.471 -12.677 1.00 0.00 O ATOM 1894 NE2 GLN A1039 9.883 0.813 -14.178 1.00 0.00 N ATOM 0 H GLN A1039 10.581 0.919 -8.169 1.00 0.00 H new ATOM 0 HA GLN A1039 11.472 -1.111 -9.902 1.00 0.00 H new ATOM 0 HB2 GLN A1039 9.735 0.592 -10.422 1.00 0.00 H new ATOM 0 HB3 GLN A1039 10.958 1.847 -10.408 1.00 0.00 H new ATOM 0 HG2 GLN A1039 12.111 0.765 -12.306 1.00 0.00 H new ATOM 0 HG3 GLN A1039 10.920 -0.521 -12.309 1.00 0.00 H new ATOM 0 HE21 GLN A1039 10.241 -0.112 -14.416 1.00 0.00 H new ATOM 0 HE22 GLN A1039 9.293 1.317 -14.840 1.00 0.00 H new ATOM 1903 N LYS A1040 13.565 1.415 -9.473 1.00 0.00 N ATOM 1904 CA LYS A1040 14.940 1.842 -9.691 1.00 0.00 C ATOM 1905 C LYS A1040 15.897 1.144 -8.728 1.00 0.00 C ATOM 1906 O LYS A1040 17.071 0.955 -9.039 1.00 0.00 O ATOM 1907 CB LYS A1040 15.061 3.359 -9.562 1.00 0.00 C ATOM 1908 CG LYS A1040 14.271 4.110 -10.621 1.00 0.00 C ATOM 1909 CD LYS A1040 14.596 5.594 -10.623 1.00 0.00 C ATOM 1910 CE LYS A1040 14.130 6.287 -9.353 1.00 0.00 C ATOM 1911 NZ LYS A1040 14.426 7.742 -9.390 1.00 0.00 N ATOM 0 H LYS A1040 12.990 2.084 -8.961 1.00 0.00 H new ATOM 0 HA LYS A1040 15.219 1.557 -10.705 1.00 0.00 H new ATOM 0 HB2 LYS A1040 14.714 3.663 -8.574 1.00 0.00 H new ATOM 0 HB3 LYS A1040 16.111 3.641 -9.632 1.00 0.00 H new ATOM 0 HG2 LYS A1040 14.488 3.689 -11.603 1.00 0.00 H new ATOM 0 HG3 LYS A1040 13.204 3.972 -10.444 1.00 0.00 H new ATOM 0 HD2 LYS A1040 15.672 5.728 -10.734 1.00 0.00 H new ATOM 0 HD3 LYS A1040 14.125 6.066 -11.486 1.00 0.00 H new ATOM 0 HE2 LYS A1040 13.058 6.135 -9.226 1.00 0.00 H new ATOM 0 HE3 LYS A1040 14.620 5.836 -8.490 1.00 0.00 H new ATOM 0 HZ1 LYS A1040 14.096 8.186 -8.509 1.00 0.00 H new ATOM 0 HZ2 LYS A1040 15.452 7.885 -9.487 1.00 0.00 H new ATOM 0 HZ3 LYS A1040 13.938 8.175 -10.200 1.00 0.00 H new ATOM 1925 N ALA A1041 15.392 0.748 -7.568 1.00 0.00 N ATOM 1926 CA ALA A1041 16.206 0.046 -6.585 1.00 0.00 C ATOM 1927 C ALA A1041 16.575 -1.349 -7.078 1.00 0.00 C ATOM 1928 O ALA A1041 17.594 -1.913 -6.681 1.00 0.00 O ATOM 1929 CB ALA A1041 15.478 -0.038 -5.252 1.00 0.00 C ATOM 0 H ALA A1041 14.424 0.900 -7.285 1.00 0.00 H new ATOM 0 HA ALA A1041 17.127 0.611 -6.444 1.00 0.00 H new ATOM 0 HB1 ALA A1041 16.101 -0.566 -4.530 1.00 0.00 H new ATOM 0 HB2 ALA A1041 15.271 0.968 -4.886 1.00 0.00 H new ATOM 0 HB3 ALA A1041 14.539 -0.576 -5.383 1.00 0.00 H new ATOM 1935 N GLN A1042 15.742 -1.896 -7.952 1.00 0.00 N ATOM 1936 CA GLN A1042 15.960 -3.232 -8.485 1.00 0.00 C ATOM 1937 C GLN A1042 17.014 -3.208 -9.594 1.00 0.00 C ATOM 1938 O GLN A1042 17.660 -4.216 -9.877 1.00 0.00 O ATOM 1939 CB GLN A1042 14.645 -3.797 -9.014 1.00 0.00 C ATOM 1940 CG GLN A1042 14.697 -5.278 -9.353 1.00 0.00 C ATOM 1941 CD GLN A1042 13.357 -5.799 -9.827 1.00 0.00 C ATOM 1942 OE1 GLN A1042 12.573 -5.067 -10.431 1.00 0.00 O ATOM 1943 NE2 GLN A1042 13.075 -7.061 -9.554 1.00 0.00 N ATOM 0 H GLN A1042 14.906 -1.432 -8.308 1.00 0.00 H new ATOM 0 HA GLN A1042 16.327 -3.873 -7.683 1.00 0.00 H new ATOM 0 HB2 GLN A1042 13.866 -3.633 -8.270 1.00 0.00 H new ATOM 0 HB3 GLN A1042 14.356 -3.241 -9.906 1.00 0.00 H new ATOM 0 HG2 GLN A1042 15.446 -5.447 -10.127 1.00 0.00 H new ATOM 0 HG3 GLN A1042 15.014 -5.840 -8.475 1.00 0.00 H new ATOM 0 HE21 GLN A1042 13.750 -7.637 -9.051 1.00 0.00 H new ATOM 0 HE22 GLN A1042 12.182 -7.459 -9.846 1.00 0.00 H new ATOM 1952 N GLU A1043 17.196 -2.044 -10.205 1.00 0.00 N ATOM 1953 CA GLU A1043 18.138 -1.897 -11.306 1.00 0.00 C ATOM 1954 C GLU A1043 19.399 -1.164 -10.852 1.00 0.00 C ATOM 1955 O GLU A1043 20.150 -0.626 -11.673 1.00 0.00 O ATOM 1956 CB GLU A1043 17.481 -1.143 -12.464 1.00 0.00 C ATOM 1957 CG GLU A1043 16.920 0.209 -12.062 1.00 0.00 C ATOM 1958 CD GLU A1043 16.437 1.016 -13.242 1.00 0.00 C ATOM 1959 OE1 GLU A1043 15.271 0.830 -13.649 1.00 0.00 O ATOM 1960 OE2 GLU A1043 17.215 1.837 -13.769 1.00 0.00 O ATOM 0 H GLU A1043 16.702 -1.187 -9.956 1.00 0.00 H new ATOM 0 HA GLU A1043 18.424 -2.893 -11.645 1.00 0.00 H new ATOM 0 HB2 GLU A1043 18.214 -1.002 -13.258 1.00 0.00 H new ATOM 0 HB3 GLU A1043 16.678 -1.754 -12.876 1.00 0.00 H new ATOM 0 HG2 GLU A1043 16.094 0.062 -11.366 1.00 0.00 H new ATOM 0 HG3 GLU A1043 17.688 0.773 -11.532 1.00 0.00 H new ATOM 1967 N ALA A1044 19.633 -1.149 -9.548 1.00 0.00 N ATOM 1968 CA ALA A1044 20.810 -0.499 -8.992 1.00 0.00 C ATOM 1969 C ALA A1044 21.338 -1.275 -7.793 1.00 0.00 C ATOM 1970 O ALA A1044 20.961 -0.944 -6.646 1.00 0.00 O ATOM 1971 CB ALA A1044 20.491 0.939 -8.613 1.00 0.00 C ATOM 1972 OXT ALA A1044 22.110 -2.231 -8.002 1.00 0.00 O ATOM 0 H ALA A1044 19.022 -1.580 -8.854 1.00 0.00 H new ATOM 0 HA ALA A1044 21.591 -0.486 -9.752 1.00 0.00 H new ATOM 0 HB1 ALA A1044 21.381 1.412 -8.199 1.00 0.00 H new ATOM 0 HB2 ALA A1044 20.169 1.486 -9.499 1.00 0.00 H new ATOM 0 HB3 ALA A1044 19.694 0.951 -7.869 1.00 0.00 H new TER 1978 ALA A1044