USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1101 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 951 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A1014 GLN :FLIP amide:sc= -2.19 F(o=-5.3!,f=-2.2) USER MOD Set 1.3: A1018 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A1006 GLN : amide:sc= -0.681 X(o=-2.1,f=-2.3!) USER MOD Set 2.2: A1007 GLN :FLIP amide:sc= -1.45! F(o=-2.6,f=-2.1!) USER MOD Single : A 921 SER OG : rot 180:sc= 0.0144 USER MOD Single : A 922 ASN : amide:sc= 1.06 K(o=1.1,f=-0.44) USER MOD Single : A 924 LYS NZ :NH3+ -165:sc= 1.21 (180deg=1.09) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 928 ASN : amide:sc= -3.02! C(o=-3!,f=-10!) USER MOD Single : A 930 THR OG1 : rot 80:sc= 1.24 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl -158:sc= -0.499 (180deg=-1.18) USER MOD Single : A 940 SER OG : rot 25:sc= 0.769 USER MOD Single : A 941 SER OG : rot -72:sc= -0.165 USER MOD Single : A 942 LYS NZ :NH3+ -172:sc= 1.21 (180deg=1.1) USER MOD Single : A 944 GLN : amide:sc= -0.394 K(o=-0.39,f=-1.3) USER MOD Single : A 954 MET CE :methyl 147:sc= -9.33! (180deg=-12.4!) USER MOD Single : A 956 LYS NZ :NH3+ -131:sc= -0.121 (180deg=-0.573) USER MOD Single : A 964 THR OG1 : rot 82:sc= 1.25 USER MOD Single : A 968 THR OG1 : rot -127:sc= -2.83! USER MOD Single : A 972 SER OG : rot -15:sc= 0.897 USER MOD Single : A 979 SER OG : rot 4:sc= 0.872 USER MOD Single : A 980 THR OG1 : rot -3:sc= -1.8 USER MOD Single : A 981 HIS : no HE2:sc= -0.218 K(o=-0.22,f=-5.1!) USER MOD Single : A 986 MET CE :methyl 140:sc= -0.116 (180deg=-0.947) USER MOD Single : A 988 GLN :FLIP amide:sc= -0.0337 F(o=-2.4!,f=-0.034) USER MOD Single : A 989 LYS NZ :NH3+ -142:sc= -2.1! (180deg=-4.7!) USER MOD Single : A 992 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 993 SER OG : rot 75:sc= 0.185 USER MOD Single : A1000 ASN : amide:sc= -0.323 X(o=-0.32,f=-0.65) USER MOD Single : A1001 LYS NZ :NH3+ -126:sc= 0.737 (180deg=-1.03) USER MOD Single : A1002 MET CE :methyl 174:sc= -0.638 (180deg=-0.755) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1008 TYR OH : rot 30:sc= 0 USER MOD Single : A1010 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1011 THR OG1 : rot -34:sc= 0.418 USER MOD Single : A1012 SER OG : rot 180:sc= 0 USER MOD Single : A1015 GLN : amide:sc= -0.0719 X(o=-0.072,f=-0.17) USER MOD Single : A1017 TYR OH : rot 30:sc= 0 USER MOD Single : A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1020 GLN : amide:sc= 0.4 X(o=0.4,f=-0.019) USER MOD Single : A1021 MET CE :methyl -109:sc= -2.32! (180deg=-4.44!) USER MOD Single : A1023 THR OG1 : rot 180:sc= 0 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ 169:sc=-0.00782 (180deg=-0.141) USER MOD Single : A1034 ASN :FLIP amide:sc= -1.22 F(o=-5.7!,f=-1.2) USER MOD Single : A1041 GLN : amide:sc= -0.0993 K(o=-0.099,f=-1) USER MOD Single : A1045 LYS NZ :NH3+ -167:sc= -0.0262 (180deg=-0.354) USER MOD Single : A1046 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1048 SER OG : rot 64:sc= 0.427 USER MOD Single : A1049 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.35) USER MOD Single : A1050 SER OG : rot 80:sc= 1.15 USER MOD Single : A1053 HIS : no HD1:sc= -0.0198 X(o=-0.02,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -8.190 -19.329 -2.395 1.00 0.00 N ATOM 2 CA ARG A 920 -8.124 -18.312 -1.362 1.00 0.00 C ATOM 3 C ARG A 920 -9.219 -17.277 -1.574 1.00 0.00 C ATOM 4 O ARG A 920 -9.540 -16.918 -2.706 1.00 0.00 O ATOM 5 CB ARG A 920 -6.751 -17.629 -1.302 1.00 0.00 C ATOM 6 CG ARG A 920 -6.543 -16.502 -2.306 1.00 0.00 C ATOM 7 CD ARG A 920 -6.467 -17.014 -3.728 1.00 0.00 C ATOM 8 NE ARG A 920 -6.226 -15.930 -4.683 1.00 0.00 N ATOM 9 CZ ARG A 920 -6.114 -16.092 -6.002 1.00 0.00 C ATOM 10 NH1 ARG A 920 -6.245 -17.298 -6.547 1.00 0.00 N ATOM 11 NH2 ARG A 920 -5.886 -15.041 -6.774 1.00 0.00 N ATOM 0 HA ARG A 920 -8.277 -18.812 -0.405 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -6.604 -17.231 -0.298 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -5.980 -18.383 -1.462 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -7.361 -15.786 -2.222 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -5.625 -15.966 -2.064 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -5.669 -17.752 -3.807 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -7.397 -17.522 -3.982 1.00 0.00 H new ATOM 0 HE ARG A 920 -6.138 -14.984 -4.313 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -6.433 -18.107 -5.955 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -6.158 -17.414 -7.557 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -5.797 -14.113 -6.359 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -5.799 -15.159 -7.783 1.00 0.00 H new ATOM 25 N SER A 921 -9.782 -16.803 -0.483 1.00 0.00 N ATOM 26 CA SER A 921 -10.843 -15.816 -0.540 1.00 0.00 C ATOM 27 C SER A 921 -10.266 -14.406 -0.482 1.00 0.00 C ATOM 28 O SER A 921 -10.948 -13.457 -0.088 1.00 0.00 O ATOM 29 CB SER A 921 -11.802 -16.063 0.616 1.00 0.00 C ATOM 30 OG SER A 921 -11.095 -16.191 1.844 1.00 0.00 O ATOM 0 H SER A 921 -9.521 -17.087 0.461 1.00 0.00 H new ATOM 0 HA SER A 921 -11.383 -15.908 -1.482 1.00 0.00 H new ATOM 0 HB2 SER A 921 -12.514 -15.240 0.686 1.00 0.00 H new ATOM 0 HB3 SER A 921 -12.379 -16.968 0.428 1.00 0.00 H new ATOM 0 HG SER A 921 -11.731 -16.347 2.573 1.00 0.00 H new ATOM 36 N ASN A 922 -9.006 -14.290 -0.917 1.00 0.00 N ATOM 37 CA ASN A 922 -8.239 -13.041 -0.856 1.00 0.00 C ATOM 38 C ASN A 922 -8.407 -12.395 0.486 1.00 0.00 C ATOM 39 O ASN A 922 -8.760 -11.217 0.573 1.00 0.00 O ATOM 40 CB ASN A 922 -8.642 -12.036 -1.926 1.00 0.00 C ATOM 41 CG ASN A 922 -9.465 -12.637 -3.046 1.00 0.00 C ATOM 42 OD1 ASN A 922 -10.695 -12.562 -3.056 1.00 0.00 O ATOM 43 ND2 ASN A 922 -8.783 -13.263 -3.984 1.00 0.00 N ATOM 0 H ASN A 922 -8.486 -15.067 -1.325 1.00 0.00 H new ATOM 0 HA ASN A 922 -7.199 -13.318 -1.030 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -9.211 -11.231 -1.460 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -7.743 -11.588 -2.348 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -9.273 -13.710 -4.759 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -7.765 -13.300 -3.935 1.00 0.00 H new ATOM 50 N ASP A 923 -8.101 -13.188 1.501 1.00 0.00 N ATOM 51 CA ASP A 923 -8.237 -12.839 2.913 1.00 0.00 C ATOM 52 C ASP A 923 -7.660 -11.455 3.222 1.00 0.00 C ATOM 53 O ASP A 923 -7.300 -10.704 2.330 1.00 0.00 O ATOM 54 CB ASP A 923 -7.541 -13.912 3.760 1.00 0.00 C ATOM 55 CG ASP A 923 -8.062 -13.982 5.183 1.00 0.00 C ATOM 56 OD1 ASP A 923 -9.093 -14.643 5.406 1.00 0.00 O ATOM 57 OD2 ASP A 923 -7.446 -13.369 6.078 1.00 0.00 O ATOM 0 H ASP A 923 -7.736 -14.130 1.362 1.00 0.00 H new ATOM 0 HA ASP A 923 -9.299 -12.799 3.157 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -7.673 -14.884 3.284 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -6.470 -13.710 3.782 1.00 0.00 H new ATOM 62 N LYS A 924 -7.614 -11.113 4.492 1.00 0.00 N ATOM 63 CA LYS A 924 -7.115 -9.809 4.963 1.00 0.00 C ATOM 64 C LYS A 924 -5.885 -9.342 4.153 1.00 0.00 C ATOM 65 O LYS A 924 -5.597 -8.146 4.082 1.00 0.00 O ATOM 66 CB LYS A 924 -6.762 -9.901 6.454 1.00 0.00 C ATOM 67 CG LYS A 924 -7.235 -8.718 7.297 1.00 0.00 C ATOM 68 CD LYS A 924 -6.660 -7.403 6.801 1.00 0.00 C ATOM 69 CE LYS A 924 -6.897 -6.265 7.779 1.00 0.00 C ATOM 70 NZ LYS A 924 -8.343 -5.971 7.968 1.00 0.00 N ATOM 0 H LYS A 924 -7.922 -11.728 5.245 1.00 0.00 H new ATOM 0 HA LYS A 924 -7.904 -9.071 4.817 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -7.195 -10.815 6.860 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.680 -9.990 6.552 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -8.324 -8.669 7.275 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -6.943 -8.873 8.336 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -5.589 -7.518 6.633 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -7.109 -7.152 5.840 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -6.452 -6.518 8.741 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -6.391 -5.369 7.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -8.452 -5.046 8.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -8.818 -5.953 7.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -8.772 -6.708 8.563 1.00 0.00 H new ATOM 84 N VAL A 925 -5.182 -10.294 3.529 1.00 0.00 N ATOM 85 CA VAL A 925 -4.077 -9.988 2.646 1.00 0.00 C ATOM 86 C VAL A 925 -4.505 -9.054 1.510 1.00 0.00 C ATOM 87 O VAL A 925 -3.930 -7.978 1.350 1.00 0.00 O ATOM 88 CB VAL A 925 -3.456 -11.278 2.055 1.00 0.00 C ATOM 89 CG1 VAL A 925 -2.707 -12.046 3.132 1.00 0.00 C ATOM 90 CG2 VAL A 925 -4.517 -12.174 1.430 1.00 0.00 C ATOM 0 H VAL A 925 -5.371 -11.291 3.629 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.324 -9.479 3.248 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.759 -10.978 1.272 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -2.276 -12.950 2.701 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.910 -11.422 3.537 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -3.397 -12.318 3.931 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -4.045 -13.069 1.026 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -5.246 -12.459 2.189 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -5.021 -11.636 0.627 1.00 0.00 H new ATOM 100 N TYR A 926 -5.559 -9.405 0.775 1.00 0.00 N ATOM 101 CA TYR A 926 -5.951 -8.602 -0.364 1.00 0.00 C ATOM 102 C TYR A 926 -6.685 -7.383 0.154 1.00 0.00 C ATOM 103 O TYR A 926 -6.597 -6.281 -0.390 1.00 0.00 O ATOM 104 CB TYR A 926 -6.838 -9.441 -1.286 1.00 0.00 C ATOM 105 CG TYR A 926 -7.592 -8.668 -2.345 1.00 0.00 C ATOM 106 CD1 TYR A 926 -8.803 -8.050 -2.052 1.00 0.00 C ATOM 107 CD2 TYR A 926 -7.103 -8.574 -3.639 1.00 0.00 C ATOM 108 CE1 TYR A 926 -9.502 -7.358 -3.025 1.00 0.00 C ATOM 109 CE2 TYR A 926 -7.794 -7.884 -4.614 1.00 0.00 C ATOM 110 CZ TYR A 926 -8.990 -7.277 -4.304 1.00 0.00 C ATOM 111 OH TYR A 926 -9.677 -6.591 -5.278 1.00 0.00 O ATOM 0 H TYR A 926 -6.142 -10.224 0.948 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.084 -8.276 -0.939 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.216 -10.187 -1.780 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.559 -9.982 -0.674 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -9.203 -8.111 -1.051 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -6.165 -9.049 -3.888 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -10.442 -6.884 -2.785 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -7.398 -7.820 -5.617 1.00 0.00 H new ATOM 0 HH TYR A 926 -9.177 -6.631 -6.120 1.00 0.00 H new ATOM 121 N GLU A 927 -7.379 -7.621 1.251 1.00 0.00 N ATOM 122 CA GLU A 927 -8.251 -6.649 1.864 1.00 0.00 C ATOM 123 C GLU A 927 -7.497 -5.401 2.307 1.00 0.00 C ATOM 124 O GLU A 927 -7.798 -4.294 1.863 1.00 0.00 O ATOM 125 CB GLU A 927 -8.930 -7.288 3.066 1.00 0.00 C ATOM 126 CG GLU A 927 -10.189 -6.575 3.486 1.00 0.00 C ATOM 127 CD GLU A 927 -10.423 -6.647 4.979 1.00 0.00 C ATOM 128 OE1 GLU A 927 -9.806 -5.855 5.720 1.00 0.00 O ATOM 129 OE2 GLU A 927 -11.222 -7.499 5.421 1.00 0.00 O ATOM 0 H GLU A 927 -7.349 -8.512 1.746 1.00 0.00 H new ATOM 0 HA GLU A 927 -8.988 -6.339 1.123 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -9.169 -8.325 2.831 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -8.232 -7.303 3.903 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -10.131 -5.530 3.180 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -11.041 -7.012 2.966 1.00 0.00 H new ATOM 136 N ASN A 928 -6.509 -5.580 3.174 1.00 0.00 N ATOM 137 CA ASN A 928 -5.824 -4.446 3.780 1.00 0.00 C ATOM 138 C ASN A 928 -4.939 -3.751 2.762 1.00 0.00 C ATOM 139 O ASN A 928 -4.742 -2.541 2.840 1.00 0.00 O ATOM 140 CB ASN A 928 -4.998 -4.887 4.983 1.00 0.00 C ATOM 141 CG ASN A 928 -4.750 -3.776 5.997 1.00 0.00 C ATOM 142 OD1 ASN A 928 -4.691 -4.034 7.196 1.00 0.00 O ATOM 143 ND2 ASN A 928 -4.592 -2.543 5.537 1.00 0.00 N ATOM 0 H ASN A 928 -6.166 -6.493 3.472 1.00 0.00 H new ATOM 0 HA ASN A 928 -6.581 -3.741 4.124 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.508 -5.713 5.479 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -4.039 -5.269 4.634 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -4.416 -1.776 6.185 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -4.647 -2.362 4.535 1.00 0.00 H new ATOM 150 N VAL A 929 -4.385 -4.501 1.818 1.00 0.00 N ATOM 151 CA VAL A 929 -3.646 -3.868 0.738 1.00 0.00 C ATOM 152 C VAL A 929 -4.582 -2.982 -0.092 1.00 0.00 C ATOM 153 O VAL A 929 -4.192 -1.908 -0.555 1.00 0.00 O ATOM 154 CB VAL A 929 -2.913 -4.885 -0.157 1.00 0.00 C ATOM 155 CG1 VAL A 929 -2.068 -4.157 -1.183 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.041 -5.799 0.687 1.00 0.00 C ATOM 0 H VAL A 929 -4.431 -5.519 1.778 1.00 0.00 H new ATOM 0 HA VAL A 929 -2.875 -3.247 1.193 1.00 0.00 H new ATOM 0 HB VAL A 929 -3.653 -5.494 -0.676 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -1.553 -4.883 -1.812 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -2.709 -3.530 -1.803 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -1.334 -3.533 -0.673 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -1.529 -6.512 0.041 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -1.304 -5.203 1.225 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -2.663 -6.338 1.401 1.00 0.00 H new ATOM 166 N THR A 930 -5.829 -3.416 -0.243 1.00 0.00 N ATOM 167 CA THR A 930 -6.860 -2.563 -0.817 1.00 0.00 C ATOM 168 C THR A 930 -7.111 -1.381 0.121 1.00 0.00 C ATOM 169 O THR A 930 -7.310 -0.248 -0.316 1.00 0.00 O ATOM 170 CB THR A 930 -8.179 -3.336 -1.036 1.00 0.00 C ATOM 171 OG1 THR A 930 -7.944 -4.491 -1.847 1.00 0.00 O ATOM 172 CG2 THR A 930 -9.230 -2.458 -1.703 1.00 0.00 C ATOM 0 H THR A 930 -6.148 -4.348 0.023 1.00 0.00 H new ATOM 0 HA THR A 930 -6.512 -2.211 -1.788 1.00 0.00 H new ATOM 0 HB THR A 930 -8.551 -3.642 -0.058 1.00 0.00 H new ATOM 0 HG1 THR A 930 -7.564 -5.206 -1.295 1.00 0.00 H new ATOM 0 HG21 THR A 930 -10.147 -3.031 -1.844 1.00 0.00 H new ATOM 0 HG22 THR A 930 -9.436 -1.593 -1.072 1.00 0.00 H new ATOM 0 HG23 THR A 930 -8.861 -2.121 -2.672 1.00 0.00 H new ATOM 180 N GLY A 931 -7.089 -1.675 1.419 1.00 0.00 N ATOM 181 CA GLY A 931 -7.207 -0.651 2.445 1.00 0.00 C ATOM 182 C GLY A 931 -6.126 0.413 2.347 1.00 0.00 C ATOM 183 O GLY A 931 -6.351 1.563 2.720 1.00 0.00 O ATOM 0 H GLY A 931 -6.990 -2.622 1.783 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.185 -0.176 2.366 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.159 -1.121 3.427 1.00 0.00 H new ATOM 187 N LEU A 932 -4.950 0.036 1.847 1.00 0.00 N ATOM 188 CA LEU A 932 -3.888 1.004 1.587 1.00 0.00 C ATOM 189 C LEU A 932 -4.331 1.962 0.480 1.00 0.00 C ATOM 190 O LEU A 932 -4.083 3.166 0.547 1.00 0.00 O ATOM 191 CB LEU A 932 -2.580 0.278 1.220 1.00 0.00 C ATOM 192 CG LEU A 932 -1.465 1.151 0.614 1.00 0.00 C ATOM 193 CD1 LEU A 932 -1.071 2.280 1.550 1.00 0.00 C ATOM 194 CD2 LEU A 932 -0.246 0.300 0.290 1.00 0.00 C ATOM 0 H LEU A 932 -4.710 -0.928 1.615 1.00 0.00 H new ATOM 0 HA LEU A 932 -3.695 1.587 2.487 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -2.190 -0.201 2.118 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -2.816 -0.517 0.512 1.00 0.00 H new ATOM 0 HG LEU A 932 -1.853 1.592 -0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 932 -0.282 2.875 1.090 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -1.938 2.912 1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -0.710 1.864 2.490 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.534 0.930 -0.138 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.124 -0.167 1.202 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -0.522 -0.473 -0.427 1.00 0.00 H new ATOM 206 N VAL A 933 -5.021 1.420 -0.518 1.00 0.00 N ATOM 207 CA VAL A 933 -5.606 2.234 -1.576 1.00 0.00 C ATOM 208 C VAL A 933 -6.738 3.097 -1.012 1.00 0.00 C ATOM 209 O VAL A 933 -6.881 4.262 -1.361 1.00 0.00 O ATOM 210 CB VAL A 933 -6.154 1.365 -2.731 1.00 0.00 C ATOM 211 CG1 VAL A 933 -6.636 2.237 -3.881 1.00 0.00 C ATOM 212 CG2 VAL A 933 -5.102 0.376 -3.213 1.00 0.00 C ATOM 0 H VAL A 933 -5.189 0.419 -0.616 1.00 0.00 H new ATOM 0 HA VAL A 933 -4.815 2.870 -1.973 1.00 0.00 H new ATOM 0 HB VAL A 933 -7.004 0.798 -2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -7.017 1.604 -4.682 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -7.430 2.896 -3.530 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -5.806 2.836 -4.256 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -5.512 -0.224 -4.026 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -4.227 0.920 -3.569 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -4.813 -0.278 -2.390 1.00 0.00 H new ATOM 222 N LYS A 934 -7.541 2.513 -0.135 1.00 0.00 N ATOM 223 CA LYS A 934 -8.618 3.243 0.524 1.00 0.00 C ATOM 224 C LYS A 934 -8.045 4.384 1.356 1.00 0.00 C ATOM 225 O LYS A 934 -8.672 5.423 1.524 1.00 0.00 O ATOM 226 CB LYS A 934 -9.442 2.318 1.430 1.00 0.00 C ATOM 227 CG LYS A 934 -9.913 1.017 0.781 1.00 0.00 C ATOM 228 CD LYS A 934 -10.834 1.243 -0.411 1.00 0.00 C ATOM 229 CE LYS A 934 -10.064 1.275 -1.724 1.00 0.00 C ATOM 230 NZ LYS A 934 -10.969 1.360 -2.903 1.00 0.00 N ATOM 0 H LYS A 934 -7.468 1.533 0.138 1.00 0.00 H new ATOM 0 HA LYS A 934 -9.272 3.644 -0.251 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -8.845 2.071 2.308 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -10.316 2.866 1.782 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.044 0.444 0.458 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -10.433 0.414 1.525 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -11.582 0.451 -0.448 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -11.371 2.183 -0.282 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -9.386 2.129 -1.726 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -9.448 0.379 -1.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -10.402 1.379 -3.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -11.599 0.532 -2.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -11.539 2.228 -2.841 1.00 0.00 H new ATOM 244 N ALA A 935 -6.837 4.185 1.864 1.00 0.00 N ATOM 245 CA ALA A 935 -6.172 5.197 2.664 1.00 0.00 C ATOM 246 C ALA A 935 -5.610 6.309 1.794 1.00 0.00 C ATOM 247 O ALA A 935 -5.438 7.435 2.249 1.00 0.00 O ATOM 248 CB ALA A 935 -5.081 4.582 3.499 1.00 0.00 C ATOM 0 H ALA A 935 -6.298 3.329 1.734 1.00 0.00 H new ATOM 0 HA ALA A 935 -6.916 5.634 3.329 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -4.595 5.357 4.091 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -5.510 3.833 4.164 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.346 4.110 2.847 1.00 0.00 H new ATOM 254 N VAL A 936 -5.302 6.005 0.543 1.00 0.00 N ATOM 255 CA VAL A 936 -4.925 7.057 -0.381 1.00 0.00 C ATOM 256 C VAL A 936 -6.191 7.667 -0.989 1.00 0.00 C ATOM 257 O VAL A 936 -6.150 8.658 -1.719 1.00 0.00 O ATOM 258 CB VAL A 936 -3.912 6.581 -1.457 1.00 0.00 C ATOM 259 CG1 VAL A 936 -4.533 5.606 -2.439 1.00 0.00 C ATOM 260 CG2 VAL A 936 -3.298 7.766 -2.194 1.00 0.00 C ATOM 0 H VAL A 936 -5.305 5.062 0.153 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.394 7.832 0.173 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.119 6.050 -0.930 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -3.786 5.302 -3.172 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -4.893 4.728 -1.902 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -5.368 6.086 -2.950 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -2.592 7.404 -2.942 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -4.086 8.337 -2.685 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -2.776 8.406 -1.483 1.00 0.00 H new ATOM 270 N ILE A 937 -7.331 7.068 -0.648 1.00 0.00 N ATOM 271 CA ILE A 937 -8.617 7.716 -0.837 1.00 0.00 C ATOM 272 C ILE A 937 -8.846 8.671 0.333 1.00 0.00 C ATOM 273 O ILE A 937 -9.374 9.772 0.164 1.00 0.00 O ATOM 274 CB ILE A 937 -9.786 6.711 -0.934 1.00 0.00 C ATOM 275 CG1 ILE A 937 -9.604 5.794 -2.147 1.00 0.00 C ATOM 276 CG2 ILE A 937 -11.118 7.444 -1.019 1.00 0.00 C ATOM 277 CD1 ILE A 937 -10.722 4.788 -2.319 1.00 0.00 C ATOM 0 H ILE A 937 -7.385 6.135 -0.240 1.00 0.00 H new ATOM 0 HA ILE A 937 -8.593 8.253 -1.785 1.00 0.00 H new ATOM 0 HB ILE A 937 -9.787 6.099 -0.032 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -9.535 6.405 -3.047 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -8.658 5.261 -2.050 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -11.929 6.719 -1.087 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.253 8.057 -0.128 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -11.127 8.081 -1.903 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -10.526 4.173 -3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -10.778 4.152 -1.436 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -11.668 5.314 -2.448 1.00 0.00 H new ATOM 289 N GLU A 938 -8.437 8.232 1.527 1.00 0.00 N ATOM 290 CA GLU A 938 -8.344 9.121 2.685 1.00 0.00 C ATOM 291 C GLU A 938 -7.512 10.338 2.320 1.00 0.00 C ATOM 292 O GLU A 938 -7.839 11.457 2.683 1.00 0.00 O ATOM 293 CB GLU A 938 -7.692 8.421 3.881 1.00 0.00 C ATOM 294 CG GLU A 938 -8.430 7.180 4.360 1.00 0.00 C ATOM 295 CD GLU A 938 -9.829 7.478 4.848 1.00 0.00 C ATOM 296 OE1 GLU A 938 -9.991 8.394 5.683 1.00 0.00 O ATOM 297 OE2 GLU A 938 -10.771 6.786 4.415 1.00 0.00 O ATOM 0 H GLU A 938 -8.166 7.267 1.715 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.356 9.414 2.964 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -6.673 8.142 3.612 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -7.622 9.129 4.707 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.481 6.457 3.546 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -7.862 6.714 5.165 1.00 0.00 H new ATOM 304 N MET A 939 -6.446 10.093 1.571 1.00 0.00 N ATOM 305 CA MET A 939 -5.568 11.156 1.102 1.00 0.00 C ATOM 306 C MET A 939 -6.341 12.165 0.254 1.00 0.00 C ATOM 307 O MET A 939 -6.200 13.372 0.435 1.00 0.00 O ATOM 308 CB MET A 939 -4.388 10.561 0.316 1.00 0.00 C ATOM 309 CG MET A 939 -3.590 11.568 -0.505 1.00 0.00 C ATOM 310 SD MET A 939 -4.285 11.831 -2.150 1.00 0.00 S ATOM 311 CE MET A 939 -3.151 13.043 -2.819 1.00 0.00 C ATOM 0 H MET A 939 -6.167 9.158 1.273 1.00 0.00 H new ATOM 0 HA MET A 939 -5.171 11.687 1.967 1.00 0.00 H new ATOM 0 HB2 MET A 939 -3.713 10.071 1.018 1.00 0.00 H new ATOM 0 HB3 MET A 939 -4.768 9.789 -0.353 1.00 0.00 H new ATOM 0 HG2 MET A 939 -3.556 12.519 0.027 1.00 0.00 H new ATOM 0 HG3 MET A 939 -2.562 11.219 -0.601 1.00 0.00 H new ATOM 0 HE1 MET A 939 -3.636 13.586 -3.631 1.00 0.00 H new ATOM 0 HE2 MET A 939 -2.863 13.744 -2.035 1.00 0.00 H new ATOM 0 HE3 MET A 939 -2.262 12.539 -3.199 1.00 0.00 H new ATOM 321 N SER A 940 -7.172 11.668 -0.651 1.00 0.00 N ATOM 322 CA SER A 940 -7.937 12.538 -1.530 1.00 0.00 C ATOM 323 C SER A 940 -9.099 13.216 -0.799 1.00 0.00 C ATOM 324 O SER A 940 -9.518 14.309 -1.179 1.00 0.00 O ATOM 325 CB SER A 940 -8.437 11.758 -2.750 1.00 0.00 C ATOM 326 OG SER A 940 -8.931 10.480 -2.384 1.00 0.00 O ATOM 0 H SER A 940 -7.333 10.671 -0.795 1.00 0.00 H new ATOM 0 HA SER A 940 -7.270 13.330 -1.870 1.00 0.00 H new ATOM 0 HB2 SER A 940 -9.224 12.325 -3.248 1.00 0.00 H new ATOM 0 HB3 SER A 940 -7.625 11.643 -3.468 1.00 0.00 H new ATOM 0 HG SER A 940 -9.228 10.499 -1.450 1.00 0.00 H new ATOM 332 N SER A 941 -9.622 12.591 0.252 1.00 0.00 N ATOM 333 CA SER A 941 -10.724 13.200 0.984 1.00 0.00 C ATOM 334 C SER A 941 -10.156 14.264 1.902 1.00 0.00 C ATOM 335 O SER A 941 -10.647 15.403 1.978 1.00 0.00 O ATOM 336 CB SER A 941 -11.518 12.144 1.759 1.00 0.00 C ATOM 337 OG SER A 941 -10.665 11.144 2.289 1.00 0.00 O ATOM 0 H SER A 941 -9.310 11.687 0.608 1.00 0.00 H new ATOM 0 HA SER A 941 -11.424 13.663 0.289 1.00 0.00 H new ATOM 0 HB2 SER A 941 -12.068 12.622 2.569 1.00 0.00 H new ATOM 0 HB3 SER A 941 -12.255 11.685 1.101 1.00 0.00 H new ATOM 0 HG SER A 941 -10.333 10.578 1.561 1.00 0.00 H new ATOM 343 N LYS A 942 -9.079 13.868 2.558 1.00 0.00 N ATOM 344 CA LYS A 942 -8.277 14.748 3.371 1.00 0.00 C ATOM 345 C LYS A 942 -7.891 15.991 2.601 1.00 0.00 C ATOM 346 O LYS A 942 -7.966 17.092 3.130 1.00 0.00 O ATOM 347 CB LYS A 942 -7.017 14.015 3.809 1.00 0.00 C ATOM 348 CG LYS A 942 -7.010 13.643 5.268 1.00 0.00 C ATOM 349 CD LYS A 942 -6.807 14.874 6.115 1.00 0.00 C ATOM 350 CE LYS A 942 -6.985 14.565 7.596 1.00 0.00 C ATOM 351 NZ LYS A 942 -8.190 15.226 8.161 1.00 0.00 N ATOM 0 H LYS A 942 -8.736 12.908 2.536 1.00 0.00 H new ATOM 0 HA LYS A 942 -8.861 15.047 4.241 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -6.908 13.110 3.212 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -6.151 14.642 3.599 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -7.951 13.161 5.533 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -6.216 12.922 5.464 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -5.808 15.275 5.943 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -7.516 15.645 5.815 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -7.064 13.487 7.735 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -6.101 14.893 8.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -8.201 15.103 9.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -8.169 16.240 7.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -9.045 14.797 7.752 1.00 0.00 H new ATOM 365 N ILE A 943 -7.491 15.797 1.345 1.00 0.00 N ATOM 366 CA ILE A 943 -7.000 16.886 0.520 1.00 0.00 C ATOM 367 C ILE A 943 -8.126 17.873 0.198 1.00 0.00 C ATOM 368 O ILE A 943 -7.877 19.068 0.034 1.00 0.00 O ATOM 369 CB ILE A 943 -6.333 16.355 -0.790 1.00 0.00 C ATOM 370 CG1 ILE A 943 -5.130 17.218 -1.201 1.00 0.00 C ATOM 371 CG2 ILE A 943 -7.327 16.271 -1.941 1.00 0.00 C ATOM 372 CD1 ILE A 943 -5.479 18.606 -1.697 1.00 0.00 C ATOM 0 H ILE A 943 -7.500 14.889 0.880 1.00 0.00 H new ATOM 0 HA ILE A 943 -6.234 17.414 1.089 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.980 15.348 -0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -4.460 17.311 -0.346 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -4.578 16.697 -1.983 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.822 15.897 -2.832 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -8.138 15.594 -1.673 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -7.734 17.262 -2.143 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -4.565 19.138 -1.963 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -6.122 18.528 -2.574 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -6.001 19.152 -0.912 1.00 0.00 H new ATOM 384 N GLN A 944 -9.363 17.376 0.139 1.00 0.00 N ATOM 385 CA GLN A 944 -10.506 18.223 -0.186 1.00 0.00 C ATOM 386 C GLN A 944 -10.556 19.469 0.707 1.00 0.00 C ATOM 387 O GLN A 944 -10.528 20.585 0.189 1.00 0.00 O ATOM 388 CB GLN A 944 -11.825 17.443 -0.122 1.00 0.00 C ATOM 389 CG GLN A 944 -11.931 16.343 -1.166 1.00 0.00 C ATOM 390 CD GLN A 944 -11.712 16.855 -2.577 1.00 0.00 C ATOM 391 OE1 GLN A 944 -12.016 18.007 -2.891 1.00 0.00 O ATOM 392 NE2 GLN A 944 -11.172 16.006 -3.435 1.00 0.00 N ATOM 0 H GLN A 944 -9.595 16.398 0.311 1.00 0.00 H new ATOM 0 HA GLN A 944 -10.373 18.559 -1.214 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -11.930 17.003 0.870 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -12.655 18.137 -0.252 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -11.197 15.567 -0.947 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -12.915 15.879 -1.101 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -10.934 15.060 -3.136 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -10.993 16.297 -4.396 1.00 0.00 H new ATOM 401 N PRO A 945 -10.629 19.329 2.047 1.00 0.00 N ATOM 402 CA PRO A 945 -10.576 20.476 2.945 1.00 0.00 C ATOM 403 C PRO A 945 -9.197 20.670 3.598 1.00 0.00 C ATOM 404 O PRO A 945 -9.096 21.249 4.679 1.00 0.00 O ATOM 405 CB PRO A 945 -11.614 20.096 3.999 1.00 0.00 C ATOM 406 CG PRO A 945 -11.673 18.592 3.990 1.00 0.00 C ATOM 407 CD PRO A 945 -10.851 18.110 2.816 1.00 0.00 C ATOM 0 HA PRO A 945 -10.763 21.418 2.429 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -11.329 20.471 4.982 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -12.587 20.527 3.763 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -11.281 18.188 4.923 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -12.704 18.250 3.902 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -9.912 17.660 3.139 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -11.382 17.357 2.234 1.00 0.00 H new ATOM 415 N ALA A 946 -8.146 20.198 2.933 1.00 0.00 N ATOM 416 CA ALA A 946 -6.798 20.207 3.503 1.00 0.00 C ATOM 417 C ALA A 946 -6.046 21.522 3.335 1.00 0.00 C ATOM 418 O ALA A 946 -5.845 21.995 2.215 1.00 0.00 O ATOM 419 CB ALA A 946 -5.961 19.113 2.870 1.00 0.00 C ATOM 0 H ALA A 946 -8.201 19.802 1.994 1.00 0.00 H new ATOM 0 HA ALA A 946 -6.943 20.050 4.572 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -4.959 19.127 3.300 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -6.424 18.145 3.060 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -5.897 19.280 1.795 1.00 0.00 H new ATOM 425 N PRO A 947 -5.628 22.124 4.459 1.00 0.00 N ATOM 426 CA PRO A 947 -4.510 23.063 4.485 1.00 0.00 C ATOM 427 C PRO A 947 -3.182 22.283 4.541 1.00 0.00 C ATOM 428 O PRO A 947 -3.197 21.051 4.482 1.00 0.00 O ATOM 429 CB PRO A 947 -4.756 23.842 5.782 1.00 0.00 C ATOM 430 CG PRO A 947 -5.438 22.873 6.679 1.00 0.00 C ATOM 431 CD PRO A 947 -6.253 21.974 5.786 1.00 0.00 C ATOM 0 HA PRO A 947 -4.445 23.711 3.611 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -3.820 24.193 6.217 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -5.375 24.721 5.605 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -4.712 22.297 7.253 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -6.075 23.389 7.397 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -6.222 20.939 6.127 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.301 22.273 5.769 1.00 0.00 H new ATOM 439 N PRO A 948 -2.017 22.958 4.650 1.00 0.00 N ATOM 440 CA PRO A 948 -0.715 22.276 4.760 1.00 0.00 C ATOM 441 C PRO A 948 -0.693 21.222 5.861 1.00 0.00 C ATOM 442 O PRO A 948 -0.170 20.111 5.683 1.00 0.00 O ATOM 443 CB PRO A 948 0.265 23.405 5.097 1.00 0.00 C ATOM 444 CG PRO A 948 -0.580 24.597 5.416 1.00 0.00 C ATOM 445 CD PRO A 948 -1.853 24.417 4.648 1.00 0.00 C ATOM 0 HA PRO A 948 -0.472 21.739 3.843 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.896 23.135 5.944 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.929 23.610 4.257 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -0.776 24.662 6.486 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -0.077 25.520 5.128 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -2.692 24.921 5.128 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -1.777 24.816 3.637 1.00 0.00 H new ATOM 453 N GLU A 949 -1.303 21.571 6.984 1.00 0.00 N ATOM 454 CA GLU A 949 -1.352 20.704 8.145 1.00 0.00 C ATOM 455 C GLU A 949 -2.139 19.433 7.874 1.00 0.00 C ATOM 456 O GLU A 949 -2.163 18.543 8.709 1.00 0.00 O ATOM 457 CB GLU A 949 -1.966 21.447 9.327 1.00 0.00 C ATOM 458 CG GLU A 949 -1.049 22.499 9.924 1.00 0.00 C ATOM 459 CD GLU A 949 -1.693 23.265 11.059 1.00 0.00 C ATOM 460 OE1 GLU A 949 -1.791 22.716 12.178 1.00 0.00 O ATOM 461 OE2 GLU A 949 -2.108 24.423 10.837 1.00 0.00 O ATOM 0 H GLU A 949 -1.777 22.465 7.113 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.327 20.417 8.381 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -2.892 21.924 9.005 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -2.231 20.726 10.101 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -0.140 22.018 10.286 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -0.750 23.199 9.143 1.00 0.00 H new ATOM 468 N GLU A 950 -2.786 19.348 6.717 1.00 0.00 N ATOM 469 CA GLU A 950 -3.492 18.134 6.347 1.00 0.00 C ATOM 470 C GLU A 950 -2.784 17.408 5.215 1.00 0.00 C ATOM 471 O GLU A 950 -3.044 16.229 4.975 1.00 0.00 O ATOM 472 CB GLU A 950 -4.921 18.435 5.938 1.00 0.00 C ATOM 473 CG GLU A 950 -5.764 19.018 7.056 1.00 0.00 C ATOM 474 CD GLU A 950 -6.249 17.974 8.030 1.00 0.00 C ATOM 475 OE1 GLU A 950 -5.418 17.367 8.730 1.00 0.00 O ATOM 476 OE2 GLU A 950 -7.478 17.763 8.104 1.00 0.00 O ATOM 0 H GLU A 950 -2.835 20.098 6.028 1.00 0.00 H new ATOM 0 HA GLU A 950 -3.503 17.490 7.226 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -4.911 19.133 5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.389 17.517 5.582 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -5.180 19.765 7.593 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -6.623 19.533 6.626 1.00 0.00 H new ATOM 483 N TYR A 951 -1.893 18.108 4.515 1.00 0.00 N ATOM 484 CA TYR A 951 -1.092 17.478 3.473 1.00 0.00 C ATOM 485 C TYR A 951 -0.277 16.355 4.071 1.00 0.00 C ATOM 486 O TYR A 951 -0.098 15.296 3.457 1.00 0.00 O ATOM 487 CB TYR A 951 -0.165 18.483 2.785 1.00 0.00 C ATOM 488 CG TYR A 951 -0.860 19.362 1.773 1.00 0.00 C ATOM 489 CD1 TYR A 951 -1.491 18.812 0.665 1.00 0.00 C ATOM 490 CD2 TYR A 951 -0.881 20.740 1.922 1.00 0.00 C ATOM 491 CE1 TYR A 951 -2.126 19.612 -0.263 1.00 0.00 C ATOM 492 CE2 TYR A 951 -1.512 21.546 0.998 1.00 0.00 C ATOM 493 CZ TYR A 951 -2.132 20.978 -0.094 1.00 0.00 C ATOM 494 OH TYR A 951 -2.762 21.775 -1.019 1.00 0.00 O ATOM 0 H TYR A 951 -1.710 19.102 4.650 1.00 0.00 H new ATOM 0 HA TYR A 951 -1.772 17.083 2.718 1.00 0.00 H new ATOM 0 HB2 TYR A 951 0.297 19.114 3.544 1.00 0.00 H new ATOM 0 HB3 TYR A 951 0.639 17.940 2.289 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -1.485 17.741 0.527 1.00 0.00 H new ATOM 0 HD2 TYR A 951 -0.395 21.190 2.775 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -2.616 19.169 -1.117 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.520 22.618 1.130 1.00 0.00 H new ATOM 0 HH TYR A 951 -2.676 22.715 -0.754 1.00 0.00 H new ATOM 504 N VAL A 952 0.197 16.579 5.283 1.00 0.00 N ATOM 505 CA VAL A 952 0.954 15.555 5.974 1.00 0.00 C ATOM 506 C VAL A 952 0.050 14.428 6.548 1.00 0.00 C ATOM 507 O VAL A 952 0.321 13.258 6.286 1.00 0.00 O ATOM 508 CB VAL A 952 1.958 16.150 7.014 1.00 0.00 C ATOM 509 CG1 VAL A 952 1.431 17.421 7.671 1.00 0.00 C ATOM 510 CG2 VAL A 952 2.334 15.120 8.071 1.00 0.00 C ATOM 0 H VAL A 952 0.073 17.448 5.802 1.00 0.00 H new ATOM 0 HA VAL A 952 1.576 15.067 5.223 1.00 0.00 H new ATOM 0 HB VAL A 952 2.855 16.420 6.457 1.00 0.00 H new ATOM 0 HG11 VAL A 952 2.166 17.793 8.384 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.251 18.178 6.907 1.00 0.00 H new ATOM 0 HG13 VAL A 952 0.499 17.202 8.192 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.033 15.564 8.779 1.00 0.00 H new ATOM 0 HG22 VAL A 952 1.437 14.798 8.600 1.00 0.00 H new ATOM 0 HG23 VAL A 952 2.801 14.260 7.591 1.00 0.00 H new ATOM 520 N PRO A 953 -1.039 14.728 7.305 1.00 0.00 N ATOM 521 CA PRO A 953 -2.005 13.702 7.760 1.00 0.00 C ATOM 522 C PRO A 953 -2.635 12.875 6.644 1.00 0.00 C ATOM 523 O PRO A 953 -2.897 11.691 6.834 1.00 0.00 O ATOM 524 CB PRO A 953 -3.094 14.513 8.434 1.00 0.00 C ATOM 525 CG PRO A 953 -2.386 15.710 8.922 1.00 0.00 C ATOM 526 CD PRO A 953 -1.384 16.035 7.853 1.00 0.00 C ATOM 0 HA PRO A 953 -1.496 12.974 8.391 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.889 14.775 7.736 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -3.557 13.960 9.252 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -3.076 16.539 9.081 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -1.896 15.516 9.876 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.807 16.691 7.092 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -0.510 16.543 8.262 1.00 0.00 H new ATOM 534 N MET A 954 -2.920 13.481 5.495 1.00 0.00 N ATOM 535 CA MET A 954 -3.507 12.718 4.397 1.00 0.00 C ATOM 536 C MET A 954 -2.552 11.601 4.005 1.00 0.00 C ATOM 537 O MET A 954 -2.942 10.444 3.835 1.00 0.00 O ATOM 538 CB MET A 954 -3.823 13.607 3.181 1.00 0.00 C ATOM 539 CG MET A 954 -2.602 14.115 2.432 1.00 0.00 C ATOM 540 SD MET A 954 -3.016 15.174 1.037 1.00 0.00 S ATOM 541 CE MET A 954 -3.927 16.461 1.882 1.00 0.00 C ATOM 0 H MET A 954 -2.760 14.470 5.302 1.00 0.00 H new ATOM 0 HA MET A 954 -4.454 12.298 4.737 1.00 0.00 H new ATOM 0 HB2 MET A 954 -4.449 13.044 2.489 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.409 14.463 3.516 1.00 0.00 H new ATOM 0 HG2 MET A 954 -1.964 14.667 3.122 1.00 0.00 H new ATOM 0 HG3 MET A 954 -2.023 13.264 2.074 1.00 0.00 H new ATOM 0 HE1 MET A 954 -3.761 17.414 1.380 1.00 0.00 H new ATOM 0 HE2 MET A 954 -4.991 16.223 1.867 1.00 0.00 H new ATOM 0 HE3 MET A 954 -3.585 16.531 2.915 1.00 0.00 H new ATOM 551 N VAL A 955 -1.292 11.965 3.849 1.00 0.00 N ATOM 552 CA VAL A 955 -0.252 10.975 3.633 1.00 0.00 C ATOM 553 C VAL A 955 -0.079 10.077 4.853 1.00 0.00 C ATOM 554 O VAL A 955 0.327 8.924 4.737 1.00 0.00 O ATOM 555 CB VAL A 955 1.094 11.622 3.266 1.00 0.00 C ATOM 556 CG1 VAL A 955 2.142 10.553 3.015 1.00 0.00 C ATOM 557 CG2 VAL A 955 0.937 12.519 2.049 1.00 0.00 C ATOM 0 H VAL A 955 -0.965 12.931 3.868 1.00 0.00 H new ATOM 0 HA VAL A 955 -0.576 10.365 2.790 1.00 0.00 H new ATOM 0 HB VAL A 955 1.425 12.237 4.103 1.00 0.00 H new ATOM 0 HG11 VAL A 955 3.089 11.026 2.756 1.00 0.00 H new ATOM 0 HG12 VAL A 955 2.271 9.951 3.915 1.00 0.00 H new ATOM 0 HG13 VAL A 955 1.820 9.913 2.194 1.00 0.00 H new ATOM 0 HG21 VAL A 955 1.899 12.969 1.802 1.00 0.00 H new ATOM 0 HG22 VAL A 955 0.586 11.927 1.204 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.214 13.305 2.267 1.00 0.00 H new ATOM 567 N LYS A 956 -0.386 10.597 6.027 1.00 0.00 N ATOM 568 CA LYS A 956 -0.301 9.795 7.236 1.00 0.00 C ATOM 569 C LYS A 956 -1.278 8.630 7.124 1.00 0.00 C ATOM 570 O LYS A 956 -0.984 7.513 7.553 1.00 0.00 O ATOM 571 CB LYS A 956 -0.608 10.647 8.468 1.00 0.00 C ATOM 572 CG LYS A 956 -0.344 9.948 9.788 1.00 0.00 C ATOM 573 CD LYS A 956 1.114 9.541 9.928 1.00 0.00 C ATOM 574 CE LYS A 956 1.427 9.108 11.349 1.00 0.00 C ATOM 575 NZ LYS A 956 1.236 10.222 12.319 1.00 0.00 N ATOM 0 H LYS A 956 -0.693 11.559 6.170 1.00 0.00 H new ATOM 0 HA LYS A 956 0.711 9.407 7.348 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.009 11.557 8.425 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.654 10.952 8.434 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -0.618 10.609 10.611 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -0.977 9.064 9.865 1.00 0.00 H new ATOM 0 HD2 LYS A 956 1.335 8.726 9.239 1.00 0.00 H new ATOM 0 HD3 LYS A 956 1.756 10.376 9.649 1.00 0.00 H new ATOM 0 HE2 LYS A 956 0.785 8.272 11.624 1.00 0.00 H new ATOM 0 HE3 LYS A 956 2.456 8.751 11.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 2.073 10.295 12.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 1.107 11.115 11.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 0.395 10.035 12.901 1.00 0.00 H new ATOM 589 N GLU A 957 -2.431 8.912 6.525 1.00 0.00 N ATOM 590 CA GLU A 957 -3.426 7.888 6.232 1.00 0.00 C ATOM 591 C GLU A 957 -2.834 6.749 5.394 1.00 0.00 C ATOM 592 O GLU A 957 -3.016 5.581 5.732 1.00 0.00 O ATOM 593 CB GLU A 957 -4.653 8.500 5.535 1.00 0.00 C ATOM 594 CG GLU A 957 -5.480 9.372 6.460 1.00 0.00 C ATOM 595 CD GLU A 957 -5.868 8.644 7.733 1.00 0.00 C ATOM 596 OE1 GLU A 957 -6.434 7.531 7.643 1.00 0.00 O ATOM 597 OE2 GLU A 957 -5.600 9.176 8.831 1.00 0.00 O ATOM 0 H GLU A 957 -2.700 9.851 6.231 1.00 0.00 H new ATOM 0 HA GLU A 957 -3.749 7.463 7.182 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.323 9.094 4.683 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.279 7.699 5.142 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.915 10.269 6.713 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -6.381 9.699 5.941 1.00 0.00 H new ATOM 604 N VAL A 958 -2.099 7.073 4.328 1.00 0.00 N ATOM 605 CA VAL A 958 -1.468 6.028 3.514 1.00 0.00 C ATOM 606 C VAL A 958 -0.277 5.380 4.240 1.00 0.00 C ATOM 607 O VAL A 958 0.037 4.211 4.008 1.00 0.00 O ATOM 608 CB VAL A 958 -1.002 6.555 2.134 1.00 0.00 C ATOM 609 CG1 VAL A 958 -2.089 7.387 1.478 1.00 0.00 C ATOM 610 CG2 VAL A 958 0.286 7.353 2.244 1.00 0.00 C ATOM 0 H VAL A 958 -1.927 8.027 4.012 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.238 5.274 3.352 1.00 0.00 H new ATOM 0 HB VAL A 958 -0.802 5.687 1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -1.738 7.746 0.510 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -2.980 6.775 1.337 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -2.330 8.238 2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 958 0.581 7.706 1.256 1.00 0.00 H new ATOM 0 HG22 VAL A 958 0.130 8.207 2.903 1.00 0.00 H new ATOM 0 HG23 VAL A 958 1.073 6.719 2.653 1.00 0.00 H new ATOM 620 N GLY A 959 0.388 6.129 5.114 1.00 0.00 N ATOM 621 CA GLY A 959 1.525 5.577 5.828 1.00 0.00 C ATOM 622 C GLY A 959 1.095 4.596 6.895 1.00 0.00 C ATOM 623 O GLY A 959 1.673 3.514 7.029 1.00 0.00 O ATOM 0 H GLY A 959 0.163 7.098 5.339 1.00 0.00 H new ATOM 0 HA2 GLY A 959 2.190 5.079 5.123 1.00 0.00 H new ATOM 0 HA3 GLY A 959 2.094 6.386 6.286 1.00 0.00 H new ATOM 627 N LEU A 960 0.077 4.976 7.652 1.00 0.00 N ATOM 628 CA LEU A 960 -0.578 4.060 8.575 1.00 0.00 C ATOM 629 C LEU A 960 -1.188 2.900 7.809 1.00 0.00 C ATOM 630 O LEU A 960 -1.260 1.785 8.310 1.00 0.00 O ATOM 631 CB LEU A 960 -1.661 4.788 9.374 1.00 0.00 C ATOM 632 CG LEU A 960 -1.159 5.926 10.266 1.00 0.00 C ATOM 633 CD1 LEU A 960 -2.327 6.682 10.875 1.00 0.00 C ATOM 634 CD2 LEU A 960 -0.252 5.383 11.358 1.00 0.00 C ATOM 0 H LEU A 960 -0.316 5.917 7.645 1.00 0.00 H new ATOM 0 HA LEU A 960 0.167 3.675 9.271 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -2.395 5.191 8.677 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -2.180 4.061 9.998 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.585 6.618 9.650 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -1.950 7.487 11.506 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -2.943 7.102 10.080 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -2.928 6.000 11.477 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.097 6.205 11.984 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -0.805 4.671 11.970 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.604 4.884 10.905 1.00 0.00 H new ATOM 646 N ALA A 961 -1.615 3.182 6.590 1.00 0.00 N ATOM 647 CA ALA A 961 -2.189 2.168 5.723 1.00 0.00 C ATOM 648 C ALA A 961 -1.199 1.051 5.440 1.00 0.00 C ATOM 649 O ALA A 961 -1.509 -0.107 5.678 1.00 0.00 O ATOM 650 CB ALA A 961 -2.668 2.770 4.426 1.00 0.00 C ATOM 0 H ALA A 961 -1.574 4.113 6.176 1.00 0.00 H new ATOM 0 HA ALA A 961 -3.044 1.744 6.250 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -3.093 1.988 3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.429 3.522 4.633 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -1.829 3.236 3.909 1.00 0.00 H new ATOM 656 N LEU A 962 -0.011 1.384 4.929 1.00 0.00 N ATOM 657 CA LEU A 962 0.987 0.368 4.648 1.00 0.00 C ATOM 658 C LEU A 962 1.473 -0.304 5.932 1.00 0.00 C ATOM 659 O LEU A 962 1.813 -1.481 5.923 1.00 0.00 O ATOM 660 CB LEU A 962 2.141 0.971 3.835 1.00 0.00 C ATOM 661 CG LEU A 962 3.395 0.100 3.682 1.00 0.00 C ATOM 662 CD1 LEU A 962 4.068 0.392 2.355 1.00 0.00 C ATOM 663 CD2 LEU A 962 4.378 0.351 4.818 1.00 0.00 C ATOM 0 H LEU A 962 0.274 2.338 4.706 1.00 0.00 H new ATOM 0 HA LEU A 962 0.529 -0.415 4.044 1.00 0.00 H new ATOM 0 HB2 LEU A 962 1.768 1.212 2.839 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.433 1.912 4.302 1.00 0.00 H new ATOM 0 HG LEU A 962 3.088 -0.945 3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 962 4.957 -0.230 2.253 1.00 0.00 H new ATOM 0 HD12 LEU A 962 3.377 0.173 1.541 1.00 0.00 H new ATOM 0 HD13 LEU A 962 4.354 1.443 2.316 1.00 0.00 H new ATOM 0 HD21 LEU A 962 5.257 -0.279 4.684 1.00 0.00 H new ATOM 0 HD22 LEU A 962 4.679 1.399 4.814 1.00 0.00 H new ATOM 0 HD23 LEU A 962 3.903 0.113 5.770 1.00 0.00 H new ATOM 675 N ARG A 963 1.522 0.434 7.034 1.00 0.00 N ATOM 676 CA ARG A 963 1.838 -0.172 8.328 1.00 0.00 C ATOM 677 C ARG A 963 0.756 -1.163 8.765 1.00 0.00 C ATOM 678 O ARG A 963 1.061 -2.283 9.173 1.00 0.00 O ATOM 679 CB ARG A 963 2.056 0.907 9.391 1.00 0.00 C ATOM 680 CG ARG A 963 3.359 1.665 9.203 1.00 0.00 C ATOM 681 CD ARG A 963 4.553 0.723 9.248 1.00 0.00 C ATOM 682 NE ARG A 963 5.801 1.376 8.854 1.00 0.00 N ATOM 683 CZ ARG A 963 6.963 0.733 8.720 1.00 0.00 C ATOM 684 NH1 ARG A 963 7.044 -0.561 9.006 1.00 0.00 N ATOM 685 NH2 ARG A 963 8.044 1.387 8.308 1.00 0.00 N ATOM 0 H ARG A 963 1.350 1.439 7.062 1.00 0.00 H new ATOM 0 HA ARG A 963 2.766 -0.733 8.214 1.00 0.00 H new ATOM 0 HB2 ARG A 963 1.224 1.611 9.363 1.00 0.00 H new ATOM 0 HB3 ARG A 963 2.049 0.445 10.378 1.00 0.00 H new ATOM 0 HG2 ARG A 963 3.343 2.191 8.248 1.00 0.00 H new ATOM 0 HG3 ARG A 963 3.459 2.421 9.982 1.00 0.00 H new ATOM 0 HD2 ARG A 963 4.659 0.325 10.257 1.00 0.00 H new ATOM 0 HD3 ARG A 963 4.367 -0.125 8.589 1.00 0.00 H new ATOM 0 HE ARG A 963 5.782 2.379 8.671 1.00 0.00 H new ATOM 0 HH11 ARG A 963 6.218 -1.065 9.328 1.00 0.00 H new ATOM 0 HH12 ARG A 963 7.932 -1.051 8.903 1.00 0.00 H new ATOM 0 HH21 ARG A 963 7.987 2.383 8.093 1.00 0.00 H new ATOM 0 HH22 ARG A 963 8.931 0.893 8.206 1.00 0.00 H new ATOM 699 N THR A 964 -0.501 -0.756 8.697 1.00 0.00 N ATOM 700 CA THR A 964 -1.599 -1.687 8.936 1.00 0.00 C ATOM 701 C THR A 964 -1.544 -2.833 7.918 1.00 0.00 C ATOM 702 O THR A 964 -1.797 -3.994 8.245 1.00 0.00 O ATOM 703 CB THR A 964 -2.966 -0.982 8.862 1.00 0.00 C ATOM 704 OG1 THR A 964 -2.931 0.229 9.627 1.00 0.00 O ATOM 705 CG2 THR A 964 -4.069 -1.879 9.401 1.00 0.00 C ATOM 0 H THR A 964 -0.787 0.199 8.482 1.00 0.00 H new ATOM 0 HA THR A 964 -1.485 -2.088 9.943 1.00 0.00 H new ATOM 0 HB THR A 964 -3.174 -0.756 7.816 1.00 0.00 H new ATOM 0 HG1 THR A 964 -2.525 0.943 9.092 1.00 0.00 H new ATOM 0 HG21 THR A 964 -5.025 -1.358 9.338 1.00 0.00 H new ATOM 0 HG22 THR A 964 -4.115 -2.794 8.811 1.00 0.00 H new ATOM 0 HG23 THR A 964 -3.860 -2.128 10.441 1.00 0.00 H new ATOM 713 N LEU A 965 -1.172 -2.485 6.690 1.00 0.00 N ATOM 714 CA LEU A 965 -0.938 -3.451 5.622 1.00 0.00 C ATOM 715 C LEU A 965 0.157 -4.438 6.024 1.00 0.00 C ATOM 716 O LEU A 965 0.143 -5.595 5.619 1.00 0.00 O ATOM 717 CB LEU A 965 -0.572 -2.691 4.333 1.00 0.00 C ATOM 718 CG LEU A 965 0.019 -3.510 3.181 1.00 0.00 C ATOM 719 CD1 LEU A 965 -0.274 -2.826 1.860 1.00 0.00 C ATOM 720 CD2 LEU A 965 1.527 -3.663 3.339 1.00 0.00 C ATOM 0 H LEU A 965 -1.023 -1.517 6.406 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.843 -4.032 5.442 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -1.470 -2.193 3.968 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.142 -1.909 4.593 1.00 0.00 H new ATOM 0 HG LEU A 965 -0.439 -4.499 3.198 1.00 0.00 H new ATOM 0 HD11 LEU A 965 0.149 -3.413 1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -1.352 -2.742 1.725 1.00 0.00 H new ATOM 0 HD13 LEU A 965 0.171 -1.831 1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 965 1.922 -4.248 2.509 1.00 0.00 H new ATOM 0 HD22 LEU A 965 1.994 -2.678 3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 965 1.745 -4.172 4.278 1.00 0.00 H new ATOM 732 N LEU A 966 1.086 -3.963 6.842 1.00 0.00 N ATOM 733 CA LEU A 966 2.202 -4.781 7.318 1.00 0.00 C ATOM 734 C LEU A 966 1.703 -5.905 8.231 1.00 0.00 C ATOM 735 O LEU A 966 2.296 -6.983 8.280 1.00 0.00 O ATOM 736 CB LEU A 966 3.237 -3.920 8.050 1.00 0.00 C ATOM 737 CG LEU A 966 4.488 -4.662 8.529 1.00 0.00 C ATOM 738 CD1 LEU A 966 5.286 -5.190 7.347 1.00 0.00 C ATOM 739 CD2 LEU A 966 5.347 -3.751 9.392 1.00 0.00 C ATOM 0 H LEU A 966 1.091 -3.006 7.195 1.00 0.00 H new ATOM 0 HA LEU A 966 2.682 -5.231 6.449 1.00 0.00 H new ATOM 0 HB2 LEU A 966 3.546 -3.112 7.387 1.00 0.00 H new ATOM 0 HB3 LEU A 966 2.756 -3.459 8.913 1.00 0.00 H new ATOM 0 HG LEU A 966 4.173 -5.513 9.133 1.00 0.00 H new ATOM 0 HD11 LEU A 966 6.170 -5.714 7.710 1.00 0.00 H new ATOM 0 HD12 LEU A 966 4.669 -5.878 6.769 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.592 -4.357 6.713 1.00 0.00 H new ATOM 0 HD21 LEU A 966 6.232 -4.293 9.724 1.00 0.00 H new ATOM 0 HD22 LEU A 966 5.652 -2.881 8.811 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.774 -3.425 10.260 1.00 0.00 H new ATOM 751 N ALA A 967 0.619 -5.652 8.957 1.00 0.00 N ATOM 752 CA ALA A 967 -0.027 -6.703 9.745 1.00 0.00 C ATOM 753 C ALA A 967 -0.604 -7.764 8.811 1.00 0.00 C ATOM 754 O ALA A 967 -0.503 -8.968 9.051 1.00 0.00 O ATOM 755 CB ALA A 967 -1.116 -6.118 10.635 1.00 0.00 C ATOM 0 H ALA A 967 0.170 -4.738 9.018 1.00 0.00 H new ATOM 0 HA ALA A 967 0.717 -7.168 10.391 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.583 -6.917 11.212 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -0.677 -5.388 11.315 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.869 -5.630 10.016 1.00 0.00 H new ATOM 761 N THR A 968 -1.199 -7.299 7.733 1.00 0.00 N ATOM 762 CA THR A 968 -1.635 -8.171 6.661 1.00 0.00 C ATOM 763 C THR A 968 -0.442 -8.920 6.050 1.00 0.00 C ATOM 764 O THR A 968 -0.544 -10.099 5.702 1.00 0.00 O ATOM 765 CB THR A 968 -2.389 -7.348 5.602 1.00 0.00 C ATOM 766 OG1 THR A 968 -3.763 -7.273 5.969 1.00 0.00 O ATOM 767 CG2 THR A 968 -2.264 -7.927 4.211 1.00 0.00 C ATOM 0 H THR A 968 -1.394 -6.310 7.575 1.00 0.00 H new ATOM 0 HA THR A 968 -2.315 -8.922 7.062 1.00 0.00 H new ATOM 0 HB THR A 968 -1.939 -6.356 5.572 1.00 0.00 H new ATOM 0 HG1 THR A 968 -4.319 -7.574 5.220 1.00 0.00 H new ATOM 0 HG21 THR A 968 -2.816 -7.304 3.507 1.00 0.00 H new ATOM 0 HG22 THR A 968 -1.213 -7.957 3.922 1.00 0.00 H new ATOM 0 HG23 THR A 968 -2.672 -8.937 4.199 1.00 0.00 H new ATOM 775 N VAL A 969 0.682 -8.224 5.926 1.00 0.00 N ATOM 776 CA VAL A 969 1.942 -8.853 5.542 1.00 0.00 C ATOM 777 C VAL A 969 2.290 -10.006 6.487 1.00 0.00 C ATOM 778 O VAL A 969 2.902 -10.974 6.072 1.00 0.00 O ATOM 779 CB VAL A 969 3.112 -7.839 5.495 1.00 0.00 C ATOM 780 CG1 VAL A 969 4.440 -8.536 5.246 1.00 0.00 C ATOM 781 CG2 VAL A 969 2.862 -6.793 4.423 1.00 0.00 C ATOM 0 H VAL A 969 0.747 -7.219 6.087 1.00 0.00 H new ATOM 0 HA VAL A 969 1.801 -9.247 4.535 1.00 0.00 H new ATOM 0 HB VAL A 969 3.166 -7.348 6.467 1.00 0.00 H new ATOM 0 HG11 VAL A 969 5.240 -7.796 5.219 1.00 0.00 H new ATOM 0 HG12 VAL A 969 4.633 -9.249 6.048 1.00 0.00 H new ATOM 0 HG13 VAL A 969 4.401 -9.063 4.293 1.00 0.00 H new ATOM 0 HG21 VAL A 969 3.693 -6.088 4.402 1.00 0.00 H new ATOM 0 HG22 VAL A 969 2.776 -7.281 3.452 1.00 0.00 H new ATOM 0 HG23 VAL A 969 1.938 -6.259 4.644 1.00 0.00 H new ATOM 791 N ASP A 970 1.881 -9.909 7.747 1.00 0.00 N ATOM 792 CA ASP A 970 2.117 -10.983 8.720 1.00 0.00 C ATOM 793 C ASP A 970 1.356 -12.239 8.349 1.00 0.00 C ATOM 794 O ASP A 970 1.797 -13.335 8.641 1.00 0.00 O ATOM 795 CB ASP A 970 1.741 -10.528 10.136 1.00 0.00 C ATOM 796 CG ASP A 970 1.843 -11.635 11.169 1.00 0.00 C ATOM 797 OD1 ASP A 970 0.880 -12.423 11.309 1.00 0.00 O ATOM 798 OD2 ASP A 970 2.875 -11.705 11.865 1.00 0.00 O ATOM 0 H ASP A 970 1.385 -9.101 8.124 1.00 0.00 H new ATOM 0 HA ASP A 970 3.182 -11.216 8.702 1.00 0.00 H new ATOM 0 HB2 ASP A 970 2.392 -9.705 10.430 1.00 0.00 H new ATOM 0 HB3 ASP A 970 0.722 -10.141 10.127 1.00 0.00 H new ATOM 803 N GLU A 971 0.229 -12.078 7.692 1.00 0.00 N ATOM 804 CA GLU A 971 -0.494 -13.228 7.153 1.00 0.00 C ATOM 805 C GLU A 971 0.334 -13.885 6.052 1.00 0.00 C ATOM 806 O GLU A 971 0.631 -15.091 6.075 1.00 0.00 O ATOM 807 CB GLU A 971 -1.841 -12.783 6.608 1.00 0.00 C ATOM 808 CG GLU A 971 -2.756 -12.255 7.687 1.00 0.00 C ATOM 809 CD GLU A 971 -3.250 -13.361 8.591 1.00 0.00 C ATOM 810 OE1 GLU A 971 -3.937 -14.279 8.091 1.00 0.00 O ATOM 811 OE2 GLU A 971 -2.944 -13.330 9.803 1.00 0.00 O ATOM 0 H GLU A 971 -0.210 -11.175 7.515 1.00 0.00 H new ATOM 0 HA GLU A 971 -0.663 -13.954 7.948 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -1.687 -12.009 5.856 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -2.322 -13.623 6.107 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -2.227 -11.509 8.280 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -3.607 -11.752 7.228 1.00 0.00 H new ATOM 818 N SER A 972 0.748 -13.057 5.115 1.00 0.00 N ATOM 819 CA SER A 972 1.540 -13.479 3.991 1.00 0.00 C ATOM 820 C SER A 972 2.924 -13.948 4.465 1.00 0.00 C ATOM 821 O SER A 972 3.604 -14.697 3.779 1.00 0.00 O ATOM 822 CB SER A 972 1.620 -12.316 3.001 1.00 0.00 C ATOM 823 OG SER A 972 2.459 -11.278 3.475 1.00 0.00 O ATOM 0 H SER A 972 0.538 -12.059 5.118 1.00 0.00 H new ATOM 0 HA SER A 972 1.082 -14.330 3.487 1.00 0.00 H new ATOM 0 HB2 SER A 972 1.996 -12.679 2.044 1.00 0.00 H new ATOM 0 HB3 SER A 972 0.620 -11.922 2.822 1.00 0.00 H new ATOM 0 HG SER A 972 2.622 -11.401 4.433 1.00 0.00 H new ATOM 829 N LEU A 973 3.332 -13.462 5.639 1.00 0.00 N ATOM 830 CA LEU A 973 4.654 -13.729 6.206 1.00 0.00 C ATOM 831 C LEU A 973 4.928 -15.226 6.408 1.00 0.00 C ATOM 832 O LEU A 973 5.924 -15.711 5.903 1.00 0.00 O ATOM 833 CB LEU A 973 4.823 -12.960 7.524 1.00 0.00 C ATOM 834 CG LEU A 973 6.151 -13.158 8.261 1.00 0.00 C ATOM 835 CD1 LEU A 973 7.317 -12.643 7.430 1.00 0.00 C ATOM 836 CD2 LEU A 973 6.106 -12.460 9.612 1.00 0.00 C ATOM 0 H LEU A 973 2.749 -12.867 6.227 1.00 0.00 H new ATOM 0 HA LEU A 973 5.391 -13.379 5.484 1.00 0.00 H new ATOM 0 HB2 LEU A 973 4.702 -11.897 7.317 1.00 0.00 H new ATOM 0 HB3 LEU A 973 4.014 -13.249 8.194 1.00 0.00 H new ATOM 0 HG LEU A 973 6.301 -14.226 8.421 1.00 0.00 H new ATOM 0 HD11 LEU A 973 8.248 -12.795 7.976 1.00 0.00 H new ATOM 0 HD12 LEU A 973 7.358 -13.185 6.485 1.00 0.00 H new ATOM 0 HD13 LEU A 973 7.182 -11.580 7.233 1.00 0.00 H new ATOM 0 HD21 LEU A 973 7.054 -12.606 10.129 1.00 0.00 H new ATOM 0 HD22 LEU A 973 5.933 -11.394 9.465 1.00 0.00 H new ATOM 0 HD23 LEU A 973 5.298 -12.879 10.211 1.00 0.00 H new ATOM 848 N PRO A 974 4.086 -16.007 7.127 1.00 0.00 N ATOM 849 CA PRO A 974 4.272 -17.457 7.177 1.00 0.00 C ATOM 850 C PRO A 974 4.063 -18.063 5.801 1.00 0.00 C ATOM 851 O PRO A 974 4.629 -19.116 5.465 1.00 0.00 O ATOM 852 CB PRO A 974 3.199 -17.950 8.155 1.00 0.00 C ATOM 853 CG PRO A 974 2.792 -16.737 8.908 1.00 0.00 C ATOM 854 CD PRO A 974 2.958 -15.595 7.949 1.00 0.00 C ATOM 0 HA PRO A 974 5.277 -17.739 7.492 1.00 0.00 H new ATOM 0 HB2 PRO A 974 2.354 -18.391 7.627 1.00 0.00 H new ATOM 0 HB3 PRO A 974 3.593 -18.717 8.822 1.00 0.00 H new ATOM 0 HG2 PRO A 974 1.760 -16.815 9.250 1.00 0.00 H new ATOM 0 HG3 PRO A 974 3.412 -16.599 9.794 1.00 0.00 H new ATOM 0 HD2 PRO A 974 2.060 -15.439 7.351 1.00 0.00 H new ATOM 0 HD3 PRO A 974 3.161 -14.659 8.470 1.00 0.00 H new ATOM 862 N VAL A 975 3.280 -17.372 4.980 1.00 0.00 N ATOM 863 CA VAL A 975 3.045 -17.852 3.625 1.00 0.00 C ATOM 864 C VAL A 975 4.260 -17.602 2.721 1.00 0.00 C ATOM 865 O VAL A 975 4.386 -18.224 1.667 1.00 0.00 O ATOM 866 CB VAL A 975 1.784 -17.234 2.997 1.00 0.00 C ATOM 867 CG1 VAL A 975 1.393 -18.015 1.762 1.00 0.00 C ATOM 868 CG2 VAL A 975 0.633 -17.219 3.989 1.00 0.00 C ATOM 0 H VAL A 975 2.808 -16.500 5.221 1.00 0.00 H new ATOM 0 HA VAL A 975 2.885 -18.927 3.705 1.00 0.00 H new ATOM 0 HB VAL A 975 2.007 -16.204 2.720 1.00 0.00 H new ATOM 0 HG11 VAL A 975 0.499 -17.574 1.320 1.00 0.00 H new ATOM 0 HG12 VAL A 975 2.208 -17.984 1.039 1.00 0.00 H new ATOM 0 HG13 VAL A 975 1.189 -19.050 2.036 1.00 0.00 H new ATOM 0 HG21 VAL A 975 -0.246 -16.777 3.520 1.00 0.00 H new ATOM 0 HG22 VAL A 975 0.405 -18.239 4.298 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.913 -16.630 4.862 1.00 0.00 H new ATOM 878 N LEU A 976 5.184 -16.731 3.132 1.00 0.00 N ATOM 879 CA LEU A 976 6.332 -16.433 2.284 1.00 0.00 C ATOM 880 C LEU A 976 7.435 -17.497 2.372 1.00 0.00 C ATOM 881 O LEU A 976 8.009 -17.828 1.339 1.00 0.00 O ATOM 882 CB LEU A 976 6.870 -14.989 2.455 1.00 0.00 C ATOM 883 CG LEU A 976 7.388 -14.553 3.828 1.00 0.00 C ATOM 884 CD1 LEU A 976 8.840 -14.957 4.030 1.00 0.00 C ATOM 885 CD2 LEU A 976 7.234 -13.049 3.982 1.00 0.00 C ATOM 0 H LEU A 976 5.160 -16.233 4.022 1.00 0.00 H new ATOM 0 HA LEU A 976 5.953 -16.479 1.263 1.00 0.00 H new ATOM 0 HB2 LEU A 976 7.679 -14.851 1.738 1.00 0.00 H new ATOM 0 HB3 LEU A 976 6.072 -14.303 2.170 1.00 0.00 H new ATOM 0 HG LEU A 976 6.795 -15.058 4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 976 9.175 -14.632 5.015 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.930 -16.041 3.956 1.00 0.00 H new ATOM 0 HD13 LEU A 976 9.458 -14.489 3.264 1.00 0.00 H new ATOM 0 HD21 LEU A 976 7.604 -12.744 4.961 1.00 0.00 H new ATOM 0 HD22 LEU A 976 7.806 -12.543 3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 976 6.182 -12.780 3.892 1.00 0.00 H new ATOM 897 N PRO A 977 7.754 -18.096 3.550 1.00 0.00 N ATOM 898 CA PRO A 977 8.668 -19.236 3.580 1.00 0.00 C ATOM 899 C PRO A 977 8.036 -20.427 2.881 1.00 0.00 C ATOM 900 O PRO A 977 8.725 -21.305 2.358 1.00 0.00 O ATOM 901 CB PRO A 977 8.874 -19.531 5.071 1.00 0.00 C ATOM 902 CG PRO A 977 8.388 -18.315 5.772 1.00 0.00 C ATOM 903 CD PRO A 977 7.309 -17.753 4.898 1.00 0.00 C ATOM 0 HA PRO A 977 9.610 -19.032 3.070 1.00 0.00 H new ATOM 0 HB2 PRO A 977 8.316 -20.415 5.380 1.00 0.00 H new ATOM 0 HB3 PRO A 977 9.923 -19.723 5.294 1.00 0.00 H new ATOM 0 HG2 PRO A 977 8.003 -18.560 6.762 1.00 0.00 H new ATOM 0 HG3 PRO A 977 9.194 -17.595 5.913 1.00 0.00 H new ATOM 0 HD2 PRO A 977 6.338 -18.193 5.125 1.00 0.00 H new ATOM 0 HD3 PRO A 977 7.208 -16.675 5.026 1.00 0.00 H new ATOM 911 N ALA A 978 6.707 -20.448 2.883 1.00 0.00 N ATOM 912 CA ALA A 978 5.967 -21.447 2.137 1.00 0.00 C ATOM 913 C ALA A 978 6.092 -21.219 0.629 1.00 0.00 C ATOM 914 O ALA A 978 6.452 -22.134 -0.111 1.00 0.00 O ATOM 915 CB ALA A 978 4.505 -21.445 2.556 1.00 0.00 C ATOM 0 H ALA A 978 6.125 -19.784 3.394 1.00 0.00 H new ATOM 0 HA ALA A 978 6.396 -22.423 2.364 1.00 0.00 H new ATOM 0 HB1 ALA A 978 3.962 -22.200 1.987 1.00 0.00 H new ATOM 0 HB2 ALA A 978 4.431 -21.670 3.620 1.00 0.00 H new ATOM 0 HB3 ALA A 978 4.072 -20.464 2.361 1.00 0.00 H new ATOM 921 N SER A 979 5.810 -19.997 0.173 1.00 0.00 N ATOM 922 CA SER A 979 5.735 -19.722 -1.262 1.00 0.00 C ATOM 923 C SER A 979 5.826 -18.217 -1.596 1.00 0.00 C ATOM 924 O SER A 979 6.600 -17.815 -2.467 1.00 0.00 O ATOM 925 CB SER A 979 4.425 -20.305 -1.794 1.00 0.00 C ATOM 926 OG SER A 979 4.494 -21.718 -1.885 1.00 0.00 O ATOM 0 H SER A 979 5.631 -19.190 0.770 1.00 0.00 H new ATOM 0 HA SER A 979 6.595 -20.189 -1.742 1.00 0.00 H new ATOM 0 HB2 SER A 979 3.603 -20.020 -1.137 1.00 0.00 H new ATOM 0 HB3 SER A 979 4.209 -19.885 -2.776 1.00 0.00 H new ATOM 0 HG SER A 979 5.355 -22.027 -1.533 1.00 0.00 H new ATOM 932 N THR A 980 5.031 -17.412 -0.893 1.00 0.00 N ATOM 933 CA THR A 980 4.908 -15.951 -1.109 1.00 0.00 C ATOM 934 C THR A 980 6.239 -15.188 -1.246 1.00 0.00 C ATOM 935 O THR A 980 6.261 -14.088 -1.798 1.00 0.00 O ATOM 936 CB THR A 980 4.114 -15.336 0.054 1.00 0.00 C ATOM 937 OG1 THR A 980 2.864 -16.010 0.165 1.00 0.00 O ATOM 938 CG2 THR A 980 3.881 -13.846 -0.140 1.00 0.00 C ATOM 0 H THR A 980 4.437 -17.754 -0.138 1.00 0.00 H new ATOM 0 HA THR A 980 4.401 -15.845 -2.068 1.00 0.00 H new ATOM 0 HB THR A 980 4.696 -15.457 0.968 1.00 0.00 H new ATOM 0 HG1 THR A 980 2.784 -16.671 -0.554 1.00 0.00 H new ATOM 0 HG21 THR A 980 3.316 -13.453 0.705 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.841 -13.333 -0.205 1.00 0.00 H new ATOM 0 HG23 THR A 980 3.319 -13.682 -1.059 1.00 0.00 H new ATOM 946 N HIS A 981 7.333 -15.766 -0.763 1.00 0.00 N ATOM 947 CA HIS A 981 8.633 -15.075 -0.705 1.00 0.00 C ATOM 948 C HIS A 981 9.035 -14.465 -2.053 1.00 0.00 C ATOM 949 O HIS A 981 9.854 -13.562 -2.094 1.00 0.00 O ATOM 950 CB HIS A 981 9.732 -16.043 -0.257 1.00 0.00 C ATOM 951 CG HIS A 981 10.878 -15.393 0.466 1.00 0.00 C ATOM 952 ND1 HIS A 981 11.817 -14.589 -0.142 1.00 0.00 N ATOM 953 CD2 HIS A 981 11.231 -15.448 1.771 1.00 0.00 C ATOM 954 CE1 HIS A 981 12.693 -14.182 0.757 1.00 0.00 C ATOM 955 NE2 HIS A 981 12.359 -14.689 1.926 1.00 0.00 N ATOM 0 H HIS A 981 7.353 -16.719 -0.401 1.00 0.00 H new ATOM 0 HA HIS A 981 8.521 -14.265 0.016 1.00 0.00 H new ATOM 0 HB2 HIS A 981 9.290 -16.798 0.393 1.00 0.00 H new ATOM 0 HB3 HIS A 981 10.120 -16.563 -1.133 1.00 0.00 H new ATOM 0 HD1 HIS A 981 11.833 -14.346 -1.133 1.00 0.00 H new ATOM 0 HD2 HIS A 981 10.716 -15.992 2.549 1.00 0.00 H new ATOM 0 HE1 HIS A 981 13.541 -13.541 0.566 1.00 0.00 H new ATOM 964 N ARG A 982 8.452 -14.941 -3.141 1.00 0.00 N ATOM 965 CA ARG A 982 8.828 -14.435 -4.455 1.00 0.00 C ATOM 966 C ARG A 982 8.200 -13.057 -4.713 1.00 0.00 C ATOM 967 O ARG A 982 8.903 -12.079 -4.992 1.00 0.00 O ATOM 968 CB ARG A 982 8.406 -15.417 -5.551 1.00 0.00 C ATOM 969 CG ARG A 982 8.991 -16.814 -5.391 1.00 0.00 C ATOM 970 CD ARG A 982 10.515 -16.800 -5.382 1.00 0.00 C ATOM 971 NE ARG A 982 11.062 -18.155 -5.292 1.00 0.00 N ATOM 972 CZ ARG A 982 12.327 -18.449 -4.994 1.00 0.00 C ATOM 973 NH1 ARG A 982 13.212 -17.489 -4.748 1.00 0.00 N ATOM 974 NH2 ARG A 982 12.701 -19.718 -4.946 1.00 0.00 N ATOM 0 H ARG A 982 7.731 -15.662 -3.145 1.00 0.00 H new ATOM 0 HA ARG A 982 9.913 -14.330 -4.475 1.00 0.00 H new ATOM 0 HB2 ARG A 982 7.318 -15.489 -5.561 1.00 0.00 H new ATOM 0 HB3 ARG A 982 8.708 -15.017 -6.519 1.00 0.00 H new ATOM 0 HG2 ARG A 982 8.628 -17.255 -4.463 1.00 0.00 H new ATOM 0 HG3 ARG A 982 8.640 -17.449 -6.204 1.00 0.00 H new ATOM 0 HD2 ARG A 982 10.881 -16.318 -6.288 1.00 0.00 H new ATOM 0 HD3 ARG A 982 10.870 -16.206 -4.540 1.00 0.00 H new ATOM 0 HE ARG A 982 10.427 -18.933 -5.471 1.00 0.00 H new ATOM 0 HH11 ARG A 982 12.927 -16.510 -4.786 1.00 0.00 H new ATOM 0 HH12 ARG A 982 14.177 -17.731 -4.521 1.00 0.00 H new ATOM 0 HH21 ARG A 982 12.024 -20.457 -5.136 1.00 0.00 H new ATOM 0 HH22 ARG A 982 13.666 -19.957 -4.719 1.00 0.00 H new ATOM 988 N GLU A 983 6.883 -12.957 -4.580 1.00 0.00 N ATOM 989 CA GLU A 983 6.208 -11.690 -4.803 1.00 0.00 C ATOM 990 C GLU A 983 6.348 -10.760 -3.615 1.00 0.00 C ATOM 991 O GLU A 983 6.466 -9.544 -3.776 1.00 0.00 O ATOM 992 CB GLU A 983 4.732 -11.864 -5.104 1.00 0.00 C ATOM 993 CG GLU A 983 3.949 -12.590 -4.045 1.00 0.00 C ATOM 994 CD GLU A 983 3.857 -14.086 -4.271 1.00 0.00 C ATOM 995 OE1 GLU A 983 4.907 -14.728 -4.496 1.00 0.00 O ATOM 996 OE2 GLU A 983 2.737 -14.630 -4.229 1.00 0.00 O ATOM 0 H GLU A 983 6.269 -13.730 -4.322 1.00 0.00 H new ATOM 0 HA GLU A 983 6.698 -11.251 -5.672 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.288 -10.880 -5.252 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.630 -12.405 -6.045 1.00 0.00 H new ATOM 0 HG2 GLU A 983 4.410 -12.406 -3.075 1.00 0.00 H new ATOM 0 HG3 GLU A 983 2.942 -12.176 -4.003 1.00 0.00 H new ATOM 1003 N ILE A 984 6.305 -11.326 -2.419 1.00 0.00 N ATOM 1004 CA ILE A 984 6.399 -10.526 -1.211 1.00 0.00 C ATOM 1005 C ILE A 984 7.746 -9.817 -1.181 1.00 0.00 C ATOM 1006 O ILE A 984 7.908 -8.792 -0.530 1.00 0.00 O ATOM 1007 CB ILE A 984 6.193 -11.376 0.064 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.828 -10.488 1.255 1.00 0.00 C ATOM 1009 CG2 ILE A 984 7.441 -12.181 0.387 1.00 0.00 C ATOM 1010 CD1 ILE A 984 4.498 -9.783 1.101 1.00 0.00 C ATOM 0 H ILE A 984 6.206 -12.329 -2.261 1.00 0.00 H new ATOM 0 HA ILE A 984 5.599 -9.786 -1.225 1.00 0.00 H new ATOM 0 HB ILE A 984 5.371 -12.066 -0.127 1.00 0.00 H new ATOM 0 HG12 ILE A 984 5.804 -11.098 2.158 1.00 0.00 H new ATOM 0 HG13 ILE A 984 6.611 -9.742 1.395 1.00 0.00 H new ATOM 0 HG21 ILE A 984 7.271 -12.770 1.288 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.670 -12.847 -0.445 1.00 0.00 H new ATOM 0 HG23 ILE A 984 8.279 -11.503 0.550 1.00 0.00 H new ATOM 0 HD11 ILE A 984 4.306 -9.172 1.983 1.00 0.00 H new ATOM 0 HD12 ILE A 984 4.524 -9.146 0.217 1.00 0.00 H new ATOM 0 HD13 ILE A 984 3.705 -10.523 0.992 1.00 0.00 H new ATOM 1022 N GLU A 985 8.702 -10.363 -1.925 1.00 0.00 N ATOM 1023 CA GLU A 985 9.988 -9.711 -2.100 1.00 0.00 C ATOM 1024 C GLU A 985 9.840 -8.504 -3.004 1.00 0.00 C ATOM 1025 O GLU A 985 10.312 -7.413 -2.680 1.00 0.00 O ATOM 1026 CB GLU A 985 11.026 -10.659 -2.703 1.00 0.00 C ATOM 1027 CG GLU A 985 11.846 -11.424 -1.680 1.00 0.00 C ATOM 1028 CD GLU A 985 12.917 -12.279 -2.330 1.00 0.00 C ATOM 1029 OE1 GLU A 985 13.911 -11.710 -2.829 1.00 0.00 O ATOM 1030 OE2 GLU A 985 12.774 -13.520 -2.341 1.00 0.00 O ATOM 0 H GLU A 985 8.608 -11.253 -2.414 1.00 0.00 H new ATOM 0 HA GLU A 985 10.333 -9.402 -1.113 1.00 0.00 H new ATOM 0 HB2 GLU A 985 10.516 -11.373 -3.349 1.00 0.00 H new ATOM 0 HB3 GLU A 985 11.702 -10.083 -3.335 1.00 0.00 H new ATOM 0 HG2 GLU A 985 12.313 -10.720 -0.991 1.00 0.00 H new ATOM 0 HG3 GLU A 985 11.186 -12.058 -1.088 1.00 0.00 H new ATOM 1037 N MET A 986 9.149 -8.684 -4.127 1.00 0.00 N ATOM 1038 CA MET A 986 9.130 -7.645 -5.149 1.00 0.00 C ATOM 1039 C MET A 986 8.290 -6.442 -4.719 1.00 0.00 C ATOM 1040 O MET A 986 8.725 -5.300 -4.842 1.00 0.00 O ATOM 1041 CB MET A 986 8.639 -8.189 -6.497 1.00 0.00 C ATOM 1042 CG MET A 986 7.192 -8.646 -6.499 1.00 0.00 C ATOM 1043 SD MET A 986 6.639 -9.196 -8.123 1.00 0.00 S ATOM 1044 CE MET A 986 7.758 -10.569 -8.404 1.00 0.00 C ATOM 0 H MET A 986 8.607 -9.519 -4.348 1.00 0.00 H new ATOM 0 HA MET A 986 10.159 -7.308 -5.274 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.764 -7.415 -7.255 1.00 0.00 H new ATOM 0 HB3 MET A 986 9.272 -9.027 -6.789 1.00 0.00 H new ATOM 0 HG2 MET A 986 7.071 -9.460 -5.784 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.556 -7.828 -6.161 1.00 0.00 H new ATOM 0 HE1 MET A 986 7.216 -11.390 -8.874 1.00 0.00 H new ATOM 0 HE2 MET A 986 8.570 -10.249 -9.057 1.00 0.00 H new ATOM 0 HE3 MET A 986 8.169 -10.904 -7.452 1.00 0.00 H new ATOM 1054 N ALA A 987 7.100 -6.702 -4.192 1.00 0.00 N ATOM 1055 CA ALA A 987 6.169 -5.654 -3.839 1.00 0.00 C ATOM 1056 C ALA A 987 6.532 -4.994 -2.521 1.00 0.00 C ATOM 1057 O ALA A 987 6.515 -3.781 -2.425 1.00 0.00 O ATOM 1058 CB ALA A 987 4.756 -6.198 -3.782 1.00 0.00 C ATOM 0 H ALA A 987 6.760 -7.644 -4.000 1.00 0.00 H new ATOM 0 HA ALA A 987 6.227 -4.892 -4.616 1.00 0.00 H new ATOM 0 HB1 ALA A 987 4.068 -5.396 -3.515 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.482 -6.602 -4.757 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.700 -6.988 -3.033 1.00 0.00 H new ATOM 1064 N GLN A 988 6.858 -5.788 -1.501 1.00 0.00 N ATOM 1065 CA GLN A 988 7.116 -5.227 -0.174 1.00 0.00 C ATOM 1066 C GLN A 988 8.313 -4.279 -0.199 1.00 0.00 C ATOM 1067 O GLN A 988 8.265 -3.196 0.383 1.00 0.00 O ATOM 1068 CB GLN A 988 7.353 -6.321 0.867 1.00 0.00 C ATOM 1069 CG GLN A 988 7.501 -5.784 2.283 1.00 0.00 C ATOM 1070 CD GLN A 988 7.937 -6.846 3.276 1.00 0.00 C ATOM 1071 OE1 GLN A 988 7.581 -8.095 3.011 1.00 0.00 O flip ATOM 1072 NE2 GLN A 988 8.601 -6.548 4.270 1.00 0.00 N flip ATOM 0 H GLN A 988 6.949 -6.802 -1.564 1.00 0.00 H new ATOM 0 HA GLN A 988 6.224 -4.668 0.109 1.00 0.00 H new ATOM 0 HB2 GLN A 988 6.522 -7.026 0.838 1.00 0.00 H new ATOM 0 HB3 GLN A 988 8.252 -6.877 0.601 1.00 0.00 H new ATOM 0 HG2 GLN A 988 8.229 -4.973 2.284 1.00 0.00 H new ATOM 0 HG3 GLN A 988 6.550 -5.360 2.606 1.00 0.00 H new ATOM 0 HE21 GLN A 988 8.856 -5.575 4.440 1.00 0.00 H new ATOM 0 HE22 GLN A 988 8.896 -7.274 4.923 1.00 0.00 H new ATOM 1081 N LYS A 989 9.383 -4.683 -0.883 1.00 0.00 N ATOM 1082 CA LYS A 989 10.557 -3.826 -1.017 1.00 0.00 C ATOM 1083 C LYS A 989 10.202 -2.608 -1.851 1.00 0.00 C ATOM 1084 O LYS A 989 10.710 -1.507 -1.629 1.00 0.00 O ATOM 1085 CB LYS A 989 11.715 -4.582 -1.663 1.00 0.00 C ATOM 1086 CG LYS A 989 12.336 -5.642 -0.765 1.00 0.00 C ATOM 1087 CD LYS A 989 13.482 -6.378 -1.454 1.00 0.00 C ATOM 1088 CE LYS A 989 14.723 -5.506 -1.631 1.00 0.00 C ATOM 1089 NZ LYS A 989 14.547 -4.452 -2.671 1.00 0.00 N ATOM 0 H LYS A 989 9.460 -5.588 -1.347 1.00 0.00 H new ATOM 0 HA LYS A 989 10.872 -3.510 -0.023 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.361 -5.057 -2.578 1.00 0.00 H new ATOM 0 HB3 LYS A 989 12.486 -3.868 -1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 989 12.704 -5.173 0.148 1.00 0.00 H new ATOM 0 HG3 LYS A 989 11.571 -6.360 -0.469 1.00 0.00 H new ATOM 0 HD2 LYS A 989 13.744 -7.261 -0.871 1.00 0.00 H new ATOM 0 HD3 LYS A 989 13.148 -6.729 -2.430 1.00 0.00 H new ATOM 0 HE2 LYS A 989 14.968 -5.034 -0.680 1.00 0.00 H new ATOM 0 HE3 LYS A 989 15.570 -6.138 -1.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 15.433 -4.338 -3.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 13.785 -4.730 -3.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 14.300 -3.551 -2.214 1.00 0.00 H new ATOM 1103 N LEU A 990 9.296 -2.820 -2.793 1.00 0.00 N ATOM 1104 CA LEU A 990 8.799 -1.760 -3.640 1.00 0.00 C ATOM 1105 C LEU A 990 8.030 -0.749 -2.789 1.00 0.00 C ATOM 1106 O LEU A 990 8.259 0.454 -2.887 1.00 0.00 O ATOM 1107 CB LEU A 990 7.943 -2.394 -4.752 1.00 0.00 C ATOM 1108 CG LEU A 990 6.807 -1.563 -5.333 1.00 0.00 C ATOM 1109 CD1 LEU A 990 7.325 -0.277 -5.956 1.00 0.00 C ATOM 1110 CD2 LEU A 990 6.055 -2.367 -6.373 1.00 0.00 C ATOM 0 H LEU A 990 8.888 -3.734 -2.988 1.00 0.00 H new ATOM 0 HA LEU A 990 9.610 -1.211 -4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.608 -2.671 -5.570 1.00 0.00 H new ATOM 0 HB3 LEU A 990 7.517 -3.318 -4.361 1.00 0.00 H new ATOM 0 HG LEU A 990 6.134 -1.300 -4.517 1.00 0.00 H new ATOM 0 HD11 LEU A 990 6.489 0.293 -6.362 1.00 0.00 H new ATOM 0 HD12 LEU A 990 7.834 0.316 -5.196 1.00 0.00 H new ATOM 0 HD13 LEU A 990 8.024 -0.517 -6.758 1.00 0.00 H new ATOM 0 HD21 LEU A 990 5.244 -1.764 -6.783 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.736 -2.652 -7.175 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.642 -3.264 -5.911 1.00 0.00 H new ATOM 1122 N LEU A 991 7.206 -1.273 -1.887 1.00 0.00 N ATOM 1123 CA LEU A 991 6.368 -0.460 -1.010 1.00 0.00 C ATOM 1124 C LEU A 991 7.211 0.453 -0.148 1.00 0.00 C ATOM 1125 O LEU A 991 6.915 1.638 0.006 1.00 0.00 O ATOM 1126 CB LEU A 991 5.550 -1.366 -0.100 1.00 0.00 C ATOM 1127 CG LEU A 991 4.609 -2.318 -0.817 1.00 0.00 C ATOM 1128 CD1 LEU A 991 4.238 -3.467 0.099 1.00 0.00 C ATOM 1129 CD2 LEU A 991 3.359 -1.589 -1.264 1.00 0.00 C ATOM 0 H LEU A 991 7.100 -2.277 -1.743 1.00 0.00 H new ATOM 0 HA LEU A 991 5.712 0.145 -1.636 1.00 0.00 H new ATOM 0 HB2 LEU A 991 6.234 -1.950 0.515 1.00 0.00 H new ATOM 0 HB3 LEU A 991 4.965 -0.743 0.577 1.00 0.00 H new ATOM 0 HG LEU A 991 5.116 -2.712 -1.697 1.00 0.00 H new ATOM 0 HD11 LEU A 991 3.563 -4.145 -0.423 1.00 0.00 H new ATOM 0 HD12 LEU A 991 5.140 -4.006 0.390 1.00 0.00 H new ATOM 0 HD13 LEU A 991 3.744 -3.078 0.989 1.00 0.00 H new ATOM 0 HD21 LEU A 991 2.695 -2.285 -1.776 1.00 0.00 H new ATOM 0 HD22 LEU A 991 2.849 -1.174 -0.394 1.00 0.00 H new ATOM 0 HD23 LEU A 991 3.632 -0.782 -1.944 1.00 0.00 H new ATOM 1141 N ASN A 992 8.256 -0.122 0.425 1.00 0.00 N ATOM 1142 CA ASN A 992 9.151 0.608 1.304 1.00 0.00 C ATOM 1143 C ASN A 992 9.696 1.843 0.608 1.00 0.00 C ATOM 1144 O ASN A 992 9.757 2.916 1.198 1.00 0.00 O ATOM 1145 CB ASN A 992 10.303 -0.293 1.741 1.00 0.00 C ATOM 1146 CG ASN A 992 11.290 0.413 2.659 1.00 0.00 C ATOM 1147 OD1 ASN A 992 12.223 1.069 2.199 1.00 0.00 O ATOM 1148 ND2 ASN A 992 11.103 0.273 3.964 1.00 0.00 N ATOM 0 H ASN A 992 8.506 -1.102 0.294 1.00 0.00 H new ATOM 0 HA ASN A 992 8.589 0.925 2.183 1.00 0.00 H new ATOM 0 HB2 ASN A 992 9.900 -1.167 2.252 1.00 0.00 H new ATOM 0 HB3 ASN A 992 10.830 -0.655 0.858 1.00 0.00 H new ATOM 0 HD21 ASN A 992 11.744 0.717 4.622 1.00 0.00 H new ATOM 0 HD22 ASN A 992 10.318 -0.279 4.310 1.00 0.00 H new ATOM 1155 N SER A 993 10.049 1.691 -0.660 1.00 0.00 N ATOM 1156 CA SER A 993 10.683 2.764 -1.401 1.00 0.00 C ATOM 1157 C SER A 993 9.699 3.885 -1.756 1.00 0.00 C ATOM 1158 O SER A 993 10.080 5.059 -1.752 1.00 0.00 O ATOM 1159 CB SER A 993 11.324 2.212 -2.673 1.00 0.00 C ATOM 1160 OG SER A 993 12.218 1.142 -2.391 1.00 0.00 O ATOM 0 H SER A 993 9.906 0.834 -1.194 1.00 0.00 H new ATOM 0 HA SER A 993 11.450 3.195 -0.757 1.00 0.00 H new ATOM 0 HB2 SER A 993 10.545 1.866 -3.352 1.00 0.00 H new ATOM 0 HB3 SER A 993 11.862 3.010 -3.185 1.00 0.00 H new ATOM 0 HG SER A 993 11.705 0.336 -2.173 1.00 0.00 H new ATOM 1166 N ASP A 994 8.436 3.553 -2.028 1.00 0.00 N ATOM 1167 CA ASP A 994 7.523 4.559 -2.573 1.00 0.00 C ATOM 1168 C ASP A 994 6.532 5.097 -1.539 1.00 0.00 C ATOM 1169 O ASP A 994 6.146 6.264 -1.619 1.00 0.00 O ATOM 1170 CB ASP A 994 6.808 4.054 -3.823 1.00 0.00 C ATOM 1171 CG ASP A 994 7.654 4.245 -5.070 1.00 0.00 C ATOM 1172 OD1 ASP A 994 8.683 3.553 -5.222 1.00 0.00 O ATOM 1173 OD2 ASP A 994 7.313 5.112 -5.899 1.00 0.00 O ATOM 0 H ASP A 994 8.031 2.627 -1.886 1.00 0.00 H new ATOM 0 HA ASP A 994 8.147 5.404 -2.863 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.569 2.997 -3.704 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.862 4.583 -3.940 1.00 0.00 H new ATOM 1178 N LEU A 995 6.118 4.282 -0.563 1.00 0.00 N ATOM 1179 CA LEU A 995 5.431 4.841 0.608 1.00 0.00 C ATOM 1180 C LEU A 995 6.376 5.862 1.247 1.00 0.00 C ATOM 1181 O LEU A 995 5.960 6.936 1.680 1.00 0.00 O ATOM 1182 CB LEU A 995 4.979 3.727 1.609 1.00 0.00 C ATOM 1183 CG LEU A 995 4.517 4.165 3.012 1.00 0.00 C ATOM 1184 CD1 LEU A 995 5.698 4.424 3.935 1.00 0.00 C ATOM 1185 CD2 LEU A 995 3.612 5.387 2.936 1.00 0.00 C ATOM 0 H LEU A 995 6.240 3.269 -0.556 1.00 0.00 H new ATOM 0 HA LEU A 995 4.507 5.335 0.307 1.00 0.00 H new ATOM 0 HB2 LEU A 995 4.163 3.172 1.146 1.00 0.00 H new ATOM 0 HB3 LEU A 995 5.809 3.031 1.732 1.00 0.00 H new ATOM 0 HG LEU A 995 3.941 3.342 3.435 1.00 0.00 H new ATOM 0 HD11 LEU A 995 5.333 4.731 4.915 1.00 0.00 H new ATOM 0 HD12 LEU A 995 6.287 3.513 4.036 1.00 0.00 H new ATOM 0 HD13 LEU A 995 6.321 5.214 3.516 1.00 0.00 H new ATOM 0 HD21 LEU A 995 3.302 5.673 3.941 1.00 0.00 H new ATOM 0 HD22 LEU A 995 4.154 6.213 2.475 1.00 0.00 H new ATOM 0 HD23 LEU A 995 2.732 5.151 2.338 1.00 0.00 H new ATOM 1197 N ALA A 996 7.659 5.518 1.246 1.00 0.00 N ATOM 1198 CA ALA A 996 8.698 6.425 1.723 1.00 0.00 C ATOM 1199 C ALA A 996 8.658 7.761 0.992 1.00 0.00 C ATOM 1200 O ALA A 996 8.695 8.816 1.627 1.00 0.00 O ATOM 1201 CB ALA A 996 10.078 5.801 1.597 1.00 0.00 C ATOM 0 H ALA A 996 8.006 4.616 0.920 1.00 0.00 H new ATOM 0 HA ALA A 996 8.497 6.609 2.778 1.00 0.00 H new ATOM 0 HB1 ALA A 996 10.829 6.502 1.961 1.00 0.00 H new ATOM 0 HB2 ALA A 996 10.119 4.886 2.188 1.00 0.00 H new ATOM 0 HB3 ALA A 996 10.277 5.566 0.551 1.00 0.00 H new ATOM 1207 N GLU A 997 8.601 7.734 -0.333 1.00 0.00 N ATOM 1208 CA GLU A 997 8.539 8.973 -1.097 1.00 0.00 C ATOM 1209 C GLU A 997 7.249 9.723 -0.844 1.00 0.00 C ATOM 1210 O GLU A 997 7.224 10.952 -0.882 1.00 0.00 O ATOM 1211 CB GLU A 997 8.732 8.746 -2.587 1.00 0.00 C ATOM 1212 CG GLU A 997 10.087 8.151 -2.917 1.00 0.00 C ATOM 1213 CD GLU A 997 10.506 8.425 -4.341 1.00 0.00 C ATOM 1214 OE1 GLU A 997 10.808 9.596 -4.651 1.00 0.00 O ATOM 1215 OE2 GLU A 997 10.555 7.474 -5.148 1.00 0.00 O ATOM 0 H GLU A 997 8.596 6.882 -0.894 1.00 0.00 H new ATOM 0 HA GLU A 997 9.369 9.586 -0.746 1.00 0.00 H new ATOM 0 HB2 GLU A 997 7.949 8.082 -2.954 1.00 0.00 H new ATOM 0 HB3 GLU A 997 8.618 9.694 -3.113 1.00 0.00 H new ATOM 0 HG2 GLU A 997 10.835 8.558 -2.237 1.00 0.00 H new ATOM 0 HG3 GLU A 997 10.058 7.074 -2.751 1.00 0.00 H new ATOM 1222 N LEU A 998 6.169 9.008 -0.592 1.00 0.00 N ATOM 1223 CA LEU A 998 4.923 9.689 -0.314 1.00 0.00 C ATOM 1224 C LEU A 998 5.012 10.338 1.058 1.00 0.00 C ATOM 1225 O LEU A 998 4.372 11.348 1.326 1.00 0.00 O ATOM 1226 CB LEU A 998 3.713 8.764 -0.405 1.00 0.00 C ATOM 1227 CG LEU A 998 2.394 9.516 -0.589 1.00 0.00 C ATOM 1228 CD1 LEU A 998 2.483 10.415 -1.805 1.00 0.00 C ATOM 1229 CD2 LEU A 998 1.232 8.559 -0.733 1.00 0.00 C ATOM 0 H LEU A 998 6.128 7.989 -0.574 1.00 0.00 H new ATOM 0 HA LEU A 998 4.774 10.452 -1.078 1.00 0.00 H new ATOM 0 HB2 LEU A 998 3.851 8.076 -1.239 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.656 8.160 0.500 1.00 0.00 H new ATOM 0 HG LEU A 998 2.219 10.123 0.300 1.00 0.00 H new ATOM 0 HD11 LEU A 998 1.541 10.949 -1.932 1.00 0.00 H new ATOM 0 HD12 LEU A 998 3.292 11.133 -1.668 1.00 0.00 H new ATOM 0 HD13 LEU A 998 2.680 9.811 -2.691 1.00 0.00 H new ATOM 0 HD21 LEU A 998 0.309 9.124 -0.862 1.00 0.00 H new ATOM 0 HD22 LEU A 998 1.392 7.921 -1.602 1.00 0.00 H new ATOM 0 HD23 LEU A 998 1.157 7.941 0.162 1.00 0.00 H new ATOM 1241 N ILE A 999 5.839 9.767 1.918 1.00 0.00 N ATOM 1242 CA ILE A 999 6.188 10.425 3.177 1.00 0.00 C ATOM 1243 C ILE A 999 6.910 11.748 2.884 1.00 0.00 C ATOM 1244 O ILE A 999 6.839 12.698 3.655 1.00 0.00 O ATOM 1245 CB ILE A 999 7.068 9.531 4.084 1.00 0.00 C ATOM 1246 CG1 ILE A 999 6.297 8.278 4.509 1.00 0.00 C ATOM 1247 CG2 ILE A 999 7.541 10.304 5.309 1.00 0.00 C ATOM 1248 CD1 ILE A 999 7.094 7.350 5.403 1.00 0.00 C ATOM 0 H ILE A 999 6.280 8.859 1.775 1.00 0.00 H new ATOM 0 HA ILE A 999 5.261 10.617 3.717 1.00 0.00 H new ATOM 0 HB ILE A 999 7.945 9.224 3.514 1.00 0.00 H new ATOM 0 HG12 ILE A 999 5.389 8.580 5.030 1.00 0.00 H new ATOM 0 HG13 ILE A 999 5.987 7.733 3.618 1.00 0.00 H new ATOM 0 HG21 ILE A 999 8.158 9.656 5.932 1.00 0.00 H new ATOM 0 HG22 ILE A 999 8.127 11.167 4.991 1.00 0.00 H new ATOM 0 HG23 ILE A 999 6.677 10.643 5.881 1.00 0.00 H new ATOM 0 HD11 ILE A 999 6.485 6.485 5.664 1.00 0.00 H new ATOM 0 HD12 ILE A 999 7.989 7.018 4.877 1.00 0.00 H new ATOM 0 HD13 ILE A 999 7.382 7.879 6.312 1.00 0.00 H new ATOM 1260 N ASN A1000 7.571 11.818 1.741 1.00 0.00 N ATOM 1261 CA ASN A1000 8.186 13.063 1.298 1.00 0.00 C ATOM 1262 C ASN A1000 7.138 13.957 0.667 1.00 0.00 C ATOM 1263 O ASN A1000 7.421 15.086 0.339 1.00 0.00 O ATOM 1264 CB ASN A1000 9.319 12.811 0.296 1.00 0.00 C ATOM 1265 CG ASN A1000 10.436 11.965 0.864 1.00 0.00 C ATOM 1266 OD1 ASN A1000 10.680 11.962 2.070 1.00 0.00 O ATOM 1267 ND2 ASN A1000 11.133 11.250 -0.003 1.00 0.00 N ATOM 0 H ASN A1000 7.697 11.032 1.103 1.00 0.00 H new ATOM 0 HA ASN A1000 8.614 13.552 2.173 1.00 0.00 H new ATOM 0 HB2 ASN A1000 8.912 12.319 -0.587 1.00 0.00 H new ATOM 0 HB3 ASN A1000 9.726 13.768 -0.031 1.00 0.00 H new ATOM 0 HD21 ASN A1000 11.906 10.668 0.320 1.00 0.00 H new ATOM 0 HD22 ASN A1000 10.898 11.281 -0.995 1.00 0.00 H new ATOM 1274 N LYS A1001 5.926 13.443 0.494 1.00 0.00 N ATOM 1275 CA LYS A1001 4.811 14.277 0.055 1.00 0.00 C ATOM 1276 C LYS A1001 4.262 15.047 1.234 1.00 0.00 C ATOM 1277 O LYS A1001 3.995 16.245 1.137 1.00 0.00 O ATOM 1278 CB LYS A1001 3.672 13.469 -0.580 1.00 0.00 C ATOM 1279 CG LYS A1001 2.454 14.329 -0.905 1.00 0.00 C ATOM 1280 CD LYS A1001 1.328 13.526 -1.530 1.00 0.00 C ATOM 1281 CE LYS A1001 0.124 14.399 -1.833 1.00 0.00 C ATOM 1282 NZ LYS A1001 -0.429 15.023 -0.601 1.00 0.00 N ATOM 0 H LYS A1001 5.690 12.463 0.649 1.00 0.00 H new ATOM 0 HA LYS A1001 5.202 14.950 -0.708 1.00 0.00 H new ATOM 0 HB2 LYS A1001 4.032 12.996 -1.493 1.00 0.00 H new ATOM 0 HB3 LYS A1001 3.377 12.669 0.099 1.00 0.00 H new ATOM 0 HG2 LYS A1001 2.094 14.804 0.008 1.00 0.00 H new ATOM 0 HG3 LYS A1001 2.748 15.128 -1.586 1.00 0.00 H new ATOM 0 HD2 LYS A1001 1.680 13.058 -2.449 1.00 0.00 H new ATOM 0 HD3 LYS A1001 1.035 12.722 -0.855 1.00 0.00 H new ATOM 0 HE2 LYS A1001 0.409 15.179 -2.539 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -0.648 13.799 -2.315 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -1.443 14.804 -0.526 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 0.068 14.647 0.232 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -0.299 16.054 -0.646 1.00 0.00 H new ATOM 1296 N MET A1002 4.086 14.347 2.352 1.00 0.00 N ATOM 1297 CA MET A1002 3.654 14.993 3.573 1.00 0.00 C ATOM 1298 C MET A1002 4.740 15.951 3.983 1.00 0.00 C ATOM 1299 O MET A1002 4.477 17.061 4.431 1.00 0.00 O ATOM 1300 CB MET A1002 3.378 13.990 4.708 1.00 0.00 C ATOM 1301 CG MET A1002 4.609 13.301 5.268 1.00 0.00 C ATOM 1302 SD MET A1002 4.307 12.441 6.825 1.00 0.00 S ATOM 1303 CE MET A1002 3.154 11.169 6.318 1.00 0.00 C ATOM 0 H MET A1002 4.236 13.341 2.431 1.00 0.00 H new ATOM 0 HA MET A1002 2.712 15.510 3.387 1.00 0.00 H new ATOM 0 HB2 MET A1002 2.872 14.513 5.520 1.00 0.00 H new ATOM 0 HB3 MET A1002 2.690 13.229 4.341 1.00 0.00 H new ATOM 0 HG2 MET A1002 4.981 12.587 4.534 1.00 0.00 H new ATOM 0 HG3 MET A1002 5.394 14.042 5.418 1.00 0.00 H new ATOM 0 HE1 MET A1002 2.963 10.497 7.154 1.00 0.00 H new ATOM 0 HE2 MET A1002 2.218 11.631 6.002 1.00 0.00 H new ATOM 0 HE3 MET A1002 3.578 10.604 5.488 1.00 0.00 H new ATOM 1313 N LYS A1003 5.972 15.509 3.772 1.00 0.00 N ATOM 1314 CA LYS A1003 7.118 16.313 4.071 1.00 0.00 C ATOM 1315 C LYS A1003 7.175 17.499 3.120 1.00 0.00 C ATOM 1316 O LYS A1003 7.006 18.611 3.556 1.00 0.00 O ATOM 1317 CB LYS A1003 8.382 15.455 3.944 1.00 0.00 C ATOM 1318 CG LYS A1003 9.679 16.213 4.155 1.00 0.00 C ATOM 1319 CD LYS A1003 10.887 15.333 3.878 1.00 0.00 C ATOM 1320 CE LYS A1003 12.192 16.100 4.044 1.00 0.00 C ATOM 1321 NZ LYS A1003 12.512 16.371 5.471 1.00 0.00 N ATOM 0 H LYS A1003 6.190 14.588 3.391 1.00 0.00 H new ATOM 0 HA LYS A1003 7.050 16.693 5.090 1.00 0.00 H new ATOM 0 HB2 LYS A1003 8.329 14.642 4.668 1.00 0.00 H new ATOM 0 HB3 LYS A1003 8.399 14.999 2.954 1.00 0.00 H new ATOM 0 HG2 LYS A1003 9.704 17.084 3.500 1.00 0.00 H new ATOM 0 HG3 LYS A1003 9.724 16.583 5.179 1.00 0.00 H new ATOM 0 HD2 LYS A1003 10.878 14.479 4.555 1.00 0.00 H new ATOM 0 HD3 LYS A1003 10.824 14.937 2.864 1.00 0.00 H new ATOM 0 HE2 LYS A1003 13.005 15.530 3.594 1.00 0.00 H new ATOM 0 HE3 LYS A1003 12.127 17.044 3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 13.408 16.895 5.532 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 11.750 16.937 5.896 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 12.601 15.471 5.984 1.00 0.00 H new ATOM 1335 N LEU A1004 7.302 17.236 1.821 1.00 0.00 N ATOM 1336 CA LEU A1004 7.506 18.292 0.819 1.00 0.00 C ATOM 1337 C LEU A1004 6.415 19.356 0.834 1.00 0.00 C ATOM 1338 O LEU A1004 6.710 20.546 0.962 1.00 0.00 O ATOM 1339 CB LEU A1004 7.580 17.701 -0.591 1.00 0.00 C ATOM 1340 CG LEU A1004 8.410 18.511 -1.593 1.00 0.00 C ATOM 1341 CD1 LEU A1004 9.885 18.203 -1.428 1.00 0.00 C ATOM 1342 CD2 LEU A1004 7.975 18.242 -3.024 1.00 0.00 C ATOM 0 H LEU A1004 7.267 16.294 1.431 1.00 0.00 H new ATOM 0 HA LEU A1004 8.449 18.767 1.088 1.00 0.00 H new ATOM 0 HB2 LEU A1004 7.997 16.696 -0.526 1.00 0.00 H new ATOM 0 HB3 LEU A1004 6.567 17.600 -0.980 1.00 0.00 H new ATOM 0 HG LEU A1004 8.241 19.568 -1.385 1.00 0.00 H new ATOM 0 HD11 LEU A1004 10.461 18.786 -2.147 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.200 18.460 -0.417 1.00 0.00 H new ATOM 0 HD13 LEU A1004 10.057 17.141 -1.602 1.00 0.00 H new ATOM 0 HD21 LEU A1004 8.585 18.833 -3.707 1.00 0.00 H new ATOM 0 HD22 LEU A1004 8.100 17.183 -3.249 1.00 0.00 H new ATOM 0 HD23 LEU A1004 6.927 18.517 -3.143 1.00 0.00 H new ATOM 1354 N ALA A1005 5.168 18.931 0.679 1.00 0.00 N ATOM 1355 CA ALA A1005 4.054 19.863 0.563 1.00 0.00 C ATOM 1356 C ALA A1005 3.983 20.773 1.779 1.00 0.00 C ATOM 1357 O ALA A1005 3.863 21.994 1.656 1.00 0.00 O ATOM 1358 CB ALA A1005 2.747 19.105 0.384 1.00 0.00 C ATOM 0 H ALA A1005 4.902 17.947 0.631 1.00 0.00 H new ATOM 0 HA ALA A1005 4.217 20.486 -0.317 1.00 0.00 H new ATOM 0 HB1 ALA A1005 1.924 19.814 0.299 1.00 0.00 H new ATOM 0 HB2 ALA A1005 2.799 18.499 -0.520 1.00 0.00 H new ATOM 0 HB3 ALA A1005 2.581 18.458 1.245 1.00 0.00 H new ATOM 1364 N GLN A1006 4.093 20.172 2.953 1.00 0.00 N ATOM 1365 CA GLN A1006 4.029 20.919 4.192 1.00 0.00 C ATOM 1366 C GLN A1006 5.345 21.659 4.423 1.00 0.00 C ATOM 1367 O GLN A1006 5.386 22.678 5.109 1.00 0.00 O ATOM 1368 CB GLN A1006 3.719 19.954 5.345 1.00 0.00 C ATOM 1369 CG GLN A1006 4.932 19.526 6.156 1.00 0.00 C ATOM 1370 CD GLN A1006 5.132 20.373 7.397 1.00 0.00 C ATOM 1371 OE1 GLN A1006 4.172 20.826 8.018 1.00 0.00 O ATOM 1372 NE2 GLN A1006 6.382 20.616 7.748 1.00 0.00 N ATOM 0 H GLN A1006 4.227 19.168 3.071 1.00 0.00 H new ATOM 0 HA GLN A1006 3.235 21.664 4.139 1.00 0.00 H new ATOM 0 HB2 GLN A1006 3.000 20.427 6.014 1.00 0.00 H new ATOM 0 HB3 GLN A1006 3.238 19.064 4.938 1.00 0.00 H new ATOM 0 HG2 GLN A1006 4.819 18.482 6.448 1.00 0.00 H new ATOM 0 HG3 GLN A1006 5.823 19.588 5.531 1.00 0.00 H new ATOM 0 HE21 GLN A1006 7.150 20.221 7.206 1.00 0.00 H new ATOM 0 HE22 GLN A1006 6.579 21.199 8.562 1.00 0.00 H new ATOM 1381 N GLN A1007 6.414 21.147 3.820 1.00 0.00 N ATOM 1382 CA GLN A1007 7.746 21.652 4.054 1.00 0.00 C ATOM 1383 C GLN A1007 7.932 23.047 3.475 1.00 0.00 C ATOM 1384 O GLN A1007 8.474 23.927 4.145 1.00 0.00 O ATOM 1385 CB GLN A1007 8.758 20.676 3.470 1.00 0.00 C ATOM 1386 CG GLN A1007 9.849 20.274 4.443 1.00 0.00 C ATOM 1387 CD GLN A1007 9.311 20.017 5.843 1.00 0.00 C ATOM 1388 OE1 GLN A1007 8.728 18.846 6.060 1.00 0.00 O flip ATOM 1389 NE2 GLN A1007 9.356 20.894 6.705 1.00 0.00 N flip ATOM 0 H GLN A1007 6.372 20.372 3.158 1.00 0.00 H new ATOM 0 HA GLN A1007 7.904 21.738 5.129 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.234 19.781 3.135 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.217 21.126 2.589 1.00 0.00 H new ATOM 0 HG2 GLN A1007 10.346 19.375 4.077 1.00 0.00 H new ATOM 0 HG3 GLN A1007 10.603 21.060 4.485 1.00 0.00 H new ATOM 0 HE21 GLN A1007 9.813 21.784 6.504 1.00 0.00 H new ATOM 0 HE22 GLN A1007 8.937 20.731 7.620 1.00 0.00 H new ATOM 1398 N TYR A1008 7.492 23.259 2.242 1.00 0.00 N ATOM 1399 CA TYR A1008 7.555 24.596 1.666 1.00 0.00 C ATOM 1400 C TYR A1008 6.177 25.082 1.250 1.00 0.00 C ATOM 1401 O TYR A1008 6.052 25.802 0.257 1.00 0.00 O ATOM 1402 CB TYR A1008 8.469 24.688 0.443 1.00 0.00 C ATOM 1403 CG TYR A1008 9.393 23.527 0.170 1.00 0.00 C ATOM 1404 CD1 TYR A1008 10.657 23.472 0.737 1.00 0.00 C ATOM 1405 CD2 TYR A1008 9.031 22.535 -0.731 1.00 0.00 C ATOM 1406 CE1 TYR A1008 11.529 22.451 0.426 1.00 0.00 C ATOM 1407 CE2 TYR A1008 9.899 21.522 -1.063 1.00 0.00 C ATOM 1408 CZ TYR A1008 11.150 21.480 -0.475 1.00 0.00 C ATOM 1409 OH TYR A1008 12.033 20.477 -0.800 1.00 0.00 O ATOM 0 H TYR A1008 7.097 22.542 1.634 1.00 0.00 H new ATOM 0 HA TYR A1008 7.966 25.223 2.457 1.00 0.00 H new ATOM 0 HB2 TYR A1008 7.840 24.830 -0.436 1.00 0.00 H new ATOM 0 HB3 TYR A1008 9.079 25.585 0.547 1.00 0.00 H new ATOM 0 HD1 TYR A1008 10.963 24.240 1.432 1.00 0.00 H new ATOM 0 HD2 TYR A1008 8.049 22.559 -1.180 1.00 0.00 H new ATOM 0 HE1 TYR A1008 12.505 22.412 0.887 1.00 0.00 H new ATOM 0 HE2 TYR A1008 9.607 20.766 -1.777 1.00 0.00 H new ATOM 0 HH TYR A1008 12.622 20.300 -0.037 1.00 0.00 H new ATOM 1419 N VAL A1009 5.144 24.679 1.981 1.00 0.00 N ATOM 1420 CA VAL A1009 3.807 25.204 1.747 1.00 0.00 C ATOM 1421 C VAL A1009 3.832 26.729 1.615 1.00 0.00 C ATOM 1422 O VAL A1009 4.321 27.445 2.492 1.00 0.00 O ATOM 1423 CB VAL A1009 2.819 24.789 2.860 1.00 0.00 C ATOM 1424 CG1 VAL A1009 3.316 25.215 4.235 1.00 0.00 C ATOM 1425 CG2 VAL A1009 1.438 25.365 2.580 1.00 0.00 C ATOM 0 H VAL A1009 5.207 23.995 2.735 1.00 0.00 H new ATOM 0 HA VAL A1009 3.458 24.771 0.809 1.00 0.00 H new ATOM 0 HB VAL A1009 2.750 23.701 2.862 1.00 0.00 H new ATOM 0 HG11 VAL A1009 2.596 24.907 4.994 1.00 0.00 H new ATOM 0 HG12 VAL A1009 4.279 24.745 4.436 1.00 0.00 H new ATOM 0 HG13 VAL A1009 3.429 26.299 4.261 1.00 0.00 H new ATOM 0 HG21 VAL A1009 0.751 25.065 3.372 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.498 26.453 2.544 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.075 24.990 1.623 1.00 0.00 H new ATOM 1435 N MET A1010 3.339 27.211 0.485 1.00 0.00 N ATOM 1436 CA MET A1010 3.347 28.632 0.188 1.00 0.00 C ATOM 1437 C MET A1010 2.207 28.939 -0.779 1.00 0.00 C ATOM 1438 O MET A1010 1.877 28.108 -1.619 1.00 0.00 O ATOM 1439 CB MET A1010 4.710 29.018 -0.409 1.00 0.00 C ATOM 1440 CG MET A1010 5.048 30.500 -0.319 1.00 0.00 C ATOM 1441 SD MET A1010 4.163 31.504 -1.523 1.00 0.00 S ATOM 1442 CE MET A1010 4.768 33.135 -1.097 1.00 0.00 C ATOM 0 H MET A1010 2.925 26.632 -0.246 1.00 0.00 H new ATOM 0 HA MET A1010 3.198 29.217 1.096 1.00 0.00 H new ATOM 0 HB2 MET A1010 5.488 28.450 0.101 1.00 0.00 H new ATOM 0 HB3 MET A1010 4.731 28.718 -1.457 1.00 0.00 H new ATOM 0 HG2 MET A1010 4.816 30.859 0.684 1.00 0.00 H new ATOM 0 HG3 MET A1010 6.120 30.631 -0.464 1.00 0.00 H new ATOM 0 HE1 MET A1010 4.313 33.875 -1.755 1.00 0.00 H new ATOM 0 HE2 MET A1010 4.509 33.360 -0.063 1.00 0.00 H new ATOM 0 HE3 MET A1010 5.851 33.163 -1.214 1.00 0.00 H new ATOM 1452 N THR A1011 1.625 30.128 -0.674 1.00 0.00 N ATOM 1453 CA THR A1011 0.432 30.487 -1.448 1.00 0.00 C ATOM 1454 C THR A1011 0.667 30.449 -2.969 1.00 0.00 C ATOM 1455 O THR A1011 -0.275 30.607 -3.748 1.00 0.00 O ATOM 1456 CB THR A1011 -0.086 31.887 -1.040 1.00 0.00 C ATOM 1457 OG1 THR A1011 -1.318 32.181 -1.712 1.00 0.00 O ATOM 1458 CG2 THR A1011 0.938 32.969 -1.359 1.00 0.00 C ATOM 0 H THR A1011 1.959 30.868 -0.057 1.00 0.00 H new ATOM 0 HA THR A1011 -0.318 29.732 -1.214 1.00 0.00 H new ATOM 0 HB THR A1011 -0.255 31.875 0.037 1.00 0.00 H new ATOM 0 HG1 THR A1011 -1.306 31.781 -2.607 1.00 0.00 H new ATOM 0 HG21 THR A1011 0.545 33.941 -1.061 1.00 0.00 H new ATOM 0 HG22 THR A1011 1.861 32.768 -0.815 1.00 0.00 H new ATOM 0 HG23 THR A1011 1.142 32.973 -2.430 1.00 0.00 H new ATOM 1466 N SER A1012 1.909 30.246 -3.391 1.00 0.00 N ATOM 1467 CA SER A1012 2.216 30.122 -4.808 1.00 0.00 C ATOM 1468 C SER A1012 3.171 28.954 -5.068 1.00 0.00 C ATOM 1469 O SER A1012 2.937 28.132 -5.954 1.00 0.00 O ATOM 1470 CB SER A1012 2.821 31.429 -5.332 1.00 0.00 C ATOM 1471 OG SER A1012 3.121 31.340 -6.715 1.00 0.00 O ATOM 0 H SER A1012 2.717 30.164 -2.774 1.00 0.00 H new ATOM 0 HA SER A1012 1.286 29.920 -5.340 1.00 0.00 H new ATOM 0 HB2 SER A1012 2.124 32.249 -5.161 1.00 0.00 H new ATOM 0 HB3 SER A1012 3.729 31.661 -4.775 1.00 0.00 H new ATOM 0 HG SER A1012 3.504 32.188 -7.022 1.00 0.00 H new ATOM 1477 N LEU A1013 4.236 28.870 -4.278 1.00 0.00 N ATOM 1478 CA LEU A1013 5.287 27.879 -4.510 1.00 0.00 C ATOM 1479 C LEU A1013 4.842 26.465 -4.140 1.00 0.00 C ATOM 1480 O LEU A1013 5.413 25.493 -4.629 1.00 0.00 O ATOM 1481 CB LEU A1013 6.560 28.234 -3.728 1.00 0.00 C ATOM 1482 CG LEU A1013 7.358 29.435 -4.254 1.00 0.00 C ATOM 1483 CD1 LEU A1013 6.618 30.743 -4.011 1.00 0.00 C ATOM 1484 CD2 LEU A1013 8.735 29.478 -3.613 1.00 0.00 C ATOM 0 H LEU A1013 4.397 29.474 -3.472 1.00 0.00 H new ATOM 0 HA LEU A1013 5.499 27.899 -5.579 1.00 0.00 H new ATOM 0 HB2 LEU A1013 6.283 28.432 -2.692 1.00 0.00 H new ATOM 0 HB3 LEU A1013 7.214 27.362 -3.722 1.00 0.00 H new ATOM 0 HG LEU A1013 7.474 29.313 -5.331 1.00 0.00 H new ATOM 0 HD11 LEU A1013 7.211 31.573 -4.395 1.00 0.00 H new ATOM 0 HD12 LEU A1013 5.656 30.717 -4.522 1.00 0.00 H new ATOM 0 HD13 LEU A1013 6.457 30.877 -2.941 1.00 0.00 H new ATOM 0 HD21 LEU A1013 9.288 30.335 -3.997 1.00 0.00 H new ATOM 0 HD22 LEU A1013 8.630 29.568 -2.532 1.00 0.00 H new ATOM 0 HD23 LEU A1013 9.276 28.562 -3.850 1.00 0.00 H new ATOM 1496 N GLN A1014 3.811 26.357 -3.301 1.00 0.00 N ATOM 1497 CA GLN A1014 3.374 25.061 -2.770 1.00 0.00 C ATOM 1498 C GLN A1014 3.035 24.083 -3.891 1.00 0.00 C ATOM 1499 O GLN A1014 3.448 22.932 -3.851 1.00 0.00 O ATOM 1500 CB GLN A1014 2.154 25.246 -1.853 1.00 0.00 C ATOM 1501 CG GLN A1014 1.871 24.086 -0.900 1.00 0.00 C ATOM 1502 CD GLN A1014 1.127 22.954 -1.566 1.00 0.00 C ATOM 1503 OE1 GLN A1014 1.867 21.998 -2.080 1.00 0.00 O flip ATOM 1504 NE2 GLN A1014 -0.102 22.931 -1.602 1.00 0.00 N flip ATOM 0 H GLN A1014 3.261 27.151 -2.973 1.00 0.00 H new ATOM 0 HA GLN A1014 4.200 24.644 -2.194 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.297 26.152 -1.264 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.274 25.406 -2.475 1.00 0.00 H new ATOM 0 HG2 GLN A1014 2.813 23.711 -0.501 1.00 0.00 H new ATOM 0 HG3 GLN A1014 1.289 24.450 -0.054 1.00 0.00 H new ATOM 0 HE21 GLN A1014 -0.639 23.695 -1.190 1.00 0.00 H new ATOM 0 HE22 GLN A1014 -0.585 22.148 -2.043 1.00 0.00 H new ATOM 1513 N GLN A1015 2.346 24.567 -4.915 1.00 0.00 N ATOM 1514 CA GLN A1015 1.698 23.699 -5.902 1.00 0.00 C ATOM 1515 C GLN A1015 2.657 22.671 -6.510 1.00 0.00 C ATOM 1516 O GLN A1015 2.261 21.540 -6.758 1.00 0.00 O ATOM 1517 CB GLN A1015 1.089 24.544 -7.006 1.00 0.00 C ATOM 1518 CG GLN A1015 0.105 25.588 -6.505 1.00 0.00 C ATOM 1519 CD GLN A1015 -1.031 24.983 -5.705 1.00 0.00 C ATOM 1520 OE1 GLN A1015 -0.941 24.839 -4.483 1.00 0.00 O ATOM 1521 NE2 GLN A1015 -2.107 24.635 -6.385 1.00 0.00 N ATOM 0 H GLN A1015 2.218 25.564 -5.089 1.00 0.00 H new ATOM 0 HA GLN A1015 0.921 23.143 -5.377 1.00 0.00 H new ATOM 0 HB2 GLN A1015 1.889 25.044 -7.552 1.00 0.00 H new ATOM 0 HB3 GLN A1015 0.581 23.889 -7.714 1.00 0.00 H new ATOM 0 HG2 GLN A1015 0.634 26.313 -5.886 1.00 0.00 H new ATOM 0 HG3 GLN A1015 -0.305 26.133 -7.355 1.00 0.00 H new ATOM 0 HE21 GLN A1015 -2.138 24.772 -7.395 1.00 0.00 H new ATOM 0 HE22 GLN A1015 -2.907 24.229 -5.900 1.00 0.00 H new ATOM 1530 N GLU A1016 3.902 23.069 -6.760 1.00 0.00 N ATOM 1531 CA GLU A1016 4.946 22.111 -7.158 1.00 0.00 C ATOM 1532 C GLU A1016 4.954 20.879 -6.257 1.00 0.00 C ATOM 1533 O GLU A1016 4.902 19.748 -6.730 1.00 0.00 O ATOM 1534 CB GLU A1016 6.326 22.762 -7.062 1.00 0.00 C ATOM 1535 CG GLU A1016 7.457 21.749 -6.928 1.00 0.00 C ATOM 1536 CD GLU A1016 7.956 21.241 -8.266 1.00 0.00 C ATOM 1537 OE1 GLU A1016 8.732 21.963 -8.929 1.00 0.00 O ATOM 1538 OE2 GLU A1016 7.585 20.114 -8.656 1.00 0.00 O ATOM 0 H GLU A1016 4.217 24.037 -6.697 1.00 0.00 H new ATOM 0 HA GLU A1016 4.726 21.812 -8.183 1.00 0.00 H new ATOM 0 HB2 GLU A1016 6.496 23.372 -7.949 1.00 0.00 H new ATOM 0 HB3 GLU A1016 6.345 23.434 -6.204 1.00 0.00 H new ATOM 0 HG2 GLU A1016 8.285 22.206 -6.387 1.00 0.00 H new ATOM 0 HG3 GLU A1016 7.113 20.905 -6.330 1.00 0.00 H new ATOM 1545 N TYR A1017 4.998 21.119 -4.961 1.00 0.00 N ATOM 1546 CA TYR A1017 5.157 20.063 -3.971 1.00 0.00 C ATOM 1547 C TYR A1017 3.902 19.205 -3.949 1.00 0.00 C ATOM 1548 O TYR A1017 3.925 18.024 -3.597 1.00 0.00 O ATOM 1549 CB TYR A1017 5.449 20.714 -2.614 1.00 0.00 C ATOM 1550 CG TYR A1017 6.374 21.893 -2.782 1.00 0.00 C ATOM 1551 CD1 TYR A1017 7.506 21.781 -3.575 1.00 0.00 C ATOM 1552 CD2 TYR A1017 6.091 23.124 -2.209 1.00 0.00 C ATOM 1553 CE1 TYR A1017 8.328 22.856 -3.804 1.00 0.00 C ATOM 1554 CE2 TYR A1017 6.918 24.210 -2.424 1.00 0.00 C ATOM 1555 CZ TYR A1017 8.033 24.075 -3.228 1.00 0.00 C ATOM 1556 OH TYR A1017 8.852 25.158 -3.454 1.00 0.00 O ATOM 0 H TYR A1017 4.925 22.054 -4.560 1.00 0.00 H new ATOM 0 HA TYR A1017 5.991 19.406 -4.217 1.00 0.00 H new ATOM 0 HB2 TYR A1017 4.517 21.039 -2.152 1.00 0.00 H new ATOM 0 HB3 TYR A1017 5.900 19.983 -1.943 1.00 0.00 H new ATOM 0 HD1 TYR A1017 7.746 20.828 -4.022 1.00 0.00 H new ATOM 0 HD2 TYR A1017 5.214 23.235 -1.588 1.00 0.00 H new ATOM 0 HE1 TYR A1017 9.201 22.749 -4.431 1.00 0.00 H new ATOM 0 HE2 TYR A1017 6.693 25.161 -1.965 1.00 0.00 H new ATOM 0 HH TYR A1017 9.267 25.076 -4.338 1.00 0.00 H new ATOM 1566 N LYS A1018 2.820 19.821 -4.388 1.00 0.00 N ATOM 1567 CA LYS A1018 1.537 19.163 -4.528 1.00 0.00 C ATOM 1568 C LYS A1018 1.509 18.334 -5.819 1.00 0.00 C ATOM 1569 O LYS A1018 1.038 17.203 -5.825 1.00 0.00 O ATOM 1570 CB LYS A1018 0.446 20.237 -4.547 1.00 0.00 C ATOM 1571 CG LYS A1018 -0.979 19.730 -4.432 1.00 0.00 C ATOM 1572 CD LYS A1018 -1.939 20.904 -4.359 1.00 0.00 C ATOM 1573 CE LYS A1018 -3.373 20.467 -4.136 1.00 0.00 C ATOM 1574 NZ LYS A1018 -4.270 21.638 -3.956 1.00 0.00 N ATOM 0 H LYS A1018 2.809 20.804 -4.660 1.00 0.00 H new ATOM 0 HA LYS A1018 1.366 18.484 -3.693 1.00 0.00 H new ATOM 0 HB2 LYS A1018 0.632 20.932 -3.728 1.00 0.00 H new ATOM 0 HB3 LYS A1018 0.537 20.804 -5.473 1.00 0.00 H new ATOM 0 HG2 LYS A1018 -1.222 19.103 -5.290 1.00 0.00 H new ATOM 0 HG3 LYS A1018 -1.083 19.108 -3.543 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -1.635 21.568 -3.550 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -1.877 21.478 -5.283 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -3.711 19.874 -4.985 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -3.428 19.825 -3.257 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -5.245 21.309 -3.805 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -3.959 22.190 -3.131 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -4.234 22.237 -4.806 1.00 0.00 H new ATOM 1588 N LYS A1019 2.057 18.906 -6.892 1.00 0.00 N ATOM 1589 CA LYS A1019 2.008 18.303 -8.228 1.00 0.00 C ATOM 1590 C LYS A1019 3.029 17.180 -8.376 1.00 0.00 C ATOM 1591 O LYS A1019 2.783 16.165 -9.034 1.00 0.00 O ATOM 1592 CB LYS A1019 2.276 19.379 -9.285 1.00 0.00 C ATOM 1593 CG LYS A1019 2.374 18.845 -10.703 1.00 0.00 C ATOM 1594 CD LYS A1019 2.938 19.893 -11.646 1.00 0.00 C ATOM 1595 CE LYS A1019 3.115 19.346 -13.053 1.00 0.00 C ATOM 1596 NZ LYS A1019 3.794 20.326 -13.940 1.00 0.00 N ATOM 0 H LYS A1019 2.547 19.800 -6.861 1.00 0.00 H new ATOM 0 HA LYS A1019 1.015 17.876 -8.368 1.00 0.00 H new ATOM 0 HB2 LYS A1019 1.479 20.121 -9.242 1.00 0.00 H new ATOM 0 HB3 LYS A1019 3.204 19.893 -9.037 1.00 0.00 H new ATOM 0 HG2 LYS A1019 3.009 17.959 -10.718 1.00 0.00 H new ATOM 0 HG3 LYS A1019 1.387 18.536 -11.047 1.00 0.00 H new ATOM 0 HD2 LYS A1019 2.272 20.755 -11.672 1.00 0.00 H new ATOM 0 HD3 LYS A1019 3.899 20.243 -11.268 1.00 0.00 H new ATOM 0 HE2 LYS A1019 3.696 18.425 -13.015 1.00 0.00 H new ATOM 0 HE3 LYS A1019 2.141 19.091 -13.470 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 3.898 19.919 -14.891 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 3.226 21.196 -13.995 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 4.734 20.550 -13.555 1.00 0.00 H new ATOM 1610 N GLN A1020 4.153 17.351 -7.712 1.00 0.00 N ATOM 1611 CA GLN A1020 5.278 16.451 -7.897 1.00 0.00 C ATOM 1612 C GLN A1020 5.062 15.215 -7.049 1.00 0.00 C ATOM 1613 O GLN A1020 5.211 14.080 -7.507 1.00 0.00 O ATOM 1614 CB GLN A1020 6.595 17.130 -7.521 1.00 0.00 C ATOM 1615 CG GLN A1020 7.816 16.274 -7.822 1.00 0.00 C ATOM 1616 CD GLN A1020 9.119 16.914 -7.384 1.00 0.00 C ATOM 1617 OE1 GLN A1020 10.068 16.217 -7.023 1.00 0.00 O ATOM 1618 NE2 GLN A1020 9.188 18.234 -7.430 1.00 0.00 N ATOM 0 H GLN A1020 4.314 18.102 -7.041 1.00 0.00 H new ATOM 0 HA GLN A1020 5.341 16.172 -8.949 1.00 0.00 H new ATOM 0 HB2 GLN A1020 6.678 18.073 -8.062 1.00 0.00 H new ATOM 0 HB3 GLN A1020 6.582 17.372 -6.458 1.00 0.00 H new ATOM 0 HG2 GLN A1020 7.707 15.310 -7.325 1.00 0.00 H new ATOM 0 HG3 GLN A1020 7.858 16.077 -8.893 1.00 0.00 H new ATOM 0 HE21 GLN A1020 8.380 18.777 -7.735 1.00 0.00 H new ATOM 0 HE22 GLN A1020 10.049 18.709 -7.161 1.00 0.00 H new ATOM 1627 N MET A1021 4.667 15.449 -5.813 1.00 0.00 N ATOM 1628 CA MET A1021 4.413 14.370 -4.887 1.00 0.00 C ATOM 1629 C MET A1021 3.090 13.682 -5.206 1.00 0.00 C ATOM 1630 O MET A1021 2.838 12.568 -4.751 1.00 0.00 O ATOM 1631 CB MET A1021 4.442 14.889 -3.459 1.00 0.00 C ATOM 1632 CG MET A1021 5.815 15.373 -3.006 1.00 0.00 C ATOM 1633 SD MET A1021 7.055 14.057 -2.923 1.00 0.00 S ATOM 1634 CE MET A1021 7.592 13.941 -4.628 1.00 0.00 C ATOM 0 H MET A1021 4.515 16.381 -5.428 1.00 0.00 H new ATOM 0 HA MET A1021 5.201 13.624 -4.992 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.730 15.709 -3.366 1.00 0.00 H new ATOM 0 HB3 MET A1021 4.107 14.098 -2.788 1.00 0.00 H new ATOM 0 HG2 MET A1021 6.163 16.146 -3.691 1.00 0.00 H new ATOM 0 HG3 MET A1021 5.722 15.836 -2.024 1.00 0.00 H new ATOM 0 HE1 MET A1021 7.224 13.012 -5.063 1.00 0.00 H new ATOM 0 HE2 MET A1021 7.199 14.787 -5.192 1.00 0.00 H new ATOM 0 HE3 MET A1021 8.681 13.953 -4.668 1.00 0.00 H new ATOM 1644 N LEU A1022 2.238 14.352 -5.977 1.00 0.00 N ATOM 1645 CA LEU A1022 1.025 13.724 -6.488 1.00 0.00 C ATOM 1646 C LEU A1022 1.404 12.571 -7.412 1.00 0.00 C ATOM 1647 O LEU A1022 0.836 11.480 -7.336 1.00 0.00 O ATOM 1648 CB LEU A1022 0.166 14.735 -7.248 1.00 0.00 C ATOM 1649 CG LEU A1022 -1.158 14.195 -7.790 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -2.047 13.717 -6.653 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -1.870 15.259 -8.615 1.00 0.00 C ATOM 0 H LEU A1022 2.364 15.324 -6.260 1.00 0.00 H new ATOM 0 HA LEU A1022 0.445 13.348 -5.646 1.00 0.00 H new ATOM 0 HB2 LEU A1022 -0.047 15.575 -6.587 1.00 0.00 H new ATOM 0 HB3 LEU A1022 0.748 15.126 -8.082 1.00 0.00 H new ATOM 0 HG LEU A1022 -0.943 13.344 -8.437 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -2.984 13.337 -7.059 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -1.540 12.923 -6.104 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -2.255 14.548 -5.979 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -2.810 14.858 -8.993 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -2.072 16.129 -7.990 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -1.238 15.553 -9.453 1.00 0.00 H new ATOM 1663 N THR A1023 2.393 12.819 -8.267 1.00 0.00 N ATOM 1664 CA THR A1023 2.936 11.790 -9.144 1.00 0.00 C ATOM 1665 C THR A1023 3.540 10.650 -8.316 1.00 0.00 C ATOM 1666 O THR A1023 3.543 9.486 -8.732 1.00 0.00 O ATOM 1667 CB THR A1023 4.013 12.386 -10.075 1.00 0.00 C ATOM 1668 OG1 THR A1023 3.511 13.583 -10.692 1.00 0.00 O ATOM 1669 CG2 THR A1023 4.416 11.389 -11.152 1.00 0.00 C ATOM 0 H THR A1023 2.836 13.732 -8.370 1.00 0.00 H new ATOM 0 HA THR A1023 2.123 11.396 -9.753 1.00 0.00 H new ATOM 0 HB THR A1023 4.892 12.620 -9.475 1.00 0.00 H new ATOM 0 HG1 THR A1023 4.197 13.960 -11.281 1.00 0.00 H new ATOM 0 HG21 THR A1023 5.176 11.834 -11.794 1.00 0.00 H new ATOM 0 HG22 THR A1023 4.818 10.490 -10.684 1.00 0.00 H new ATOM 0 HG23 THR A1023 3.543 11.127 -11.750 1.00 0.00 H new ATOM 1677 N ALA A1024 4.010 10.995 -7.120 1.00 0.00 N ATOM 1678 CA ALA A1024 4.597 10.016 -6.213 1.00 0.00 C ATOM 1679 C ALA A1024 3.507 9.201 -5.517 1.00 0.00 C ATOM 1680 O ALA A1024 3.701 8.029 -5.191 1.00 0.00 O ATOM 1681 CB ALA A1024 5.482 10.704 -5.184 1.00 0.00 C ATOM 0 H ALA A1024 3.995 11.948 -6.757 1.00 0.00 H new ATOM 0 HA ALA A1024 5.213 9.335 -6.800 1.00 0.00 H new ATOM 0 HB1 ALA A1024 5.911 9.957 -4.516 1.00 0.00 H new ATOM 0 HB2 ALA A1024 6.284 11.239 -5.693 1.00 0.00 H new ATOM 0 HB3 ALA A1024 4.886 11.409 -4.605 1.00 0.00 H new ATOM 1687 N ALA A1025 2.356 9.827 -5.300 1.00 0.00 N ATOM 1688 CA ALA A1025 1.215 9.150 -4.694 1.00 0.00 C ATOM 1689 C ALA A1025 0.674 8.086 -5.632 1.00 0.00 C ATOM 1690 O ALA A1025 0.313 6.991 -5.204 1.00 0.00 O ATOM 1691 CB ALA A1025 0.124 10.150 -4.343 1.00 0.00 C ATOM 0 H ALA A1025 2.188 10.805 -5.535 1.00 0.00 H new ATOM 0 HA ALA A1025 1.549 8.668 -3.775 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -0.719 9.626 -3.892 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.515 10.883 -3.637 1.00 0.00 H new ATOM 0 HB3 ALA A1025 -0.208 10.659 -5.248 1.00 0.00 H new ATOM 1697 N HIS A1026 0.626 8.420 -6.918 1.00 0.00 N ATOM 1698 CA HIS A1026 0.222 7.466 -7.940 1.00 0.00 C ATOM 1699 C HIS A1026 1.139 6.252 -7.914 1.00 0.00 C ATOM 1700 O HIS A1026 0.690 5.120 -8.090 1.00 0.00 O ATOM 1701 CB HIS A1026 0.253 8.119 -9.328 1.00 0.00 C ATOM 1702 CG HIS A1026 -0.072 7.178 -10.454 1.00 0.00 C ATOM 1703 ND1 HIS A1026 0.733 7.030 -11.562 1.00 0.00 N ATOM 1704 CD2 HIS A1026 -1.123 6.343 -10.645 1.00 0.00 C ATOM 1705 CE1 HIS A1026 0.188 6.150 -12.384 1.00 0.00 C ATOM 1706 NE2 HIS A1026 -0.937 5.718 -11.851 1.00 0.00 N ATOM 0 H HIS A1026 0.863 9.346 -7.275 1.00 0.00 H new ATOM 0 HA HIS A1026 -0.798 7.145 -7.730 1.00 0.00 H new ATOM 0 HB2 HIS A1026 -0.455 8.947 -9.344 1.00 0.00 H new ATOM 0 HB3 HIS A1026 1.243 8.543 -9.497 1.00 0.00 H new ATOM 0 HD2 HIS A1026 -1.954 6.197 -9.971 1.00 0.00 H new ATOM 0 HE1 HIS A1026 0.596 5.837 -13.334 1.00 0.00 H new ATOM 0 HE2 HIS A1026 -1.566 5.031 -12.267 1.00 0.00 H new ATOM 1715 N ALA A1027 2.418 6.500 -7.678 1.00 0.00 N ATOM 1716 CA ALA A1027 3.405 5.438 -7.619 1.00 0.00 C ATOM 1717 C ALA A1027 3.138 4.509 -6.443 1.00 0.00 C ATOM 1718 O ALA A1027 3.048 3.299 -6.625 1.00 0.00 O ATOM 1719 CB ALA A1027 4.803 6.024 -7.542 1.00 0.00 C ATOM 0 H ALA A1027 2.797 7.434 -7.524 1.00 0.00 H new ATOM 0 HA ALA A1027 3.329 4.846 -8.531 1.00 0.00 H new ATOM 0 HB1 ALA A1027 5.534 5.217 -7.498 1.00 0.00 H new ATOM 0 HB2 ALA A1027 4.990 6.636 -8.425 1.00 0.00 H new ATOM 0 HB3 ALA A1027 4.890 6.641 -6.648 1.00 0.00 H new ATOM 1725 N LEU A1028 2.941 5.074 -5.252 1.00 0.00 N ATOM 1726 CA LEU A1028 2.726 4.253 -4.063 1.00 0.00 C ATOM 1727 C LEU A1028 1.376 3.535 -4.157 1.00 0.00 C ATOM 1728 O LEU A1028 1.183 2.458 -3.593 1.00 0.00 O ATOM 1729 CB LEU A1028 2.855 5.087 -2.762 1.00 0.00 C ATOM 1730 CG LEU A1028 1.799 4.813 -1.674 1.00 0.00 C ATOM 1731 CD1 LEU A1028 2.306 5.258 -0.318 1.00 0.00 C ATOM 1732 CD2 LEU A1028 0.483 5.525 -1.978 1.00 0.00 C ATOM 0 H LEU A1028 2.926 6.080 -5.087 1.00 0.00 H new ATOM 0 HA LEU A1028 3.508 3.495 -4.019 1.00 0.00 H new ATOM 0 HB2 LEU A1028 3.842 4.907 -2.335 1.00 0.00 H new ATOM 0 HB3 LEU A1028 2.810 6.144 -3.026 1.00 0.00 H new ATOM 0 HG LEU A1028 1.618 3.738 -1.663 1.00 0.00 H new ATOM 0 HD11 LEU A1028 1.547 5.057 0.438 1.00 0.00 H new ATOM 0 HD12 LEU A1028 3.217 4.711 -0.073 1.00 0.00 H new ATOM 0 HD13 LEU A1028 2.520 6.327 -0.342 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -0.238 5.309 -1.190 1.00 0.00 H new ATOM 0 HD22 LEU A1028 0.654 6.600 -2.029 1.00 0.00 H new ATOM 0 HD23 LEU A1028 0.092 5.175 -2.933 1.00 0.00 H new ATOM 1744 N ALA A1029 0.434 4.154 -4.856 1.00 0.00 N ATOM 1745 CA ALA A1029 -0.829 3.503 -5.163 1.00 0.00 C ATOM 1746 C ALA A1029 -0.594 2.227 -5.971 1.00 0.00 C ATOM 1747 O ALA A1029 -1.227 1.199 -5.725 1.00 0.00 O ATOM 1748 CB ALA A1029 -1.757 4.448 -5.911 1.00 0.00 C ATOM 0 H ALA A1029 0.521 5.103 -5.219 1.00 0.00 H new ATOM 0 HA ALA A1029 -1.308 3.231 -4.223 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -2.696 3.939 -6.130 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -1.955 5.326 -5.296 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -1.286 4.758 -6.844 1.00 0.00 H new ATOM 1754 N VAL A1030 0.308 2.299 -6.946 1.00 0.00 N ATOM 1755 CA VAL A1030 0.704 1.122 -7.714 1.00 0.00 C ATOM 1756 C VAL A1030 1.458 0.125 -6.836 1.00 0.00 C ATOM 1757 O VAL A1030 1.371 -1.089 -7.043 1.00 0.00 O ATOM 1758 CB VAL A1030 1.567 1.511 -8.938 1.00 0.00 C ATOM 1759 CG1 VAL A1030 1.911 0.287 -9.768 1.00 0.00 C ATOM 1760 CG2 VAL A1030 0.847 2.540 -9.795 1.00 0.00 C ATOM 0 H VAL A1030 0.779 3.160 -7.223 1.00 0.00 H new ATOM 0 HA VAL A1030 -0.208 0.648 -8.076 1.00 0.00 H new ATOM 0 HB VAL A1030 2.494 1.950 -8.570 1.00 0.00 H new ATOM 0 HG11 VAL A1030 2.518 0.586 -10.623 1.00 0.00 H new ATOM 0 HG12 VAL A1030 2.469 -0.422 -9.157 1.00 0.00 H new ATOM 0 HG13 VAL A1030 0.993 -0.183 -10.121 1.00 0.00 H new ATOM 0 HG21 VAL A1030 1.470 2.801 -10.651 1.00 0.00 H new ATOM 0 HG22 VAL A1030 -0.097 2.124 -10.147 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.651 3.434 -9.203 1.00 0.00 H new ATOM 1770 N ASP A1031 2.178 0.645 -5.852 1.00 0.00 N ATOM 1771 CA ASP A1031 2.835 -0.196 -4.857 1.00 0.00 C ATOM 1772 C ASP A1031 1.807 -1.090 -4.184 1.00 0.00 C ATOM 1773 O ASP A1031 2.002 -2.304 -4.065 1.00 0.00 O ATOM 1774 CB ASP A1031 3.525 0.655 -3.794 1.00 0.00 C ATOM 1775 CG ASP A1031 4.829 1.250 -4.257 1.00 0.00 C ATOM 1776 OD1 ASP A1031 4.930 1.641 -5.439 1.00 0.00 O ATOM 1777 OD2 ASP A1031 5.758 1.321 -3.436 1.00 0.00 O ATOM 0 H ASP A1031 2.323 1.646 -5.720 1.00 0.00 H new ATOM 0 HA ASP A1031 3.585 -0.802 -5.365 1.00 0.00 H new ATOM 0 HB2 ASP A1031 2.854 1.459 -3.492 1.00 0.00 H new ATOM 0 HB3 ASP A1031 3.707 0.043 -2.911 1.00 0.00 H new ATOM 1782 N ALA A1032 0.691 -0.483 -3.783 1.00 0.00 N ATOM 1783 CA ALA A1032 -0.423 -1.220 -3.218 1.00 0.00 C ATOM 1784 C ALA A1032 -0.928 -2.256 -4.210 1.00 0.00 C ATOM 1785 O ALA A1032 -0.995 -3.437 -3.896 1.00 0.00 O ATOM 1786 CB ALA A1032 -1.548 -0.271 -2.838 1.00 0.00 C ATOM 0 H ALA A1032 0.540 0.524 -3.842 1.00 0.00 H new ATOM 0 HA ALA A1032 -0.078 -1.732 -2.320 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -2.376 -0.840 -2.416 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -1.186 0.445 -2.101 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.889 0.263 -3.725 1.00 0.00 H new ATOM 1792 N LYS A1033 -1.241 -1.811 -5.422 1.00 0.00 N ATOM 1793 CA LYS A1033 -1.802 -2.687 -6.450 1.00 0.00 C ATOM 1794 C LYS A1033 -0.923 -3.920 -6.683 1.00 0.00 C ATOM 1795 O LYS A1033 -1.426 -5.041 -6.826 1.00 0.00 O ATOM 1796 CB LYS A1033 -1.961 -1.914 -7.759 1.00 0.00 C ATOM 1797 CG LYS A1033 -2.662 -2.700 -8.856 1.00 0.00 C ATOM 1798 CD LYS A1033 -2.640 -1.951 -10.180 1.00 0.00 C ATOM 1799 CE LYS A1033 -1.227 -1.825 -10.728 1.00 0.00 C ATOM 1800 NZ LYS A1033 -0.664 -3.143 -11.129 1.00 0.00 N ATOM 0 H LYS A1033 -1.116 -0.844 -5.720 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.776 -3.029 -6.101 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -2.523 -1.000 -7.564 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -0.975 -1.613 -8.114 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -2.178 -3.669 -8.977 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -3.694 -2.894 -8.564 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -3.267 -2.472 -10.904 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -3.068 -0.958 -10.044 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -1.230 -1.156 -11.588 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -0.585 -1.371 -9.973 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 0.216 -2.996 -11.664 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -0.462 -3.707 -10.279 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -1.351 -3.647 -11.724 1.00 0.00 H new ATOM 1814 N ASN A1034 0.387 -3.711 -6.716 1.00 0.00 N ATOM 1815 CA ASN A1034 1.328 -4.801 -6.949 1.00 0.00 C ATOM 1816 C ASN A1034 1.262 -5.826 -5.819 1.00 0.00 C ATOM 1817 O ASN A1034 1.080 -7.018 -6.068 1.00 0.00 O ATOM 1818 CB ASN A1034 2.754 -4.267 -7.088 1.00 0.00 C ATOM 1819 CG ASN A1034 3.758 -5.366 -7.390 1.00 0.00 C ATOM 1820 OD1 ASN A1034 4.969 -5.210 -6.883 1.00 0.00 O flip ATOM 1821 ND2 ASN A1034 3.450 -6.343 -8.071 1.00 0.00 N flip ATOM 0 H ASN A1034 0.822 -2.798 -6.585 1.00 0.00 H new ATOM 0 HA ASN A1034 1.046 -5.291 -7.881 1.00 0.00 H new ATOM 0 HB2 ASN A1034 2.784 -3.523 -7.884 1.00 0.00 H new ATOM 0 HB3 ASN A1034 3.041 -3.760 -6.166 1.00 0.00 H new ATOM 0 HD21 ASN A1034 2.505 -6.427 -8.444 1.00 0.00 H new ATOM 0 HD22 ASN A1034 4.140 -7.069 -8.262 1.00 0.00 H new ATOM 1828 N LEU A1035 1.336 -5.352 -4.575 1.00 0.00 N ATOM 1829 CA LEU A1035 1.362 -6.253 -3.417 1.00 0.00 C ATOM 1830 C LEU A1035 -0.028 -6.853 -3.204 1.00 0.00 C ATOM 1831 O LEU A1035 -0.169 -7.943 -2.678 1.00 0.00 O ATOM 1832 CB LEU A1035 1.798 -5.516 -2.143 1.00 0.00 C ATOM 1833 CG LEU A1035 1.761 -6.365 -0.870 1.00 0.00 C ATOM 1834 CD1 LEU A1035 3.028 -7.190 -0.737 1.00 0.00 C ATOM 1835 CD2 LEU A1035 1.558 -5.495 0.352 1.00 0.00 C ATOM 0 H LEU A1035 1.379 -4.360 -4.342 1.00 0.00 H new ATOM 0 HA LEU A1035 2.085 -7.043 -3.620 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.812 -5.142 -2.285 1.00 0.00 H new ATOM 0 HB3 LEU A1035 1.154 -4.648 -2.003 1.00 0.00 H new ATOM 0 HG LEU A1035 0.915 -7.049 -0.944 1.00 0.00 H new ATOM 0 HD11 LEU A1035 2.980 -7.786 0.175 1.00 0.00 H new ATOM 0 HD12 LEU A1035 3.124 -7.851 -1.598 1.00 0.00 H new ATOM 0 HD13 LEU A1035 3.891 -6.526 -0.692 1.00 0.00 H new ATOM 0 HD21 LEU A1035 1.535 -6.121 1.244 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.378 -4.781 0.430 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.615 -4.956 0.262 1.00 0.00 H new ATOM 1847 N LEU A1036 -1.042 -6.115 -3.626 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.438 -6.541 -3.548 1.00 0.00 C ATOM 1849 C LEU A1036 -2.642 -7.851 -4.286 1.00 0.00 C ATOM 1850 O LEU A1036 -3.402 -8.712 -3.852 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.331 -5.431 -4.131 1.00 0.00 C ATOM 1852 CG LEU A1036 -4.800 -5.783 -4.379 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -5.676 -4.564 -4.136 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -4.994 -6.277 -5.809 1.00 0.00 C ATOM 0 H LEU A1036 -0.921 -5.190 -4.039 1.00 0.00 H new ATOM 0 HA LEU A1036 -2.711 -6.710 -2.506 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -3.296 -4.577 -3.454 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -2.896 -5.107 -5.076 1.00 0.00 H new ATOM 0 HG LEU A1036 -5.087 -6.576 -3.689 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -6.719 -4.824 -4.315 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -5.557 -4.230 -3.105 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -5.381 -3.763 -4.813 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -6.044 -6.523 -5.970 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -4.693 -5.496 -6.508 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -4.384 -7.165 -5.973 1.00 0.00 H new ATOM 1866 N ASP A1037 -1.923 -8.006 -5.381 1.00 0.00 N ATOM 1867 CA ASP A1037 -2.028 -9.202 -6.193 1.00 0.00 C ATOM 1868 C ASP A1037 -0.976 -10.172 -5.718 1.00 0.00 C ATOM 1869 O ASP A1037 -1.176 -11.371 -5.702 1.00 0.00 O ATOM 1870 CB ASP A1037 -1.821 -8.870 -7.671 1.00 0.00 C ATOM 1871 CG ASP A1037 -1.979 -10.077 -8.574 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -3.127 -10.418 -8.919 1.00 0.00 O ATOM 1873 OD2 ASP A1037 -0.952 -10.670 -8.972 1.00 0.00 O ATOM 0 H ASP A1037 -1.258 -7.316 -5.729 1.00 0.00 H new ATOM 0 HA ASP A1037 -3.021 -9.640 -6.093 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -2.536 -8.103 -7.970 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.825 -8.448 -7.808 1.00 0.00 H new ATOM 1878 N VAL A1038 0.133 -9.599 -5.295 1.00 0.00 N ATOM 1879 CA VAL A1038 1.239 -10.323 -4.701 1.00 0.00 C ATOM 1880 C VAL A1038 0.784 -11.141 -3.491 1.00 0.00 C ATOM 1881 O VAL A1038 1.098 -12.312 -3.365 1.00 0.00 O ATOM 1882 CB VAL A1038 2.311 -9.289 -4.280 1.00 0.00 C ATOM 1883 CG1 VAL A1038 3.082 -9.702 -3.037 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.259 -9.004 -5.434 1.00 0.00 C ATOM 0 H VAL A1038 0.294 -8.594 -5.356 1.00 0.00 H new ATOM 0 HA VAL A1038 1.648 -11.026 -5.427 1.00 0.00 H new ATOM 0 HB VAL A1038 1.778 -8.374 -4.021 1.00 0.00 H new ATOM 0 HG11 VAL A1038 3.818 -8.936 -2.794 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.391 -9.819 -2.202 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.591 -10.648 -3.222 1.00 0.00 H new ATOM 0 HG21 VAL A1038 4.006 -8.275 -5.120 1.00 0.00 H new ATOM 0 HG22 VAL A1038 3.756 -9.927 -5.733 1.00 0.00 H new ATOM 0 HG23 VAL A1038 2.696 -8.606 -6.278 1.00 0.00 H new ATOM 1894 N ILE A1039 0.015 -10.515 -2.629 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.360 -11.092 -1.362 1.00 0.00 C ATOM 1896 C ILE A1039 -1.704 -11.823 -1.469 1.00 0.00 C ATOM 1897 O ILE A1039 -1.977 -12.754 -0.712 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.397 -9.997 -0.283 1.00 0.00 C ATOM 1899 CG1 ILE A1039 -0.214 -10.579 1.102 1.00 0.00 C ATOM 1900 CG2 ILE A1039 -1.692 -9.230 -0.337 1.00 0.00 C ATOM 1901 CD1 ILE A1039 -0.257 -9.529 2.183 1.00 0.00 C ATOM 0 H ILE A1039 -0.370 -9.584 -2.791 1.00 0.00 H new ATOM 0 HA ILE A1039 0.386 -11.833 -1.074 1.00 0.00 H new ATOM 0 HB ILE A1039 0.430 -9.317 -0.488 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -0.994 -11.318 1.287 1.00 0.00 H new ATOM 0 HG13 ILE A1039 0.740 -11.104 1.148 1.00 0.00 H new ATOM 0 HG21 ILE A1039 -1.692 -8.462 0.436 1.00 0.00 H new ATOM 0 HG22 ILE A1039 -1.796 -8.760 -1.315 1.00 0.00 H new ATOM 0 HG23 ILE A1039 -2.526 -9.912 -0.171 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -0.121 -10.002 3.155 1.00 0.00 H new ATOM 0 HD12 ILE A1039 0.540 -8.804 2.017 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -1.221 -9.021 2.159 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.562 -11.377 -2.381 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.666 -12.229 -2.818 1.00 0.00 C ATOM 1915 C ASP A1040 -3.096 -13.532 -3.364 1.00 0.00 C ATOM 1916 O ASP A1040 -3.585 -14.625 -3.061 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.531 -11.558 -3.883 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.487 -12.542 -4.535 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -6.170 -13.293 -3.803 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -5.540 -12.591 -5.781 1.00 0.00 O ATOM 0 H ASP A1040 -2.520 -10.458 -2.822 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.307 -12.419 -1.957 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -5.099 -10.745 -3.431 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -3.890 -11.114 -4.645 1.00 0.00 H new ATOM 1925 N GLN A1041 -2.027 -13.406 -4.143 1.00 0.00 N ATOM 1926 CA GLN A1041 -1.313 -14.568 -4.632 1.00 0.00 C ATOM 1927 C GLN A1041 -0.596 -15.240 -3.492 1.00 0.00 C ATOM 1928 O GLN A1041 -0.402 -16.435 -3.532 1.00 0.00 O ATOM 1929 CB GLN A1041 -0.295 -14.227 -5.707 1.00 0.00 C ATOM 1930 CG GLN A1041 -0.891 -13.930 -7.073 1.00 0.00 C ATOM 1931 CD GLN A1041 -1.508 -15.150 -7.720 1.00 0.00 C ATOM 1932 OE1 GLN A1041 -2.699 -15.417 -7.575 1.00 0.00 O ATOM 1933 NE2 GLN A1041 -0.694 -15.903 -8.440 1.00 0.00 N ATOM 0 H GLN A1041 -1.641 -12.512 -4.446 1.00 0.00 H new ATOM 0 HA GLN A1041 -2.058 -15.229 -5.074 1.00 0.00 H new ATOM 0 HB2 GLN A1041 0.282 -13.361 -5.381 1.00 0.00 H new ATOM 0 HB3 GLN A1041 0.404 -15.058 -5.803 1.00 0.00 H new ATOM 0 HG2 GLN A1041 -1.650 -13.154 -6.972 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -0.113 -13.532 -7.725 1.00 0.00 H new ATOM 0 HE21 GLN A1041 0.288 -15.646 -8.535 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -1.048 -16.741 -8.901 1.00 0.00 H new ATOM 1942 N ALA A1042 -0.163 -14.465 -2.498 1.00 0.00 N ATOM 1943 CA ALA A1042 0.370 -15.035 -1.279 1.00 0.00 C ATOM 1944 C ALA A1042 -0.617 -16.018 -0.674 1.00 0.00 C ATOM 1945 O ALA A1042 -0.297 -17.177 -0.452 1.00 0.00 O ATOM 1946 CB ALA A1042 0.682 -13.945 -0.270 1.00 0.00 C ATOM 0 H ALA A1042 -0.174 -13.445 -2.520 1.00 0.00 H new ATOM 0 HA ALA A1042 1.291 -15.562 -1.529 1.00 0.00 H new ATOM 0 HB1 ALA A1042 1.082 -14.394 0.639 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.419 -13.260 -0.690 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.230 -13.397 -0.033 1.00 0.00 H new ATOM 1952 N ARG A1043 -1.825 -15.549 -0.418 1.00 0.00 N ATOM 1953 CA ARG A1043 -2.869 -16.409 0.110 1.00 0.00 C ATOM 1954 C ARG A1043 -3.110 -17.602 -0.824 1.00 0.00 C ATOM 1955 O ARG A1043 -3.418 -18.701 -0.368 1.00 0.00 O ATOM 1956 CB ARG A1043 -4.154 -15.614 0.329 1.00 0.00 C ATOM 1957 CG ARG A1043 -5.046 -16.191 1.420 1.00 0.00 C ATOM 1958 CD ARG A1043 -4.348 -16.184 2.775 1.00 0.00 C ATOM 1959 NE ARG A1043 -5.236 -16.623 3.854 1.00 0.00 N ATOM 1960 CZ ARG A1043 -5.127 -16.224 5.128 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -4.120 -15.442 5.507 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -6.018 -16.623 6.027 1.00 0.00 N ATOM 0 H ARG A1043 -2.107 -14.580 -0.567 1.00 0.00 H new ATOM 0 HA ARG A1043 -2.544 -16.799 1.074 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -3.897 -14.586 0.586 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -4.714 -15.578 -0.606 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -5.968 -15.612 1.482 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -5.327 -17.211 1.160 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -3.475 -16.836 2.736 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -3.986 -15.179 2.991 1.00 0.00 H new ATOM 0 HE ARG A1043 -5.985 -17.274 3.620 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -3.423 -15.141 4.825 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -4.045 -15.143 6.479 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -6.786 -17.234 5.748 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -5.935 -16.319 6.997 1.00 0.00 H new ATOM 1976 N LEU A1044 -2.960 -17.385 -2.131 1.00 0.00 N ATOM 1977 CA LEU A1044 -3.017 -18.488 -3.092 1.00 0.00 C ATOM 1978 C LEU A1044 -1.802 -19.406 -2.948 1.00 0.00 C ATOM 1979 O LEU A1044 -1.937 -20.616 -3.019 1.00 0.00 O ATOM 1980 CB LEU A1044 -3.098 -17.979 -4.531 1.00 0.00 C ATOM 1981 CG LEU A1044 -3.130 -19.086 -5.591 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -4.389 -19.930 -5.454 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -3.033 -18.492 -6.983 1.00 0.00 C ATOM 0 H LEU A1044 -2.800 -16.467 -2.546 1.00 0.00 H new ATOM 0 HA LEU A1044 -3.923 -19.052 -2.870 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -3.992 -17.365 -4.637 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -2.242 -17.332 -4.724 1.00 0.00 H new ATOM 0 HG LEU A1044 -2.269 -19.735 -5.433 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -4.390 -20.709 -6.217 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -4.413 -20.390 -4.466 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -5.267 -19.297 -5.581 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -3.057 -19.292 -7.723 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -3.873 -17.818 -7.150 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -2.099 -17.938 -7.078 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.621 -18.812 -2.764 1.00 0.00 N ATOM 1996 CA LYS A1045 0.611 -19.553 -2.494 1.00 0.00 C ATOM 1997 C LYS A1045 0.395 -20.521 -1.353 1.00 0.00 C ATOM 1998 O LYS A1045 0.922 -21.634 -1.332 1.00 0.00 O ATOM 1999 CB LYS A1045 1.741 -18.601 -2.088 1.00 0.00 C ATOM 2000 CG LYS A1045 2.257 -17.700 -3.188 1.00 0.00 C ATOM 2001 CD LYS A1045 2.604 -18.492 -4.439 1.00 0.00 C ATOM 2002 CE LYS A1045 3.187 -17.611 -5.532 1.00 0.00 C ATOM 2003 NZ LYS A1045 2.264 -16.514 -5.920 1.00 0.00 N ATOM 0 H LYS A1045 -0.493 -17.801 -2.798 1.00 0.00 H new ATOM 0 HA LYS A1045 0.881 -20.085 -3.406 1.00 0.00 H new ATOM 0 HB2 LYS A1045 1.390 -17.978 -1.266 1.00 0.00 H new ATOM 0 HB3 LYS A1045 2.573 -19.193 -1.707 1.00 0.00 H new ATOM 0 HG2 LYS A1045 1.504 -16.949 -3.428 1.00 0.00 H new ATOM 0 HG3 LYS A1045 3.140 -17.165 -2.838 1.00 0.00 H new ATOM 0 HD2 LYS A1045 3.319 -19.274 -4.185 1.00 0.00 H new ATOM 0 HD3 LYS A1045 1.708 -18.988 -4.813 1.00 0.00 H new ATOM 0 HE2 LYS A1045 4.130 -17.186 -5.189 1.00 0.00 H new ATOM 0 HE3 LYS A1045 3.412 -18.221 -6.407 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 2.595 -16.078 -6.804 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 1.308 -16.898 -6.061 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 2.241 -15.797 -5.167 1.00 0.00 H new ATOM 2017 N MET A1046 -0.380 -20.064 -0.397 1.00 0.00 N ATOM 2018 CA MET A1046 -0.692 -20.860 0.774 1.00 0.00 C ATOM 2019 C MET A1046 -1.583 -22.036 0.384 1.00 0.00 C ATOM 2020 O MET A1046 -1.429 -23.150 0.891 1.00 0.00 O ATOM 2021 CB MET A1046 -1.371 -19.986 1.817 1.00 0.00 C ATOM 2022 CG MET A1046 -1.608 -20.688 3.136 1.00 0.00 C ATOM 2023 SD MET A1046 -2.371 -19.606 4.361 1.00 0.00 S ATOM 2024 CE MET A1046 -2.579 -20.746 5.725 1.00 0.00 C ATOM 0 H MET A1046 -0.810 -19.139 -0.405 1.00 0.00 H new ATOM 0 HA MET A1046 0.229 -21.259 1.200 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.759 -19.101 1.991 1.00 0.00 H new ATOM 0 HB3 MET A1046 -2.326 -19.640 1.422 1.00 0.00 H new ATOM 0 HG2 MET A1046 -2.247 -21.556 2.973 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.659 -21.059 3.523 1.00 0.00 H new ATOM 0 HE1 MET A1046 -3.041 -20.228 6.565 1.00 0.00 H new ATOM 0 HE2 MET A1046 -3.217 -21.573 5.414 1.00 0.00 H new ATOM 0 HE3 MET A1046 -1.606 -21.132 6.028 1.00 0.00 H new ATOM 2034 N ILE A1047 -2.501 -21.777 -0.539 1.00 0.00 N ATOM 2035 CA ILE A1047 -3.339 -22.822 -1.112 1.00 0.00 C ATOM 2036 C ILE A1047 -2.475 -23.761 -1.952 1.00 0.00 C ATOM 2037 O ILE A1047 -2.694 -24.969 -1.978 1.00 0.00 O ATOM 2038 CB ILE A1047 -4.461 -22.225 -1.995 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -5.263 -21.182 -1.212 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -5.382 -23.322 -2.513 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -5.951 -21.731 0.022 1.00 0.00 C ATOM 0 H ILE A1047 -2.685 -20.844 -0.909 1.00 0.00 H new ATOM 0 HA ILE A1047 -3.806 -23.371 -0.295 1.00 0.00 H new ATOM 0 HB ILE A1047 -3.996 -21.735 -2.850 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -4.595 -20.374 -0.914 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -6.014 -20.747 -1.871 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -6.163 -22.879 -3.131 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -4.806 -24.030 -3.108 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -5.837 -23.843 -1.671 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -6.497 -20.930 0.520 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -6.646 -22.518 -0.269 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -5.205 -22.140 0.703 1.00 0.00 H new ATOM 2053 N SER A1048 -1.483 -23.180 -2.623 1.00 0.00 N ATOM 2054 CA SER A1048 -0.528 -23.926 -3.430 1.00 0.00 C ATOM 2055 C SER A1048 0.175 -25.004 -2.604 1.00 0.00 C ATOM 2056 O SER A1048 0.196 -26.174 -2.986 1.00 0.00 O ATOM 2057 CB SER A1048 0.498 -22.957 -4.035 1.00 0.00 C ATOM 2058 OG SER A1048 -0.130 -22.054 -4.934 1.00 0.00 O ATOM 0 H SER A1048 -1.321 -22.173 -2.620 1.00 0.00 H new ATOM 0 HA SER A1048 -1.069 -24.428 -4.232 1.00 0.00 H new ATOM 0 HB2 SER A1048 0.992 -22.400 -3.239 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.271 -23.519 -4.558 1.00 0.00 H new ATOM 0 HG SER A1048 -0.771 -21.498 -4.444 1.00 0.00 H new ATOM 2064 N GLN A1049 0.725 -24.613 -1.459 1.00 0.00 N ATOM 2065 CA GLN A1049 1.407 -25.561 -0.579 1.00 0.00 C ATOM 2066 C GLN A1049 0.431 -26.580 -0.004 1.00 0.00 C ATOM 2067 O GLN A1049 0.798 -27.723 0.266 1.00 0.00 O ATOM 2068 CB GLN A1049 2.120 -24.826 0.556 1.00 0.00 C ATOM 2069 CG GLN A1049 3.304 -23.995 0.091 1.00 0.00 C ATOM 2070 CD GLN A1049 4.363 -24.828 -0.606 1.00 0.00 C ATOM 2071 OE1 GLN A1049 4.329 -25.009 -1.825 1.00 0.00 O ATOM 2072 NE2 GLN A1049 5.307 -25.348 0.162 1.00 0.00 N ATOM 0 H GLN A1049 0.713 -23.652 -1.118 1.00 0.00 H new ATOM 0 HA GLN A1049 2.147 -26.093 -1.177 1.00 0.00 H new ATOM 0 HB2 GLN A1049 1.406 -24.176 1.062 1.00 0.00 H new ATOM 0 HB3 GLN A1049 2.464 -25.554 1.290 1.00 0.00 H new ATOM 0 HG2 GLN A1049 2.953 -23.218 -0.588 1.00 0.00 H new ATOM 0 HG3 GLN A1049 3.749 -23.492 0.949 1.00 0.00 H new ATOM 0 HE21 GLN A1049 5.300 -25.175 1.167 1.00 0.00 H new ATOM 0 HE22 GLN A1049 6.042 -25.922 -0.251 1.00 0.00 H new ATOM 2081 N SER A1050 -0.814 -26.166 0.170 1.00 0.00 N ATOM 2082 CA SER A1050 -1.844 -27.054 0.695 1.00 0.00 C ATOM 2083 C SER A1050 -2.366 -27.979 -0.405 1.00 0.00 C ATOM 2084 O SER A1050 -3.010 -28.990 -0.122 1.00 0.00 O ATOM 2085 CB SER A1050 -2.986 -26.228 1.289 1.00 0.00 C ATOM 2086 OG SER A1050 -2.498 -25.317 2.264 1.00 0.00 O ATOM 0 H SER A1050 -1.137 -25.223 -0.044 1.00 0.00 H new ATOM 0 HA SER A1050 -1.410 -27.673 1.481 1.00 0.00 H new ATOM 0 HB2 SER A1050 -3.495 -25.680 0.496 1.00 0.00 H new ATOM 0 HB3 SER A1050 -3.723 -26.891 1.742 1.00 0.00 H new ATOM 0 HG SER A1050 -2.110 -24.536 1.817 1.00 0.00 H new ATOM 2092 N ARG A1051 -2.042 -27.626 -1.650 1.00 0.00 N ATOM 2093 CA ARG A1051 -2.484 -28.354 -2.842 1.00 0.00 C ATOM 2094 C ARG A1051 -3.999 -28.259 -3.027 1.00 0.00 C ATOM 2095 O ARG A1051 -4.768 -28.893 -2.304 1.00 0.00 O ATOM 2096 CB ARG A1051 -2.048 -29.826 -2.804 1.00 0.00 C ATOM 2097 CG ARG A1051 -2.401 -30.585 -4.073 1.00 0.00 C ATOM 2098 CD ARG A1051 -1.652 -30.025 -5.270 1.00 0.00 C ATOM 2099 NE ARG A1051 -2.194 -30.505 -6.542 1.00 0.00 N ATOM 2100 CZ ARG A1051 -1.460 -30.719 -7.631 1.00 0.00 C ATOM 2101 NH1 ARG A1051 -0.140 -30.587 -7.583 1.00 0.00 N ATOM 2102 NH2 ARG A1051 -2.054 -31.075 -8.762 1.00 0.00 N ATOM 0 H ARG A1051 -1.458 -26.817 -1.862 1.00 0.00 H new ATOM 0 HA ARG A1051 -2.002 -27.878 -3.696 1.00 0.00 H new ATOM 0 HB2 ARG A1051 -0.971 -29.876 -2.646 1.00 0.00 H new ATOM 0 HB3 ARG A1051 -2.518 -30.316 -1.952 1.00 0.00 H new ATOM 0 HG2 ARG A1051 -2.158 -31.640 -3.949 1.00 0.00 H new ATOM 0 HG3 ARG A1051 -3.475 -30.524 -4.251 1.00 0.00 H new ATOM 0 HD2 ARG A1051 -1.697 -28.936 -5.247 1.00 0.00 H new ATOM 0 HD3 ARG A1051 -0.600 -30.302 -5.199 1.00 0.00 H new ATOM 0 HE ARG A1051 -3.196 -30.687 -6.597 1.00 0.00 H new ATOM 0 HH11 ARG A1051 0.314 -30.321 -6.710 1.00 0.00 H new ATOM 0 HH12 ARG A1051 0.420 -30.752 -8.420 1.00 0.00 H new ATOM 0 HH21 ARG A1051 -3.068 -31.183 -8.794 1.00 0.00 H new ATOM 0 HH22 ARG A1051 -1.497 -31.241 -9.600 1.00 0.00 H new ATOM 2116 N PRO A1052 -4.445 -27.462 -4.010 1.00 0.00 N ATOM 2117 CA PRO A1052 -5.860 -27.330 -4.334 1.00 0.00 C ATOM 2118 C PRO A1052 -6.363 -28.534 -5.130 1.00 0.00 C ATOM 2119 O PRO A1052 -6.935 -29.470 -4.569 1.00 0.00 O ATOM 2120 CB PRO A1052 -5.933 -26.048 -5.180 1.00 0.00 C ATOM 2121 CG PRO A1052 -4.541 -25.499 -5.241 1.00 0.00 C ATOM 2122 CD PRO A1052 -3.613 -26.624 -4.880 1.00 0.00 C ATOM 0 HA PRO A1052 -6.485 -27.283 -3.442 1.00 0.00 H new ATOM 0 HB2 PRO A1052 -6.309 -26.264 -6.180 1.00 0.00 H new ATOM 0 HB3 PRO A1052 -6.616 -25.326 -4.732 1.00 0.00 H new ATOM 0 HG2 PRO A1052 -4.319 -25.120 -6.238 1.00 0.00 H new ATOM 0 HG3 PRO A1052 -4.424 -24.665 -4.549 1.00 0.00 H new ATOM 0 HD2 PRO A1052 -3.274 -27.168 -5.762 1.00 0.00 H new ATOM 0 HD3 PRO A1052 -2.722 -26.265 -4.365 1.00 0.00 H new ATOM 2130 N HIS A1053 -6.132 -28.508 -6.437 1.00 0.00 N ATOM 2131 CA HIS A1053 -6.447 -29.633 -7.305 1.00 0.00 C ATOM 2132 C HIS A1053 -5.291 -29.868 -8.256 1.00 0.00 C ATOM 2133 O HIS A1053 -4.594 -30.885 -8.099 1.00 0.00 O ATOM 2134 CB HIS A1053 -7.740 -29.395 -8.097 1.00 0.00 C ATOM 2135 CG HIS A1053 -8.980 -29.433 -7.260 1.00 0.00 C ATOM 2136 ND1 HIS A1053 -9.975 -28.488 -7.346 1.00 0.00 N ATOM 2137 CD2 HIS A1053 -9.386 -30.319 -6.323 1.00 0.00 C ATOM 2138 CE1 HIS A1053 -10.938 -28.787 -6.496 1.00 0.00 C ATOM 2139 NE2 HIS A1053 -10.606 -29.894 -5.861 1.00 0.00 N ATOM 2140 OXT HIS A1053 -5.056 -29.004 -9.129 1.00 0.00 O ATOM 0 H HIS A1053 -5.723 -27.710 -6.922 1.00 0.00 H new ATOM 0 HA HIS A1053 -6.603 -30.513 -6.682 1.00 0.00 H new ATOM 0 HB2 HIS A1053 -7.678 -28.426 -8.593 1.00 0.00 H new ATOM 0 HB3 HIS A1053 -7.819 -30.149 -8.880 1.00 0.00 H new ATOM 0 HD2 HIS A1053 -8.849 -31.198 -5.998 1.00 0.00 H new ATOM 0 HE1 HIS A1053 -11.845 -28.221 -6.345 1.00 0.00 H new ATOM 0 HE2 HIS A1053 -11.164 -30.358 -5.144 1.00 0.00 H new TER 2149 HIS A1053