USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=30 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= 0.869 K(o=1.6,f=-0.57) USER MOD Set 1.2: A1042 GLN : amide:sc= 0.774 K(o=1.6,f=-1.2) USER MOD Set 2.1: A1022 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.32) USER MOD Set 2.2: A1025 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 973 SER OG : rot -98:sc= 2.06 USER MOD Set 3.2: A 983 GLN : amide:sc= -0.702 K(o=1.4,f=-1.4!) USER MOD Single : A 912 THR OG1 : rot -170:sc= -0.229 USER MOD Single : A 915 GLN : amide:sc= 0.102 K(o=0.1,f=-5.9!) USER MOD Single : A 919 HIS : no HD1:sc= -0.0188 X(o=-0.019,f=-0.4) USER MOD Single : A 922 LYS NZ :NH3+ 174:sc=-0.00955 (180deg=-0.0924) USER MOD Single : A 923 GLN : amide:sc= -1.05 X(o=-1.1,f=-0.88) USER MOD Single : A 927 SER OG : rot 80:sc= 1.13 USER MOD Single : A 929 THR OG1 : rot 90:sc= 1.22 USER MOD Single : A 930 GLN : amide:sc= -0.221 K(o=-0.22,f=-1.1) USER MOD Single : A 931 THR OG1 : rot 71:sc= 0.658 USER MOD Single : A 936 GLN : amide:sc= -0.0196 X(o=-0.02,f=-0.34) USER MOD Single : A 937 HIS : no HE2:sc= 1.22 K(o=1.2,f=-4.8!) USER MOD Single : A 940 SER OG : rot -16:sc= 0.374 USER MOD Single : A 943 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 945 SER OG : rot 30:sc= 1.23 USER MOD Single : A 949 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 954 GLN :FLIP amide:sc= -0.0482 F(o=-1.6,f=-0.048) USER MOD Single : A 955 SER OG : rot 180:sc= -0.0781 USER MOD Single : A 956 CYS SG : rot -36:sc= -1.6 USER MOD Single : A 957 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0336) USER MOD Single : A 962 GLN :FLIP amide:sc= -0.0696 F(o=-1.2,f=-0.07) USER MOD Single : A 968 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 974 GLN :FLIP amide:sc= -0.359 F(o=-2.1,f=-0.36) USER MOD Single : A 976 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 979 SER OG : rot 180:sc= 0.215 USER MOD Single : A 981 SER OG : rot 180:sc= 0 USER MOD Single : A 990 SER OG : rot 69:sc= 1.29 USER MOD Single : A 992 SER OG : rot 86:sc= 0.0792 USER MOD Single : A 995 GLN : amide:sc=-2.32e-05 K(o=-2.3e-05,f=-1.1) USER MOD Single : A 999 LYS NZ :NH3+ -166:sc= -0.0406 (180deg=-0.234) USER MOD Single : A1000 MET CE :methyl 154:sc= -0.628 (180deg=-2.36) USER MOD Single : A1005 LYS NZ :NH3+ -165:sc= -0.0352 (180deg=-0.249) USER MOD Single : A1007 SER OG : rot -110:sc= -0.099 USER MOD Single : A1010 THR OG1 : rot -1:sc= 1.22 USER MOD Single : A1012 GLN : amide:sc= -0.9 K(o=-0.9,f=-1.9!) USER MOD Single : A1014 GLN : amide:sc= -0.0132 K(o=-0.013,f=-0.57) USER MOD Single : A1016 SER OG : rot 180:sc= 0 USER MOD Single : A1018 MET CE :methyl 162:sc= -0.0514 (180deg=-0.397) USER MOD Single : A1019 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1021 SER OG : rot 180:sc= 0 USER MOD Single : A1023 CYS SG : rot 71:sc= 0.373 USER MOD Single : A1026 ASN : amide:sc=-0.00367 K(o=-0.0037,f=-0.76) USER MOD Single : A1029 THR OG1 : rot 75:sc= 1.14 USER MOD Single : A1036 THR OG1 : rot 75:sc= 0.00879 USER MOD Single : A1039 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1040 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 907 11.523 17.882 5.086 1.00 0.00 N ATOM 2 CA GLY A 907 11.463 17.904 3.606 1.00 0.00 C ATOM 3 C GLY A 907 11.670 16.527 3.012 1.00 0.00 C ATOM 4 O GLY A 907 10.778 15.679 3.071 1.00 0.00 O ATOM 0 HA2 GLY A 907 10.497 18.295 3.288 1.00 0.00 H new ATOM 0 HA3 GLY A 907 12.224 18.583 3.222 1.00 0.00 H new ATOM 10 N ILE A 908 12.843 16.292 2.443 1.00 0.00 N ATOM 11 CA ILE A 908 13.159 14.994 1.860 1.00 0.00 C ATOM 12 C ILE A 908 14.508 14.504 2.360 1.00 0.00 C ATOM 13 O ILE A 908 15.363 15.302 2.749 1.00 0.00 O ATOM 14 CB ILE A 908 13.171 15.000 0.304 1.00 0.00 C ATOM 15 CG1 ILE A 908 14.308 15.872 -0.264 1.00 0.00 C ATOM 16 CG2 ILE A 908 11.824 15.456 -0.244 1.00 0.00 C ATOM 17 CD1 ILE A 908 14.079 17.367 -0.153 1.00 0.00 C ATOM 0 H ILE A 908 13.592 16.981 2.372 1.00 0.00 H new ATOM 0 HA ILE A 908 12.362 14.322 2.178 1.00 0.00 H new ATOM 0 HB ILE A 908 13.354 13.975 -0.020 1.00 0.00 H new ATOM 0 HG12 ILE A 908 15.233 15.621 0.255 1.00 0.00 H new ATOM 0 HG13 ILE A 908 14.452 15.618 -1.314 1.00 0.00 H new ATOM 0 HG21 ILE A 908 11.855 15.453 -1.334 1.00 0.00 H new ATOM 0 HG22 ILE A 908 11.043 14.777 0.099 1.00 0.00 H new ATOM 0 HG23 ILE A 908 11.610 16.464 0.110 1.00 0.00 H new ATOM 0 HD11 ILE A 908 14.931 17.898 -0.578 1.00 0.00 H new ATOM 0 HD12 ILE A 908 13.174 17.638 -0.697 1.00 0.00 H new ATOM 0 HD13 ILE A 908 13.967 17.641 0.896 1.00 0.00 H new ATOM 29 N ASP A 909 14.692 13.195 2.365 1.00 0.00 N ATOM 30 CA ASP A 909 15.965 12.612 2.751 1.00 0.00 C ATOM 31 C ASP A 909 16.481 11.720 1.634 1.00 0.00 C ATOM 32 O ASP A 909 16.159 10.530 1.565 1.00 0.00 O ATOM 33 CB ASP A 909 15.844 11.822 4.054 1.00 0.00 C ATOM 34 CG ASP A 909 17.199 11.485 4.641 1.00 0.00 C ATOM 35 OD1 ASP A 909 17.871 12.393 5.171 1.00 0.00 O ATOM 36 OD2 ASP A 909 17.594 10.301 4.586 1.00 0.00 O ATOM 0 H ASP A 909 13.976 12.516 2.106 1.00 0.00 H new ATOM 0 HA ASP A 909 16.675 13.421 2.922 1.00 0.00 H new ATOM 0 HB2 ASP A 909 15.270 12.401 4.777 1.00 0.00 H new ATOM 0 HB3 ASP A 909 15.290 10.902 3.870 1.00 0.00 H new ATOM 41 N PRO A 910 17.271 12.302 0.721 1.00 0.00 N ATOM 42 CA PRO A 910 17.795 11.606 -0.441 1.00 0.00 C ATOM 43 C PRO A 910 19.141 10.944 -0.164 1.00 0.00 C ATOM 44 O PRO A 910 20.001 10.875 -1.044 1.00 0.00 O ATOM 45 CB PRO A 910 17.947 12.738 -1.455 1.00 0.00 C ATOM 46 CG PRO A 910 18.268 13.948 -0.638 1.00 0.00 C ATOM 47 CD PRO A 910 17.713 13.707 0.749 1.00 0.00 C ATOM 0 HA PRO A 910 17.151 10.791 -0.770 1.00 0.00 H new ATOM 0 HB2 PRO A 910 18.741 12.523 -2.171 1.00 0.00 H new ATOM 0 HB3 PRO A 910 17.031 12.880 -2.028 1.00 0.00 H new ATOM 0 HG2 PRO A 910 19.345 14.112 -0.599 1.00 0.00 H new ATOM 0 HG3 PRO A 910 17.825 14.840 -1.081 1.00 0.00 H new ATOM 0 HD2 PRO A 910 18.471 13.871 1.515 1.00 0.00 H new ATOM 0 HD3 PRO A 910 16.885 14.381 0.970 1.00 0.00 H new ATOM 55 N PHE A 911 19.313 10.455 1.062 1.00 0.00 N ATOM 56 CA PHE A 911 20.541 9.775 1.454 1.00 0.00 C ATOM 57 C PHE A 911 20.807 8.601 0.516 1.00 0.00 C ATOM 58 O PHE A 911 21.849 8.535 -0.137 1.00 0.00 O ATOM 59 CB PHE A 911 20.438 9.294 2.904 1.00 0.00 C ATOM 60 CG PHE A 911 21.709 8.691 3.436 1.00 0.00 C ATOM 61 CD1 PHE A 911 22.874 9.439 3.495 1.00 0.00 C ATOM 62 CD2 PHE A 911 21.733 7.382 3.890 1.00 0.00 C ATOM 63 CE1 PHE A 911 24.041 8.889 3.989 1.00 0.00 C ATOM 64 CE2 PHE A 911 22.899 6.828 4.383 1.00 0.00 C ATOM 65 CZ PHE A 911 24.054 7.583 4.435 1.00 0.00 C ATOM 0 H PHE A 911 18.614 10.518 1.802 1.00 0.00 H new ATOM 0 HA PHE A 911 21.374 10.474 1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 911 20.153 10.135 3.536 1.00 0.00 H new ATOM 0 HB3 PHE A 911 19.639 8.556 2.976 1.00 0.00 H new ATOM 0 HD1 PHE A 911 22.870 10.463 3.151 1.00 0.00 H new ATOM 0 HD2 PHE A 911 20.831 6.789 3.858 1.00 0.00 H new ATOM 0 HE1 PHE A 911 24.943 9.481 4.026 1.00 0.00 H new ATOM 0 HE2 PHE A 911 22.907 5.804 4.728 1.00 0.00 H new ATOM 0 HZ PHE A 911 24.965 7.153 4.824 1.00 0.00 H new ATOM 75 N THR A 912 19.852 7.691 0.438 1.00 0.00 N ATOM 76 CA THR A 912 19.927 6.581 -0.495 1.00 0.00 C ATOM 77 C THR A 912 18.575 6.394 -1.172 1.00 0.00 C ATOM 78 O THR A 912 17.587 7.027 -0.785 1.00 0.00 O ATOM 79 CB THR A 912 20.331 5.263 0.206 1.00 0.00 C ATOM 80 OG1 THR A 912 19.298 4.852 1.102 1.00 0.00 O ATOM 81 CG2 THR A 912 21.628 5.426 0.982 1.00 0.00 C ATOM 0 H THR A 912 19.010 7.700 1.014 1.00 0.00 H new ATOM 0 HA THR A 912 20.694 6.819 -1.232 1.00 0.00 H new ATOM 0 HB THR A 912 20.479 4.507 -0.565 1.00 0.00 H new ATOM 0 HG1 THR A 912 19.621 4.111 1.656 1.00 0.00 H new ATOM 0 HG21 THR A 912 21.885 4.482 1.463 1.00 0.00 H new ATOM 0 HG22 THR A 912 22.427 5.714 0.299 1.00 0.00 H new ATOM 0 HG23 THR A 912 21.503 6.198 1.741 1.00 0.00 H new ATOM 89 N LEU A 913 18.527 5.538 -2.180 1.00 0.00 N ATOM 90 CA LEU A 913 17.276 5.216 -2.846 1.00 0.00 C ATOM 91 C LEU A 913 16.422 4.323 -1.960 1.00 0.00 C ATOM 92 O LEU A 913 15.204 4.500 -1.871 1.00 0.00 O ATOM 93 CB LEU A 913 17.544 4.532 -4.185 1.00 0.00 C ATOM 94 CG LEU A 913 18.126 5.443 -5.260 1.00 0.00 C ATOM 95 CD1 LEU A 913 18.546 4.636 -6.472 1.00 0.00 C ATOM 96 CD2 LEU A 913 17.110 6.495 -5.661 1.00 0.00 C ATOM 0 H LEU A 913 19.342 5.053 -2.555 1.00 0.00 H new ATOM 0 HA LEU A 913 16.735 6.144 -3.033 1.00 0.00 H new ATOM 0 HB2 LEU A 913 18.230 3.701 -4.022 1.00 0.00 H new ATOM 0 HB3 LEU A 913 16.610 4.107 -4.554 1.00 0.00 H new ATOM 0 HG LEU A 913 19.007 5.939 -4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 913 18.959 5.304 -7.228 1.00 0.00 H new ATOM 0 HD12 LEU A 913 19.302 3.907 -6.180 1.00 0.00 H new ATOM 0 HD13 LEU A 913 17.680 4.116 -6.881 1.00 0.00 H new ATOM 0 HD21 LEU A 913 17.537 7.139 -6.429 1.00 0.00 H new ATOM 0 HD22 LEU A 913 16.217 6.008 -6.052 1.00 0.00 H new ATOM 0 HD23 LEU A 913 16.845 7.095 -4.791 1.00 0.00 H new ATOM 108 N VAL A 914 17.071 3.382 -1.288 1.00 0.00 N ATOM 109 CA VAL A 914 16.374 2.472 -0.393 1.00 0.00 C ATOM 110 C VAL A 914 15.875 3.214 0.846 1.00 0.00 C ATOM 111 O VAL A 914 14.891 2.816 1.462 1.00 0.00 O ATOM 112 CB VAL A 914 17.263 1.278 0.013 1.00 0.00 C ATOM 113 CG1 VAL A 914 17.698 0.508 -1.226 1.00 0.00 C ATOM 114 CG2 VAL A 914 18.477 1.733 0.813 1.00 0.00 C ATOM 0 H VAL A 914 18.078 3.230 -1.346 1.00 0.00 H new ATOM 0 HA VAL A 914 15.515 2.074 -0.933 1.00 0.00 H new ATOM 0 HB VAL A 914 16.675 0.620 0.653 1.00 0.00 H new ATOM 0 HG11 VAL A 914 18.325 -0.333 -0.930 1.00 0.00 H new ATOM 0 HG12 VAL A 914 16.818 0.137 -1.752 1.00 0.00 H new ATOM 0 HG13 VAL A 914 18.263 1.168 -1.885 1.00 0.00 H new ATOM 0 HG21 VAL A 914 19.081 0.866 1.082 1.00 0.00 H new ATOM 0 HG22 VAL A 914 19.074 2.418 0.211 1.00 0.00 H new ATOM 0 HG23 VAL A 914 18.146 2.240 1.719 1.00 0.00 H new ATOM 124 N GLN A 915 16.552 4.308 1.181 1.00 0.00 N ATOM 125 CA GLN A 915 16.117 5.200 2.250 1.00 0.00 C ATOM 126 C GLN A 915 14.697 5.687 1.984 1.00 0.00 C ATOM 127 O GLN A 915 13.855 5.724 2.882 1.00 0.00 O ATOM 128 CB GLN A 915 17.081 6.388 2.348 1.00 0.00 C ATOM 129 CG GLN A 915 16.677 7.468 3.335 1.00 0.00 C ATOM 130 CD GLN A 915 16.671 7.007 4.781 1.00 0.00 C ATOM 131 OE1 GLN A 915 16.415 5.844 5.086 1.00 0.00 O ATOM 132 NE2 GLN A 915 16.952 7.929 5.683 1.00 0.00 N ATOM 0 H GLN A 915 17.414 4.600 0.721 1.00 0.00 H new ATOM 0 HA GLN A 915 16.122 4.658 3.196 1.00 0.00 H new ATOM 0 HB2 GLN A 915 18.066 6.014 2.626 1.00 0.00 H new ATOM 0 HB3 GLN A 915 17.178 6.839 1.360 1.00 0.00 H new ATOM 0 HG2 GLN A 915 17.360 8.312 3.235 1.00 0.00 H new ATOM 0 HG3 GLN A 915 15.682 7.831 3.075 1.00 0.00 H new ATOM 0 HE21 GLN A 915 17.159 8.884 5.389 1.00 0.00 H new ATOM 0 HE22 GLN A 915 16.962 7.687 6.674 1.00 0.00 H new ATOM 141 N ARG A 916 14.428 6.047 0.735 1.00 0.00 N ATOM 142 CA ARG A 916 13.092 6.467 0.351 1.00 0.00 C ATOM 143 C ARG A 916 12.165 5.262 0.311 1.00 0.00 C ATOM 144 O ARG A 916 11.018 5.336 0.743 1.00 0.00 O ATOM 145 CB ARG A 916 13.099 7.162 -1.011 1.00 0.00 C ATOM 146 CG ARG A 916 11.748 7.758 -1.372 1.00 0.00 C ATOM 147 CD ARG A 916 11.745 8.394 -2.750 1.00 0.00 C ATOM 148 NE ARG A 916 10.474 9.077 -3.002 1.00 0.00 N ATOM 149 CZ ARG A 916 10.244 9.903 -4.018 1.00 0.00 C ATOM 150 NH1 ARG A 916 11.179 10.132 -4.930 1.00 0.00 N ATOM 151 NH2 ARG A 916 9.061 10.492 -4.116 1.00 0.00 N ATOM 0 H ARG A 916 15.112 6.056 -0.021 1.00 0.00 H new ATOM 0 HA ARG A 916 12.734 7.180 1.093 1.00 0.00 H new ATOM 0 HB2 ARG A 916 13.851 7.951 -1.008 1.00 0.00 H new ATOM 0 HB3 ARG A 916 13.392 6.446 -1.778 1.00 0.00 H new ATOM 0 HG2 ARG A 916 10.988 6.978 -1.333 1.00 0.00 H new ATOM 0 HG3 ARG A 916 11.474 8.507 -0.629 1.00 0.00 H new ATOM 0 HD2 ARG A 916 12.568 9.105 -2.830 1.00 0.00 H new ATOM 0 HD3 ARG A 916 11.910 7.629 -3.509 1.00 0.00 H new ATOM 0 HE ARG A 916 9.709 8.906 -2.350 1.00 0.00 H new ATOM 0 HH11 ARG A 916 12.087 9.672 -4.857 1.00 0.00 H new ATOM 0 HH12 ARG A 916 10.991 10.768 -5.705 1.00 0.00 H new ATOM 0 HH21 ARG A 916 8.341 10.309 -3.417 1.00 0.00 H new ATOM 0 HH22 ARG A 916 8.871 11.128 -4.890 1.00 0.00 H new ATOM 165 N LEU A 917 12.686 4.148 -0.193 1.00 0.00 N ATOM 166 CA LEU A 917 11.931 2.902 -0.287 1.00 0.00 C ATOM 167 C LEU A 917 11.382 2.489 1.077 1.00 0.00 C ATOM 168 O LEU A 917 10.211 2.135 1.198 1.00 0.00 O ATOM 169 CB LEU A 917 12.821 1.797 -0.864 1.00 0.00 C ATOM 170 CG LEU A 917 12.169 0.419 -0.988 1.00 0.00 C ATOM 171 CD1 LEU A 917 10.955 0.477 -1.900 1.00 0.00 C ATOM 172 CD2 LEU A 917 13.177 -0.597 -1.505 1.00 0.00 C ATOM 0 H LEU A 917 13.640 4.083 -0.547 1.00 0.00 H new ATOM 0 HA LEU A 917 11.083 3.061 -0.953 1.00 0.00 H new ATOM 0 HB2 LEU A 917 13.161 2.108 -1.852 1.00 0.00 H new ATOM 0 HB3 LEU A 917 13.707 1.704 -0.236 1.00 0.00 H new ATOM 0 HG LEU A 917 11.835 0.106 0.001 1.00 0.00 H new ATOM 0 HD11 LEU A 917 10.507 -0.514 -1.973 1.00 0.00 H new ATOM 0 HD12 LEU A 917 10.225 1.175 -1.490 1.00 0.00 H new ATOM 0 HD13 LEU A 917 11.260 0.812 -2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 917 12.699 -1.573 -1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 917 13.538 -0.285 -2.485 1.00 0.00 H new ATOM 0 HD23 LEU A 917 14.016 -0.662 -0.813 1.00 0.00 H new ATOM 184 N GLU A 918 12.234 2.550 2.098 1.00 0.00 N ATOM 185 CA GLU A 918 11.831 2.246 3.469 1.00 0.00 C ATOM 186 C GLU A 918 10.617 3.071 3.881 1.00 0.00 C ATOM 187 O GLU A 918 9.599 2.533 4.318 1.00 0.00 O ATOM 188 CB GLU A 918 12.980 2.530 4.439 1.00 0.00 C ATOM 189 CG GLU A 918 14.166 1.596 4.283 1.00 0.00 C ATOM 190 CD GLU A 918 15.325 1.984 5.176 1.00 0.00 C ATOM 191 OE1 GLU A 918 15.099 2.220 6.381 1.00 0.00 O ATOM 192 OE2 GLU A 918 16.467 2.066 4.674 1.00 0.00 O ATOM 0 H GLU A 918 13.216 2.809 2.000 1.00 0.00 H new ATOM 0 HA GLU A 918 11.570 1.188 3.508 1.00 0.00 H new ATOM 0 HB2 GLU A 918 13.318 3.556 4.295 1.00 0.00 H new ATOM 0 HB3 GLU A 918 12.606 2.458 5.460 1.00 0.00 H new ATOM 0 HG2 GLU A 918 13.856 0.577 4.516 1.00 0.00 H new ATOM 0 HG3 GLU A 918 14.494 1.600 3.244 1.00 0.00 H new ATOM 199 N HIS A 919 10.724 4.384 3.718 1.00 0.00 N ATOM 200 CA HIS A 919 9.672 5.294 4.154 1.00 0.00 C ATOM 201 C HIS A 919 8.429 5.156 3.278 1.00 0.00 C ATOM 202 O HIS A 919 7.302 5.297 3.755 1.00 0.00 O ATOM 203 CB HIS A 919 10.177 6.740 4.151 1.00 0.00 C ATOM 204 CG HIS A 919 11.296 6.972 5.121 1.00 0.00 C ATOM 205 ND1 HIS A 919 12.517 7.501 4.758 1.00 0.00 N ATOM 206 CD2 HIS A 919 11.374 6.739 6.452 1.00 0.00 C ATOM 207 CE1 HIS A 919 13.296 7.576 5.822 1.00 0.00 C ATOM 208 NE2 HIS A 919 12.627 7.121 6.863 1.00 0.00 N ATOM 0 H HIS A 919 11.527 4.842 3.288 1.00 0.00 H new ATOM 0 HA HIS A 919 9.395 5.027 5.174 1.00 0.00 H new ATOM 0 HB2 HIS A 919 10.514 6.999 3.147 1.00 0.00 H new ATOM 0 HB3 HIS A 919 9.350 7.408 4.392 1.00 0.00 H new ATOM 0 HD2 HIS A 919 10.594 6.328 7.076 1.00 0.00 H new ATOM 0 HE1 HIS A 919 14.310 7.947 5.837 1.00 0.00 H new ATOM 0 HE2 HIS A 919 12.982 7.062 7.817 1.00 0.00 H new ATOM 216 N ALA A 920 8.638 4.859 2.003 1.00 0.00 N ATOM 217 CA ALA A 920 7.537 4.670 1.073 1.00 0.00 C ATOM 218 C ALA A 920 6.772 3.391 1.396 1.00 0.00 C ATOM 219 O ALA A 920 5.547 3.355 1.313 1.00 0.00 O ATOM 220 CB ALA A 920 8.047 4.644 -0.359 1.00 0.00 C ATOM 0 H ALA A 920 9.563 4.744 1.589 1.00 0.00 H new ATOM 0 HA ALA A 920 6.852 5.511 1.178 1.00 0.00 H new ATOM 0 HB1 ALA A 920 7.209 4.502 -1.041 1.00 0.00 H new ATOM 0 HB2 ALA A 920 8.543 5.588 -0.586 1.00 0.00 H new ATOM 0 HB3 ALA A 920 8.755 3.824 -0.478 1.00 0.00 H new ATOM 226 N ALA A 921 7.499 2.347 1.775 1.00 0.00 N ATOM 227 CA ALA A 921 6.880 1.081 2.144 1.00 0.00 C ATOM 228 C ALA A 921 6.105 1.222 3.448 1.00 0.00 C ATOM 229 O ALA A 921 5.017 0.667 3.599 1.00 0.00 O ATOM 230 CB ALA A 921 7.928 -0.013 2.264 1.00 0.00 C ATOM 0 H ALA A 921 8.517 2.352 1.835 1.00 0.00 H new ATOM 0 HA ALA A 921 6.180 0.802 1.356 1.00 0.00 H new ATOM 0 HB1 ALA A 921 7.445 -0.950 2.540 1.00 0.00 H new ATOM 0 HB2 ALA A 921 8.438 -0.135 1.308 1.00 0.00 H new ATOM 0 HB3 ALA A 921 8.654 0.261 3.030 1.00 0.00 H new ATOM 236 N LYS A 922 6.669 1.982 4.381 1.00 0.00 N ATOM 237 CA LYS A 922 6.012 2.251 5.655 1.00 0.00 C ATOM 238 C LYS A 922 4.690 2.985 5.443 1.00 0.00 C ATOM 239 O LYS A 922 3.651 2.565 5.955 1.00 0.00 O ATOM 240 CB LYS A 922 6.924 3.082 6.563 1.00 0.00 C ATOM 241 CG LYS A 922 8.096 2.298 7.135 1.00 0.00 C ATOM 242 CD LYS A 922 9.016 3.182 7.966 1.00 0.00 C ATOM 243 CE LYS A 922 8.276 3.859 9.112 1.00 0.00 C ATOM 244 NZ LYS A 922 7.631 2.880 10.027 1.00 0.00 N ATOM 0 H LYS A 922 7.583 2.424 4.278 1.00 0.00 H new ATOM 0 HA LYS A 922 5.807 1.294 6.134 1.00 0.00 H new ATOM 0 HB2 LYS A 922 7.308 3.932 5.998 1.00 0.00 H new ATOM 0 HB3 LYS A 922 6.333 3.486 7.385 1.00 0.00 H new ATOM 0 HG2 LYS A 922 7.721 1.482 7.753 1.00 0.00 H new ATOM 0 HG3 LYS A 922 8.663 1.847 6.321 1.00 0.00 H new ATOM 0 HD2 LYS A 922 9.832 2.580 8.367 1.00 0.00 H new ATOM 0 HD3 LYS A 922 9.465 3.941 7.326 1.00 0.00 H new ATOM 0 HE2 LYS A 922 8.974 4.476 9.678 1.00 0.00 H new ATOM 0 HE3 LYS A 922 7.517 4.528 8.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 922 7.228 3.382 10.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 922 6.874 2.378 9.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 922 8.340 2.195 10.358 1.00 0.00 H new ATOM 258 N GLN A 923 4.727 4.070 4.671 1.00 0.00 N ATOM 259 CA GLN A 923 3.526 4.865 4.426 1.00 0.00 C ATOM 260 C GLN A 923 2.514 4.069 3.605 1.00 0.00 C ATOM 261 O GLN A 923 1.305 4.255 3.745 1.00 0.00 O ATOM 262 CB GLN A 923 3.868 6.184 3.716 1.00 0.00 C ATOM 263 CG GLN A 923 4.216 6.028 2.244 1.00 0.00 C ATOM 264 CD GLN A 923 4.457 7.352 1.552 1.00 0.00 C ATOM 265 OE1 GLN A 923 3.915 8.383 1.944 1.00 0.00 O ATOM 266 NE2 GLN A 923 5.251 7.327 0.497 1.00 0.00 N ATOM 0 H GLN A 923 5.568 4.416 4.208 1.00 0.00 H new ATOM 0 HA GLN A 923 3.082 5.105 5.392 1.00 0.00 H new ATOM 0 HB2 GLN A 923 3.020 6.863 3.807 1.00 0.00 H new ATOM 0 HB3 GLN A 923 4.708 6.652 4.229 1.00 0.00 H new ATOM 0 HG2 GLN A 923 5.107 5.407 2.150 1.00 0.00 H new ATOM 0 HG3 GLN A 923 3.406 5.502 1.738 1.00 0.00 H new ATOM 0 HE21 GLN A 923 5.682 6.450 0.204 1.00 0.00 H new ATOM 0 HE22 GLN A 923 5.433 8.184 -0.025 1.00 0.00 H new ATOM 275 N ALA A 924 3.012 3.175 2.754 1.00 0.00 N ATOM 276 CA ALA A 924 2.147 2.308 1.971 1.00 0.00 C ATOM 277 C ALA A 924 1.437 1.319 2.880 1.00 0.00 C ATOM 278 O ALA A 924 0.218 1.171 2.816 1.00 0.00 O ATOM 279 CB ALA A 924 2.943 1.573 0.905 1.00 0.00 C ATOM 0 H ALA A 924 4.009 3.035 2.592 1.00 0.00 H new ATOM 0 HA ALA A 924 1.400 2.925 1.472 1.00 0.00 H new ATOM 0 HB1 ALA A 924 2.276 0.930 0.331 1.00 0.00 H new ATOM 0 HB2 ALA A 924 3.412 2.296 0.238 1.00 0.00 H new ATOM 0 HB3 ALA A 924 3.713 0.965 1.380 1.00 0.00 H new ATOM 285 N ALA A 925 2.210 0.662 3.739 1.00 0.00 N ATOM 286 CA ALA A 925 1.664 -0.278 4.711 1.00 0.00 C ATOM 287 C ALA A 925 0.638 0.416 5.604 1.00 0.00 C ATOM 288 O ALA A 925 -0.434 -0.128 5.884 1.00 0.00 O ATOM 289 CB ALA A 925 2.789 -0.876 5.547 1.00 0.00 C ATOM 0 H ALA A 925 3.224 0.765 3.781 1.00 0.00 H new ATOM 0 HA ALA A 925 1.161 -1.085 4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 925 2.372 -1.577 6.270 1.00 0.00 H new ATOM 0 HB2 ALA A 925 3.488 -1.400 4.895 1.00 0.00 H new ATOM 0 HB3 ALA A 925 3.313 -0.079 6.075 1.00 0.00 H new ATOM 295 N ALA A 926 0.972 1.629 6.028 1.00 0.00 N ATOM 296 CA ALA A 926 0.087 2.436 6.856 1.00 0.00 C ATOM 297 C ALA A 926 -1.217 2.752 6.128 1.00 0.00 C ATOM 298 O ALA A 926 -2.307 2.447 6.623 1.00 0.00 O ATOM 299 CB ALA A 926 0.788 3.727 7.253 1.00 0.00 C ATOM 0 H ALA A 926 1.861 2.079 5.808 1.00 0.00 H new ATOM 0 HA ALA A 926 -0.157 1.864 7.751 1.00 0.00 H new ATOM 0 HB1 ALA A 926 0.122 4.327 7.872 1.00 0.00 H new ATOM 0 HB2 ALA A 926 1.692 3.492 7.815 1.00 0.00 H new ATOM 0 HB3 ALA A 926 1.053 4.288 6.357 1.00 0.00 H new ATOM 305 N SER A 927 -1.096 3.340 4.946 1.00 0.00 N ATOM 306 CA SER A 927 -2.253 3.765 4.166 1.00 0.00 C ATOM 307 C SER A 927 -3.110 2.572 3.744 1.00 0.00 C ATOM 308 O SER A 927 -4.338 2.669 3.684 1.00 0.00 O ATOM 309 CB SER A 927 -1.786 4.552 2.943 1.00 0.00 C ATOM 310 OG SER A 927 -1.014 5.673 3.336 1.00 0.00 O ATOM 0 H SER A 927 -0.199 3.536 4.502 1.00 0.00 H new ATOM 0 HA SER A 927 -2.874 4.407 4.791 1.00 0.00 H new ATOM 0 HB2 SER A 927 -1.195 3.907 2.293 1.00 0.00 H new ATOM 0 HB3 SER A 927 -2.649 4.883 2.365 1.00 0.00 H new ATOM 0 HG SER A 927 -0.100 5.385 3.543 1.00 0.00 H new ATOM 316 N ALA A 928 -2.461 1.449 3.459 1.00 0.00 N ATOM 317 CA ALA A 928 -3.174 0.227 3.115 1.00 0.00 C ATOM 318 C ALA A 928 -4.046 -0.216 4.276 1.00 0.00 C ATOM 319 O ALA A 928 -5.211 -0.561 4.094 1.00 0.00 O ATOM 320 CB ALA A 928 -2.199 -0.874 2.740 1.00 0.00 C ATOM 0 H ALA A 928 -1.445 1.360 3.460 1.00 0.00 H new ATOM 0 HA ALA A 928 -3.811 0.430 2.254 1.00 0.00 H new ATOM 0 HB1 ALA A 928 -2.752 -1.779 2.486 1.00 0.00 H new ATOM 0 HB2 ALA A 928 -1.606 -0.558 1.882 1.00 0.00 H new ATOM 0 HB3 ALA A 928 -1.538 -1.077 3.582 1.00 0.00 H new ATOM 326 N THR A 929 -3.476 -0.173 5.474 1.00 0.00 N ATOM 327 CA THR A 929 -4.202 -0.538 6.680 1.00 0.00 C ATOM 328 C THR A 929 -5.404 0.383 6.880 1.00 0.00 C ATOM 329 O THR A 929 -6.494 -0.068 7.244 1.00 0.00 O ATOM 330 CB THR A 929 -3.284 -0.475 7.916 1.00 0.00 C ATOM 331 OG1 THR A 929 -2.094 -1.244 7.683 1.00 0.00 O ATOM 332 CG2 THR A 929 -3.995 -1.011 9.150 1.00 0.00 C ATOM 0 H THR A 929 -2.510 0.112 5.634 1.00 0.00 H new ATOM 0 HA THR A 929 -4.555 -1.563 6.561 1.00 0.00 H new ATOM 0 HB THR A 929 -3.021 0.569 8.088 1.00 0.00 H new ATOM 0 HG1 THR A 929 -1.410 -0.673 7.274 1.00 0.00 H new ATOM 0 HG21 THR A 929 -3.326 -0.956 10.008 1.00 0.00 H new ATOM 0 HG22 THR A 929 -4.886 -0.414 9.345 1.00 0.00 H new ATOM 0 HG23 THR A 929 -4.284 -2.048 8.982 1.00 0.00 H new ATOM 340 N GLN A 930 -5.205 1.673 6.614 1.00 0.00 N ATOM 341 CA GLN A 930 -6.279 2.654 6.727 1.00 0.00 C ATOM 342 C GLN A 930 -7.406 2.336 5.751 1.00 0.00 C ATOM 343 O GLN A 930 -8.584 2.494 6.072 1.00 0.00 O ATOM 344 CB GLN A 930 -5.758 4.067 6.453 1.00 0.00 C ATOM 345 CG GLN A 930 -4.670 4.527 7.409 1.00 0.00 C ATOM 346 CD GLN A 930 -5.080 4.425 8.865 1.00 0.00 C ATOM 347 OE1 GLN A 930 -6.261 4.513 9.202 1.00 0.00 O ATOM 348 NE2 GLN A 930 -4.101 4.258 9.737 1.00 0.00 N ATOM 0 H GLN A 930 -4.309 2.062 6.319 1.00 0.00 H new ATOM 0 HA GLN A 930 -6.662 2.606 7.746 1.00 0.00 H new ATOM 0 HB2 GLN A 930 -5.372 4.109 5.434 1.00 0.00 H new ATOM 0 HB3 GLN A 930 -6.592 4.766 6.507 1.00 0.00 H new ATOM 0 HG2 GLN A 930 -3.774 3.928 7.247 1.00 0.00 H new ATOM 0 HG3 GLN A 930 -4.408 5.560 7.182 1.00 0.00 H new ATOM 0 HE21 GLN A 930 -3.136 4.190 9.414 1.00 0.00 H new ATOM 0 HE22 GLN A 930 -4.310 4.197 10.733 1.00 0.00 H new ATOM 357 N THR A 931 -7.036 1.892 4.559 1.00 0.00 N ATOM 358 CA THR A 931 -8.012 1.562 3.538 1.00 0.00 C ATOM 359 C THR A 931 -8.755 0.274 3.897 1.00 0.00 C ATOM 360 O THR A 931 -9.977 0.223 3.822 1.00 0.00 O ATOM 361 CB THR A 931 -7.343 1.410 2.160 1.00 0.00 C ATOM 362 OG1 THR A 931 -6.495 2.538 1.902 1.00 0.00 O ATOM 363 CG2 THR A 931 -8.387 1.304 1.058 1.00 0.00 C ATOM 0 H THR A 931 -6.066 1.753 4.277 1.00 0.00 H new ATOM 0 HA THR A 931 -8.727 2.383 3.488 1.00 0.00 H new ATOM 0 HB THR A 931 -6.749 0.496 2.170 1.00 0.00 H new ATOM 0 HG1 THR A 931 -5.707 2.494 2.483 1.00 0.00 H new ATOM 0 HG21 THR A 931 -7.889 1.197 0.094 1.00 0.00 H new ATOM 0 HG22 THR A 931 -9.019 0.434 1.238 1.00 0.00 H new ATOM 0 HG23 THR A 931 -9.002 2.204 1.051 1.00 0.00 H new ATOM 371 N ILE A 932 -8.010 -0.746 4.314 1.00 0.00 N ATOM 372 CA ILE A 932 -8.593 -2.042 4.658 1.00 0.00 C ATOM 373 C ILE A 932 -9.616 -1.918 5.784 1.00 0.00 C ATOM 374 O ILE A 932 -10.733 -2.434 5.681 1.00 0.00 O ATOM 375 CB ILE A 932 -7.500 -3.058 5.067 1.00 0.00 C ATOM 376 CG1 ILE A 932 -6.612 -3.389 3.863 1.00 0.00 C ATOM 377 CG2 ILE A 932 -8.120 -4.325 5.643 1.00 0.00 C ATOM 378 CD1 ILE A 932 -5.488 -4.348 4.181 1.00 0.00 C ATOM 0 H ILE A 932 -6.997 -0.701 4.423 1.00 0.00 H new ATOM 0 HA ILE A 932 -9.100 -2.405 3.764 1.00 0.00 H new ATOM 0 HB ILE A 932 -6.883 -2.606 5.844 1.00 0.00 H new ATOM 0 HG12 ILE A 932 -7.230 -3.817 3.074 1.00 0.00 H new ATOM 0 HG13 ILE A 932 -6.189 -2.465 3.470 1.00 0.00 H new ATOM 0 HG21 ILE A 932 -7.330 -5.022 5.922 1.00 0.00 H new ATOM 0 HG22 ILE A 932 -8.710 -4.073 6.524 1.00 0.00 H new ATOM 0 HG23 ILE A 932 -8.764 -4.787 4.895 1.00 0.00 H new ATOM 0 HD11 ILE A 932 -4.903 -4.535 3.280 1.00 0.00 H new ATOM 0 HD12 ILE A 932 -4.846 -3.914 4.948 1.00 0.00 H new ATOM 0 HD13 ILE A 932 -5.903 -5.288 4.545 1.00 0.00 H new ATOM 390 N ALA A 933 -9.238 -1.216 6.849 1.00 0.00 N ATOM 391 CA ALA A 933 -10.105 -1.049 8.009 1.00 0.00 C ATOM 392 C ALA A 933 -11.433 -0.406 7.624 1.00 0.00 C ATOM 393 O ALA A 933 -12.484 -0.748 8.169 1.00 0.00 O ATOM 394 CB ALA A 933 -9.406 -0.217 9.073 1.00 0.00 C ATOM 0 H ALA A 933 -8.333 -0.752 6.931 1.00 0.00 H new ATOM 0 HA ALA A 933 -10.318 -2.039 8.413 1.00 0.00 H new ATOM 0 HB1 ALA A 933 -10.064 -0.100 9.934 1.00 0.00 H new ATOM 0 HB2 ALA A 933 -8.489 -0.718 9.383 1.00 0.00 H new ATOM 0 HB3 ALA A 933 -9.163 0.764 8.666 1.00 0.00 H new ATOM 400 N ALA A 934 -11.383 0.514 6.675 1.00 0.00 N ATOM 401 CA ALA A 934 -12.579 1.199 6.215 1.00 0.00 C ATOM 402 C ALA A 934 -13.328 0.361 5.183 1.00 0.00 C ATOM 403 O ALA A 934 -14.545 0.214 5.253 1.00 0.00 O ATOM 404 CB ALA A 934 -12.214 2.556 5.634 1.00 0.00 C ATOM 0 H ALA A 934 -10.524 0.804 6.207 1.00 0.00 H new ATOM 0 HA ALA A 934 -13.239 1.347 7.070 1.00 0.00 H new ATOM 0 HB1 ALA A 934 -13.118 3.061 5.292 1.00 0.00 H new ATOM 0 HB2 ALA A 934 -11.728 3.161 6.400 1.00 0.00 H new ATOM 0 HB3 ALA A 934 -11.534 2.421 4.793 1.00 0.00 H new ATOM 410 N ALA A 935 -12.587 -0.211 4.244 1.00 0.00 N ATOM 411 CA ALA A 935 -13.172 -0.947 3.133 1.00 0.00 C ATOM 412 C ALA A 935 -13.962 -2.166 3.599 1.00 0.00 C ATOM 413 O ALA A 935 -15.056 -2.429 3.107 1.00 0.00 O ATOM 414 CB ALA A 935 -12.089 -1.362 2.150 1.00 0.00 C ATOM 0 H ALA A 935 -11.568 -0.178 4.231 1.00 0.00 H new ATOM 0 HA ALA A 935 -13.875 -0.279 2.635 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -12.539 -1.912 1.323 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -11.588 -0.474 1.765 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -11.363 -1.998 2.656 1.00 0.00 H new ATOM 420 N GLN A 936 -13.428 -2.896 4.569 1.00 0.00 N ATOM 421 CA GLN A 936 -14.079 -4.118 5.040 1.00 0.00 C ATOM 422 C GLN A 936 -15.254 -3.819 5.973 1.00 0.00 C ATOM 423 O GLN A 936 -15.812 -4.734 6.583 1.00 0.00 O ATOM 424 CB GLN A 936 -13.075 -5.024 5.756 1.00 0.00 C ATOM 425 CG GLN A 936 -12.020 -5.621 4.840 1.00 0.00 C ATOM 426 CD GLN A 936 -11.162 -6.657 5.541 1.00 0.00 C ATOM 427 OE1 GLN A 936 -10.944 -6.585 6.751 1.00 0.00 O ATOM 428 NE2 GLN A 936 -10.672 -7.632 4.787 1.00 0.00 N ATOM 0 H GLN A 936 -12.554 -2.669 5.043 1.00 0.00 H new ATOM 0 HA GLN A 936 -14.467 -4.630 4.159 1.00 0.00 H new ATOM 0 HB2 GLN A 936 -12.579 -4.452 6.540 1.00 0.00 H new ATOM 0 HB3 GLN A 936 -13.616 -5.833 6.246 1.00 0.00 H new ATOM 0 HG2 GLN A 936 -12.508 -6.080 3.980 1.00 0.00 H new ATOM 0 HG3 GLN A 936 -11.382 -4.824 4.458 1.00 0.00 H new ATOM 0 HE21 GLN A 936 -10.876 -7.656 3.788 1.00 0.00 H new ATOM 0 HE22 GLN A 936 -10.091 -8.358 5.206 1.00 0.00 H new ATOM 437 N HIS A 937 -15.637 -2.550 6.089 1.00 0.00 N ATOM 438 CA HIS A 937 -16.721 -2.172 6.993 1.00 0.00 C ATOM 439 C HIS A 937 -17.679 -1.158 6.362 1.00 0.00 C ATOM 440 O HIS A 937 -18.889 -1.220 6.579 1.00 0.00 O ATOM 441 CB HIS A 937 -16.159 -1.607 8.305 1.00 0.00 C ATOM 442 CG HIS A 937 -15.406 -2.613 9.123 1.00 0.00 C ATOM 443 ND1 HIS A 937 -14.066 -2.493 9.421 1.00 0.00 N ATOM 444 CD2 HIS A 937 -15.813 -3.767 9.704 1.00 0.00 C ATOM 445 CE1 HIS A 937 -13.684 -3.526 10.146 1.00 0.00 C ATOM 446 NE2 HIS A 937 -14.723 -4.316 10.333 1.00 0.00 N ATOM 0 H HIS A 937 -15.219 -1.774 5.575 1.00 0.00 H new ATOM 0 HA HIS A 937 -17.288 -3.080 7.200 1.00 0.00 H new ATOM 0 HB2 HIS A 937 -15.498 -0.771 8.076 1.00 0.00 H new ATOM 0 HB3 HIS A 937 -16.981 -1.210 8.901 1.00 0.00 H new ATOM 0 HD1 HIS A 937 -13.463 -1.725 9.127 1.00 0.00 H new ATOM 0 HD2 HIS A 937 -16.811 -4.179 9.677 1.00 0.00 H new ATOM 0 HE1 HIS A 937 -12.687 -3.697 10.524 1.00 0.00 H new ATOM 454 N ALA A 938 -17.144 -0.225 5.586 1.00 0.00 N ATOM 455 CA ALA A 938 -17.955 0.854 5.027 1.00 0.00 C ATOM 456 C ALA A 938 -18.325 0.607 3.566 1.00 0.00 C ATOM 457 O ALA A 938 -19.234 1.249 3.040 1.00 0.00 O ATOM 458 CB ALA A 938 -17.225 2.183 5.167 1.00 0.00 C ATOM 0 H ALA A 938 -16.158 -0.191 5.329 1.00 0.00 H new ATOM 0 HA ALA A 938 -18.886 0.886 5.593 1.00 0.00 H new ATOM 0 HB1 ALA A 938 -17.838 2.981 4.747 1.00 0.00 H new ATOM 0 HB2 ALA A 938 -17.038 2.386 6.221 1.00 0.00 H new ATOM 0 HB3 ALA A 938 -16.276 2.135 4.633 1.00 0.00 H new ATOM 464 N ALA A 939 -17.634 -0.318 2.911 1.00 0.00 N ATOM 465 CA ALA A 939 -17.869 -0.570 1.492 1.00 0.00 C ATOM 466 C ALA A 939 -19.068 -1.487 1.279 1.00 0.00 C ATOM 467 O ALA A 939 -18.921 -2.643 0.874 1.00 0.00 O ATOM 468 CB ALA A 939 -16.631 -1.157 0.838 1.00 0.00 C ATOM 0 H ALA A 939 -16.912 -0.902 3.334 1.00 0.00 H new ATOM 0 HA ALA A 939 -18.092 0.387 1.021 1.00 0.00 H new ATOM 0 HB1 ALA A 939 -16.828 -1.337 -0.219 1.00 0.00 H new ATOM 0 HB2 ALA A 939 -15.801 -0.458 0.938 1.00 0.00 H new ATOM 0 HB3 ALA A 939 -16.374 -2.098 1.324 1.00 0.00 H new ATOM 474 N SER A 940 -20.250 -0.974 1.588 1.00 0.00 N ATOM 475 CA SER A 940 -21.490 -1.711 1.410 1.00 0.00 C ATOM 476 C SER A 940 -22.663 -0.740 1.316 1.00 0.00 C ATOM 477 O SER A 940 -22.676 0.288 1.994 1.00 0.00 O ATOM 478 CB SER A 940 -21.706 -2.687 2.575 1.00 0.00 C ATOM 479 OG SER A 940 -20.645 -3.627 2.655 1.00 0.00 O ATOM 0 H SER A 940 -20.375 -0.036 1.969 1.00 0.00 H new ATOM 0 HA SER A 940 -21.426 -2.284 0.485 1.00 0.00 H new ATOM 0 HB2 SER A 940 -21.776 -2.132 3.511 1.00 0.00 H new ATOM 0 HB3 SER A 940 -22.652 -3.212 2.444 1.00 0.00 H new ATOM 0 HG SER A 940 -20.136 -3.617 1.818 1.00 0.00 H new ATOM 485 N ALA A 941 -23.630 -1.056 0.464 1.00 0.00 N ATOM 486 CA ALA A 941 -24.821 -0.230 0.323 1.00 0.00 C ATOM 487 C ALA A 941 -25.862 -0.629 1.361 1.00 0.00 C ATOM 488 O ALA A 941 -26.417 -1.729 1.303 1.00 0.00 O ATOM 489 CB ALA A 941 -25.389 -0.354 -1.084 1.00 0.00 C ATOM 0 H ALA A 941 -23.612 -1.878 -0.139 1.00 0.00 H new ATOM 0 HA ALA A 941 -24.548 0.812 0.490 1.00 0.00 H new ATOM 0 HB1 ALA A 941 -26.279 0.269 -1.173 1.00 0.00 H new ATOM 0 HB2 ALA A 941 -24.643 -0.027 -1.808 1.00 0.00 H new ATOM 0 HB3 ALA A 941 -25.653 -1.393 -1.280 1.00 0.00 H new ATOM 495 N PRO A 942 -26.129 0.253 2.335 1.00 0.00 N ATOM 496 CA PRO A 942 -27.060 -0.027 3.432 1.00 0.00 C ATOM 497 C PRO A 942 -28.490 -0.241 2.949 1.00 0.00 C ATOM 498 O PRO A 942 -28.867 0.226 1.869 1.00 0.00 O ATOM 499 CB PRO A 942 -26.979 1.225 4.315 1.00 0.00 C ATOM 500 CG PRO A 942 -25.727 1.920 3.898 1.00 0.00 C ATOM 501 CD PRO A 942 -25.545 1.597 2.446 1.00 0.00 C ATOM 0 HA PRO A 942 -26.794 -0.947 3.952 1.00 0.00 H new ATOM 0 HB2 PRO A 942 -27.850 1.864 4.172 1.00 0.00 H new ATOM 0 HB3 PRO A 942 -26.948 0.960 5.372 1.00 0.00 H new ATOM 0 HG2 PRO A 942 -25.807 2.996 4.052 1.00 0.00 H new ATOM 0 HG3 PRO A 942 -24.875 1.577 4.485 1.00 0.00 H new ATOM 0 HD2 PRO A 942 -26.057 2.315 1.805 1.00 0.00 H new ATOM 0 HD3 PRO A 942 -24.494 1.606 2.158 1.00 0.00 H new ATOM 509 N LYS A 943 -29.270 -0.958 3.761 1.00 0.00 N ATOM 510 CA LYS A 943 -30.675 -1.270 3.473 1.00 0.00 C ATOM 511 C LYS A 943 -30.806 -2.287 2.341 1.00 0.00 C ATOM 512 O LYS A 943 -31.271 -3.409 2.558 1.00 0.00 O ATOM 513 CB LYS A 943 -31.481 -0.010 3.134 1.00 0.00 C ATOM 514 CG LYS A 943 -31.534 1.011 4.256 1.00 0.00 C ATOM 515 CD LYS A 943 -32.451 2.165 3.893 1.00 0.00 C ATOM 516 CE LYS A 943 -32.445 3.248 4.958 1.00 0.00 C ATOM 517 NZ LYS A 943 -33.405 4.337 4.635 1.00 0.00 N ATOM 0 H LYS A 943 -28.942 -1.343 4.647 1.00 0.00 H new ATOM 0 HA LYS A 943 -31.086 -1.707 4.383 1.00 0.00 H new ATOM 0 HB2 LYS A 943 -31.048 0.459 2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 943 -32.499 -0.301 2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 943 -31.887 0.535 5.171 1.00 0.00 H new ATOM 0 HG3 LYS A 943 -30.531 1.387 4.459 1.00 0.00 H new ATOM 0 HD2 LYS A 943 -32.139 2.591 2.940 1.00 0.00 H new ATOM 0 HD3 LYS A 943 -33.467 1.793 3.758 1.00 0.00 H new ATOM 0 HE2 LYS A 943 -32.700 2.811 5.924 1.00 0.00 H new ATOM 0 HE3 LYS A 943 -31.441 3.662 5.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 943 -33.375 5.059 5.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 943 -33.146 4.769 3.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 943 -34.366 3.945 4.571 1.00 0.00 H new ATOM 531 N ALA A 944 -30.380 -1.893 1.146 1.00 0.00 N ATOM 532 CA ALA A 944 -30.496 -2.738 -0.039 1.00 0.00 C ATOM 533 C ALA A 944 -29.589 -3.959 0.057 1.00 0.00 C ATOM 534 O ALA A 944 -29.791 -4.951 -0.646 1.00 0.00 O ATOM 535 CB ALA A 944 -30.170 -1.935 -1.290 1.00 0.00 C ATOM 0 H ALA A 944 -29.948 -0.986 0.971 1.00 0.00 H new ATOM 0 HA ALA A 944 -31.525 -3.091 -0.100 1.00 0.00 H new ATOM 0 HB1 ALA A 944 -30.260 -2.576 -2.167 1.00 0.00 H new ATOM 0 HB2 ALA A 944 -30.865 -1.100 -1.378 1.00 0.00 H new ATOM 0 HB3 ALA A 944 -29.151 -1.553 -1.222 1.00 0.00 H new ATOM 541 N SER A 945 -28.588 -3.882 0.919 1.00 0.00 N ATOM 542 CA SER A 945 -27.677 -4.990 1.135 1.00 0.00 C ATOM 543 C SER A 945 -26.971 -4.848 2.479 1.00 0.00 C ATOM 544 O SER A 945 -27.131 -3.841 3.170 1.00 0.00 O ATOM 545 CB SER A 945 -26.662 -5.071 -0.012 1.00 0.00 C ATOM 546 OG SER A 945 -26.128 -3.794 -0.326 1.00 0.00 O ATOM 0 H SER A 945 -28.387 -3.057 1.483 1.00 0.00 H new ATOM 0 HA SER A 945 -28.250 -5.917 1.153 1.00 0.00 H new ATOM 0 HB2 SER A 945 -25.853 -5.747 0.264 1.00 0.00 H new ATOM 0 HB3 SER A 945 -27.142 -5.493 -0.895 1.00 0.00 H new ATOM 0 HG SER A 945 -26.124 -3.234 0.478 1.00 0.00 H new ATOM 552 N ALA A 946 -26.216 -5.866 2.854 1.00 0.00 N ATOM 553 CA ALA A 946 -25.455 -5.838 4.092 1.00 0.00 C ATOM 554 C ALA A 946 -23.967 -5.755 3.788 1.00 0.00 C ATOM 555 O ALA A 946 -23.210 -5.082 4.487 1.00 0.00 O ATOM 556 CB ALA A 946 -25.758 -7.070 4.929 1.00 0.00 C ATOM 0 H ALA A 946 -26.113 -6.727 2.316 1.00 0.00 H new ATOM 0 HA ALA A 946 -25.746 -4.956 4.662 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -25.180 -7.034 5.853 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -26.821 -7.096 5.167 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -25.490 -7.966 4.368 1.00 0.00 H new ATOM 562 N GLY A 947 -23.566 -6.430 2.724 1.00 0.00 N ATOM 563 CA GLY A 947 -22.179 -6.446 2.326 1.00 0.00 C ATOM 564 C GLY A 947 -21.914 -7.509 1.287 1.00 0.00 C ATOM 565 O GLY A 947 -21.573 -8.641 1.625 1.00 0.00 O ATOM 0 H GLY A 947 -24.186 -6.973 2.123 1.00 0.00 H new ATOM 0 HA2 GLY A 947 -21.902 -5.470 1.928 1.00 0.00 H new ATOM 0 HA3 GLY A 947 -21.551 -6.624 3.199 1.00 0.00 H new ATOM 569 N PRO A 948 -22.068 -7.173 0.001 1.00 0.00 N ATOM 570 CA PRO A 948 -21.903 -8.127 -1.088 1.00 0.00 C ATOM 571 C PRO A 948 -20.449 -8.300 -1.501 1.00 0.00 C ATOM 572 O PRO A 948 -20.140 -9.067 -2.413 1.00 0.00 O ATOM 573 CB PRO A 948 -22.720 -7.514 -2.235 1.00 0.00 C ATOM 574 CG PRO A 948 -23.161 -6.153 -1.773 1.00 0.00 C ATOM 575 CD PRO A 948 -22.423 -5.846 -0.500 1.00 0.00 C ATOM 0 HA PRO A 948 -22.233 -9.125 -0.800 1.00 0.00 H new ATOM 0 HB2 PRO A 948 -22.119 -7.439 -3.141 1.00 0.00 H new ATOM 0 HB3 PRO A 948 -23.580 -8.139 -2.474 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -22.944 -5.402 -2.532 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -24.238 -6.135 -1.605 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -21.540 -5.234 -0.683 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -23.048 -5.301 0.208 1.00 0.00 H new ATOM 583 N GLN A 949 -19.569 -7.600 -0.795 1.00 0.00 N ATOM 584 CA GLN A 949 -18.136 -7.588 -1.090 1.00 0.00 C ATOM 585 C GLN A 949 -17.884 -7.280 -2.566 1.00 0.00 C ATOM 586 O GLN A 949 -17.528 -8.165 -3.344 1.00 0.00 O ATOM 587 CB GLN A 949 -17.488 -8.921 -0.699 1.00 0.00 C ATOM 588 CG GLN A 949 -17.702 -9.287 0.761 1.00 0.00 C ATOM 589 CD GLN A 949 -16.982 -10.557 1.169 1.00 0.00 C ATOM 590 OE1 GLN A 949 -15.918 -10.888 0.640 1.00 0.00 O ATOM 591 NE2 GLN A 949 -17.559 -11.286 2.110 1.00 0.00 N ATOM 0 H GLN A 949 -19.828 -7.021 0.003 1.00 0.00 H new ATOM 0 HA GLN A 949 -17.678 -6.798 -0.495 1.00 0.00 H new ATOM 0 HB2 GLN A 949 -17.894 -9.713 -1.328 1.00 0.00 H new ATOM 0 HB3 GLN A 949 -16.418 -8.870 -0.901 1.00 0.00 H new ATOM 0 HG2 GLN A 949 -17.359 -8.465 1.389 1.00 0.00 H new ATOM 0 HG3 GLN A 949 -18.769 -9.406 0.946 1.00 0.00 H new ATOM 0 HE21 GLN A 949 -18.439 -10.980 2.524 1.00 0.00 H new ATOM 0 HE22 GLN A 949 -17.124 -12.154 2.421 1.00 0.00 H new ATOM 600 N PRO A 950 -18.075 -6.010 -2.967 1.00 0.00 N ATOM 601 CA PRO A 950 -17.961 -5.590 -4.371 1.00 0.00 C ATOM 602 C PRO A 950 -16.593 -5.907 -4.965 1.00 0.00 C ATOM 603 O PRO A 950 -16.495 -6.497 -6.040 1.00 0.00 O ATOM 604 CB PRO A 950 -18.180 -4.072 -4.316 1.00 0.00 C ATOM 605 CG PRO A 950 -18.914 -3.836 -3.042 1.00 0.00 C ATOM 606 CD PRO A 950 -18.424 -4.883 -2.084 1.00 0.00 C ATOM 0 HA PRO A 950 -18.676 -6.113 -5.006 1.00 0.00 H new ATOM 0 HB2 PRO A 950 -17.231 -3.535 -4.331 1.00 0.00 H new ATOM 0 HB3 PRO A 950 -18.756 -3.725 -5.174 1.00 0.00 H new ATOM 0 HG2 PRO A 950 -18.719 -2.834 -2.659 1.00 0.00 H new ATOM 0 HG3 PRO A 950 -19.991 -3.916 -3.191 1.00 0.00 H new ATOM 0 HD2 PRO A 950 -17.562 -4.536 -1.514 1.00 0.00 H new ATOM 0 HD3 PRO A 950 -19.193 -5.160 -1.362 1.00 0.00 H new ATOM 614 N LEU A 951 -15.542 -5.517 -4.253 1.00 0.00 N ATOM 615 CA LEU A 951 -14.178 -5.748 -4.711 1.00 0.00 C ATOM 616 C LEU A 951 -13.197 -5.418 -3.590 1.00 0.00 C ATOM 617 O LEU A 951 -12.253 -6.168 -3.342 1.00 0.00 O ATOM 618 CB LEU A 951 -13.887 -4.897 -5.958 1.00 0.00 C ATOM 619 CG LEU A 951 -12.851 -5.465 -6.944 1.00 0.00 C ATOM 620 CD1 LEU A 951 -11.441 -5.361 -6.395 1.00 0.00 C ATOM 621 CD2 LEU A 951 -13.177 -6.912 -7.279 1.00 0.00 C ATOM 0 H LEU A 951 -15.609 -5.039 -3.355 1.00 0.00 H new ATOM 0 HA LEU A 951 -14.061 -6.798 -4.980 1.00 0.00 H new ATOM 0 HB2 LEU A 951 -14.823 -4.746 -6.495 1.00 0.00 H new ATOM 0 HB3 LEU A 951 -13.545 -3.915 -5.630 1.00 0.00 H new ATOM 0 HG LEU A 951 -12.900 -4.867 -7.854 1.00 0.00 H new ATOM 0 HD11 LEU A 951 -10.737 -5.772 -7.119 1.00 0.00 H new ATOM 0 HD12 LEU A 951 -11.200 -4.315 -6.208 1.00 0.00 H new ATOM 0 HD13 LEU A 951 -11.371 -5.922 -5.463 1.00 0.00 H new ATOM 0 HD21 LEU A 951 -12.435 -7.300 -7.977 1.00 0.00 H new ATOM 0 HD22 LEU A 951 -13.163 -7.509 -6.367 1.00 0.00 H new ATOM 0 HD23 LEU A 951 -14.166 -6.966 -7.733 1.00 0.00 H new ATOM 633 N LEU A 952 -13.455 -4.302 -2.905 1.00 0.00 N ATOM 634 CA LEU A 952 -12.597 -3.828 -1.815 1.00 0.00 C ATOM 635 C LEU A 952 -12.246 -4.929 -0.823 1.00 0.00 C ATOM 636 O LEU A 952 -11.072 -5.216 -0.604 1.00 0.00 O ATOM 637 CB LEU A 952 -13.273 -2.674 -1.073 1.00 0.00 C ATOM 638 CG LEU A 952 -12.965 -1.283 -1.622 1.00 0.00 C ATOM 639 CD1 LEU A 952 -13.768 -0.230 -0.877 1.00 0.00 C ATOM 640 CD2 LEU A 952 -11.479 -0.995 -1.508 1.00 0.00 C ATOM 0 H LEU A 952 -14.260 -3.703 -3.088 1.00 0.00 H new ATOM 0 HA LEU A 952 -11.668 -3.488 -2.273 1.00 0.00 H new ATOM 0 HB2 LEU A 952 -14.352 -2.828 -1.100 1.00 0.00 H new ATOM 0 HB3 LEU A 952 -12.972 -2.709 -0.026 1.00 0.00 H new ATOM 0 HG LEU A 952 -13.248 -1.251 -2.674 1.00 0.00 H new ATOM 0 HD11 LEU A 952 -13.537 0.756 -1.280 1.00 0.00 H new ATOM 0 HD12 LEU A 952 -14.832 -0.431 -0.998 1.00 0.00 H new ATOM 0 HD13 LEU A 952 -13.511 -0.258 0.182 1.00 0.00 H new ATOM 0 HD21 LEU A 952 -11.270 -0.001 -1.902 1.00 0.00 H new ATOM 0 HD22 LEU A 952 -11.179 -1.041 -0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 952 -10.920 -1.737 -2.079 1.00 0.00 H new ATOM 652 N VAL A 953 -13.267 -5.545 -0.236 1.00 0.00 N ATOM 653 CA VAL A 953 -13.070 -6.574 0.783 1.00 0.00 C ATOM 654 C VAL A 953 -12.146 -7.689 0.286 1.00 0.00 C ATOM 655 O VAL A 953 -11.324 -8.205 1.042 1.00 0.00 O ATOM 656 CB VAL A 953 -14.415 -7.185 1.226 1.00 0.00 C ATOM 657 CG1 VAL A 953 -14.211 -8.183 2.354 1.00 0.00 C ATOM 658 CG2 VAL A 953 -15.387 -6.092 1.647 1.00 0.00 C ATOM 0 H VAL A 953 -14.245 -5.349 -0.449 1.00 0.00 H new ATOM 0 HA VAL A 953 -12.601 -6.085 1.637 1.00 0.00 H new ATOM 0 HB VAL A 953 -14.842 -7.717 0.376 1.00 0.00 H new ATOM 0 HG11 VAL A 953 -15.174 -8.600 2.649 1.00 0.00 H new ATOM 0 HG12 VAL A 953 -13.556 -8.986 2.016 1.00 0.00 H new ATOM 0 HG13 VAL A 953 -13.757 -7.680 3.207 1.00 0.00 H new ATOM 0 HG21 VAL A 953 -16.330 -6.543 1.956 1.00 0.00 H new ATOM 0 HG22 VAL A 953 -14.964 -5.530 2.479 1.00 0.00 H new ATOM 0 HG23 VAL A 953 -15.564 -5.420 0.808 1.00 0.00 H new ATOM 668 N GLN A 954 -12.271 -8.031 -0.991 1.00 0.00 N ATOM 669 CA GLN A 954 -11.460 -9.089 -1.584 1.00 0.00 C ATOM 670 C GLN A 954 -10.009 -8.638 -1.729 1.00 0.00 C ATOM 671 O GLN A 954 -9.078 -9.391 -1.429 1.00 0.00 O ATOM 672 CB GLN A 954 -12.028 -9.486 -2.950 1.00 0.00 C ATOM 673 CG GLN A 954 -13.486 -9.916 -2.898 1.00 0.00 C ATOM 674 CD GLN A 954 -14.033 -10.323 -4.253 1.00 0.00 C ATOM 675 OE1 GLN A 954 -13.492 -9.748 -5.316 1.00 0.00 O flip ATOM 676 NE2 GLN A 954 -14.936 -11.155 -4.344 1.00 0.00 N flip ATOM 0 H GLN A 954 -12.927 -7.591 -1.637 1.00 0.00 H new ATOM 0 HA GLN A 954 -11.487 -9.956 -0.923 1.00 0.00 H new ATOM 0 HB2 GLN A 954 -11.930 -8.643 -3.634 1.00 0.00 H new ATOM 0 HB3 GLN A 954 -11.431 -10.301 -3.360 1.00 0.00 H new ATOM 0 HG2 GLN A 954 -13.588 -10.751 -2.205 1.00 0.00 H new ATOM 0 HG3 GLN A 954 -14.086 -9.098 -2.501 1.00 0.00 H new ATOM 0 HE21 GLN A 954 -15.328 -11.576 -3.502 1.00 0.00 H new ATOM 0 HE22 GLN A 954 -15.292 -11.423 -5.262 1.00 0.00 H new ATOM 685 N SER A 955 -9.821 -7.401 -2.174 1.00 0.00 N ATOM 686 CA SER A 955 -8.488 -6.834 -2.316 1.00 0.00 C ATOM 687 C SER A 955 -7.813 -6.696 -0.957 1.00 0.00 C ATOM 688 O SER A 955 -6.625 -6.983 -0.815 1.00 0.00 O ATOM 689 CB SER A 955 -8.567 -5.474 -3.002 1.00 0.00 C ATOM 690 OG SER A 955 -9.246 -5.570 -4.239 1.00 0.00 O ATOM 0 H SER A 955 -10.577 -6.772 -2.443 1.00 0.00 H new ATOM 0 HA SER A 955 -7.891 -7.508 -2.930 1.00 0.00 H new ATOM 0 HB2 SER A 955 -9.082 -4.765 -2.354 1.00 0.00 H new ATOM 0 HB3 SER A 955 -7.562 -5.085 -3.164 1.00 0.00 H new ATOM 0 HG SER A 955 -9.286 -4.686 -4.660 1.00 0.00 H new ATOM 696 N CYS A 956 -8.586 -6.275 0.043 1.00 0.00 N ATOM 697 CA CYS A 956 -8.079 -6.120 1.402 1.00 0.00 C ATOM 698 C CYS A 956 -7.473 -7.420 1.916 1.00 0.00 C ATOM 699 O CYS A 956 -6.510 -7.407 2.677 1.00 0.00 O ATOM 700 CB CYS A 956 -9.198 -5.665 2.339 1.00 0.00 C ATOM 701 SG CYS A 956 -9.886 -4.045 1.938 1.00 0.00 S ATOM 0 H CYS A 956 -9.571 -6.034 -0.066 1.00 0.00 H new ATOM 0 HA CYS A 956 -7.297 -5.361 1.381 1.00 0.00 H new ATOM 0 HB2 CYS A 956 -9.999 -6.404 2.315 1.00 0.00 H new ATOM 0 HB3 CYS A 956 -8.815 -5.642 3.359 1.00 0.00 H new ATOM 0 HG CYS A 956 -8.939 -3.267 1.504 1.00 0.00 H new ATOM 707 N LYS A 957 -8.040 -8.541 1.486 1.00 0.00 N ATOM 708 CA LYS A 957 -7.533 -9.850 1.869 1.00 0.00 C ATOM 709 C LYS A 957 -6.107 -10.041 1.356 1.00 0.00 C ATOM 710 O LYS A 957 -5.207 -10.401 2.116 1.00 0.00 O ATOM 711 CB LYS A 957 -8.446 -10.947 1.320 1.00 0.00 C ATOM 712 CG LYS A 957 -9.867 -10.878 1.859 1.00 0.00 C ATOM 713 CD LYS A 957 -10.796 -11.827 1.120 1.00 0.00 C ATOM 714 CE LYS A 957 -12.223 -11.730 1.637 1.00 0.00 C ATOM 715 NZ LYS A 957 -12.357 -12.259 3.020 1.00 0.00 N ATOM 0 H LYS A 957 -8.853 -8.568 0.871 1.00 0.00 H new ATOM 0 HA LYS A 957 -7.519 -9.915 2.957 1.00 0.00 H new ATOM 0 HB2 LYS A 957 -8.474 -10.875 0.233 1.00 0.00 H new ATOM 0 HB3 LYS A 957 -8.020 -11.920 1.564 1.00 0.00 H new ATOM 0 HG2 LYS A 957 -9.866 -11.124 2.921 1.00 0.00 H new ATOM 0 HG3 LYS A 957 -10.241 -9.858 1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 957 -10.778 -11.598 0.054 1.00 0.00 H new ATOM 0 HD3 LYS A 957 -10.437 -12.850 1.232 1.00 0.00 H new ATOM 0 HE2 LYS A 957 -12.545 -10.689 1.615 1.00 0.00 H new ATOM 0 HE3 LYS A 957 -12.887 -12.283 0.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 957 -13.361 -12.267 3.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 957 -11.980 -13.227 3.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 957 -11.825 -11.653 3.677 1.00 0.00 H new ATOM 729 N ALA A 958 -5.906 -9.768 0.074 1.00 0.00 N ATOM 730 CA ALA A 958 -4.599 -9.930 -0.551 1.00 0.00 C ATOM 731 C ALA A 958 -3.603 -8.905 -0.015 1.00 0.00 C ATOM 732 O ALA A 958 -2.444 -9.227 0.248 1.00 0.00 O ATOM 733 CB ALA A 958 -4.717 -9.815 -2.063 1.00 0.00 C ATOM 0 H ALA A 958 -6.634 -9.432 -0.556 1.00 0.00 H new ATOM 0 HA ALA A 958 -4.227 -10.924 -0.303 1.00 0.00 H new ATOM 0 HB1 ALA A 958 -3.733 -9.938 -2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 958 -5.387 -10.590 -2.436 1.00 0.00 H new ATOM 0 HB3 ALA A 958 -5.116 -8.835 -2.323 1.00 0.00 H new ATOM 739 N VAL A 959 -4.070 -7.670 0.155 1.00 0.00 N ATOM 740 CA VAL A 959 -3.225 -6.587 0.647 1.00 0.00 C ATOM 741 C VAL A 959 -2.753 -6.858 2.075 1.00 0.00 C ATOM 742 O VAL A 959 -1.582 -6.653 2.400 1.00 0.00 O ATOM 743 CB VAL A 959 -3.965 -5.229 0.596 1.00 0.00 C ATOM 744 CG1 VAL A 959 -3.124 -4.121 1.212 1.00 0.00 C ATOM 745 CG2 VAL A 959 -4.333 -4.872 -0.834 1.00 0.00 C ATOM 0 H VAL A 959 -5.032 -7.395 -0.042 1.00 0.00 H new ATOM 0 HA VAL A 959 -2.355 -6.538 -0.009 1.00 0.00 H new ATOM 0 HB VAL A 959 -4.880 -5.328 1.180 1.00 0.00 H new ATOM 0 HG11 VAL A 959 -3.670 -3.179 1.162 1.00 0.00 H new ATOM 0 HG12 VAL A 959 -2.911 -4.362 2.254 1.00 0.00 H new ATOM 0 HG13 VAL A 959 -2.187 -4.027 0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 959 -4.852 -3.914 -0.848 1.00 0.00 H new ATOM 0 HG22 VAL A 959 -3.427 -4.802 -1.436 1.00 0.00 H new ATOM 0 HG23 VAL A 959 -4.984 -5.643 -1.246 1.00 0.00 H new ATOM 755 N ALA A 960 -3.660 -7.351 2.915 1.00 0.00 N ATOM 756 CA ALA A 960 -3.355 -7.610 4.322 1.00 0.00 C ATOM 757 C ALA A 960 -2.238 -8.634 4.481 1.00 0.00 C ATOM 758 O ALA A 960 -1.563 -8.671 5.512 1.00 0.00 O ATOM 759 CB ALA A 960 -4.599 -8.077 5.058 1.00 0.00 C ATOM 0 H ALA A 960 -4.617 -7.580 2.645 1.00 0.00 H new ATOM 0 HA ALA A 960 -3.011 -6.672 4.758 1.00 0.00 H new ATOM 0 HB1 ALA A 960 -4.354 -8.265 6.103 1.00 0.00 H new ATOM 0 HB2 ALA A 960 -5.368 -7.307 4.998 1.00 0.00 H new ATOM 0 HB3 ALA A 960 -4.969 -8.995 4.601 1.00 0.00 H new ATOM 765 N GLU A 961 -2.044 -9.465 3.465 1.00 0.00 N ATOM 766 CA GLU A 961 -1.001 -10.481 3.504 1.00 0.00 C ATOM 767 C GLU A 961 0.346 -9.893 3.081 1.00 0.00 C ATOM 768 O GLU A 961 1.401 -10.443 3.399 1.00 0.00 O ATOM 769 CB GLU A 961 -1.365 -11.659 2.596 1.00 0.00 C ATOM 770 CG GLU A 961 -2.721 -12.277 2.905 1.00 0.00 C ATOM 771 CD GLU A 961 -2.852 -12.730 4.347 1.00 0.00 C ATOM 772 OE1 GLU A 961 -2.390 -13.844 4.674 1.00 0.00 O ATOM 773 OE2 GLU A 961 -3.413 -11.970 5.165 1.00 0.00 O ATOM 0 H GLU A 961 -2.594 -9.455 2.606 1.00 0.00 H new ATOM 0 HA GLU A 961 -0.917 -10.839 4.530 1.00 0.00 H new ATOM 0 HB2 GLU A 961 -1.357 -11.322 1.559 1.00 0.00 H new ATOM 0 HB3 GLU A 961 -0.597 -12.427 2.687 1.00 0.00 H new ATOM 0 HG2 GLU A 961 -3.503 -11.551 2.686 1.00 0.00 H new ATOM 0 HG3 GLU A 961 -2.884 -13.130 2.246 1.00 0.00 H new ATOM 780 N GLN A 962 0.306 -8.765 2.377 1.00 0.00 N ATOM 781 CA GLN A 962 1.519 -8.135 1.864 1.00 0.00 C ATOM 782 C GLN A 962 2.024 -7.040 2.803 1.00 0.00 C ATOM 783 O GLN A 962 3.213 -6.718 2.798 1.00 0.00 O ATOM 784 CB GLN A 962 1.267 -7.541 0.475 1.00 0.00 C ATOM 785 CG GLN A 962 1.011 -8.580 -0.603 1.00 0.00 C ATOM 786 CD GLN A 962 2.247 -9.397 -0.943 1.00 0.00 C ATOM 787 OE1 GLN A 962 3.417 -8.783 -0.859 1.00 0.00 O flip ATOM 788 NE2 GLN A 962 2.144 -10.569 -1.298 1.00 0.00 N flip ATOM 0 H GLN A 962 -0.555 -8.268 2.148 1.00 0.00 H new ATOM 0 HA GLN A 962 2.284 -8.909 1.796 1.00 0.00 H new ATOM 0 HB2 GLN A 962 0.411 -6.869 0.528 1.00 0.00 H new ATOM 0 HB3 GLN A 962 2.128 -6.938 0.187 1.00 0.00 H new ATOM 0 HG2 GLN A 962 0.218 -9.251 -0.273 1.00 0.00 H new ATOM 0 HG3 GLN A 962 0.652 -8.081 -1.503 1.00 0.00 H new ATOM 0 HE21 GLN A 962 1.224 -11.007 -1.350 1.00 0.00 H new ATOM 0 HE22 GLN A 962 2.978 -11.104 -1.540 1.00 0.00 H new ATOM 797 N ILE A 963 1.120 -6.475 3.601 1.00 0.00 N ATOM 798 CA ILE A 963 1.471 -5.401 4.538 1.00 0.00 C ATOM 799 C ILE A 963 2.646 -5.789 5.450 1.00 0.00 C ATOM 800 O ILE A 963 3.654 -5.081 5.485 1.00 0.00 O ATOM 801 CB ILE A 963 0.264 -4.969 5.405 1.00 0.00 C ATOM 802 CG1 ILE A 963 -0.849 -4.404 4.521 1.00 0.00 C ATOM 803 CG2 ILE A 963 0.688 -3.942 6.449 1.00 0.00 C ATOM 804 CD1 ILE A 963 -2.085 -3.995 5.292 1.00 0.00 C ATOM 0 H ILE A 963 0.136 -6.742 3.620 1.00 0.00 H new ATOM 0 HA ILE A 963 1.776 -4.556 3.921 1.00 0.00 H new ATOM 0 HB ILE A 963 -0.116 -5.848 5.926 1.00 0.00 H new ATOM 0 HG12 ILE A 963 -0.467 -3.540 3.978 1.00 0.00 H new ATOM 0 HG13 ILE A 963 -1.125 -5.151 3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 963 -0.176 -3.653 7.047 1.00 0.00 H new ATOM 0 HG22 ILE A 963 1.449 -4.376 7.098 1.00 0.00 H new ATOM 0 HG23 ILE A 963 1.095 -3.062 5.950 1.00 0.00 H new ATOM 0 HD11 ILE A 963 -2.832 -3.604 4.601 1.00 0.00 H new ATOM 0 HD12 ILE A 963 -2.492 -4.861 5.814 1.00 0.00 H new ATOM 0 HD13 ILE A 963 -1.823 -3.225 6.017 1.00 0.00 H new ATOM 816 N PRO A 964 2.556 -6.915 6.197 1.00 0.00 N ATOM 817 CA PRO A 964 3.648 -7.354 7.072 1.00 0.00 C ATOM 818 C PRO A 964 4.936 -7.602 6.297 1.00 0.00 C ATOM 819 O PRO A 964 6.029 -7.349 6.797 1.00 0.00 O ATOM 820 CB PRO A 964 3.130 -8.660 7.691 1.00 0.00 C ATOM 821 CG PRO A 964 2.011 -9.095 6.808 1.00 0.00 C ATOM 822 CD PRO A 964 1.406 -7.834 6.263 1.00 0.00 C ATOM 0 HA PRO A 964 3.899 -6.598 7.816 1.00 0.00 H new ATOM 0 HB2 PRO A 964 3.915 -9.415 7.732 1.00 0.00 H new ATOM 0 HB3 PRO A 964 2.786 -8.502 8.713 1.00 0.00 H new ATOM 0 HG2 PRO A 964 2.374 -9.734 6.003 1.00 0.00 H new ATOM 0 HG3 PRO A 964 1.274 -9.673 7.366 1.00 0.00 H new ATOM 0 HD2 PRO A 964 0.959 -7.992 5.281 1.00 0.00 H new ATOM 0 HD3 PRO A 964 0.620 -7.450 6.913 1.00 0.00 H new ATOM 830 N LEU A 965 4.797 -8.074 5.062 1.00 0.00 N ATOM 831 CA LEU A 965 5.947 -8.360 4.213 1.00 0.00 C ATOM 832 C LEU A 965 6.708 -7.083 3.886 1.00 0.00 C ATOM 833 O LEU A 965 7.941 -7.084 3.835 1.00 0.00 O ATOM 834 CB LEU A 965 5.505 -9.064 2.931 1.00 0.00 C ATOM 835 CG LEU A 965 4.934 -10.467 3.141 1.00 0.00 C ATOM 836 CD1 LEU A 965 4.481 -11.064 1.818 1.00 0.00 C ATOM 837 CD2 LEU A 965 5.971 -11.359 3.807 1.00 0.00 C ATOM 0 H LEU A 965 3.895 -8.267 4.626 1.00 0.00 H new ATOM 0 HA LEU A 965 6.616 -9.025 4.759 1.00 0.00 H new ATOM 0 HB2 LEU A 965 4.753 -8.450 2.435 1.00 0.00 H new ATOM 0 HB3 LEU A 965 6.358 -9.130 2.256 1.00 0.00 H new ATOM 0 HG LEU A 965 4.065 -10.396 3.795 1.00 0.00 H new ATOM 0 HD11 LEU A 965 4.078 -12.062 1.988 1.00 0.00 H new ATOM 0 HD12 LEU A 965 3.710 -10.431 1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 965 5.330 -11.127 1.137 1.00 0.00 H new ATOM 0 HD21 LEU A 965 5.554 -12.356 3.952 1.00 0.00 H new ATOM 0 HD22 LEU A 965 6.856 -11.424 3.174 1.00 0.00 H new ATOM 0 HD23 LEU A 965 6.247 -10.937 4.773 1.00 0.00 H new ATOM 849 N LEU A 966 5.971 -5.996 3.674 1.00 0.00 N ATOM 850 CA LEU A 966 6.580 -4.686 3.486 1.00 0.00 C ATOM 851 C LEU A 966 7.455 -4.345 4.677 1.00 0.00 C ATOM 852 O LEU A 966 8.650 -4.104 4.534 1.00 0.00 O ATOM 853 CB LEU A 966 5.517 -3.597 3.345 1.00 0.00 C ATOM 854 CG LEU A 966 4.669 -3.641 2.083 1.00 0.00 C ATOM 855 CD1 LEU A 966 3.638 -2.528 2.129 1.00 0.00 C ATOM 856 CD2 LEU A 966 5.544 -3.510 0.846 1.00 0.00 C ATOM 0 H LEU A 966 4.952 -5.998 3.628 1.00 0.00 H new ATOM 0 HA LEU A 966 7.175 -4.728 2.574 1.00 0.00 H new ATOM 0 HB2 LEU A 966 4.852 -3.655 4.206 1.00 0.00 H new ATOM 0 HB3 LEU A 966 6.013 -2.627 3.390 1.00 0.00 H new ATOM 0 HG LEU A 966 4.156 -4.601 2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 966 3.029 -2.558 1.225 1.00 0.00 H new ATOM 0 HD12 LEU A 966 2.998 -2.660 3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 966 4.145 -1.565 2.193 1.00 0.00 H new ATOM 0 HD21 LEU A 966 4.919 -3.544 -0.047 1.00 0.00 H new ATOM 0 HD22 LEU A 966 6.080 -2.561 0.878 1.00 0.00 H new ATOM 0 HD23 LEU A 966 6.261 -4.331 0.819 1.00 0.00 H new ATOM 868 N VAL A 967 6.844 -4.361 5.852 1.00 0.00 N ATOM 869 CA VAL A 967 7.515 -3.962 7.080 1.00 0.00 C ATOM 870 C VAL A 967 8.688 -4.888 7.400 1.00 0.00 C ATOM 871 O VAL A 967 9.722 -4.433 7.890 1.00 0.00 O ATOM 872 CB VAL A 967 6.522 -3.921 8.257 1.00 0.00 C ATOM 873 CG1 VAL A 967 7.209 -3.465 9.537 1.00 0.00 C ATOM 874 CG2 VAL A 967 5.355 -3.004 7.913 1.00 0.00 C ATOM 0 H VAL A 967 5.874 -4.649 5.981 1.00 0.00 H new ATOM 0 HA VAL A 967 7.913 -2.959 6.928 1.00 0.00 H new ATOM 0 HB VAL A 967 6.142 -4.928 8.429 1.00 0.00 H new ATOM 0 HG11 VAL A 967 6.485 -3.445 10.351 1.00 0.00 H new ATOM 0 HG12 VAL A 967 8.014 -4.157 9.784 1.00 0.00 H new ATOM 0 HG13 VAL A 967 7.620 -2.466 9.393 1.00 0.00 H new ATOM 0 HG21 VAL A 967 4.655 -2.978 8.748 1.00 0.00 H new ATOM 0 HG22 VAL A 967 5.727 -1.998 7.720 1.00 0.00 H new ATOM 0 HG23 VAL A 967 4.847 -3.380 7.025 1.00 0.00 H new ATOM 884 N GLN A 968 8.538 -6.178 7.110 1.00 0.00 N ATOM 885 CA GLN A 968 9.642 -7.123 7.254 1.00 0.00 C ATOM 886 C GLN A 968 10.817 -6.692 6.380 1.00 0.00 C ATOM 887 O GLN A 968 11.972 -6.720 6.813 1.00 0.00 O ATOM 888 CB GLN A 968 9.210 -8.542 6.878 1.00 0.00 C ATOM 889 CG GLN A 968 8.265 -9.185 7.883 1.00 0.00 C ATOM 890 CD GLN A 968 7.857 -10.589 7.478 1.00 0.00 C ATOM 891 OE1 GLN A 968 8.608 -11.298 6.810 1.00 0.00 O ATOM 892 NE2 GLN A 968 6.664 -10.998 7.878 1.00 0.00 N ATOM 0 H GLN A 968 7.668 -6.591 6.776 1.00 0.00 H new ATOM 0 HA GLN A 968 9.948 -7.125 8.300 1.00 0.00 H new ATOM 0 HB2 GLN A 968 8.725 -8.517 5.902 1.00 0.00 H new ATOM 0 HB3 GLN A 968 10.097 -9.167 6.777 1.00 0.00 H new ATOM 0 HG2 GLN A 968 8.746 -9.217 8.861 1.00 0.00 H new ATOM 0 HG3 GLN A 968 7.374 -8.566 7.987 1.00 0.00 H new ATOM 0 HE21 GLN A 968 6.071 -10.379 8.431 1.00 0.00 H new ATOM 0 HE22 GLN A 968 6.337 -11.933 7.634 1.00 0.00 H new ATOM 901 N GLY A 969 10.506 -6.277 5.158 1.00 0.00 N ATOM 902 CA GLY A 969 11.527 -5.764 4.264 1.00 0.00 C ATOM 903 C GLY A 969 12.119 -4.461 4.767 1.00 0.00 C ATOM 904 O GLY A 969 13.336 -4.275 4.740 1.00 0.00 O ATOM 0 H GLY A 969 9.563 -6.287 4.769 1.00 0.00 H new ATOM 0 HA2 GLY A 969 12.319 -6.504 4.156 1.00 0.00 H new ATOM 0 HA3 GLY A 969 11.098 -5.609 3.274 1.00 0.00 H new ATOM 908 N VAL A 970 11.251 -3.562 5.235 1.00 0.00 N ATOM 909 CA VAL A 970 11.689 -2.284 5.799 1.00 0.00 C ATOM 910 C VAL A 970 12.660 -2.524 6.955 1.00 0.00 C ATOM 911 O VAL A 970 13.693 -1.865 7.062 1.00 0.00 O ATOM 912 CB VAL A 970 10.496 -1.434 6.305 1.00 0.00 C ATOM 913 CG1 VAL A 970 10.965 -0.063 6.770 1.00 0.00 C ATOM 914 CG2 VAL A 970 9.427 -1.285 5.230 1.00 0.00 C ATOM 0 H VAL A 970 10.240 -3.696 5.234 1.00 0.00 H new ATOM 0 HA VAL A 970 12.186 -1.733 5.000 1.00 0.00 H new ATOM 0 HB VAL A 970 10.057 -1.959 7.153 1.00 0.00 H new ATOM 0 HG11 VAL A 970 10.110 0.515 7.120 1.00 0.00 H new ATOM 0 HG12 VAL A 970 11.681 -0.180 7.583 1.00 0.00 H new ATOM 0 HG13 VAL A 970 11.440 0.460 5.940 1.00 0.00 H new ATOM 0 HG21 VAL A 970 8.604 -0.684 5.616 1.00 0.00 H new ATOM 0 HG22 VAL A 970 9.856 -0.795 4.356 1.00 0.00 H new ATOM 0 HG23 VAL A 970 9.055 -2.270 4.947 1.00 0.00 H new ATOM 924 N ARG A 971 12.323 -3.488 7.811 1.00 0.00 N ATOM 925 CA ARG A 971 13.187 -3.875 8.924 1.00 0.00 C ATOM 926 C ARG A 971 14.565 -4.294 8.428 1.00 0.00 C ATOM 927 O ARG A 971 15.580 -3.944 9.031 1.00 0.00 O ATOM 928 CB ARG A 971 12.566 -5.028 9.711 1.00 0.00 C ATOM 929 CG ARG A 971 11.390 -4.627 10.584 1.00 0.00 C ATOM 930 CD ARG A 971 10.782 -5.839 11.264 1.00 0.00 C ATOM 931 NE ARG A 971 11.795 -6.640 11.955 1.00 0.00 N ATOM 932 CZ ARG A 971 11.823 -7.974 11.949 1.00 0.00 C ATOM 933 NH1 ARG A 971 10.852 -8.659 11.359 1.00 0.00 N ATOM 934 NH2 ARG A 971 12.814 -8.624 12.546 1.00 0.00 N ATOM 0 H ARG A 971 11.453 -4.017 7.754 1.00 0.00 H new ATOM 0 HA ARG A 971 13.293 -3.006 9.574 1.00 0.00 H new ATOM 0 HB2 ARG A 971 12.238 -5.796 9.010 1.00 0.00 H new ATOM 0 HB3 ARG A 971 13.334 -5.478 10.340 1.00 0.00 H new ATOM 0 HG2 ARG A 971 11.718 -3.910 11.336 1.00 0.00 H new ATOM 0 HG3 ARG A 971 10.634 -4.129 9.977 1.00 0.00 H new ATOM 0 HD2 ARG A 971 10.026 -5.514 11.979 1.00 0.00 H new ATOM 0 HD3 ARG A 971 10.275 -6.456 10.522 1.00 0.00 H new ATOM 0 HE ARG A 971 12.523 -6.148 12.472 1.00 0.00 H new ATOM 0 HH11 ARG A 971 10.081 -8.166 10.908 1.00 0.00 H new ATOM 0 HH12 ARG A 971 10.876 -9.679 11.356 1.00 0.00 H new ATOM 0 HH21 ARG A 971 13.558 -8.104 13.012 1.00 0.00 H new ATOM 0 HH22 ARG A 971 12.832 -9.644 12.539 1.00 0.00 H new ATOM 948 N GLY A 972 14.589 -5.035 7.326 1.00 0.00 N ATOM 949 CA GLY A 972 15.844 -5.502 6.767 1.00 0.00 C ATOM 950 C GLY A 972 16.766 -4.363 6.385 1.00 0.00 C ATOM 951 O GLY A 972 17.952 -4.380 6.718 1.00 0.00 O ATOM 0 H GLY A 972 13.758 -5.322 6.808 1.00 0.00 H new ATOM 0 HA2 GLY A 972 16.345 -6.144 7.492 1.00 0.00 H new ATOM 0 HA3 GLY A 972 15.642 -6.113 5.887 1.00 0.00 H new ATOM 955 N SER A 973 16.221 -3.364 5.701 1.00 0.00 N ATOM 956 CA SER A 973 17.013 -2.221 5.268 1.00 0.00 C ATOM 957 C SER A 973 17.439 -1.376 6.467 1.00 0.00 C ATOM 958 O SER A 973 18.536 -0.816 6.485 1.00 0.00 O ATOM 959 CB SER A 973 16.224 -1.369 4.271 1.00 0.00 C ATOM 960 OG SER A 973 17.051 -0.385 3.673 1.00 0.00 O ATOM 0 H SER A 973 15.237 -3.323 5.435 1.00 0.00 H new ATOM 0 HA SER A 973 17.909 -2.594 4.773 1.00 0.00 H new ATOM 0 HB2 SER A 973 15.798 -2.009 3.498 1.00 0.00 H new ATOM 0 HB3 SER A 973 15.390 -0.887 4.781 1.00 0.00 H new ATOM 0 HG SER A 973 16.933 0.469 4.140 1.00 0.00 H new ATOM 966 N GLN A 974 16.572 -1.291 7.474 1.00 0.00 N ATOM 967 CA GLN A 974 16.896 -0.569 8.702 1.00 0.00 C ATOM 968 C GLN A 974 18.061 -1.240 9.424 1.00 0.00 C ATOM 969 O GLN A 974 18.928 -0.568 9.982 1.00 0.00 O ATOM 970 CB GLN A 974 15.679 -0.497 9.631 1.00 0.00 C ATOM 971 CG GLN A 974 14.545 0.363 9.099 1.00 0.00 C ATOM 972 CD GLN A 974 13.337 0.368 10.017 1.00 0.00 C ATOM 973 OE1 GLN A 974 12.426 -0.567 9.798 1.00 0.00 O flip ATOM 974 NE2 GLN A 974 13.222 1.206 10.912 1.00 0.00 N flip ATOM 0 H GLN A 974 15.643 -1.712 7.464 1.00 0.00 H new ATOM 0 HA GLN A 974 17.185 0.446 8.429 1.00 0.00 H new ATOM 0 HB2 GLN A 974 15.306 -1.507 9.803 1.00 0.00 H new ATOM 0 HB3 GLN A 974 15.995 -0.105 10.598 1.00 0.00 H new ATOM 0 HG2 GLN A 974 14.900 1.385 8.966 1.00 0.00 H new ATOM 0 HG3 GLN A 974 14.248 -0.001 8.116 1.00 0.00 H new ATOM 0 HE21 GLN A 974 13.947 1.910 11.048 1.00 0.00 H new ATOM 0 HE22 GLN A 974 12.401 1.196 11.518 1.00 0.00 H new ATOM 983 N ALA A 975 18.075 -2.566 9.400 1.00 0.00 N ATOM 984 CA ALA A 975 19.137 -3.331 10.034 1.00 0.00 C ATOM 985 C ALA A 975 20.434 -3.216 9.241 1.00 0.00 C ATOM 986 O ALA A 975 21.468 -2.812 9.778 1.00 0.00 O ATOM 987 CB ALA A 975 18.731 -4.789 10.174 1.00 0.00 C ATOM 0 H ALA A 975 17.360 -3.134 8.946 1.00 0.00 H new ATOM 0 HA ALA A 975 19.306 -2.919 11.029 1.00 0.00 H new ATOM 0 HB1 ALA A 975 19.537 -5.347 10.650 1.00 0.00 H new ATOM 0 HB2 ALA A 975 17.831 -4.859 10.785 1.00 0.00 H new ATOM 0 HB3 ALA A 975 18.533 -5.208 9.187 1.00 0.00 H new ATOM 993 N GLN A 976 20.372 -3.564 7.962 1.00 0.00 N ATOM 994 CA GLN A 976 21.548 -3.524 7.104 1.00 0.00 C ATOM 995 C GLN A 976 21.219 -2.912 5.749 1.00 0.00 C ATOM 996 O GLN A 976 20.751 -3.605 4.845 1.00 0.00 O ATOM 997 CB GLN A 976 22.113 -4.931 6.896 1.00 0.00 C ATOM 998 CG GLN A 976 22.717 -5.548 8.143 1.00 0.00 C ATOM 999 CD GLN A 976 23.142 -6.983 7.920 1.00 0.00 C ATOM 1000 OE1 GLN A 976 22.367 -7.911 8.143 1.00 0.00 O ATOM 1001 NE2 GLN A 976 24.370 -7.177 7.471 1.00 0.00 N ATOM 0 H GLN A 976 19.520 -3.877 7.497 1.00 0.00 H new ATOM 0 HA GLN A 976 22.293 -2.903 7.601 1.00 0.00 H new ATOM 0 HB2 GLN A 976 21.317 -5.580 6.532 1.00 0.00 H new ATOM 0 HB3 GLN A 976 22.875 -4.893 6.117 1.00 0.00 H new ATOM 0 HG2 GLN A 976 23.579 -4.960 8.457 1.00 0.00 H new ATOM 0 HG3 GLN A 976 21.991 -5.507 8.955 1.00 0.00 H new ATOM 0 HE21 GLN A 976 24.982 -6.379 7.299 1.00 0.00 H new ATOM 0 HE22 GLN A 976 24.706 -8.124 7.297 1.00 0.00 H new ATOM 1010 N PRO A 977 21.457 -1.603 5.586 1.00 0.00 N ATOM 1011 CA PRO A 977 21.274 -0.929 4.299 1.00 0.00 C ATOM 1012 C PRO A 977 22.288 -1.416 3.270 1.00 0.00 C ATOM 1013 O PRO A 977 22.076 -1.314 2.061 1.00 0.00 O ATOM 1014 CB PRO A 977 21.500 0.551 4.625 1.00 0.00 C ATOM 1015 CG PRO A 977 22.314 0.553 5.875 1.00 0.00 C ATOM 1016 CD PRO A 977 21.909 -0.676 6.640 1.00 0.00 C ATOM 0 HA PRO A 977 20.294 -1.124 3.863 1.00 0.00 H new ATOM 0 HB2 PRO A 977 22.022 1.058 3.814 1.00 0.00 H new ATOM 0 HB3 PRO A 977 20.554 1.072 4.770 1.00 0.00 H new ATOM 0 HG2 PRO A 977 23.380 0.536 5.646 1.00 0.00 H new ATOM 0 HG3 PRO A 977 22.128 1.454 6.459 1.00 0.00 H new ATOM 0 HD2 PRO A 977 22.743 -1.089 7.207 1.00 0.00 H new ATOM 0 HD3 PRO A 977 21.114 -0.461 7.354 1.00 0.00 H new ATOM 1024 N ASP A 978 23.387 -1.965 3.776 1.00 0.00 N ATOM 1025 CA ASP A 978 24.464 -2.484 2.943 1.00 0.00 C ATOM 1026 C ASP A 978 24.105 -3.856 2.391 1.00 0.00 C ATOM 1027 O ASP A 978 24.757 -4.355 1.475 1.00 0.00 O ATOM 1028 CB ASP A 978 25.755 -2.608 3.759 1.00 0.00 C ATOM 1029 CG ASP A 978 26.188 -1.307 4.403 1.00 0.00 C ATOM 1030 OD1 ASP A 978 25.430 -0.773 5.234 1.00 0.00 O ATOM 1031 OD2 ASP A 978 27.269 -0.792 4.043 1.00 0.00 O ATOM 0 H ASP A 978 23.556 -2.062 4.777 1.00 0.00 H new ATOM 0 HA ASP A 978 24.611 -1.787 2.118 1.00 0.00 H new ATOM 0 HB2 ASP A 978 25.614 -3.360 4.536 1.00 0.00 H new ATOM 0 HB3 ASP A 978 26.553 -2.966 3.109 1.00 0.00 H new ATOM 1036 N SER A 979 23.076 -4.465 2.961 1.00 0.00 N ATOM 1037 CA SER A 979 22.686 -5.817 2.593 1.00 0.00 C ATOM 1038 C SER A 979 21.813 -5.815 1.344 1.00 0.00 C ATOM 1039 O SER A 979 20.702 -5.288 1.355 1.00 0.00 O ATOM 1040 CB SER A 979 21.938 -6.482 3.755 1.00 0.00 C ATOM 1041 OG SER A 979 21.446 -7.764 3.394 1.00 0.00 O ATOM 0 H SER A 979 22.494 -4.042 3.684 1.00 0.00 H new ATOM 0 HA SER A 979 23.591 -6.385 2.375 1.00 0.00 H new ATOM 0 HB2 SER A 979 22.605 -6.576 4.612 1.00 0.00 H new ATOM 0 HB3 SER A 979 21.108 -5.847 4.065 1.00 0.00 H new ATOM 0 HG SER A 979 20.976 -8.161 4.157 1.00 0.00 H new ATOM 1047 N PRO A 980 22.308 -6.412 0.246 1.00 0.00 N ATOM 1048 CA PRO A 980 21.529 -6.565 -0.981 1.00 0.00 C ATOM 1049 C PRO A 980 20.350 -7.502 -0.763 1.00 0.00 C ATOM 1050 O PRO A 980 19.270 -7.304 -1.317 1.00 0.00 O ATOM 1051 CB PRO A 980 22.520 -7.173 -1.984 1.00 0.00 C ATOM 1052 CG PRO A 980 23.869 -6.986 -1.374 1.00 0.00 C ATOM 1053 CD PRO A 980 23.659 -6.978 0.111 1.00 0.00 C ATOM 0 HA PRO A 980 21.108 -5.620 -1.324 1.00 0.00 H new ATOM 0 HB2 PRO A 980 22.309 -8.229 -2.154 1.00 0.00 H new ATOM 0 HB3 PRO A 980 22.454 -6.675 -2.952 1.00 0.00 H new ATOM 0 HG2 PRO A 980 24.544 -7.790 -1.667 1.00 0.00 H new ATOM 0 HG3 PRO A 980 24.321 -6.052 -1.708 1.00 0.00 H new ATOM 0 HD2 PRO A 980 23.722 -7.981 0.534 1.00 0.00 H new ATOM 0 HD3 PRO A 980 24.405 -6.370 0.622 1.00 0.00 H new ATOM 1061 N SER A 981 20.566 -8.508 0.078 1.00 0.00 N ATOM 1062 CA SER A 981 19.537 -9.485 0.397 1.00 0.00 C ATOM 1063 C SER A 981 18.355 -8.816 1.095 1.00 0.00 C ATOM 1064 O SER A 981 17.194 -9.109 0.794 1.00 0.00 O ATOM 1065 CB SER A 981 20.125 -10.577 1.287 1.00 0.00 C ATOM 1066 OG SER A 981 21.305 -11.112 0.711 1.00 0.00 O ATOM 0 H SER A 981 21.454 -8.667 0.554 1.00 0.00 H new ATOM 0 HA SER A 981 19.177 -9.931 -0.530 1.00 0.00 H new ATOM 0 HB2 SER A 981 20.348 -10.169 2.273 1.00 0.00 H new ATOM 0 HB3 SER A 981 19.392 -11.371 1.430 1.00 0.00 H new ATOM 0 HG SER A 981 21.668 -11.809 1.297 1.00 0.00 H new ATOM 1072 N ALA A 982 18.661 -7.907 2.016 1.00 0.00 N ATOM 1073 CA ALA A 982 17.631 -7.169 2.733 1.00 0.00 C ATOM 1074 C ALA A 982 16.860 -6.266 1.779 1.00 0.00 C ATOM 1075 O ALA A 982 15.640 -6.142 1.874 1.00 0.00 O ATOM 1076 CB ALA A 982 18.251 -6.353 3.854 1.00 0.00 C ATOM 0 H ALA A 982 19.615 -7.665 2.282 1.00 0.00 H new ATOM 0 HA ALA A 982 16.933 -7.883 3.169 1.00 0.00 H new ATOM 0 HB1 ALA A 982 17.469 -5.806 4.381 1.00 0.00 H new ATOM 0 HB2 ALA A 982 18.761 -7.019 4.550 1.00 0.00 H new ATOM 0 HB3 ALA A 982 18.969 -5.647 3.436 1.00 0.00 H new ATOM 1082 N GLN A 983 17.583 -5.653 0.848 1.00 0.00 N ATOM 1083 CA GLN A 983 16.965 -4.785 -0.142 1.00 0.00 C ATOM 1084 C GLN A 983 16.058 -5.579 -1.070 1.00 0.00 C ATOM 1085 O GLN A 983 14.947 -5.153 -1.366 1.00 0.00 O ATOM 1086 CB GLN A 983 18.017 -4.039 -0.959 1.00 0.00 C ATOM 1087 CG GLN A 983 18.870 -3.098 -0.132 1.00 0.00 C ATOM 1088 CD GLN A 983 18.054 -2.251 0.827 1.00 0.00 C ATOM 1089 OE1 GLN A 983 16.890 -1.942 0.570 1.00 0.00 O ATOM 1090 NE2 GLN A 983 18.662 -1.868 1.936 1.00 0.00 N ATOM 0 H GLN A 983 18.595 -5.742 0.760 1.00 0.00 H new ATOM 0 HA GLN A 983 16.364 -4.053 0.397 1.00 0.00 H new ATOM 0 HB2 GLN A 983 18.664 -4.764 -1.452 1.00 0.00 H new ATOM 0 HB3 GLN A 983 17.519 -3.470 -1.744 1.00 0.00 H new ATOM 0 HG2 GLN A 983 19.599 -3.679 0.434 1.00 0.00 H new ATOM 0 HG3 GLN A 983 19.432 -2.444 -0.799 1.00 0.00 H new ATOM 0 HE21 GLN A 983 19.628 -2.146 2.110 1.00 0.00 H new ATOM 0 HE22 GLN A 983 18.166 -1.294 2.618 1.00 0.00 H new ATOM 1099 N LEU A 984 16.535 -6.738 -1.514 1.00 0.00 N ATOM 1100 CA LEU A 984 15.753 -7.604 -2.391 1.00 0.00 C ATOM 1101 C LEU A 984 14.412 -7.948 -1.758 1.00 0.00 C ATOM 1102 O LEU A 984 13.392 -7.993 -2.438 1.00 0.00 O ATOM 1103 CB LEU A 984 16.521 -8.888 -2.712 1.00 0.00 C ATOM 1104 CG LEU A 984 17.793 -8.699 -3.541 1.00 0.00 C ATOM 1105 CD1 LEU A 984 18.503 -10.029 -3.733 1.00 0.00 C ATOM 1106 CD2 LEU A 984 17.468 -8.069 -4.887 1.00 0.00 C ATOM 0 H LEU A 984 17.460 -7.100 -1.281 1.00 0.00 H new ATOM 0 HA LEU A 984 15.573 -7.061 -3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 984 16.787 -9.377 -1.775 1.00 0.00 H new ATOM 0 HB3 LEU A 984 15.856 -9.566 -3.247 1.00 0.00 H new ATOM 0 HG LEU A 984 18.458 -8.026 -3.001 1.00 0.00 H new ATOM 0 HD11 LEU A 984 19.406 -9.877 -4.325 1.00 0.00 H new ATOM 0 HD12 LEU A 984 18.772 -10.442 -2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 984 17.842 -10.723 -4.252 1.00 0.00 H new ATOM 0 HD21 LEU A 984 18.386 -7.943 -5.461 1.00 0.00 H new ATOM 0 HD22 LEU A 984 16.783 -8.716 -5.435 1.00 0.00 H new ATOM 0 HD23 LEU A 984 17.002 -7.096 -4.730 1.00 0.00 H new ATOM 1118 N ALA A 985 14.419 -8.175 -0.450 1.00 0.00 N ATOM 1119 CA ALA A 985 13.193 -8.469 0.277 1.00 0.00 C ATOM 1120 C ALA A 985 12.239 -7.280 0.227 1.00 0.00 C ATOM 1121 O ALA A 985 11.057 -7.433 -0.078 1.00 0.00 O ATOM 1122 CB ALA A 985 13.505 -8.841 1.720 1.00 0.00 C ATOM 0 H ALA A 985 15.260 -8.161 0.127 1.00 0.00 H new ATOM 0 HA ALA A 985 12.707 -9.319 -0.202 1.00 0.00 H new ATOM 0 HB1 ALA A 985 12.577 -9.058 2.249 1.00 0.00 H new ATOM 0 HB2 ALA A 985 14.147 -9.722 1.738 1.00 0.00 H new ATOM 0 HB3 ALA A 985 14.015 -8.010 2.208 1.00 0.00 H new ATOM 1128 N LEU A 986 12.771 -6.094 0.506 1.00 0.00 N ATOM 1129 CA LEU A 986 11.977 -4.870 0.512 1.00 0.00 C ATOM 1130 C LEU A 986 11.434 -4.580 -0.890 1.00 0.00 C ATOM 1131 O LEU A 986 10.230 -4.395 -1.072 1.00 0.00 O ATOM 1132 CB LEU A 986 12.830 -3.693 1.002 1.00 0.00 C ATOM 1133 CG LEU A 986 12.110 -2.672 1.897 1.00 0.00 C ATOM 1134 CD1 LEU A 986 13.059 -1.554 2.291 1.00 0.00 C ATOM 1135 CD2 LEU A 986 10.879 -2.101 1.210 1.00 0.00 C ATOM 0 H LEU A 986 13.756 -5.954 0.732 1.00 0.00 H new ATOM 0 HA LEU A 986 11.134 -5.003 1.190 1.00 0.00 H new ATOM 0 HB2 LEU A 986 13.683 -4.091 1.551 1.00 0.00 H new ATOM 0 HB3 LEU A 986 13.227 -3.169 0.132 1.00 0.00 H new ATOM 0 HG LEU A 986 11.780 -3.192 2.797 1.00 0.00 H new ATOM 0 HD11 LEU A 986 12.535 -0.838 2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 986 13.905 -1.971 2.837 1.00 0.00 H new ATOM 0 HD13 LEU A 986 13.419 -1.049 1.394 1.00 0.00 H new ATOM 0 HD21 LEU A 986 10.394 -1.383 1.871 1.00 0.00 H new ATOM 0 HD22 LEU A 986 11.176 -1.602 0.287 1.00 0.00 H new ATOM 0 HD23 LEU A 986 10.184 -2.908 0.979 1.00 0.00 H new ATOM 1147 N ILE A 987 12.331 -4.565 -1.872 1.00 0.00 N ATOM 1148 CA ILE A 987 11.974 -4.258 -3.255 1.00 0.00 C ATOM 1149 C ILE A 987 10.913 -5.224 -3.781 1.00 0.00 C ATOM 1150 O ILE A 987 9.891 -4.798 -4.328 1.00 0.00 O ATOM 1151 CB ILE A 987 13.215 -4.308 -4.177 1.00 0.00 C ATOM 1152 CG1 ILE A 987 14.262 -3.293 -3.707 1.00 0.00 C ATOM 1153 CG2 ILE A 987 12.819 -4.037 -5.624 1.00 0.00 C ATOM 1154 CD1 ILE A 987 15.600 -3.422 -4.408 1.00 0.00 C ATOM 0 H ILE A 987 13.322 -4.764 -1.733 1.00 0.00 H new ATOM 0 HA ILE A 987 11.567 -3.247 -3.262 1.00 0.00 H new ATOM 0 HB ILE A 987 13.648 -5.307 -4.124 1.00 0.00 H new ATOM 0 HG12 ILE A 987 13.875 -2.286 -3.866 1.00 0.00 H new ATOM 0 HG13 ILE A 987 14.412 -3.411 -2.634 1.00 0.00 H new ATOM 0 HG21 ILE A 987 13.705 -4.076 -6.257 1.00 0.00 H new ATOM 0 HG22 ILE A 987 12.104 -4.791 -5.953 1.00 0.00 H new ATOM 0 HG23 ILE A 987 12.364 -3.049 -5.698 1.00 0.00 H new ATOM 0 HD11 ILE A 987 16.287 -2.670 -4.021 1.00 0.00 H new ATOM 0 HD12 ILE A 987 16.011 -4.416 -4.228 1.00 0.00 H new ATOM 0 HD13 ILE A 987 15.465 -3.274 -5.479 1.00 0.00 H new ATOM 1166 N ALA A 988 11.151 -6.518 -3.595 1.00 0.00 N ATOM 1167 CA ALA A 988 10.229 -7.541 -4.075 1.00 0.00 C ATOM 1168 C ALA A 988 8.855 -7.385 -3.438 1.00 0.00 C ATOM 1169 O ALA A 988 7.838 -7.373 -4.134 1.00 0.00 O ATOM 1170 CB ALA A 988 10.788 -8.929 -3.800 1.00 0.00 C ATOM 0 H ALA A 988 11.974 -6.883 -3.116 1.00 0.00 H new ATOM 0 HA ALA A 988 10.116 -7.415 -5.152 1.00 0.00 H new ATOM 0 HB1 ALA A 988 10.089 -9.682 -4.164 1.00 0.00 H new ATOM 0 HB2 ALA A 988 11.744 -9.044 -4.311 1.00 0.00 H new ATOM 0 HB3 ALA A 988 10.933 -9.057 -2.727 1.00 0.00 H new ATOM 1176 N ALA A 989 8.833 -7.241 -2.115 1.00 0.00 N ATOM 1177 CA ALA A 989 7.584 -7.100 -1.379 1.00 0.00 C ATOM 1178 C ALA A 989 6.829 -5.846 -1.805 1.00 0.00 C ATOM 1179 O ALA A 989 5.605 -5.853 -1.894 1.00 0.00 O ATOM 1180 CB ALA A 989 7.850 -7.070 0.118 1.00 0.00 C ATOM 0 H ALA A 989 9.669 -7.219 -1.532 1.00 0.00 H new ATOM 0 HA ALA A 989 6.961 -7.964 -1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 989 6.906 -6.964 0.653 1.00 0.00 H new ATOM 0 HB2 ALA A 989 8.336 -7.998 0.420 1.00 0.00 H new ATOM 0 HB3 ALA A 989 8.498 -6.227 0.356 1.00 0.00 H new ATOM 1186 N SER A 990 7.571 -4.778 -2.081 1.00 0.00 N ATOM 1187 CA SER A 990 6.971 -3.511 -2.485 1.00 0.00 C ATOM 1188 C SER A 990 6.280 -3.636 -3.839 1.00 0.00 C ATOM 1189 O SER A 990 5.147 -3.183 -4.012 1.00 0.00 O ATOM 1190 CB SER A 990 8.037 -2.415 -2.534 1.00 0.00 C ATOM 1191 OG SER A 990 8.643 -2.239 -1.267 1.00 0.00 O ATOM 0 H SER A 990 8.590 -4.765 -2.032 1.00 0.00 H new ATOM 0 HA SER A 990 6.217 -3.242 -1.745 1.00 0.00 H new ATOM 0 HB2 SER A 990 8.797 -2.674 -3.271 1.00 0.00 H new ATOM 0 HB3 SER A 990 7.585 -1.478 -2.858 1.00 0.00 H new ATOM 0 HG SER A 990 9.191 -3.023 -1.055 1.00 0.00 H new ATOM 1197 N GLN A 991 6.953 -4.265 -4.794 1.00 0.00 N ATOM 1198 CA GLN A 991 6.395 -4.433 -6.131 1.00 0.00 C ATOM 1199 C GLN A 991 5.222 -5.408 -6.100 1.00 0.00 C ATOM 1200 O GLN A 991 4.219 -5.213 -6.789 1.00 0.00 O ATOM 1201 CB GLN A 991 7.472 -4.908 -7.106 1.00 0.00 C ATOM 1202 CG GLN A 991 8.617 -3.919 -7.260 1.00 0.00 C ATOM 1203 CD GLN A 991 9.670 -4.376 -8.249 1.00 0.00 C ATOM 1204 OE1 GLN A 991 9.889 -5.572 -8.434 1.00 0.00 O ATOM 1205 NE2 GLN A 991 10.328 -3.426 -8.891 1.00 0.00 N ATOM 0 H GLN A 991 7.882 -4.666 -4.669 1.00 0.00 H new ATOM 0 HA GLN A 991 6.027 -3.467 -6.477 1.00 0.00 H new ATOM 0 HB2 GLN A 991 7.869 -5.863 -6.762 1.00 0.00 H new ATOM 0 HB3 GLN A 991 7.018 -5.084 -8.081 1.00 0.00 H new ATOM 0 HG2 GLN A 991 8.217 -2.958 -7.583 1.00 0.00 H new ATOM 0 HG3 GLN A 991 9.085 -3.760 -6.288 1.00 0.00 H new ATOM 0 HE21 GLN A 991 10.115 -2.445 -8.708 1.00 0.00 H new ATOM 0 HE22 GLN A 991 11.048 -3.674 -9.569 1.00 0.00 H new ATOM 1214 N SER A 992 5.340 -6.441 -5.277 1.00 0.00 N ATOM 1215 CA SER A 992 4.277 -7.404 -5.096 1.00 0.00 C ATOM 1216 C SER A 992 3.151 -6.832 -4.233 1.00 0.00 C ATOM 1217 O SER A 992 2.117 -7.468 -4.049 1.00 0.00 O ATOM 1218 CB SER A 992 4.854 -8.664 -4.464 1.00 0.00 C ATOM 1219 OG SER A 992 5.755 -9.311 -5.350 1.00 0.00 O ATOM 0 H SER A 992 6.174 -6.629 -4.721 1.00 0.00 H new ATOM 0 HA SER A 992 3.847 -7.646 -6.068 1.00 0.00 H new ATOM 0 HB2 SER A 992 5.370 -8.408 -3.539 1.00 0.00 H new ATOM 0 HB3 SER A 992 4.045 -9.346 -4.200 1.00 0.00 H new ATOM 0 HG SER A 992 6.649 -8.921 -5.250 1.00 0.00 H new ATOM 1225 N PHE A 993 3.366 -5.635 -3.699 1.00 0.00 N ATOM 1226 CA PHE A 993 2.341 -4.941 -2.931 1.00 0.00 C ATOM 1227 C PHE A 993 1.579 -3.979 -3.835 1.00 0.00 C ATOM 1228 O PHE A 993 0.388 -3.733 -3.641 1.00 0.00 O ATOM 1229 CB PHE A 993 2.972 -4.183 -1.760 1.00 0.00 C ATOM 1230 CG PHE A 993 1.974 -3.514 -0.857 1.00 0.00 C ATOM 1231 CD1 PHE A 993 1.309 -4.238 0.116 1.00 0.00 C ATOM 1232 CD2 PHE A 993 1.707 -2.161 -0.979 1.00 0.00 C ATOM 1233 CE1 PHE A 993 0.394 -3.627 0.950 1.00 0.00 C ATOM 1234 CE2 PHE A 993 0.794 -1.544 -0.149 1.00 0.00 C ATOM 1235 CZ PHE A 993 0.137 -2.278 0.816 1.00 0.00 C ATOM 0 H PHE A 993 4.245 -5.124 -3.785 1.00 0.00 H new ATOM 0 HA PHE A 993 1.644 -5.676 -2.529 1.00 0.00 H new ATOM 0 HB2 PHE A 993 3.571 -4.878 -1.171 1.00 0.00 H new ATOM 0 HB3 PHE A 993 3.653 -3.429 -2.154 1.00 0.00 H new ATOM 0 HD1 PHE A 993 1.508 -5.294 0.225 1.00 0.00 H new ATOM 0 HD2 PHE A 993 2.220 -1.582 -1.733 1.00 0.00 H new ATOM 0 HE1 PHE A 993 -0.119 -4.203 1.705 1.00 0.00 H new ATOM 0 HE2 PHE A 993 0.594 -0.488 -0.255 1.00 0.00 H new ATOM 0 HZ PHE A 993 -0.578 -1.797 1.467 1.00 0.00 H new ATOM 1245 N LEU A 994 2.281 -3.445 -4.830 1.00 0.00 N ATOM 1246 CA LEU A 994 1.680 -2.550 -5.815 1.00 0.00 C ATOM 1247 C LEU A 994 0.546 -3.251 -6.549 1.00 0.00 C ATOM 1248 O LEU A 994 -0.502 -2.656 -6.812 1.00 0.00 O ATOM 1249 CB LEU A 994 2.734 -2.100 -6.827 1.00 0.00 C ATOM 1250 CG LEU A 994 3.932 -1.355 -6.240 1.00 0.00 C ATOM 1251 CD1 LEU A 994 5.019 -1.203 -7.289 1.00 0.00 C ATOM 1252 CD2 LEU A 994 3.509 0.006 -5.709 1.00 0.00 C ATOM 0 H LEU A 994 3.275 -3.618 -4.976 1.00 0.00 H new ATOM 0 HA LEU A 994 1.283 -1.681 -5.291 1.00 0.00 H new ATOM 0 HB2 LEU A 994 3.099 -2.978 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 994 2.254 -1.457 -7.564 1.00 0.00 H new ATOM 0 HG LEU A 994 4.329 -1.937 -5.408 1.00 0.00 H new ATOM 0 HD11 LEU A 994 5.868 -0.671 -6.859 1.00 0.00 H new ATOM 0 HD12 LEU A 994 5.341 -2.189 -7.625 1.00 0.00 H new ATOM 0 HD13 LEU A 994 4.630 -0.640 -8.137 1.00 0.00 H new ATOM 0 HD21 LEU A 994 4.376 0.521 -5.295 1.00 0.00 H new ATOM 0 HD22 LEU A 994 3.089 0.599 -6.521 1.00 0.00 H new ATOM 0 HD23 LEU A 994 2.759 -0.125 -4.929 1.00 0.00 H new ATOM 1264 N GLN A 995 0.772 -4.521 -6.867 1.00 0.00 N ATOM 1265 CA GLN A 995 -0.204 -5.338 -7.580 1.00 0.00 C ATOM 1266 C GLN A 995 -1.570 -5.352 -6.864 1.00 0.00 C ATOM 1267 O GLN A 995 -2.548 -4.853 -7.417 1.00 0.00 O ATOM 1268 CB GLN A 995 0.351 -6.755 -7.779 1.00 0.00 C ATOM 1269 CG GLN A 995 -0.641 -7.745 -8.369 1.00 0.00 C ATOM 1270 CD GLN A 995 -0.077 -9.152 -8.421 1.00 0.00 C ATOM 1271 OE1 GLN A 995 0.773 -9.522 -7.609 1.00 0.00 O ATOM 1272 NE2 GLN A 995 -0.546 -9.945 -9.365 1.00 0.00 N ATOM 0 H GLN A 995 1.636 -5.013 -6.638 1.00 0.00 H new ATOM 0 HA GLN A 995 -0.377 -4.895 -8.561 1.00 0.00 H new ATOM 0 HB2 GLN A 995 1.223 -6.702 -8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 995 0.695 -7.135 -6.817 1.00 0.00 H new ATOM 0 HG2 GLN A 995 -1.554 -7.742 -7.773 1.00 0.00 H new ATOM 0 HG3 GLN A 995 -0.916 -7.427 -9.375 1.00 0.00 H new ATOM 0 HE21 GLN A 995 -1.250 -9.600 -10.018 1.00 0.00 H new ATOM 0 HE22 GLN A 995 -0.205 -10.903 -9.442 1.00 0.00 H new ATOM 1281 N PRO A 996 -1.676 -5.889 -5.626 1.00 0.00 N ATOM 1282 CA PRO A 996 -2.951 -5.925 -4.904 1.00 0.00 C ATOM 1283 C PRO A 996 -3.386 -4.536 -4.443 1.00 0.00 C ATOM 1284 O PRO A 996 -4.578 -4.229 -4.402 1.00 0.00 O ATOM 1285 CB PRO A 996 -2.676 -6.825 -3.689 1.00 0.00 C ATOM 1286 CG PRO A 996 -1.351 -7.459 -3.952 1.00 0.00 C ATOM 1287 CD PRO A 996 -0.604 -6.501 -4.828 1.00 0.00 C ATOM 0 HA PRO A 996 -3.758 -6.293 -5.538 1.00 0.00 H new ATOM 0 HB2 PRO A 996 -2.657 -6.244 -2.767 1.00 0.00 H new ATOM 0 HB3 PRO A 996 -3.455 -7.578 -3.575 1.00 0.00 H new ATOM 0 HG2 PRO A 996 -0.812 -7.639 -3.022 1.00 0.00 H new ATOM 0 HG3 PRO A 996 -1.471 -8.425 -4.443 1.00 0.00 H new ATOM 0 HD2 PRO A 996 -0.060 -5.759 -4.244 1.00 0.00 H new ATOM 0 HD3 PRO A 996 0.127 -7.011 -5.455 1.00 0.00 H new ATOM 1295 N GLY A 997 -2.409 -3.701 -4.104 1.00 0.00 N ATOM 1296 CA GLY A 997 -2.697 -2.363 -3.625 1.00 0.00 C ATOM 1297 C GLY A 997 -3.413 -1.520 -4.659 1.00 0.00 C ATOM 1298 O GLY A 997 -4.440 -0.907 -4.365 1.00 0.00 O ATOM 0 H GLY A 997 -1.416 -3.930 -4.153 1.00 0.00 H new ATOM 0 HA2 GLY A 997 -3.309 -2.426 -2.725 1.00 0.00 H new ATOM 0 HA3 GLY A 997 -1.765 -1.873 -3.343 1.00 0.00 H new ATOM 1302 N GLY A 998 -2.879 -1.501 -5.878 1.00 0.00 N ATOM 1303 CA GLY A 998 -3.484 -0.734 -6.950 1.00 0.00 C ATOM 1304 C GLY A 998 -4.900 -1.188 -7.247 1.00 0.00 C ATOM 1305 O GLY A 998 -5.766 -0.372 -7.577 1.00 0.00 O ATOM 0 H GLY A 998 -2.033 -2.007 -6.142 1.00 0.00 H new ATOM 0 HA2 GLY A 998 -3.491 0.322 -6.680 1.00 0.00 H new ATOM 0 HA3 GLY A 998 -2.877 -0.829 -7.850 1.00 0.00 H new ATOM 1309 N LYS A 999 -5.138 -2.487 -7.111 1.00 0.00 N ATOM 1310 CA LYS A 999 -6.460 -3.054 -7.325 1.00 0.00 C ATOM 1311 C LYS A 999 -7.437 -2.547 -6.272 1.00 0.00 C ATOM 1312 O LYS A 999 -8.598 -2.269 -6.571 1.00 0.00 O ATOM 1313 CB LYS A 999 -6.401 -4.584 -7.284 1.00 0.00 C ATOM 1314 CG LYS A 999 -5.548 -5.198 -8.381 1.00 0.00 C ATOM 1315 CD LYS A 999 -5.472 -6.709 -8.240 1.00 0.00 C ATOM 1316 CE LYS A 999 -4.638 -7.336 -9.346 1.00 0.00 C ATOM 1317 NZ LYS A 999 -5.211 -7.075 -10.693 1.00 0.00 N ATOM 0 H LYS A 999 -4.426 -3.170 -6.852 1.00 0.00 H new ATOM 0 HA LYS A 999 -6.808 -2.740 -8.309 1.00 0.00 H new ATOM 0 HB2 LYS A 999 -6.010 -4.897 -6.316 1.00 0.00 H new ATOM 0 HB3 LYS A 999 -7.414 -4.979 -7.361 1.00 0.00 H new ATOM 0 HG2 LYS A 999 -5.965 -4.942 -9.355 1.00 0.00 H new ATOM 0 HG3 LYS A 999 -4.544 -4.776 -8.343 1.00 0.00 H new ATOM 0 HD2 LYS A 999 -5.042 -6.963 -7.271 1.00 0.00 H new ATOM 0 HD3 LYS A 999 -6.478 -7.128 -8.261 1.00 0.00 H new ATOM 0 HE2 LYS A 999 -3.623 -6.942 -9.302 1.00 0.00 H new ATOM 0 HE3 LYS A 999 -4.570 -8.412 -9.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 999 -4.762 -7.704 -11.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 999 -6.235 -7.254 -10.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 999 -5.037 -6.085 -10.958 1.00 0.00 H new ATOM 1331 N MET A1000 -6.954 -2.401 -5.042 1.00 0.00 N ATOM 1332 CA MET A1000 -7.805 -1.970 -3.946 1.00 0.00 C ATOM 1333 C MET A1000 -8.117 -0.484 -4.074 1.00 0.00 C ATOM 1334 O MET A1000 -9.203 -0.042 -3.718 1.00 0.00 O ATOM 1335 CB MET A1000 -7.153 -2.269 -2.594 1.00 0.00 C ATOM 1336 CG MET A1000 -8.121 -2.162 -1.426 1.00 0.00 C ATOM 1337 SD MET A1000 -7.413 -2.731 0.131 1.00 0.00 S ATOM 1338 CE MET A1000 -6.164 -1.484 0.407 1.00 0.00 C ATOM 0 H MET A1000 -5.983 -2.575 -4.783 1.00 0.00 H new ATOM 0 HA MET A1000 -8.739 -2.529 -3.998 1.00 0.00 H new ATOM 0 HB2 MET A1000 -6.730 -3.273 -2.616 1.00 0.00 H new ATOM 0 HB3 MET A1000 -6.325 -1.578 -2.436 1.00 0.00 H new ATOM 0 HG2 MET A1000 -8.437 -1.125 -1.317 1.00 0.00 H new ATOM 0 HG3 MET A1000 -9.014 -2.746 -1.647 1.00 0.00 H new ATOM 0 HE1 MET A1000 -5.963 -1.401 1.475 1.00 0.00 H new ATOM 0 HE2 MET A1000 -5.249 -1.764 -0.114 1.00 0.00 H new ATOM 0 HE3 MET A1000 -6.518 -0.525 0.029 1.00 0.00 H new ATOM 1348 N VAL A1001 -7.164 0.279 -4.602 1.00 0.00 N ATOM 1349 CA VAL A1001 -7.384 1.698 -4.863 1.00 0.00 C ATOM 1350 C VAL A1001 -8.501 1.874 -5.889 1.00 0.00 C ATOM 1351 O VAL A1001 -9.407 2.688 -5.706 1.00 0.00 O ATOM 1352 CB VAL A1001 -6.104 2.399 -5.374 1.00 0.00 C ATOM 1353 CG1 VAL A1001 -6.358 3.877 -5.628 1.00 0.00 C ATOM 1354 CG2 VAL A1001 -4.963 2.222 -4.384 1.00 0.00 C ATOM 0 H VAL A1001 -6.236 -0.060 -4.856 1.00 0.00 H new ATOM 0 HA VAL A1001 -7.667 2.161 -3.918 1.00 0.00 H new ATOM 0 HB VAL A1001 -5.821 1.933 -6.318 1.00 0.00 H new ATOM 0 HG11 VAL A1001 -5.442 4.347 -5.987 1.00 0.00 H new ATOM 0 HG12 VAL A1001 -7.141 3.988 -6.378 1.00 0.00 H new ATOM 0 HG13 VAL A1001 -6.673 4.357 -4.701 1.00 0.00 H new ATOM 0 HG21 VAL A1001 -4.072 2.723 -4.763 1.00 0.00 H new ATOM 0 HG22 VAL A1001 -5.243 2.656 -3.424 1.00 0.00 H new ATOM 0 HG23 VAL A1001 -4.755 1.160 -4.255 1.00 0.00 H new ATOM 1364 N ALA A1002 -8.443 1.081 -6.956 1.00 0.00 N ATOM 1365 CA ALA A1002 -9.460 1.125 -8.000 1.00 0.00 C ATOM 1366 C ALA A1002 -10.808 0.663 -7.456 1.00 0.00 C ATOM 1367 O ALA A1002 -11.857 1.209 -7.804 1.00 0.00 O ATOM 1368 CB ALA A1002 -9.043 0.265 -9.182 1.00 0.00 C ATOM 0 H ALA A1002 -7.701 0.400 -7.119 1.00 0.00 H new ATOM 0 HA ALA A1002 -9.561 2.156 -8.338 1.00 0.00 H new ATOM 0 HB1 ALA A1002 -9.812 0.308 -9.953 1.00 0.00 H new ATOM 0 HB2 ALA A1002 -8.102 0.636 -9.588 1.00 0.00 H new ATOM 0 HB3 ALA A1002 -8.915 -0.767 -8.854 1.00 0.00 H new ATOM 1374 N ALA A1003 -10.765 -0.344 -6.592 1.00 0.00 N ATOM 1375 CA ALA A1003 -11.962 -0.850 -5.941 1.00 0.00 C ATOM 1376 C ALA A1003 -12.563 0.202 -5.021 1.00 0.00 C ATOM 1377 O ALA A1003 -13.778 0.385 -4.977 1.00 0.00 O ATOM 1378 CB ALA A1003 -11.639 -2.110 -5.155 1.00 0.00 C ATOM 0 H ALA A1003 -9.907 -0.827 -6.326 1.00 0.00 H new ATOM 0 HA ALA A1003 -12.695 -1.091 -6.711 1.00 0.00 H new ATOM 0 HB1 ALA A1003 -12.544 -2.479 -4.672 1.00 0.00 H new ATOM 0 HB2 ALA A1003 -11.252 -2.872 -5.832 1.00 0.00 H new ATOM 0 HB3 ALA A1003 -10.889 -1.884 -4.397 1.00 0.00 H new ATOM 1384 N ALA A1004 -11.695 0.894 -4.293 1.00 0.00 N ATOM 1385 CA ALA A1004 -12.117 1.930 -3.366 1.00 0.00 C ATOM 1386 C ALA A1004 -12.853 3.045 -4.094 1.00 0.00 C ATOM 1387 O ALA A1004 -13.977 3.393 -3.735 1.00 0.00 O ATOM 1388 CB ALA A1004 -10.915 2.481 -2.610 1.00 0.00 C ATOM 0 H ALA A1004 -10.686 0.752 -4.330 1.00 0.00 H new ATOM 0 HA ALA A1004 -12.807 1.488 -2.648 1.00 0.00 H new ATOM 0 HB1 ALA A1004 -11.244 3.257 -1.919 1.00 0.00 H new ATOM 0 HB2 ALA A1004 -10.436 1.676 -2.052 1.00 0.00 H new ATOM 0 HB3 ALA A1004 -10.203 2.905 -3.318 1.00 0.00 H new ATOM 1394 N LYS A1005 -12.229 3.568 -5.142 1.00 0.00 N ATOM 1395 CA LYS A1005 -12.802 4.662 -5.924 1.00 0.00 C ATOM 1396 C LYS A1005 -14.177 4.297 -6.481 1.00 0.00 C ATOM 1397 O LYS A1005 -15.049 5.154 -6.618 1.00 0.00 O ATOM 1398 CB LYS A1005 -11.866 5.029 -7.071 1.00 0.00 C ATOM 1399 CG LYS A1005 -10.533 5.593 -6.606 1.00 0.00 C ATOM 1400 CD LYS A1005 -9.615 5.911 -7.774 1.00 0.00 C ATOM 1401 CE LYS A1005 -8.332 6.579 -7.305 1.00 0.00 C ATOM 1402 NZ LYS A1005 -8.584 7.920 -6.710 1.00 0.00 N ATOM 0 H LYS A1005 -11.318 3.250 -5.474 1.00 0.00 H new ATOM 0 HA LYS A1005 -12.923 5.517 -5.258 1.00 0.00 H new ATOM 0 HB2 LYS A1005 -11.685 4.143 -7.680 1.00 0.00 H new ATOM 0 HB3 LYS A1005 -12.358 5.761 -7.712 1.00 0.00 H new ATOM 0 HG2 LYS A1005 -10.705 6.497 -6.023 1.00 0.00 H new ATOM 0 HG3 LYS A1005 -10.046 4.876 -5.946 1.00 0.00 H new ATOM 0 HD2 LYS A1005 -9.374 4.993 -8.310 1.00 0.00 H new ATOM 0 HD3 LYS A1005 -10.131 6.565 -8.477 1.00 0.00 H new ATOM 0 HE2 LYS A1005 -7.841 5.943 -6.569 1.00 0.00 H new ATOM 0 HE3 LYS A1005 -7.647 6.679 -8.147 1.00 0.00 H new ATOM 0 HZ1 LYS A1005 -7.687 8.442 -6.638 1.00 0.00 H new ATOM 0 HZ2 LYS A1005 -9.245 8.449 -7.314 1.00 0.00 H new ATOM 0 HZ3 LYS A1005 -8.996 7.807 -5.762 1.00 0.00 H new ATOM 1416 N ALA A1006 -14.366 3.019 -6.782 1.00 0.00 N ATOM 1417 CA ALA A1006 -15.614 2.547 -7.362 1.00 0.00 C ATOM 1418 C ALA A1006 -16.660 2.259 -6.290 1.00 0.00 C ATOM 1419 O ALA A1006 -17.859 2.255 -6.566 1.00 0.00 O ATOM 1420 CB ALA A1006 -15.359 1.307 -8.200 1.00 0.00 C ATOM 0 H ALA A1006 -13.668 2.290 -6.633 1.00 0.00 H new ATOM 0 HA ALA A1006 -16.009 3.338 -8.000 1.00 0.00 H new ATOM 0 HB1 ALA A1006 -16.298 0.960 -8.631 1.00 0.00 H new ATOM 0 HB2 ALA A1006 -14.659 1.546 -9.001 1.00 0.00 H new ATOM 0 HB3 ALA A1006 -14.937 0.523 -7.571 1.00 0.00 H new ATOM 1426 N SER A1007 -16.209 2.032 -5.065 1.00 0.00 N ATOM 1427 CA SER A1007 -17.116 1.691 -3.980 1.00 0.00 C ATOM 1428 C SER A1007 -17.591 2.947 -3.252 1.00 0.00 C ATOM 1429 O SER A1007 -18.661 2.953 -2.644 1.00 0.00 O ATOM 1430 CB SER A1007 -16.434 0.730 -3.006 1.00 0.00 C ATOM 1431 OG SER A1007 -17.358 0.198 -2.072 1.00 0.00 O ATOM 0 H SER A1007 -15.225 2.077 -4.799 1.00 0.00 H new ATOM 0 HA SER A1007 -17.991 1.197 -4.404 1.00 0.00 H new ATOM 0 HB2 SER A1007 -15.967 -0.083 -3.562 1.00 0.00 H new ATOM 0 HB3 SER A1007 -15.638 1.252 -2.475 1.00 0.00 H new ATOM 0 HG SER A1007 -17.175 0.568 -1.183 1.00 0.00 H new ATOM 1437 N VAL A1008 -16.800 4.013 -3.325 1.00 0.00 N ATOM 1438 CA VAL A1008 -17.149 5.280 -2.682 1.00 0.00 C ATOM 1439 C VAL A1008 -18.533 5.803 -3.117 1.00 0.00 C ATOM 1440 O VAL A1008 -19.363 6.106 -2.262 1.00 0.00 O ATOM 1441 CB VAL A1008 -16.080 6.369 -2.937 1.00 0.00 C ATOM 1442 CG1 VAL A1008 -16.518 7.711 -2.369 1.00 0.00 C ATOM 1443 CG2 VAL A1008 -14.748 5.957 -2.332 1.00 0.00 C ATOM 0 H VAL A1008 -15.910 4.027 -3.824 1.00 0.00 H new ATOM 0 HA VAL A1008 -17.188 5.067 -1.614 1.00 0.00 H new ATOM 0 HB VAL A1008 -15.962 6.476 -4.015 1.00 0.00 H new ATOM 0 HG11 VAL A1008 -15.747 8.457 -2.563 1.00 0.00 H new ATOM 0 HG12 VAL A1008 -17.450 8.020 -2.843 1.00 0.00 H new ATOM 0 HG13 VAL A1008 -16.671 7.618 -1.294 1.00 0.00 H new ATOM 0 HG21 VAL A1008 -14.007 6.734 -2.520 1.00 0.00 H new ATOM 0 HG22 VAL A1008 -14.864 5.819 -1.257 1.00 0.00 H new ATOM 0 HG23 VAL A1008 -14.417 5.022 -2.784 1.00 0.00 H new ATOM 1453 N PRO A1009 -18.827 5.897 -4.436 1.00 0.00 N ATOM 1454 CA PRO A1009 -20.097 6.463 -4.909 1.00 0.00 C ATOM 1455 C PRO A1009 -21.310 5.622 -4.510 1.00 0.00 C ATOM 1456 O PRO A1009 -22.435 6.122 -4.473 1.00 0.00 O ATOM 1457 CB PRO A1009 -19.944 6.494 -6.435 1.00 0.00 C ATOM 1458 CG PRO A1009 -18.900 5.479 -6.738 1.00 0.00 C ATOM 1459 CD PRO A1009 -17.969 5.479 -5.562 1.00 0.00 C ATOM 0 HA PRO A1009 -20.280 7.443 -4.468 1.00 0.00 H new ATOM 0 HB2 PRO A1009 -20.884 6.253 -6.931 1.00 0.00 H new ATOM 0 HB3 PRO A1009 -19.645 7.483 -6.782 1.00 0.00 H new ATOM 0 HG2 PRO A1009 -19.344 4.494 -6.884 1.00 0.00 H new ATOM 0 HG3 PRO A1009 -18.368 5.728 -7.656 1.00 0.00 H new ATOM 0 HD2 PRO A1009 -17.538 4.492 -5.392 1.00 0.00 H new ATOM 0 HD3 PRO A1009 -17.138 6.168 -5.709 1.00 0.00 H new ATOM 1467 N THR A1010 -21.081 4.349 -4.201 1.00 0.00 N ATOM 1468 CA THR A1010 -22.169 3.466 -3.809 1.00 0.00 C ATOM 1469 C THR A1010 -22.466 3.594 -2.315 1.00 0.00 C ATOM 1470 O THR A1010 -23.514 3.158 -1.834 1.00 0.00 O ATOM 1471 CB THR A1010 -21.871 1.994 -4.170 1.00 0.00 C ATOM 1472 OG1 THR A1010 -20.658 1.551 -3.548 1.00 0.00 O ATOM 1473 CG2 THR A1010 -21.753 1.825 -5.678 1.00 0.00 C ATOM 0 H THR A1010 -20.160 3.911 -4.215 1.00 0.00 H new ATOM 0 HA THR A1010 -23.051 3.776 -4.369 1.00 0.00 H new ATOM 0 HB THR A1010 -22.700 1.389 -3.803 1.00 0.00 H new ATOM 0 HG1 THR A1010 -20.269 2.286 -3.030 1.00 0.00 H new ATOM 0 HG21 THR A1010 -21.543 0.781 -5.912 1.00 0.00 H new ATOM 0 HG22 THR A1010 -22.689 2.122 -6.152 1.00 0.00 H new ATOM 0 HG23 THR A1010 -20.943 2.451 -6.052 1.00 0.00 H new ATOM 1481 N ILE A1011 -21.543 4.210 -1.587 1.00 0.00 N ATOM 1482 CA ILE A1011 -21.748 4.475 -0.172 1.00 0.00 C ATOM 1483 C ILE A1011 -22.588 5.736 -0.014 1.00 0.00 C ATOM 1484 O ILE A1011 -22.173 6.821 -0.420 1.00 0.00 O ATOM 1485 CB ILE A1011 -20.410 4.650 0.581 1.00 0.00 C ATOM 1486 CG1 ILE A1011 -19.502 3.440 0.349 1.00 0.00 C ATOM 1487 CG2 ILE A1011 -20.660 4.848 2.071 1.00 0.00 C ATOM 1488 CD1 ILE A1011 -18.111 3.603 0.925 1.00 0.00 C ATOM 0 H ILE A1011 -20.648 4.534 -1.954 1.00 0.00 H new ATOM 0 HA ILE A1011 -22.263 3.617 0.260 1.00 0.00 H new ATOM 0 HB ILE A1011 -19.910 5.537 0.193 1.00 0.00 H new ATOM 0 HG12 ILE A1011 -19.967 2.558 0.790 1.00 0.00 H new ATOM 0 HG13 ILE A1011 -19.423 3.257 -0.723 1.00 0.00 H new ATOM 0 HG21 ILE A1011 -19.707 4.970 2.587 1.00 0.00 H new ATOM 0 HG22 ILE A1011 -21.271 5.738 2.222 1.00 0.00 H new ATOM 0 HG23 ILE A1011 -21.181 3.978 2.471 1.00 0.00 H new ATOM 0 HD11 ILE A1011 -17.526 2.706 0.722 1.00 0.00 H new ATOM 0 HD12 ILE A1011 -17.626 4.465 0.466 1.00 0.00 H new ATOM 0 HD13 ILE A1011 -18.179 3.755 2.002 1.00 0.00 H new ATOM 1500 N GLN A1012 -23.779 5.590 0.547 1.00 0.00 N ATOM 1501 CA GLN A1012 -24.684 6.724 0.703 1.00 0.00 C ATOM 1502 C GLN A1012 -24.403 7.472 2.002 1.00 0.00 C ATOM 1503 O GLN A1012 -25.032 8.487 2.295 1.00 0.00 O ATOM 1504 CB GLN A1012 -26.145 6.267 0.639 1.00 0.00 C ATOM 1505 CG GLN A1012 -26.518 5.205 1.661 1.00 0.00 C ATOM 1506 CD GLN A1012 -27.959 4.750 1.529 1.00 0.00 C ATOM 1507 OE1 GLN A1012 -28.287 3.598 1.813 1.00 0.00 O ATOM 1508 NE2 GLN A1012 -28.838 5.649 1.111 1.00 0.00 N ATOM 0 H GLN A1012 -24.142 4.705 0.900 1.00 0.00 H new ATOM 0 HA GLN A1012 -24.509 7.412 -0.124 1.00 0.00 H new ATOM 0 HB2 GLN A1012 -26.790 7.134 0.782 1.00 0.00 H new ATOM 0 HB3 GLN A1012 -26.348 5.880 -0.359 1.00 0.00 H new ATOM 0 HG2 GLN A1012 -25.857 4.346 1.545 1.00 0.00 H new ATOM 0 HG3 GLN A1012 -26.355 5.598 2.664 1.00 0.00 H new ATOM 0 HE21 GLN A1012 -28.531 6.595 0.884 1.00 0.00 H new ATOM 0 HE22 GLN A1012 -29.821 5.395 1.016 1.00 0.00 H new ATOM 1517 N ASP A1013 -23.454 6.962 2.771 1.00 0.00 N ATOM 1518 CA ASP A1013 -23.000 7.636 3.979 1.00 0.00 C ATOM 1519 C ASP A1013 -21.846 8.567 3.639 1.00 0.00 C ATOM 1520 O ASP A1013 -20.812 8.126 3.135 1.00 0.00 O ATOM 1521 CB ASP A1013 -22.568 6.623 5.041 1.00 0.00 C ATOM 1522 CG ASP A1013 -23.744 5.973 5.740 1.00 0.00 C ATOM 1523 OD1 ASP A1013 -24.336 5.030 5.175 1.00 0.00 O ATOM 1524 OD2 ASP A1013 -24.081 6.400 6.867 1.00 0.00 O ATOM 0 H ASP A1013 -22.981 6.079 2.579 1.00 0.00 H new ATOM 0 HA ASP A1013 -23.827 8.218 4.386 1.00 0.00 H new ATOM 0 HB2 ASP A1013 -21.956 5.851 4.574 1.00 0.00 H new ATOM 0 HB3 ASP A1013 -21.942 7.122 5.780 1.00 0.00 H new ATOM 1529 N GLN A1014 -22.027 9.846 3.926 1.00 0.00 N ATOM 1530 CA GLN A1014 -21.097 10.881 3.488 1.00 0.00 C ATOM 1531 C GLN A1014 -19.716 10.695 4.108 1.00 0.00 C ATOM 1532 O GLN A1014 -18.728 10.520 3.393 1.00 0.00 O ATOM 1533 CB GLN A1014 -21.650 12.263 3.839 1.00 0.00 C ATOM 1534 CG GLN A1014 -23.039 12.516 3.278 1.00 0.00 C ATOM 1535 CD GLN A1014 -23.073 12.490 1.761 1.00 0.00 C ATOM 1536 OE1 GLN A1014 -22.106 12.863 1.097 1.00 0.00 O ATOM 1537 NE2 GLN A1014 -24.188 12.043 1.206 1.00 0.00 N ATOM 0 H GLN A1014 -22.818 10.197 4.466 1.00 0.00 H new ATOM 0 HA GLN A1014 -20.989 10.798 2.407 1.00 0.00 H new ATOM 0 HB2 GLN A1014 -21.679 12.370 4.923 1.00 0.00 H new ATOM 0 HB3 GLN A1014 -20.969 13.026 3.461 1.00 0.00 H new ATOM 0 HG2 GLN A1014 -23.725 11.763 3.665 1.00 0.00 H new ATOM 0 HG3 GLN A1014 -23.397 13.484 3.629 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -24.966 11.744 1.794 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -24.270 11.998 0.190 1.00 0.00 H new ATOM 1546 N ALA A1015 -19.652 10.713 5.433 1.00 0.00 N ATOM 1547 CA ALA A1015 -18.382 10.613 6.142 1.00 0.00 C ATOM 1548 C ALA A1015 -17.692 9.287 5.847 1.00 0.00 C ATOM 1549 O ALA A1015 -16.469 9.234 5.687 1.00 0.00 O ATOM 1550 CB ALA A1015 -18.591 10.779 7.638 1.00 0.00 C ATOM 0 H ALA A1015 -20.467 10.796 6.040 1.00 0.00 H new ATOM 0 HA ALA A1015 -17.737 11.417 5.788 1.00 0.00 H new ATOM 0 HB1 ALA A1015 -17.632 10.701 8.150 1.00 0.00 H new ATOM 0 HB2 ALA A1015 -19.031 11.756 7.838 1.00 0.00 H new ATOM 0 HB3 ALA A1015 -19.260 9.999 8.001 1.00 0.00 H new ATOM 1556 N SER A1016 -18.485 8.227 5.769 1.00 0.00 N ATOM 1557 CA SER A1016 -17.969 6.899 5.476 1.00 0.00 C ATOM 1558 C SER A1016 -17.331 6.856 4.086 1.00 0.00 C ATOM 1559 O SER A1016 -16.239 6.308 3.911 1.00 0.00 O ATOM 1560 CB SER A1016 -19.098 5.871 5.573 1.00 0.00 C ATOM 1561 OG SER A1016 -19.761 5.963 6.825 1.00 0.00 O ATOM 0 H SER A1016 -19.495 8.263 5.906 1.00 0.00 H new ATOM 0 HA SER A1016 -17.200 6.656 6.209 1.00 0.00 H new ATOM 0 HB2 SER A1016 -19.813 6.033 4.766 1.00 0.00 H new ATOM 0 HB3 SER A1016 -18.693 4.867 5.444 1.00 0.00 H new ATOM 0 HG SER A1016 -20.480 5.298 6.864 1.00 0.00 H new ATOM 1567 N ALA A1017 -18.008 7.450 3.108 1.00 0.00 N ATOM 1568 CA ALA A1017 -17.521 7.466 1.734 1.00 0.00 C ATOM 1569 C ALA A1017 -16.300 8.368 1.594 1.00 0.00 C ATOM 1570 O ALA A1017 -15.331 8.015 0.919 1.00 0.00 O ATOM 1571 CB ALA A1017 -18.622 7.919 0.788 1.00 0.00 C ATOM 0 H ALA A1017 -18.899 7.928 3.243 1.00 0.00 H new ATOM 0 HA ALA A1017 -17.224 6.451 1.470 1.00 0.00 H new ATOM 0 HB1 ALA A1017 -18.243 7.926 -0.234 1.00 0.00 H new ATOM 0 HB2 ALA A1017 -19.466 7.233 0.858 1.00 0.00 H new ATOM 0 HB3 ALA A1017 -18.946 8.923 1.062 1.00 0.00 H new ATOM 1577 N MET A1018 -16.342 9.529 2.245 1.00 0.00 N ATOM 1578 CA MET A1018 -15.248 10.492 2.158 1.00 0.00 C ATOM 1579 C MET A1018 -13.953 9.908 2.705 1.00 0.00 C ATOM 1580 O MET A1018 -12.888 10.084 2.114 1.00 0.00 O ATOM 1581 CB MET A1018 -15.588 11.785 2.903 1.00 0.00 C ATOM 1582 CG MET A1018 -16.748 12.557 2.296 1.00 0.00 C ATOM 1583 SD MET A1018 -17.050 14.124 3.132 1.00 0.00 S ATOM 1584 CE MET A1018 -15.601 15.054 2.634 1.00 0.00 C ATOM 0 H MET A1018 -17.119 9.824 2.836 1.00 0.00 H new ATOM 0 HA MET A1018 -15.107 10.723 1.102 1.00 0.00 H new ATOM 0 HB2 MET A1018 -15.827 11.544 3.939 1.00 0.00 H new ATOM 0 HB3 MET A1018 -14.707 12.426 2.920 1.00 0.00 H new ATOM 0 HG2 MET A1018 -16.543 12.745 1.242 1.00 0.00 H new ATOM 0 HG3 MET A1018 -17.649 11.946 2.341 1.00 0.00 H new ATOM 0 HE1 MET A1018 -15.780 16.118 2.791 1.00 0.00 H new ATOM 0 HE2 MET A1018 -14.744 14.739 3.229 1.00 0.00 H new ATOM 0 HE3 MET A1018 -15.397 14.872 1.579 1.00 0.00 H new ATOM 1594 N GLN A1019 -14.046 9.204 3.828 1.00 0.00 N ATOM 1595 CA GLN A1019 -12.876 8.580 4.431 1.00 0.00 C ATOM 1596 C GLN A1019 -12.364 7.444 3.554 1.00 0.00 C ATOM 1597 O GLN A1019 -11.157 7.261 3.402 1.00 0.00 O ATOM 1598 CB GLN A1019 -13.194 8.067 5.837 1.00 0.00 C ATOM 1599 CG GLN A1019 -12.052 7.278 6.462 1.00 0.00 C ATOM 1600 CD GLN A1019 -12.324 6.886 7.897 1.00 0.00 C ATOM 1601 OE1 GLN A1019 -11.958 7.604 8.828 1.00 0.00 O ATOM 1602 NE2 GLN A1019 -12.984 5.755 8.086 1.00 0.00 N ATOM 0 H GLN A1019 -14.917 9.052 4.337 1.00 0.00 H new ATOM 0 HA GLN A1019 -12.094 9.335 4.513 1.00 0.00 H new ATOM 0 HB2 GLN A1019 -13.436 8.914 6.479 1.00 0.00 H new ATOM 0 HB3 GLN A1019 -14.082 7.436 5.794 1.00 0.00 H new ATOM 0 HG2 GLN A1019 -11.873 6.379 5.873 1.00 0.00 H new ATOM 0 HG3 GLN A1019 -11.140 7.873 6.420 1.00 0.00 H new ATOM 0 HE21 GLN A1019 -13.268 5.191 7.285 1.00 0.00 H new ATOM 0 HE22 GLN A1019 -13.209 5.448 9.032 1.00 0.00 H new ATOM 1611 N LEU A1020 -13.290 6.696 2.963 1.00 0.00 N ATOM 1612 CA LEU A1020 -12.933 5.589 2.086 1.00 0.00 C ATOM 1613 C LEU A1020 -12.130 6.110 0.891 1.00 0.00 C ATOM 1614 O LEU A1020 -11.098 5.542 0.524 1.00 0.00 O ATOM 1615 CB LEU A1020 -14.208 4.860 1.627 1.00 0.00 C ATOM 1616 CG LEU A1020 -14.015 3.434 1.086 1.00 0.00 C ATOM 1617 CD1 LEU A1020 -13.529 3.444 -0.350 1.00 0.00 C ATOM 1618 CD2 LEU A1020 -13.035 2.667 1.954 1.00 0.00 C ATOM 0 H LEU A1020 -14.294 6.837 3.076 1.00 0.00 H new ATOM 0 HA LEU A1020 -12.309 4.878 2.627 1.00 0.00 H new ATOM 0 HB2 LEU A1020 -14.900 4.817 2.468 1.00 0.00 H new ATOM 0 HB3 LEU A1020 -14.685 5.459 0.852 1.00 0.00 H new ATOM 0 HG LEU A1020 -14.986 2.939 1.113 1.00 0.00 H new ATOM 0 HD11 LEU A1020 -13.404 2.419 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A1020 -14.259 3.954 -0.978 1.00 0.00 H new ATOM 0 HD13 LEU A1020 -12.574 3.966 -0.407 1.00 0.00 H new ATOM 0 HD21 LEU A1020 -12.909 1.659 1.558 1.00 0.00 H new ATOM 0 HD22 LEU A1020 -12.073 3.179 1.956 1.00 0.00 H new ATOM 0 HD23 LEU A1020 -13.418 2.611 2.973 1.00 0.00 H new ATOM 1630 N SER A1021 -12.596 7.206 0.307 1.00 0.00 N ATOM 1631 CA SER A1021 -11.894 7.841 -0.800 1.00 0.00 C ATOM 1632 C SER A1021 -10.579 8.454 -0.320 1.00 0.00 C ATOM 1633 O SER A1021 -9.585 8.466 -1.049 1.00 0.00 O ATOM 1634 CB SER A1021 -12.779 8.916 -1.440 1.00 0.00 C ATOM 1635 OG SER A1021 -12.119 9.556 -2.521 1.00 0.00 O ATOM 0 H SER A1021 -13.459 7.675 0.582 1.00 0.00 H new ATOM 0 HA SER A1021 -11.667 7.081 -1.548 1.00 0.00 H new ATOM 0 HB2 SER A1021 -13.705 8.463 -1.794 1.00 0.00 H new ATOM 0 HB3 SER A1021 -13.053 9.657 -0.689 1.00 0.00 H new ATOM 0 HG SER A1021 -12.710 10.235 -2.909 1.00 0.00 H new ATOM 1641 N GLN A1022 -10.581 8.950 0.913 1.00 0.00 N ATOM 1642 CA GLN A1022 -9.397 9.564 1.497 1.00 0.00 C ATOM 1643 C GLN A1022 -8.278 8.536 1.623 1.00 0.00 C ATOM 1644 O GLN A1022 -7.140 8.790 1.226 1.00 0.00 O ATOM 1645 CB GLN A1022 -9.731 10.148 2.870 1.00 0.00 C ATOM 1646 CG GLN A1022 -8.647 11.049 3.433 1.00 0.00 C ATOM 1647 CD GLN A1022 -8.419 12.277 2.575 1.00 0.00 C ATOM 1648 OE1 GLN A1022 -7.587 12.272 1.669 1.00 0.00 O ATOM 1649 NE2 GLN A1022 -9.167 13.333 2.845 1.00 0.00 N ATOM 0 H GLN A1022 -11.394 8.938 1.529 1.00 0.00 H new ATOM 0 HA GLN A1022 -9.061 10.369 0.843 1.00 0.00 H new ATOM 0 HB2 GLN A1022 -10.660 10.714 2.797 1.00 0.00 H new ATOM 0 HB3 GLN A1022 -9.910 9.330 3.568 1.00 0.00 H new ATOM 0 HG2 GLN A1022 -8.922 11.359 4.441 1.00 0.00 H new ATOM 0 HG3 GLN A1022 -7.716 10.487 3.515 1.00 0.00 H new ATOM 0 HE21 GLN A1022 -9.846 13.296 3.605 1.00 0.00 H new ATOM 0 HE22 GLN A1022 -9.065 14.185 2.293 1.00 0.00 H new ATOM 1658 N CYS A1023 -8.614 7.370 2.165 1.00 0.00 N ATOM 1659 CA CYS A1023 -7.654 6.286 2.311 1.00 0.00 C ATOM 1660 C CYS A1023 -7.117 5.850 0.951 1.00 0.00 C ATOM 1661 O CYS A1023 -5.918 5.617 0.797 1.00 0.00 O ATOM 1662 CB CYS A1023 -8.298 5.103 3.036 1.00 0.00 C ATOM 1663 SG CYS A1023 -8.843 5.478 4.720 1.00 0.00 S ATOM 0 H CYS A1023 -9.549 7.153 2.511 1.00 0.00 H new ATOM 0 HA CYS A1023 -6.816 6.648 2.907 1.00 0.00 H new ATOM 0 HB2 CYS A1023 -9.154 4.758 2.457 1.00 0.00 H new ATOM 0 HB3 CYS A1023 -7.584 4.280 3.071 1.00 0.00 H new ATOM 0 HG CYS A1023 -9.877 6.265 4.676 1.00 0.00 H new ATOM 1669 N ALA A1024 -8.008 5.763 -0.033 1.00 0.00 N ATOM 1670 CA ALA A1024 -7.617 5.408 -1.394 1.00 0.00 C ATOM 1671 C ALA A1024 -6.639 6.429 -1.965 1.00 0.00 C ATOM 1672 O ALA A1024 -5.657 6.067 -2.611 1.00 0.00 O ATOM 1673 CB ALA A1024 -8.841 5.304 -2.290 1.00 0.00 C ATOM 0 H ALA A1024 -9.006 5.934 0.087 1.00 0.00 H new ATOM 0 HA ALA A1024 -7.121 4.438 -1.358 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -8.531 5.039 -3.301 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -9.511 4.536 -1.903 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -9.360 6.262 -2.310 1.00 0.00 H new ATOM 1679 N LYS A1025 -6.913 7.705 -1.712 1.00 0.00 N ATOM 1680 CA LYS A1025 -6.063 8.789 -2.182 1.00 0.00 C ATOM 1681 C LYS A1025 -4.672 8.686 -1.557 1.00 0.00 C ATOM 1682 O LYS A1025 -3.653 8.827 -2.241 1.00 0.00 O ATOM 1683 CB LYS A1025 -6.689 10.134 -1.819 1.00 0.00 C ATOM 1684 CG LYS A1025 -6.076 11.319 -2.543 1.00 0.00 C ATOM 1685 CD LYS A1025 -6.520 12.637 -1.927 1.00 0.00 C ATOM 1686 CE LYS A1025 -8.026 12.687 -1.715 1.00 0.00 C ATOM 1687 NZ LYS A1025 -8.455 13.972 -1.107 1.00 0.00 N ATOM 0 H LYS A1025 -7.726 8.014 -1.179 1.00 0.00 H new ATOM 0 HA LYS A1025 -5.969 8.712 -3.265 1.00 0.00 H new ATOM 0 HB2 LYS A1025 -7.755 10.098 -2.042 1.00 0.00 H new ATOM 0 HB3 LYS A1025 -6.593 10.289 -0.744 1.00 0.00 H new ATOM 0 HG2 LYS A1025 -4.989 11.247 -2.507 1.00 0.00 H new ATOM 0 HG3 LYS A1025 -6.362 11.292 -3.594 1.00 0.00 H new ATOM 0 HD2 LYS A1025 -6.014 12.780 -0.972 1.00 0.00 H new ATOM 0 HD3 LYS A1025 -6.217 13.460 -2.574 1.00 0.00 H new ATOM 0 HE2 LYS A1025 -8.532 12.550 -2.671 1.00 0.00 H new ATOM 0 HE3 LYS A1025 -8.330 11.861 -1.072 1.00 0.00 H new ATOM 0 HZ1 LYS A1025 -9.487 13.968 -0.978 1.00 0.00 H new ATOM 0 HZ2 LYS A1025 -7.991 14.091 -0.184 1.00 0.00 H new ATOM 0 HZ3 LYS A1025 -8.187 14.759 -1.733 1.00 0.00 H new ATOM 1701 N ASN A1026 -4.644 8.432 -0.254 1.00 0.00 N ATOM 1702 CA ASN A1026 -3.392 8.284 0.478 1.00 0.00 C ATOM 1703 C ASN A1026 -2.620 7.069 -0.019 1.00 0.00 C ATOM 1704 O ASN A1026 -1.421 7.152 -0.286 1.00 0.00 O ATOM 1705 CB ASN A1026 -3.656 8.147 1.980 1.00 0.00 C ATOM 1706 CG ASN A1026 -4.211 9.416 2.599 1.00 0.00 C ATOM 1707 OD1 ASN A1026 -3.902 10.526 2.163 1.00 0.00 O ATOM 1708 ND2 ASN A1026 -5.042 9.262 3.619 1.00 0.00 N ATOM 0 H ASN A1026 -5.480 8.324 0.320 1.00 0.00 H new ATOM 0 HA ASN A1026 -2.795 9.179 0.304 1.00 0.00 H new ATOM 0 HB2 ASN A1026 -4.358 7.330 2.148 1.00 0.00 H new ATOM 0 HB3 ASN A1026 -2.728 7.879 2.484 1.00 0.00 H new ATOM 0 HD21 ASN A1026 -5.450 10.080 4.072 1.00 0.00 H new ATOM 0 HD22 ASN A1026 -5.274 8.326 3.951 1.00 0.00 H new ATOM 1715 N LEU A1027 -3.320 5.949 -0.153 1.00 0.00 N ATOM 1716 CA LEU A1027 -2.714 4.708 -0.619 1.00 0.00 C ATOM 1717 C LEU A1027 -2.204 4.854 -2.050 1.00 0.00 C ATOM 1718 O LEU A1027 -1.094 4.429 -2.364 1.00 0.00 O ATOM 1719 CB LEU A1027 -3.728 3.563 -0.533 1.00 0.00 C ATOM 1720 CG LEU A1027 -3.211 2.193 -0.982 1.00 0.00 C ATOM 1721 CD1 LEU A1027 -2.046 1.744 -0.112 1.00 0.00 C ATOM 1722 CD2 LEU A1027 -4.333 1.169 -0.945 1.00 0.00 C ATOM 0 H LEU A1027 -4.316 5.875 0.056 1.00 0.00 H new ATOM 0 HA LEU A1027 -1.864 4.480 0.024 1.00 0.00 H new ATOM 0 HB2 LEU A1027 -4.073 3.482 0.498 1.00 0.00 H new ATOM 0 HB3 LEU A1027 -4.595 3.822 -1.140 1.00 0.00 H new ATOM 0 HG LEU A1027 -2.853 2.279 -2.008 1.00 0.00 H new ATOM 0 HD11 LEU A1027 -1.695 0.769 -0.449 1.00 0.00 H new ATOM 0 HD12 LEU A1027 -1.235 2.468 -0.188 1.00 0.00 H new ATOM 0 HD13 LEU A1027 -2.373 1.673 0.925 1.00 0.00 H new ATOM 0 HD21 LEU A1027 -3.952 0.200 -1.267 1.00 0.00 H new ATOM 0 HD22 LEU A1027 -4.719 1.088 0.071 1.00 0.00 H new ATOM 0 HD23 LEU A1027 -5.135 1.483 -1.613 1.00 0.00 H new ATOM 1734 N GLY A1028 -3.016 5.467 -2.905 1.00 0.00 N ATOM 1735 CA GLY A1028 -2.634 5.669 -4.290 1.00 0.00 C ATOM 1736 C GLY A1028 -1.349 6.460 -4.426 1.00 0.00 C ATOM 1737 O GLY A1028 -0.508 6.151 -5.272 1.00 0.00 O ATOM 0 H GLY A1028 -3.938 5.830 -2.661 1.00 0.00 H new ATOM 0 HA2 GLY A1028 -2.514 4.701 -4.776 1.00 0.00 H new ATOM 0 HA3 GLY A1028 -3.436 6.191 -4.813 1.00 0.00 H new ATOM 1741 N THR A1029 -1.188 7.472 -3.583 1.00 0.00 N ATOM 1742 CA THR A1029 0.013 8.295 -3.593 1.00 0.00 C ATOM 1743 C THR A1029 1.173 7.570 -2.911 1.00 0.00 C ATOM 1744 O THR A1029 2.325 7.677 -3.336 1.00 0.00 O ATOM 1745 CB THR A1029 -0.235 9.638 -2.886 1.00 0.00 C ATOM 1746 OG1 THR A1029 -1.481 10.196 -3.331 1.00 0.00 O ATOM 1747 CG2 THR A1029 0.896 10.620 -3.165 1.00 0.00 C ATOM 0 H THR A1029 -1.877 7.743 -2.882 1.00 0.00 H new ATOM 0 HA THR A1029 0.272 8.485 -4.635 1.00 0.00 H new ATOM 0 HB THR A1029 -0.275 9.458 -1.812 1.00 0.00 H new ATOM 0 HG1 THR A1029 -2.224 9.705 -2.922 1.00 0.00 H new ATOM 0 HG21 THR A1029 0.695 11.561 -2.653 1.00 0.00 H new ATOM 0 HG22 THR A1029 1.836 10.204 -2.804 1.00 0.00 H new ATOM 0 HG23 THR A1029 0.967 10.798 -4.238 1.00 0.00 H new ATOM 1755 N ALA A1030 0.856 6.823 -1.859 1.00 0.00 N ATOM 1756 CA ALA A1030 1.850 6.026 -1.153 1.00 0.00 C ATOM 1757 C ALA A1030 2.482 5.014 -2.098 1.00 0.00 C ATOM 1758 O ALA A1030 3.702 4.856 -2.134 1.00 0.00 O ATOM 1759 CB ALA A1030 1.208 5.322 0.033 1.00 0.00 C ATOM 0 H ALA A1030 -0.087 6.753 -1.476 1.00 0.00 H new ATOM 0 HA ALA A1030 2.634 6.686 -0.782 1.00 0.00 H new ATOM 0 HB1 ALA A1030 1.959 4.729 0.554 1.00 0.00 H new ATOM 0 HB2 ALA A1030 0.794 6.064 0.716 1.00 0.00 H new ATOM 0 HB3 ALA A1030 0.410 4.668 -0.320 1.00 0.00 H new ATOM 1765 N LEU A1031 1.639 4.348 -2.879 1.00 0.00 N ATOM 1766 CA LEU A1031 2.098 3.383 -3.870 1.00 0.00 C ATOM 1767 C LEU A1031 2.795 4.085 -5.023 1.00 0.00 C ATOM 1768 O LEU A1031 3.707 3.536 -5.636 1.00 0.00 O ATOM 1769 CB LEU A1031 0.917 2.577 -4.413 1.00 0.00 C ATOM 1770 CG LEU A1031 0.154 1.760 -3.377 1.00 0.00 C ATOM 1771 CD1 LEU A1031 -1.053 1.098 -4.016 1.00 0.00 C ATOM 1772 CD2 LEU A1031 1.065 0.722 -2.746 1.00 0.00 C ATOM 0 H LEU A1031 0.626 4.461 -2.844 1.00 0.00 H new ATOM 0 HA LEU A1031 2.804 2.711 -3.382 1.00 0.00 H new ATOM 0 HB2 LEU A1031 0.221 3.264 -4.895 1.00 0.00 H new ATOM 0 HB3 LEU A1031 1.284 1.901 -5.186 1.00 0.00 H new ATOM 0 HG LEU A1031 -0.196 2.429 -2.591 1.00 0.00 H new ATOM 0 HD11 LEU A1031 -1.589 0.517 -3.265 1.00 0.00 H new ATOM 0 HD12 LEU A1031 -1.714 1.863 -4.424 1.00 0.00 H new ATOM 0 HD13 LEU A1031 -0.724 0.438 -4.818 1.00 0.00 H new ATOM 0 HD21 LEU A1031 0.505 0.147 -2.008 1.00 0.00 H new ATOM 0 HD22 LEU A1031 1.443 0.052 -3.518 1.00 0.00 H new ATOM 0 HD23 LEU A1031 1.902 1.221 -2.258 1.00 0.00 H new ATOM 1784 N ALA A1032 2.355 5.305 -5.308 1.00 0.00 N ATOM 1785 CA ALA A1032 2.884 6.086 -6.418 1.00 0.00 C ATOM 1786 C ALA A1032 4.399 6.226 -6.339 1.00 0.00 C ATOM 1787 O ALA A1032 5.111 5.835 -7.267 1.00 0.00 O ATOM 1788 CB ALA A1032 2.221 7.457 -6.458 1.00 0.00 C ATOM 0 H ALA A1032 1.624 5.779 -4.778 1.00 0.00 H new ATOM 0 HA ALA A1032 2.654 5.552 -7.340 1.00 0.00 H new ATOM 0 HB1 ALA A1032 2.624 8.032 -7.292 1.00 0.00 H new ATOM 0 HB2 ALA A1032 1.145 7.337 -6.586 1.00 0.00 H new ATOM 0 HB3 ALA A1032 2.419 7.984 -5.525 1.00 0.00 H new ATOM 1794 N GLU A1033 4.899 6.763 -5.235 1.00 0.00 N ATOM 1795 CA GLU A1033 6.334 6.961 -5.102 1.00 0.00 C ATOM 1796 C GLU A1033 7.024 5.679 -4.648 1.00 0.00 C ATOM 1797 O GLU A1033 8.219 5.509 -4.871 1.00 0.00 O ATOM 1798 CB GLU A1033 6.665 8.113 -4.152 1.00 0.00 C ATOM 1799 CG GLU A1033 6.291 7.865 -2.704 1.00 0.00 C ATOM 1800 CD GLU A1033 6.863 8.923 -1.784 1.00 0.00 C ATOM 1801 OE1 GLU A1033 8.101 9.066 -1.734 1.00 0.00 O ATOM 1802 OE2 GLU A1033 6.079 9.625 -1.121 1.00 0.00 O ATOM 0 H GLU A1033 4.345 7.064 -4.433 1.00 0.00 H new ATOM 0 HA GLU A1033 6.713 7.228 -6.089 1.00 0.00 H new ATOM 0 HB2 GLU A1033 7.734 8.316 -4.208 1.00 0.00 H new ATOM 0 HB3 GLU A1033 6.152 9.010 -4.497 1.00 0.00 H new ATOM 0 HG2 GLU A1033 5.205 7.848 -2.607 1.00 0.00 H new ATOM 0 HG3 GLU A1033 6.654 6.884 -2.398 1.00 0.00 H new ATOM 1809 N LEU A1034 6.273 4.779 -4.017 1.00 0.00 N ATOM 1810 CA LEU A1034 6.802 3.467 -3.648 1.00 0.00 C ATOM 1811 C LEU A1034 7.195 2.701 -4.902 1.00 0.00 C ATOM 1812 O LEU A1034 8.257 2.083 -4.967 1.00 0.00 O ATOM 1813 CB LEU A1034 5.764 2.663 -2.853 1.00 0.00 C ATOM 1814 CG LEU A1034 6.170 1.226 -2.515 1.00 0.00 C ATOM 1815 CD1 LEU A1034 7.379 1.208 -1.593 1.00 0.00 C ATOM 1816 CD2 LEU A1034 5.008 0.474 -1.886 1.00 0.00 C ATOM 0 H LEU A1034 5.300 4.933 -3.751 1.00 0.00 H new ATOM 0 HA LEU A1034 7.680 3.613 -3.019 1.00 0.00 H new ATOM 0 HB2 LEU A1034 5.553 3.192 -1.924 1.00 0.00 H new ATOM 0 HB3 LEU A1034 4.835 2.636 -3.423 1.00 0.00 H new ATOM 0 HG LEU A1034 6.442 0.724 -3.443 1.00 0.00 H new ATOM 0 HD11 LEU A1034 7.649 0.176 -1.367 1.00 0.00 H new ATOM 0 HD12 LEU A1034 8.217 1.703 -2.083 1.00 0.00 H new ATOM 0 HD13 LEU A1034 7.139 1.731 -0.668 1.00 0.00 H new ATOM 0 HD21 LEU A1034 5.317 -0.545 -1.653 1.00 0.00 H new ATOM 0 HD22 LEU A1034 4.702 0.978 -0.970 1.00 0.00 H new ATOM 0 HD23 LEU A1034 4.171 0.449 -2.583 1.00 0.00 H new ATOM 1828 N ARG A1035 6.328 2.768 -5.900 1.00 0.00 N ATOM 1829 CA ARG A1035 6.570 2.137 -7.185 1.00 0.00 C ATOM 1830 C ARG A1035 7.843 2.686 -7.823 1.00 0.00 C ATOM 1831 O ARG A1035 8.634 1.934 -8.392 1.00 0.00 O ATOM 1832 CB ARG A1035 5.353 2.354 -8.089 1.00 0.00 C ATOM 1833 CG ARG A1035 5.526 1.879 -9.524 1.00 0.00 C ATOM 1834 CD ARG A1035 4.217 1.989 -10.293 1.00 0.00 C ATOM 1835 NE ARG A1035 3.623 3.320 -10.164 1.00 0.00 N ATOM 1836 CZ ARG A1035 2.458 3.564 -9.558 1.00 0.00 C ATOM 1837 NH1 ARG A1035 1.727 2.566 -9.080 1.00 0.00 N ATOM 1838 NH2 ARG A1035 2.013 4.808 -9.443 1.00 0.00 N ATOM 0 H ARG A1035 5.437 3.262 -5.841 1.00 0.00 H new ATOM 0 HA ARG A1035 6.716 1.066 -7.044 1.00 0.00 H new ATOM 0 HB2 ARG A1035 4.498 1.838 -7.652 1.00 0.00 H new ATOM 0 HB3 ARG A1035 5.112 3.417 -8.100 1.00 0.00 H new ATOM 0 HG2 ARG A1035 6.294 2.474 -10.018 1.00 0.00 H new ATOM 0 HG3 ARG A1035 5.870 0.845 -9.530 1.00 0.00 H new ATOM 0 HD2 ARG A1035 4.394 1.770 -11.346 1.00 0.00 H new ATOM 0 HD3 ARG A1035 3.515 1.240 -9.926 1.00 0.00 H new ATOM 0 HE ARG A1035 4.130 4.111 -10.562 1.00 0.00 H new ATOM 0 HH11 ARG A1035 2.053 1.604 -9.174 1.00 0.00 H new ATOM 0 HH12 ARG A1035 0.838 2.760 -8.618 1.00 0.00 H new ATOM 0 HH21 ARG A1035 2.561 5.582 -9.818 1.00 0.00 H new ATOM 0 HH22 ARG A1035 1.123 4.990 -8.980 1.00 0.00 H new ATOM 1852 N THR A1036 8.049 3.992 -7.701 1.00 0.00 N ATOM 1853 CA THR A1036 9.250 4.627 -8.217 1.00 0.00 C ATOM 1854 C THR A1036 10.470 4.270 -7.363 1.00 0.00 C ATOM 1855 O THR A1036 11.529 3.928 -7.888 1.00 0.00 O ATOM 1856 CB THR A1036 9.089 6.157 -8.255 1.00 0.00 C ATOM 1857 OG1 THR A1036 7.889 6.503 -8.958 1.00 0.00 O ATOM 1858 CG2 THR A1036 10.283 6.812 -8.933 1.00 0.00 C ATOM 0 H THR A1036 7.396 4.631 -7.247 1.00 0.00 H new ATOM 0 HA THR A1036 9.403 4.257 -9.231 1.00 0.00 H new ATOM 0 HB THR A1036 9.030 6.520 -7.229 1.00 0.00 H new ATOM 0 HG1 THR A1036 7.113 6.324 -8.388 1.00 0.00 H new ATOM 0 HG21 THR A1036 10.145 7.893 -8.947 1.00 0.00 H new ATOM 0 HG22 THR A1036 11.192 6.569 -8.383 1.00 0.00 H new ATOM 0 HG23 THR A1036 10.368 6.444 -9.955 1.00 0.00 H new ATOM 1866 N ALA A1037 10.307 4.349 -6.045 1.00 0.00 N ATOM 1867 CA ALA A1037 11.388 4.063 -5.109 1.00 0.00 C ATOM 1868 C ALA A1037 11.904 2.641 -5.282 1.00 0.00 C ATOM 1869 O ALA A1037 13.107 2.426 -5.423 1.00 0.00 O ATOM 1870 CB ALA A1037 10.925 4.286 -3.675 1.00 0.00 C ATOM 0 H ALA A1037 9.428 4.611 -5.599 1.00 0.00 H new ATOM 0 HA ALA A1037 12.207 4.749 -5.325 1.00 0.00 H new ATOM 0 HB1 ALA A1037 11.744 4.068 -2.990 1.00 0.00 H new ATOM 0 HB2 ALA A1037 10.614 5.323 -3.550 1.00 0.00 H new ATOM 0 HB3 ALA A1037 10.085 3.627 -3.457 1.00 0.00 H new ATOM 1876 N ALA A1038 10.987 1.680 -5.289 1.00 0.00 N ATOM 1877 CA ALA A1038 11.346 0.277 -5.463 1.00 0.00 C ATOM 1878 C ALA A1038 11.995 0.047 -6.820 1.00 0.00 C ATOM 1879 O ALA A1038 12.916 -0.755 -6.947 1.00 0.00 O ATOM 1880 CB ALA A1038 10.121 -0.613 -5.306 1.00 0.00 C ATOM 0 H ALA A1038 9.987 1.847 -5.176 1.00 0.00 H new ATOM 0 HA ALA A1038 12.068 0.016 -4.689 1.00 0.00 H new ATOM 0 HB1 ALA A1038 10.409 -1.656 -5.439 1.00 0.00 H new ATOM 0 HB2 ALA A1038 9.698 -0.478 -4.310 1.00 0.00 H new ATOM 0 HB3 ALA A1038 9.377 -0.344 -6.056 1.00 0.00 H new ATOM 1886 N GLN A1039 11.521 0.771 -7.826 1.00 0.00 N ATOM 1887 CA GLN A1039 12.052 0.641 -9.174 1.00 0.00 C ATOM 1888 C GLN A1039 13.487 1.147 -9.242 1.00 0.00 C ATOM 1889 O GLN A1039 14.378 0.442 -9.710 1.00 0.00 O ATOM 1890 CB GLN A1039 11.174 1.405 -10.165 1.00 0.00 C ATOM 1891 CG GLN A1039 11.688 1.366 -11.594 1.00 0.00 C ATOM 1892 CD GLN A1039 10.737 2.023 -12.570 1.00 0.00 C ATOM 1893 OE1 GLN A1039 10.818 3.225 -12.827 1.00 0.00 O ATOM 1894 NE2 GLN A1039 9.832 1.233 -13.124 1.00 0.00 N ATOM 0 H GLN A1039 10.769 1.454 -7.732 1.00 0.00 H new ATOM 0 HA GLN A1039 12.049 -0.416 -9.442 1.00 0.00 H new ATOM 0 HB2 GLN A1039 10.167 0.989 -10.139 1.00 0.00 H new ATOM 0 HB3 GLN A1039 11.099 2.444 -9.844 1.00 0.00 H new ATOM 0 HG2 GLN A1039 12.656 1.866 -11.642 1.00 0.00 H new ATOM 0 HG3 GLN A1039 11.849 0.330 -11.891 1.00 0.00 H new ATOM 0 HE21 GLN A1039 9.802 0.243 -12.881 1.00 0.00 H new ATOM 0 HE22 GLN A1039 9.164 1.614 -13.794 1.00 0.00 H new ATOM 1903 N LYS A1040 13.714 2.361 -8.752 1.00 0.00 N ATOM 1904 CA LYS A1040 15.043 2.956 -8.799 1.00 0.00 C ATOM 1905 C LYS A1040 16.010 2.198 -7.898 1.00 0.00 C ATOM 1906 O LYS A1040 17.200 2.109 -8.192 1.00 0.00 O ATOM 1907 CB LYS A1040 14.997 4.438 -8.412 1.00 0.00 C ATOM 1908 CG LYS A1040 14.138 5.273 -9.347 1.00 0.00 C ATOM 1909 CD LYS A1040 14.401 6.764 -9.189 1.00 0.00 C ATOM 1910 CE LYS A1040 14.042 7.270 -7.801 1.00 0.00 C ATOM 1911 NZ LYS A1040 14.271 8.736 -7.672 1.00 0.00 N ATOM 0 H LYS A1040 13.000 2.948 -8.321 1.00 0.00 H new ATOM 0 HA LYS A1040 15.403 2.884 -9.825 1.00 0.00 H new ATOM 0 HB2 LYS A1040 14.613 4.530 -7.396 1.00 0.00 H new ATOM 0 HB3 LYS A1040 16.011 4.837 -8.407 1.00 0.00 H new ATOM 0 HG2 LYS A1040 14.333 4.978 -10.378 1.00 0.00 H new ATOM 0 HG3 LYS A1040 13.085 5.068 -9.151 1.00 0.00 H new ATOM 0 HD2 LYS A1040 15.453 6.968 -9.387 1.00 0.00 H new ATOM 0 HD3 LYS A1040 13.825 7.313 -9.934 1.00 0.00 H new ATOM 0 HE2 LYS A1040 12.996 7.045 -7.591 1.00 0.00 H new ATOM 0 HE3 LYS A1040 14.637 6.742 -7.056 1.00 0.00 H new ATOM 0 HZ1 LYS A1040 14.015 9.044 -6.712 1.00 0.00 H new ATOM 0 HZ2 LYS A1040 15.274 8.947 -7.848 1.00 0.00 H new ATOM 0 HZ3 LYS A1040 13.684 9.241 -8.366 1.00 0.00 H new ATOM 1925 N ALA A1041 15.488 1.638 -6.810 1.00 0.00 N ATOM 1926 CA ALA A1041 16.288 0.808 -5.918 1.00 0.00 C ATOM 1927 C ALA A1041 16.662 -0.496 -6.606 1.00 0.00 C ATOM 1928 O ALA A1041 17.753 -1.029 -6.407 1.00 0.00 O ATOM 1929 CB ALA A1041 15.530 0.518 -4.634 1.00 0.00 C ATOM 0 H ALA A1041 14.514 1.745 -6.526 1.00 0.00 H new ATOM 0 HA ALA A1041 17.199 1.352 -5.669 1.00 0.00 H new ATOM 0 HB1 ALA A1041 16.144 -0.103 -3.981 1.00 0.00 H new ATOM 0 HB2 ALA A1041 15.297 1.456 -4.129 1.00 0.00 H new ATOM 0 HB3 ALA A1041 14.604 -0.007 -4.869 1.00 0.00 H new ATOM 1935 N GLN A1042 15.745 -1.004 -7.417 1.00 0.00 N ATOM 1936 CA GLN A1042 15.978 -2.221 -8.177 1.00 0.00 C ATOM 1937 C GLN A1042 17.034 -1.971 -9.251 1.00 0.00 C ATOM 1938 O GLN A1042 17.832 -2.851 -9.574 1.00 0.00 O ATOM 1939 CB GLN A1042 14.668 -2.700 -8.810 1.00 0.00 C ATOM 1940 CG GLN A1042 14.766 -4.059 -9.477 1.00 0.00 C ATOM 1941 CD GLN A1042 13.454 -4.502 -10.102 1.00 0.00 C ATOM 1942 OE1 GLN A1042 12.653 -3.679 -10.554 1.00 0.00 O ATOM 1943 NE2 GLN A1042 13.217 -5.804 -10.121 1.00 0.00 N ATOM 0 H GLN A1042 14.826 -0.587 -7.565 1.00 0.00 H new ATOM 0 HA GLN A1042 16.344 -2.998 -7.506 1.00 0.00 H new ATOM 0 HB2 GLN A1042 13.897 -2.739 -8.040 1.00 0.00 H new ATOM 0 HB3 GLN A1042 14.344 -1.967 -9.548 1.00 0.00 H new ATOM 0 HG2 GLN A1042 15.537 -4.027 -10.246 1.00 0.00 H new ATOM 0 HG3 GLN A1042 15.081 -4.799 -8.741 1.00 0.00 H new ATOM 0 HE21 GLN A1042 13.904 -6.453 -9.738 1.00 0.00 H new ATOM 0 HE22 GLN A1042 12.347 -6.158 -10.519 1.00 0.00 H new ATOM 1952 N GLU A1043 17.034 -0.756 -9.787 1.00 0.00 N ATOM 1953 CA GLU A1043 18.015 -0.353 -10.789 1.00 0.00 C ATOM 1954 C GLU A1043 19.378 -0.102 -10.153 1.00 0.00 C ATOM 1955 O GLU A1043 20.414 -0.425 -10.737 1.00 0.00 O ATOM 1956 CB GLU A1043 17.561 0.918 -11.507 1.00 0.00 C ATOM 1957 CG GLU A1043 16.246 0.777 -12.248 1.00 0.00 C ATOM 1958 CD GLU A1043 15.873 2.039 -12.994 1.00 0.00 C ATOM 1959 OE1 GLU A1043 16.484 2.309 -14.052 1.00 0.00 O ATOM 1960 OE2 GLU A1043 14.978 2.773 -12.530 1.00 0.00 O ATOM 0 H GLU A1043 16.362 -0.029 -9.543 1.00 0.00 H new ATOM 0 HA GLU A1043 18.101 -1.168 -11.507 1.00 0.00 H new ATOM 0 HB2 GLU A1043 17.469 1.722 -10.776 1.00 0.00 H new ATOM 0 HB3 GLU A1043 18.334 1.218 -12.215 1.00 0.00 H new ATOM 0 HG2 GLU A1043 16.315 -0.052 -12.952 1.00 0.00 H new ATOM 0 HG3 GLU A1043 15.456 0.529 -11.539 1.00 0.00 H new ATOM 1967 N ALA A1044 19.372 0.486 -8.965 1.00 0.00 N ATOM 1968 CA ALA A1044 20.604 0.858 -8.286 1.00 0.00 C ATOM 1969 C ALA A1044 20.870 -0.054 -7.093 1.00 0.00 C ATOM 1970 O ALA A1044 20.454 0.293 -5.970 1.00 0.00 O ATOM 1971 CB ALA A1044 20.535 2.311 -7.842 1.00 0.00 C ATOM 1972 OXT ALA A1044 21.498 -1.116 -7.284 1.00 0.00 O ATOM 0 H ALA A1044 18.522 0.716 -8.450 1.00 0.00 H new ATOM 0 HA ALA A1044 21.431 0.741 -8.986 1.00 0.00 H new ATOM 0 HB1 ALA A1044 21.461 2.581 -7.335 1.00 0.00 H new ATOM 0 HB2 ALA A1044 20.399 2.952 -8.713 1.00 0.00 H new ATOM 0 HB3 ALA A1044 19.696 2.443 -7.159 1.00 0.00 H new TER 1978 ALA A1044