USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1035 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 940 SER OG : rot 118:sc= -0.711 USER MOD Set 1.2: A1021 MET CE :methyl -160:sc= -1.03 (180deg=-2.44!) USER MOD Set 2.1: A 944 GLN : amide:sc= -0.02 X(o=-0.02,f=0) USER MOD Set 2.2: A1019 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A1014 GLN : amide:sc= -1.38 K(o=-2.3,f=-2.9) USER MOD Set 3.2: A1018 LYS NZ :NH3+ 179:sc= -0.911 (180deg=-0.908) USER MOD Set 4.1: A1010 MET CE :methyl 165:sc= -7.35! (180deg=-8.64!) USER MOD Set 4.2: A1011 THR OG1 : rot 180:sc= 0.0174 USER MOD Set 5.1: A1008 TYR OH : rot 180:sc= 0.105 USER MOD Set 5.2: A1017 TYR OH : rot -81:sc= 0.246 USER MOD Set 6.1: A 928 ASN : amide:sc= -3.08! K(o=-2.5!,f=-1.7) USER MOD Set 6.2: A 968 THR OG1 : rot 88:sc= 0.603 USER MOD Single : A 922 ASN : amide:sc= -0.0207 K(o=-0.021,f=-0.71) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot -96:sc= 0.0225 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 939 MET CE :methyl 156:sc= -0.75 (180deg=-2.49!) USER MOD Single : A 941 SER OG : rot -170:sc= -0.046 USER MOD Single : A 942 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.716) USER MOD Single : A 951 TYR OH : rot 130:sc= -1.15 USER MOD Single : A 954 MET CE :methyl -145:sc= -3.07 (180deg=-7.88!) USER MOD Single : A 956 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 964 THR OG1 : rot 180:sc= 0 USER MOD Single : A 972 SER OG : rot -150:sc= -0.0353 USER MOD Single : A 979 SER OG : rot 180:sc= 0 USER MOD Single : A 980 THR OG1 : rot 152:sc= 0.914 USER MOD Single : A 981 HIS : no HD1:sc= -2.64! K(o=-2.6!,f=-0.59) USER MOD Single : A 986 MET CE :methyl -114:sc= 0 (180deg=-1.58) USER MOD Single : A 988 GLN : amide:sc= -0.419 K(o=-0.42,f=-2.9!) USER MOD Single : A 989 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 992 ASN : amide:sc= -0.0844 X(o=-0.084,f=-0.32) USER MOD Single : A 993 SER OG : rot 180:sc= 0 USER MOD Single : A1000 ASN : amide:sc= -0.107 K(o=-0.11,f=-2.2!) USER MOD Single : A1001 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.201) USER MOD Single : A1002 MET CE :methyl 162:sc= -0.313 (180deg=-1.12) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1006 GLN : amide:sc= -2.48 K(o=-2.5,f=-6.6!) USER MOD Single : A1007 GLN : amide:sc= -1.03 K(o=-1,f=-1.8!) USER MOD Single : A1012 SER OG : rot 80:sc= 1.08 USER MOD Single : A1015 GLN : amide:sc= -0.116 K(o=-0.12,f=-1.2!) USER MOD Single : A1020 GLN : amide:sc= -0.385 K(o=-0.38,f=-1) USER MOD Single : A1023 THR OG1 : rot 180:sc= 0.126 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=-0.043) USER MOD Single : A1033 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.00496) USER MOD Single : A1034 ASN : amide:sc= -0.393 K(o=-0.39,f=-3.2!) USER MOD Single : A1041 GLN : amide:sc=-0.00513 X(o=-0.0051,f=-0.14) USER MOD Single : A1045 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1046 MET CE :methyl 152:sc= -0.303 (180deg=-1.54!) USER MOD ----------------------------------------------------------------- ATOM 107 N ASN A 922 7.078 -10.202 -5.996 1.00 0.00 N ATOM 108 CA ASN A 922 6.689 -9.939 -4.621 1.00 0.00 C ATOM 109 C ASN A 922 7.225 -8.571 -4.197 1.00 0.00 C ATOM 110 O ASN A 922 6.537 -7.816 -3.511 1.00 0.00 O ATOM 111 CB ASN A 922 7.271 -10.990 -3.674 1.00 0.00 C ATOM 112 CG ASN A 922 6.162 -11.699 -2.894 1.00 0.00 C ATOM 113 OD1 ASN A 922 5.201 -12.204 -3.452 1.00 0.00 O ATOM 114 ND2 ASN A 922 6.348 -11.710 -1.578 1.00 0.00 N ATOM 0 HA ASN A 922 5.601 -9.968 -4.566 1.00 0.00 H new ATOM 0 HB2 ASN A 922 7.844 -11.721 -4.244 1.00 0.00 H new ATOM 0 HB3 ASN A 922 7.963 -10.515 -2.979 1.00 0.00 H new ATOM 0 HD21 ASN A 922 5.664 -12.160 -0.970 1.00 0.00 H new ATOM 0 HD22 ASN A 922 7.175 -11.268 -1.176 1.00 0.00 H new ATOM 121 N ASP A 923 8.449 -8.292 -4.621 1.00 0.00 N ATOM 122 CA ASP A 923 9.085 -7.028 -4.293 1.00 0.00 C ATOM 123 C ASP A 923 8.474 -5.917 -5.150 1.00 0.00 C ATOM 124 O ASP A 923 8.529 -4.744 -4.783 1.00 0.00 O ATOM 125 CB ASP A 923 10.587 -7.075 -4.582 1.00 0.00 C ATOM 126 CG ASP A 923 11.485 -6.737 -3.391 1.00 0.00 C ATOM 127 OD1 ASP A 923 10.966 -6.095 -2.453 1.00 0.00 O ATOM 128 OD2 ASP A 923 12.671 -7.129 -3.445 1.00 0.00 O ATOM 0 H ASP A 923 9.017 -8.920 -5.189 1.00 0.00 H new ATOM 0 HA ASP A 923 8.928 -6.837 -3.231 1.00 0.00 H new ATOM 0 HB2 ASP A 923 10.842 -8.073 -4.939 1.00 0.00 H new ATOM 0 HB3 ASP A 923 10.808 -6.381 -5.393 1.00 0.00 H new ATOM 133 N LYS A 924 7.906 -6.326 -6.275 1.00 0.00 N ATOM 134 CA LYS A 924 7.285 -5.380 -7.187 1.00 0.00 C ATOM 135 C LYS A 924 6.105 -4.703 -6.487 1.00 0.00 C ATOM 136 O LYS A 924 6.089 -3.483 -6.327 1.00 0.00 O ATOM 137 CB LYS A 924 6.909 -6.069 -8.500 1.00 0.00 C ATOM 138 CG LYS A 924 6.163 -5.109 -9.429 1.00 0.00 C ATOM 139 CD LYS A 924 7.133 -4.391 -10.369 1.00 0.00 C ATOM 140 CE LYS A 924 6.659 -4.484 -11.821 1.00 0.00 C ATOM 141 NZ LYS A 924 7.783 -4.227 -12.750 1.00 0.00 N ATOM 0 H LYS A 924 7.863 -7.300 -6.576 1.00 0.00 H new ATOM 0 HA LYS A 924 7.989 -4.593 -7.458 1.00 0.00 H new ATOM 0 HB2 LYS A 924 7.809 -6.433 -8.995 1.00 0.00 H new ATOM 0 HB3 LYS A 924 6.285 -6.939 -8.293 1.00 0.00 H new ATOM 0 HG2 LYS A 924 5.427 -5.661 -10.013 1.00 0.00 H new ATOM 0 HG3 LYS A 924 5.615 -4.376 -8.837 1.00 0.00 H new ATOM 0 HD2 LYS A 924 7.220 -3.344 -10.077 1.00 0.00 H new ATOM 0 HD3 LYS A 924 8.126 -4.831 -10.278 1.00 0.00 H new ATOM 0 HE2 LYS A 924 6.241 -5.473 -12.011 1.00 0.00 H new ATOM 0 HE3 LYS A 924 5.862 -3.762 -11.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 7.445 -4.294 -13.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 8.164 -3.274 -12.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 8.531 -4.932 -12.593 1.00 0.00 H new ATOM 155 N VAL A 925 5.144 -5.524 -6.088 1.00 0.00 N ATOM 156 CA VAL A 925 3.963 -5.020 -5.409 1.00 0.00 C ATOM 157 C VAL A 925 4.385 -4.293 -4.131 1.00 0.00 C ATOM 158 O VAL A 925 3.817 -3.258 -3.785 1.00 0.00 O ATOM 159 CB VAL A 925 2.981 -6.165 -5.149 1.00 0.00 C ATOM 160 CG1 VAL A 925 1.770 -5.677 -4.351 1.00 0.00 C ATOM 161 CG2 VAL A 925 2.546 -6.822 -6.460 1.00 0.00 C ATOM 0 H VAL A 925 5.160 -6.535 -6.222 1.00 0.00 H new ATOM 0 HA VAL A 925 3.441 -4.297 -6.036 1.00 0.00 H new ATOM 0 HB VAL A 925 3.494 -6.918 -4.552 1.00 0.00 H new ATOM 0 HG11 VAL A 925 1.088 -6.510 -4.180 1.00 0.00 H new ATOM 0 HG12 VAL A 925 2.103 -5.277 -3.393 1.00 0.00 H new ATOM 0 HG13 VAL A 925 1.256 -4.896 -4.911 1.00 0.00 H new ATOM 0 HG21 VAL A 925 1.849 -7.632 -6.247 1.00 0.00 H new ATOM 0 HG22 VAL A 925 2.059 -6.081 -7.094 1.00 0.00 H new ATOM 0 HG23 VAL A 925 3.420 -7.221 -6.974 1.00 0.00 H new ATOM 171 N TYR A 926 5.380 -4.862 -3.466 1.00 0.00 N ATOM 172 CA TYR A 926 5.885 -4.280 -2.234 1.00 0.00 C ATOM 173 C TYR A 926 6.652 -2.986 -2.513 1.00 0.00 C ATOM 174 O TYR A 926 6.857 -2.175 -1.611 1.00 0.00 O ATOM 175 CB TYR A 926 6.847 -5.313 -1.644 1.00 0.00 C ATOM 176 CG TYR A 926 6.159 -6.418 -0.841 1.00 0.00 C ATOM 177 CD1 TYR A 926 5.010 -7.010 -1.326 1.00 0.00 C ATOM 178 CD2 TYR A 926 6.686 -6.824 0.368 1.00 0.00 C ATOM 179 CE1 TYR A 926 4.361 -8.050 -0.570 1.00 0.00 C ATOM 180 CE2 TYR A 926 6.038 -7.864 1.124 1.00 0.00 C ATOM 181 CZ TYR A 926 4.907 -8.426 0.617 1.00 0.00 C ATOM 182 OH TYR A 926 4.295 -9.409 1.331 1.00 0.00 O ATOM 0 H TYR A 926 5.850 -5.719 -3.757 1.00 0.00 H new ATOM 0 HA TYR A 926 5.064 -4.039 -1.558 1.00 0.00 H new ATOM 0 HB2 TYR A 926 7.417 -5.768 -2.454 1.00 0.00 H new ATOM 0 HB3 TYR A 926 7.562 -4.802 -1.000 1.00 0.00 H new ATOM 0 HD1 TYR A 926 4.598 -6.693 -2.273 1.00 0.00 H new ATOM 0 HD2 TYR A 926 7.585 -6.361 0.747 1.00 0.00 H new ATOM 0 HE1 TYR A 926 3.461 -8.520 -0.938 1.00 0.00 H new ATOM 0 HE2 TYR A 926 6.440 -8.191 2.072 1.00 0.00 H new ATOM 0 HH TYR A 926 4.796 -9.574 2.157 1.00 0.00 H new ATOM 192 N GLU A 927 7.056 -2.834 -3.765 1.00 0.00 N ATOM 193 CA GLU A 927 7.796 -1.652 -4.174 1.00 0.00 C ATOM 194 C GLU A 927 6.857 -0.449 -4.284 1.00 0.00 C ATOM 195 O GLU A 927 6.938 0.481 -3.483 1.00 0.00 O ATOM 196 CB GLU A 927 8.533 -1.896 -5.493 1.00 0.00 C ATOM 197 CG GLU A 927 10.048 -1.832 -5.295 1.00 0.00 C ATOM 198 CD GLU A 927 10.573 -3.123 -4.662 1.00 0.00 C ATOM 199 OE1 GLU A 927 10.210 -3.369 -3.492 1.00 0.00 O ATOM 200 OE2 GLU A 927 11.325 -3.834 -5.363 1.00 0.00 O ATOM 0 H GLU A 927 6.885 -3.509 -4.510 1.00 0.00 H new ATOM 0 HA GLU A 927 8.545 -1.434 -3.412 1.00 0.00 H new ATOM 0 HB2 GLU A 927 8.256 -2.871 -5.893 1.00 0.00 H new ATOM 0 HB3 GLU A 927 8.227 -1.151 -6.228 1.00 0.00 H new ATOM 0 HG2 GLU A 927 10.537 -1.668 -6.255 1.00 0.00 H new ATOM 0 HG3 GLU A 927 10.300 -0.983 -4.660 1.00 0.00 H new ATOM 207 N ASN A 928 5.989 -0.506 -5.283 1.00 0.00 N ATOM 208 CA ASN A 928 5.036 0.567 -5.509 1.00 0.00 C ATOM 209 C ASN A 928 4.476 1.036 -4.164 1.00 0.00 C ATOM 210 O ASN A 928 4.386 2.237 -3.910 1.00 0.00 O ATOM 211 CB ASN A 928 3.863 0.091 -6.368 1.00 0.00 C ATOM 212 CG ASN A 928 4.361 -0.610 -7.634 1.00 0.00 C ATOM 213 OD1 ASN A 928 5.446 -0.355 -8.130 1.00 0.00 O ATOM 214 ND2 ASN A 928 3.509 -1.505 -8.128 1.00 0.00 N ATOM 0 H ASN A 928 5.926 -1.279 -5.945 1.00 0.00 H new ATOM 0 HA ASN A 928 5.555 1.376 -6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 928 3.239 -0.592 -5.792 1.00 0.00 H new ATOM 0 HB3 ASN A 928 3.238 0.942 -6.641 1.00 0.00 H new ATOM 0 HD21 ASN A 928 3.749 -2.026 -8.972 1.00 0.00 H new ATOM 0 HD22 ASN A 928 2.616 -1.670 -7.663 1.00 0.00 H new ATOM 221 N VAL A 929 4.114 0.066 -3.339 1.00 0.00 N ATOM 222 CA VAL A 929 3.565 0.365 -2.027 1.00 0.00 C ATOM 223 C VAL A 929 4.510 1.315 -1.288 1.00 0.00 C ATOM 224 O VAL A 929 4.106 2.402 -0.877 1.00 0.00 O ATOM 225 CB VAL A 929 3.304 -0.933 -1.260 1.00 0.00 C ATOM 226 CG1 VAL A 929 2.962 -0.647 0.203 1.00 0.00 C ATOM 227 CG2 VAL A 929 2.201 -1.754 -1.931 1.00 0.00 C ATOM 0 H VAL A 929 4.190 -0.928 -3.553 1.00 0.00 H new ATOM 0 HA VAL A 929 2.604 0.870 -2.122 1.00 0.00 H new ATOM 0 HB VAL A 929 4.220 -1.523 -1.280 1.00 0.00 H new ATOM 0 HG11 VAL A 929 2.781 -1.587 0.725 1.00 0.00 H new ATOM 0 HG12 VAL A 929 3.793 -0.124 0.675 1.00 0.00 H new ATOM 0 HG13 VAL A 929 2.067 -0.026 0.253 1.00 0.00 H new ATOM 0 HG21 VAL A 929 2.035 -2.671 -1.366 1.00 0.00 H new ATOM 0 HG22 VAL A 929 1.279 -1.172 -1.957 1.00 0.00 H new ATOM 0 HG23 VAL A 929 2.501 -2.004 -2.949 1.00 0.00 H new ATOM 237 N THR A 930 5.750 0.871 -1.142 1.00 0.00 N ATOM 238 CA THR A 930 6.755 1.669 -0.461 1.00 0.00 C ATOM 239 C THR A 930 7.092 2.916 -1.281 1.00 0.00 C ATOM 240 O THR A 930 6.902 4.039 -0.816 1.00 0.00 O ATOM 241 CB THR A 930 7.965 0.773 -0.190 1.00 0.00 C ATOM 242 OG1 THR A 930 8.031 -0.076 -1.332 1.00 0.00 O ATOM 243 CG2 THR A 930 7.733 -0.188 0.977 1.00 0.00 C ATOM 0 H THR A 930 6.081 -0.031 -1.484 1.00 0.00 H new ATOM 0 HA THR A 930 6.386 2.039 0.496 1.00 0.00 H new ATOM 0 HB THR A 930 8.836 1.394 0.020 1.00 0.00 H new ATOM 0 HG1 THR A 930 7.582 -0.924 -1.135 1.00 0.00 H new ATOM 0 HG21 THR A 930 8.622 -0.800 1.126 1.00 0.00 H new ATOM 0 HG22 THR A 930 7.529 0.383 1.883 1.00 0.00 H new ATOM 0 HG23 THR A 930 6.882 -0.832 0.754 1.00 0.00 H new ATOM 251 N GLY A 931 7.587 2.676 -2.486 1.00 0.00 N ATOM 252 CA GLY A 931 7.953 3.766 -3.375 1.00 0.00 C ATOM 253 C GLY A 931 6.976 4.935 -3.240 1.00 0.00 C ATOM 254 O GLY A 931 7.393 6.083 -3.092 1.00 0.00 O ATOM 0 H GLY A 931 7.743 1.743 -2.868 1.00 0.00 H new ATOM 0 HA2 GLY A 931 8.964 4.104 -3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 931 7.962 3.412 -4.406 1.00 0.00 H new ATOM 258 N LEU A 932 5.695 4.603 -3.296 1.00 0.00 N ATOM 259 CA LEU A 932 4.655 5.612 -3.182 1.00 0.00 C ATOM 260 C LEU A 932 4.594 6.114 -1.738 1.00 0.00 C ATOM 261 O LEU A 932 4.606 7.320 -1.495 1.00 0.00 O ATOM 262 CB LEU A 932 3.322 5.068 -3.700 1.00 0.00 C ATOM 263 CG LEU A 932 2.305 4.655 -2.633 1.00 0.00 C ATOM 264 CD1 LEU A 932 1.838 5.867 -1.823 1.00 0.00 C ATOM 265 CD2 LEU A 932 1.132 3.897 -3.258 1.00 0.00 C ATOM 0 H LEU A 932 5.353 3.650 -3.419 1.00 0.00 H new ATOM 0 HA LEU A 932 4.888 6.472 -3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 932 2.865 5.827 -4.335 1.00 0.00 H new ATOM 0 HB3 LEU A 932 3.526 4.204 -4.333 1.00 0.00 H new ATOM 0 HG LEU A 932 2.796 3.973 -1.939 1.00 0.00 H new ATOM 0 HD11 LEU A 932 1.116 5.546 -1.072 1.00 0.00 H new ATOM 0 HD12 LEU A 932 2.694 6.327 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU A 932 1.370 6.592 -2.489 1.00 0.00 H new ATOM 0 HD21 LEU A 932 0.424 3.615 -2.478 1.00 0.00 H new ATOM 0 HD22 LEU A 932 0.633 4.535 -3.987 1.00 0.00 H new ATOM 0 HD23 LEU A 932 1.502 3.000 -3.754 1.00 0.00 H new ATOM 277 N VAL A 933 4.530 5.164 -0.816 1.00 0.00 N ATOM 278 CA VAL A 933 4.467 5.496 0.597 1.00 0.00 C ATOM 279 C VAL A 933 5.592 6.475 0.937 1.00 0.00 C ATOM 280 O VAL A 933 5.386 7.426 1.689 1.00 0.00 O ATOM 281 CB VAL A 933 4.513 4.217 1.436 1.00 0.00 C ATOM 282 CG1 VAL A 933 5.288 4.443 2.736 1.00 0.00 C ATOM 283 CG2 VAL A 933 3.103 3.698 1.722 1.00 0.00 C ATOM 0 H VAL A 933 4.520 4.165 -1.020 1.00 0.00 H new ATOM 0 HA VAL A 933 3.524 5.990 0.832 1.00 0.00 H new ATOM 0 HB VAL A 933 5.039 3.456 0.859 1.00 0.00 H new ATOM 0 HG11 VAL A 933 5.306 3.519 3.314 1.00 0.00 H new ATOM 0 HG12 VAL A 933 6.309 4.745 2.503 1.00 0.00 H new ATOM 0 HG13 VAL A 933 4.802 5.226 3.318 1.00 0.00 H new ATOM 0 HG21 VAL A 933 3.164 2.789 2.320 1.00 0.00 H new ATOM 0 HG22 VAL A 933 2.541 4.455 2.269 1.00 0.00 H new ATOM 0 HG23 VAL A 933 2.598 3.480 0.781 1.00 0.00 H new ATOM 293 N LYS A 934 6.758 6.209 0.366 1.00 0.00 N ATOM 294 CA LYS A 934 7.916 7.055 0.600 1.00 0.00 C ATOM 295 C LYS A 934 7.618 8.470 0.098 1.00 0.00 C ATOM 296 O LYS A 934 7.855 9.447 0.806 1.00 0.00 O ATOM 297 CB LYS A 934 9.168 6.433 -0.021 1.00 0.00 C ATOM 298 CG LYS A 934 9.431 5.040 0.554 1.00 0.00 C ATOM 299 CD LYS A 934 10.921 4.836 0.836 1.00 0.00 C ATOM 300 CE LYS A 934 11.156 3.561 1.648 1.00 0.00 C ATOM 301 NZ LYS A 934 12.588 3.187 1.624 1.00 0.00 N ATOM 0 H LYS A 934 6.925 5.420 -0.258 1.00 0.00 H new ATOM 0 HA LYS A 934 8.123 7.132 1.667 1.00 0.00 H new ATOM 0 HB2 LYS A 934 9.048 6.367 -1.102 1.00 0.00 H new ATOM 0 HB3 LYS A 934 10.028 7.076 0.165 1.00 0.00 H new ATOM 0 HG2 LYS A 934 8.862 4.909 1.474 1.00 0.00 H new ATOM 0 HG3 LYS A 934 9.083 4.281 -0.147 1.00 0.00 H new ATOM 0 HD2 LYS A 934 11.468 4.778 -0.105 1.00 0.00 H new ATOM 0 HD3 LYS A 934 11.313 5.695 1.380 1.00 0.00 H new ATOM 0 HE2 LYS A 934 10.831 3.713 2.677 1.00 0.00 H new ATOM 0 HE3 LYS A 934 10.555 2.748 1.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 12.730 2.320 2.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 12.887 3.021 0.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 13.155 3.957 2.033 1.00 0.00 H new ATOM 315 N ALA A 935 7.103 8.534 -1.122 1.00 0.00 N ATOM 316 CA ALA A 935 6.771 9.812 -1.727 1.00 0.00 C ATOM 317 C ALA A 935 5.738 10.531 -0.856 1.00 0.00 C ATOM 318 O ALA A 935 5.896 11.711 -0.545 1.00 0.00 O ATOM 319 CB ALA A 935 6.272 9.587 -3.156 1.00 0.00 C ATOM 0 H ALA A 935 6.908 7.721 -1.707 1.00 0.00 H new ATOM 0 HA ALA A 935 7.654 10.449 -1.786 1.00 0.00 H new ATOM 0 HB1 ALA A 935 6.023 10.546 -3.610 1.00 0.00 H new ATOM 0 HB2 ALA A 935 7.052 9.100 -3.741 1.00 0.00 H new ATOM 0 HB3 ALA A 935 5.385 8.954 -3.136 1.00 0.00 H new ATOM 325 N VAL A 936 4.704 9.790 -0.487 1.00 0.00 N ATOM 326 CA VAL A 936 3.646 10.342 0.342 1.00 0.00 C ATOM 327 C VAL A 936 4.258 11.275 1.389 1.00 0.00 C ATOM 328 O VAL A 936 3.782 12.393 1.582 1.00 0.00 O ATOM 329 CB VAL A 936 2.821 9.210 0.960 1.00 0.00 C ATOM 330 CG1 VAL A 936 2.207 9.644 2.292 1.00 0.00 C ATOM 331 CG2 VAL A 936 1.741 8.727 -0.010 1.00 0.00 C ATOM 0 H VAL A 936 4.576 8.812 -0.747 1.00 0.00 H new ATOM 0 HA VAL A 936 2.959 10.936 -0.261 1.00 0.00 H new ATOM 0 HB VAL A 936 3.493 8.374 1.157 1.00 0.00 H new ATOM 0 HG11 VAL A 936 1.626 8.822 2.710 1.00 0.00 H new ATOM 0 HG12 VAL A 936 3.001 9.917 2.987 1.00 0.00 H new ATOM 0 HG13 VAL A 936 1.556 10.503 2.130 1.00 0.00 H new ATOM 0 HG21 VAL A 936 1.169 7.923 0.453 1.00 0.00 H new ATOM 0 HG22 VAL A 936 1.073 9.554 -0.252 1.00 0.00 H new ATOM 0 HG23 VAL A 936 2.210 8.360 -0.923 1.00 0.00 H new ATOM 341 N ILE A 937 5.303 10.782 2.036 1.00 0.00 N ATOM 342 CA ILE A 937 5.985 11.557 3.058 1.00 0.00 C ATOM 343 C ILE A 937 7.003 12.487 2.392 1.00 0.00 C ATOM 344 O ILE A 937 6.893 13.708 2.494 1.00 0.00 O ATOM 345 CB ILE A 937 6.595 10.634 4.114 1.00 0.00 C ATOM 346 CG1 ILE A 937 5.511 10.046 5.020 1.00 0.00 C ATOM 347 CG2 ILE A 937 7.681 11.357 4.913 1.00 0.00 C ATOM 348 CD1 ILE A 937 5.142 8.627 4.584 1.00 0.00 C ATOM 0 H ILE A 937 5.695 9.854 1.872 1.00 0.00 H new ATOM 0 HA ILE A 937 5.276 12.189 3.593 1.00 0.00 H new ATOM 0 HB ILE A 937 7.074 9.799 3.603 1.00 0.00 H new ATOM 0 HG12 ILE A 937 5.862 10.033 6.052 1.00 0.00 H new ATOM 0 HG13 ILE A 937 4.625 10.681 4.992 1.00 0.00 H new ATOM 0 HG21 ILE A 937 8.098 10.678 5.657 1.00 0.00 H new ATOM 0 HG22 ILE A 937 8.471 11.686 4.238 1.00 0.00 H new ATOM 0 HG23 ILE A 937 7.248 12.223 5.414 1.00 0.00 H new ATOM 0 HD11 ILE A 937 4.370 8.233 5.244 1.00 0.00 H new ATOM 0 HD12 ILE A 937 4.769 8.646 3.560 1.00 0.00 H new ATOM 0 HD13 ILE A 937 6.024 7.989 4.636 1.00 0.00 H new ATOM 360 N GLU A 938 7.970 11.873 1.726 1.00 0.00 N ATOM 361 CA GLU A 938 9.005 12.630 1.044 1.00 0.00 C ATOM 362 C GLU A 938 8.437 13.947 0.511 1.00 0.00 C ATOM 363 O GLU A 938 9.010 15.011 0.738 1.00 0.00 O ATOM 364 CB GLU A 938 9.633 11.808 -0.084 1.00 0.00 C ATOM 365 CG GLU A 938 11.158 11.931 -0.069 1.00 0.00 C ATOM 366 CD GLU A 938 11.808 10.635 0.419 1.00 0.00 C ATOM 367 OE1 GLU A 938 11.694 9.631 -0.317 1.00 0.00 O ATOM 368 OE2 GLU A 938 12.405 10.678 1.516 1.00 0.00 O ATOM 0 H GLU A 938 8.058 10.860 1.644 1.00 0.00 H new ATOM 0 HA GLU A 938 9.791 12.861 1.763 1.00 0.00 H new ATOM 0 HB2 GLU A 938 9.348 10.761 0.022 1.00 0.00 H new ATOM 0 HB3 GLU A 938 9.247 12.148 -1.045 1.00 0.00 H new ATOM 0 HG2 GLU A 938 11.517 12.167 -1.071 1.00 0.00 H new ATOM 0 HG3 GLU A 938 11.453 12.756 0.579 1.00 0.00 H new ATOM 375 N MET A 939 7.317 13.832 -0.187 1.00 0.00 N ATOM 376 CA MET A 939 6.665 15.000 -0.754 1.00 0.00 C ATOM 377 C MET A 939 6.613 16.144 0.260 1.00 0.00 C ATOM 378 O MET A 939 7.296 17.154 0.097 1.00 0.00 O ATOM 379 CB MET A 939 5.243 14.633 -1.184 1.00 0.00 C ATOM 380 CG MET A 939 4.406 15.888 -1.437 1.00 0.00 C ATOM 381 SD MET A 939 3.241 15.589 -2.756 1.00 0.00 S ATOM 382 CE MET A 939 2.810 13.892 -2.410 1.00 0.00 C ATOM 0 H MET A 939 6.844 12.947 -0.373 1.00 0.00 H new ATOM 0 HA MET A 939 7.241 15.331 -1.618 1.00 0.00 H new ATOM 0 HB2 MET A 939 5.278 14.026 -2.089 1.00 0.00 H new ATOM 0 HB3 MET A 939 4.771 14.026 -0.411 1.00 0.00 H new ATOM 0 HG2 MET A 939 3.874 16.170 -0.528 1.00 0.00 H new ATOM 0 HG3 MET A 939 5.057 16.723 -1.698 1.00 0.00 H new ATOM 0 HE1 MET A 939 1.828 13.673 -2.830 1.00 0.00 H new ATOM 0 HE2 MET A 939 3.551 13.230 -2.857 1.00 0.00 H new ATOM 0 HE3 MET A 939 2.787 13.735 -1.332 1.00 0.00 H new ATOM 392 N SER A 940 5.796 15.949 1.284 1.00 0.00 N ATOM 393 CA SER A 940 5.646 16.952 2.324 1.00 0.00 C ATOM 394 C SER A 940 7.000 17.593 2.632 1.00 0.00 C ATOM 395 O SER A 940 7.076 18.790 2.907 1.00 0.00 O ATOM 396 CB SER A 940 5.046 16.344 3.593 1.00 0.00 C ATOM 397 OG SER A 940 3.894 17.058 4.034 1.00 0.00 O ATOM 0 H SER A 940 5.230 15.110 1.416 1.00 0.00 H new ATOM 0 HA SER A 940 4.962 17.720 1.963 1.00 0.00 H new ATOM 0 HB2 SER A 940 4.778 15.304 3.405 1.00 0.00 H new ATOM 0 HB3 SER A 940 5.796 16.342 4.384 1.00 0.00 H new ATOM 0 HG SER A 940 3.114 16.466 4.012 1.00 0.00 H new ATOM 403 N SER A 941 8.036 16.769 2.575 1.00 0.00 N ATOM 404 CA SER A 941 9.383 17.241 2.844 1.00 0.00 C ATOM 405 C SER A 941 9.770 18.324 1.835 1.00 0.00 C ATOM 406 O SER A 941 10.230 19.399 2.219 1.00 0.00 O ATOM 407 CB SER A 941 10.390 16.090 2.798 1.00 0.00 C ATOM 408 OG SER A 941 9.835 14.876 3.298 1.00 0.00 O ATOM 0 H SER A 941 7.969 15.777 2.346 1.00 0.00 H new ATOM 0 HA SER A 941 9.402 17.665 3.848 1.00 0.00 H new ATOM 0 HB2 SER A 941 10.723 15.941 1.771 1.00 0.00 H new ATOM 0 HB3 SER A 941 11.270 16.355 3.384 1.00 0.00 H new ATOM 0 HG SER A 941 10.546 14.209 3.401 1.00 0.00 H new ATOM 414 N LYS A 942 9.568 18.005 0.566 1.00 0.00 N ATOM 415 CA LYS A 942 9.890 18.937 -0.501 1.00 0.00 C ATOM 416 C LYS A 942 8.594 19.504 -1.085 1.00 0.00 C ATOM 417 O LYS A 942 8.544 19.864 -2.260 1.00 0.00 O ATOM 418 CB LYS A 942 10.794 18.271 -1.541 1.00 0.00 C ATOM 419 CG LYS A 942 9.993 17.324 -2.437 1.00 0.00 C ATOM 420 CD LYS A 942 10.123 17.720 -3.909 1.00 0.00 C ATOM 421 CE LYS A 942 8.778 17.606 -4.628 1.00 0.00 C ATOM 422 NZ LYS A 942 8.827 18.301 -5.934 1.00 0.00 N ATOM 0 H LYS A 942 9.185 17.113 0.252 1.00 0.00 H new ATOM 0 HA LYS A 942 10.460 19.780 -0.111 1.00 0.00 H new ATOM 0 HB2 LYS A 942 11.276 19.035 -2.152 1.00 0.00 H new ATOM 0 HB3 LYS A 942 11.587 17.718 -1.038 1.00 0.00 H new ATOM 0 HG2 LYS A 942 10.346 16.302 -2.299 1.00 0.00 H new ATOM 0 HG3 LYS A 942 8.943 17.341 -2.144 1.00 0.00 H new ATOM 0 HD2 LYS A 942 10.493 18.742 -3.983 1.00 0.00 H new ATOM 0 HD3 LYS A 942 10.856 17.079 -4.398 1.00 0.00 H new ATOM 0 HE2 LYS A 942 8.527 16.556 -4.778 1.00 0.00 H new ATOM 0 HE3 LYS A 942 7.991 18.037 -4.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 7.877 18.647 -6.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 9.484 19.105 -5.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 9.155 17.640 -6.667 1.00 0.00 H new ATOM 436 N ILE A 943 7.577 19.564 -0.238 1.00 0.00 N ATOM 437 CA ILE A 943 6.285 20.080 -0.656 1.00 0.00 C ATOM 438 C ILE A 943 6.207 21.573 -0.329 1.00 0.00 C ATOM 439 O ILE A 943 5.886 22.386 -1.195 1.00 0.00 O ATOM 440 CB ILE A 943 5.154 19.256 -0.038 1.00 0.00 C ATOM 441 CG1 ILE A 943 4.025 19.031 -1.047 1.00 0.00 C ATOM 442 CG2 ILE A 943 4.647 19.901 1.254 1.00 0.00 C ATOM 443 CD1 ILE A 943 3.261 20.329 -1.313 1.00 0.00 C ATOM 0 H ILE A 943 7.622 19.264 0.736 1.00 0.00 H new ATOM 0 HA ILE A 943 6.167 19.983 -1.735 1.00 0.00 H new ATOM 0 HB ILE A 943 5.551 18.276 0.226 1.00 0.00 H new ATOM 0 HG12 ILE A 943 4.438 18.650 -1.981 1.00 0.00 H new ATOM 0 HG13 ILE A 943 3.340 18.273 -0.668 1.00 0.00 H new ATOM 0 HG21 ILE A 943 3.843 19.295 1.672 1.00 0.00 H new ATOM 0 HG22 ILE A 943 5.464 19.967 1.973 1.00 0.00 H new ATOM 0 HG23 ILE A 943 4.272 20.902 1.038 1.00 0.00 H new ATOM 0 HD11 ILE A 943 2.465 20.141 -2.033 1.00 0.00 H new ATOM 0 HD12 ILE A 943 2.829 20.694 -0.381 1.00 0.00 H new ATOM 0 HD13 ILE A 943 3.944 21.078 -1.714 1.00 0.00 H new ATOM 455 N GLN A 944 6.507 21.889 0.922 1.00 0.00 N ATOM 456 CA GLN A 944 6.475 23.270 1.373 1.00 0.00 C ATOM 457 C GLN A 944 7.179 24.176 0.361 1.00 0.00 C ATOM 458 O GLN A 944 6.621 25.183 -0.070 1.00 0.00 O ATOM 459 CB GLN A 944 7.103 23.407 2.762 1.00 0.00 C ATOM 460 CG GLN A 944 6.054 23.811 3.800 1.00 0.00 C ATOM 461 CD GLN A 944 6.718 24.318 5.082 1.00 0.00 C ATOM 462 OE1 GLN A 944 7.426 23.601 5.770 1.00 0.00 O ATOM 463 NE2 GLN A 944 6.451 25.590 5.363 1.00 0.00 N ATOM 0 H GLN A 944 6.773 21.213 1.637 1.00 0.00 H new ATOM 0 HA GLN A 944 5.434 23.583 1.448 1.00 0.00 H new ATOM 0 HB2 GLN A 944 7.562 22.462 3.052 1.00 0.00 H new ATOM 0 HB3 GLN A 944 7.898 24.152 2.734 1.00 0.00 H new ATOM 0 HG2 GLN A 944 5.410 24.588 3.388 1.00 0.00 H new ATOM 0 HG3 GLN A 944 5.417 22.957 4.030 1.00 0.00 H new ATOM 0 HE21 GLN A 944 5.850 26.134 4.744 1.00 0.00 H new ATOM 0 HE22 GLN A 944 6.847 26.022 6.198 1.00 0.00 H new ATOM 472 N PRO A 945 8.428 23.774 0.002 1.00 0.00 N ATOM 473 CA PRO A 945 9.215 24.538 -0.951 1.00 0.00 C ATOM 474 C PRO A 945 8.700 24.331 -2.377 1.00 0.00 C ATOM 475 O PRO A 945 8.499 25.295 -3.115 1.00 0.00 O ATOM 476 CB PRO A 945 10.643 24.055 -0.759 1.00 0.00 C ATOM 477 CG PRO A 945 10.539 22.719 -0.042 1.00 0.00 C ATOM 478 CD PRO A 945 9.122 22.586 0.492 1.00 0.00 C ATOM 0 HA PRO A 945 9.147 25.613 -0.787 1.00 0.00 H new ATOM 0 HB2 PRO A 945 11.150 23.945 -1.718 1.00 0.00 H new ATOM 0 HB3 PRO A 945 11.221 24.769 -0.172 1.00 0.00 H new ATOM 0 HG2 PRO A 945 10.768 21.901 -0.724 1.00 0.00 H new ATOM 0 HG3 PRO A 945 11.261 22.666 0.773 1.00 0.00 H new ATOM 0 HD2 PRO A 945 8.647 21.673 0.132 1.00 0.00 H new ATOM 0 HD3 PRO A 945 9.112 22.542 1.581 1.00 0.00 H new ATOM 486 N ALA A 946 8.502 23.067 -2.723 1.00 0.00 N ATOM 487 CA ALA A 946 8.015 22.721 -4.048 1.00 0.00 C ATOM 488 C ALA A 946 7.044 23.802 -4.527 1.00 0.00 C ATOM 489 O ALA A 946 6.125 24.182 -3.803 1.00 0.00 O ATOM 490 CB ALA A 946 7.371 21.334 -4.009 1.00 0.00 C ATOM 0 H ALA A 946 8.670 22.270 -2.109 1.00 0.00 H new ATOM 0 HA ALA A 946 8.838 22.678 -4.761 1.00 0.00 H new ATOM 0 HB1 ALA A 946 7.006 21.074 -5.003 1.00 0.00 H new ATOM 0 HB2 ALA A 946 8.110 20.599 -3.690 1.00 0.00 H new ATOM 0 HB3 ALA A 946 6.538 21.339 -3.306 1.00 0.00 H new ATOM 496 N PRO A 947 7.286 24.279 -5.778 1.00 0.00 N ATOM 497 CA PRO A 947 6.444 25.308 -6.363 1.00 0.00 C ATOM 498 C PRO A 947 5.099 24.729 -6.807 1.00 0.00 C ATOM 499 O PRO A 947 4.877 23.523 -6.714 1.00 0.00 O ATOM 500 CB PRO A 947 7.257 25.873 -7.516 1.00 0.00 C ATOM 501 CG PRO A 947 8.322 24.833 -7.824 1.00 0.00 C ATOM 502 CD PRO A 947 8.365 23.852 -6.664 1.00 0.00 C ATOM 0 HA PRO A 947 6.185 26.094 -5.653 1.00 0.00 H new ATOM 0 HB2 PRO A 947 6.626 26.056 -8.386 1.00 0.00 H new ATOM 0 HB3 PRO A 947 7.709 26.827 -7.244 1.00 0.00 H new ATOM 0 HG2 PRO A 947 8.091 24.314 -8.754 1.00 0.00 H new ATOM 0 HG3 PRO A 947 9.293 25.309 -7.957 1.00 0.00 H new ATOM 0 HD2 PRO A 947 8.215 22.828 -7.006 1.00 0.00 H new ATOM 0 HD3 PRO A 947 9.329 23.881 -6.156 1.00 0.00 H new ATOM 510 N PRO A 948 4.214 25.640 -7.293 1.00 0.00 N ATOM 511 CA PRO A 948 2.897 25.232 -7.752 1.00 0.00 C ATOM 512 C PRO A 948 2.981 24.536 -9.112 1.00 0.00 C ATOM 513 O PRO A 948 2.023 23.900 -9.548 1.00 0.00 O ATOM 514 CB PRO A 948 2.079 26.513 -7.789 1.00 0.00 C ATOM 515 CG PRO A 948 3.087 27.650 -7.799 1.00 0.00 C ATOM 516 CD PRO A 948 4.442 27.076 -7.418 1.00 0.00 C ATOM 0 HA PRO A 948 2.432 24.497 -7.095 1.00 0.00 H new ATOM 0 HB2 PRO A 948 1.444 26.546 -8.675 1.00 0.00 H new ATOM 0 HB3 PRO A 948 1.421 26.582 -6.923 1.00 0.00 H new ATOM 0 HG2 PRO A 948 3.132 28.112 -8.785 1.00 0.00 H new ATOM 0 HG3 PRO A 948 2.791 28.429 -7.096 1.00 0.00 H new ATOM 0 HD2 PRO A 948 5.192 27.293 -8.178 1.00 0.00 H new ATOM 0 HD3 PRO A 948 4.804 27.502 -6.482 1.00 0.00 H new ATOM 524 N GLU A 949 4.136 24.681 -9.744 1.00 0.00 N ATOM 525 CA GLU A 949 4.358 24.074 -11.046 1.00 0.00 C ATOM 526 C GLU A 949 4.919 22.660 -10.884 1.00 0.00 C ATOM 527 O GLU A 949 4.788 21.830 -11.782 1.00 0.00 O ATOM 528 CB GLU A 949 5.288 24.938 -11.902 1.00 0.00 C ATOM 529 CG GLU A 949 4.522 25.589 -13.055 1.00 0.00 C ATOM 530 CD GLU A 949 5.484 26.224 -14.062 1.00 0.00 C ATOM 531 OE1 GLU A 949 5.824 27.408 -13.853 1.00 0.00 O ATOM 532 OE2 GLU A 949 5.858 25.509 -15.017 1.00 0.00 O ATOM 0 H GLU A 949 4.928 25.210 -9.379 1.00 0.00 H new ATOM 0 HA GLU A 949 3.400 24.007 -11.562 1.00 0.00 H new ATOM 0 HB2 GLU A 949 5.746 25.710 -11.283 1.00 0.00 H new ATOM 0 HB3 GLU A 949 6.098 24.325 -12.298 1.00 0.00 H new ATOM 0 HG2 GLU A 949 3.907 24.841 -13.556 1.00 0.00 H new ATOM 0 HG3 GLU A 949 3.845 26.349 -12.664 1.00 0.00 H new ATOM 539 N GLU A 950 5.531 22.428 -9.732 1.00 0.00 N ATOM 540 CA GLU A 950 6.111 21.129 -9.441 1.00 0.00 C ATOM 541 C GLU A 950 5.219 20.355 -8.468 1.00 0.00 C ATOM 542 O GLU A 950 5.488 19.194 -8.164 1.00 0.00 O ATOM 543 CB GLU A 950 7.530 21.274 -8.886 1.00 0.00 C ATOM 544 CG GLU A 950 8.526 20.451 -9.707 1.00 0.00 C ATOM 545 CD GLU A 950 8.857 21.149 -11.027 1.00 0.00 C ATOM 546 OE1 GLU A 950 9.795 21.975 -11.013 1.00 0.00 O ATOM 547 OE2 GLU A 950 8.164 20.842 -12.021 1.00 0.00 O ATOM 0 H GLU A 950 5.638 23.119 -8.989 1.00 0.00 H new ATOM 0 HA GLU A 950 6.175 20.565 -10.372 1.00 0.00 H new ATOM 0 HB2 GLU A 950 7.823 22.324 -8.897 1.00 0.00 H new ATOM 0 HB3 GLU A 950 7.553 20.948 -7.846 1.00 0.00 H new ATOM 0 HG2 GLU A 950 9.440 20.300 -9.132 1.00 0.00 H new ATOM 0 HG3 GLU A 950 8.109 19.464 -9.908 1.00 0.00 H new ATOM 554 N TYR A 951 4.176 21.029 -8.008 1.00 0.00 N ATOM 555 CA TYR A 951 3.242 20.419 -7.076 1.00 0.00 C ATOM 556 C TYR A 951 2.050 19.807 -7.815 1.00 0.00 C ATOM 557 O TYR A 951 1.596 18.717 -7.473 1.00 0.00 O ATOM 558 CB TYR A 951 2.743 21.552 -6.177 1.00 0.00 C ATOM 559 CG TYR A 951 1.863 21.083 -5.017 1.00 0.00 C ATOM 560 CD1 TYR A 951 2.167 19.915 -4.348 1.00 0.00 C ATOM 561 CD2 TYR A 951 0.764 21.829 -4.639 1.00 0.00 C ATOM 562 CE1 TYR A 951 1.338 19.474 -3.256 1.00 0.00 C ATOM 563 CE2 TYR A 951 -0.064 21.388 -3.547 1.00 0.00 C ATOM 564 CZ TYR A 951 0.264 20.232 -2.909 1.00 0.00 C ATOM 565 OH TYR A 951 -0.519 19.816 -1.878 1.00 0.00 O ATOM 0 H TYR A 951 3.956 21.992 -8.263 1.00 0.00 H new ATOM 0 HA TYR A 951 3.727 19.622 -6.513 1.00 0.00 H new ATOM 0 HB2 TYR A 951 3.602 22.088 -5.774 1.00 0.00 H new ATOM 0 HB3 TYR A 951 2.180 22.262 -6.783 1.00 0.00 H new ATOM 0 HD1 TYR A 951 3.027 19.332 -4.643 1.00 0.00 H new ATOM 0 HD2 TYR A 951 0.526 22.743 -5.163 1.00 0.00 H new ATOM 0 HE1 TYR A 951 1.564 18.561 -2.725 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -0.926 21.962 -3.241 1.00 0.00 H new ATOM 0 HH TYR A 951 -0.651 20.555 -1.249 1.00 0.00 H new ATOM 575 N VAL A 952 1.578 20.537 -8.815 1.00 0.00 N ATOM 576 CA VAL A 952 0.448 20.079 -9.606 1.00 0.00 C ATOM 577 C VAL A 952 0.708 18.648 -10.080 1.00 0.00 C ATOM 578 O VAL A 952 -0.163 17.786 -9.971 1.00 0.00 O ATOM 579 CB VAL A 952 0.187 21.053 -10.757 1.00 0.00 C ATOM 580 CG1 VAL A 952 -0.262 20.306 -12.015 1.00 0.00 C ATOM 581 CG2 VAL A 952 -0.838 22.115 -10.355 1.00 0.00 C ATOM 0 H VAL A 952 1.957 21.442 -9.095 1.00 0.00 H new ATOM 0 HA VAL A 952 -0.459 20.060 -9.002 1.00 0.00 H new ATOM 0 HB VAL A 952 1.124 21.561 -10.985 1.00 0.00 H new ATOM 0 HG11 VAL A 952 -0.441 21.021 -12.818 1.00 0.00 H new ATOM 0 HG12 VAL A 952 0.516 19.606 -12.319 1.00 0.00 H new ATOM 0 HG13 VAL A 952 -1.181 19.759 -11.805 1.00 0.00 H new ATOM 0 HG21 VAL A 952 -1.005 22.794 -11.191 1.00 0.00 H new ATOM 0 HG22 VAL A 952 -1.777 21.631 -10.087 1.00 0.00 H new ATOM 0 HG23 VAL A 952 -0.463 22.677 -9.500 1.00 0.00 H new ATOM 591 N PRO A 953 1.942 18.434 -10.609 1.00 0.00 N ATOM 592 CA PRO A 953 2.328 17.122 -11.101 1.00 0.00 C ATOM 593 C PRO A 953 2.621 16.167 -9.942 1.00 0.00 C ATOM 594 O PRO A 953 2.085 15.061 -9.893 1.00 0.00 O ATOM 595 CB PRO A 953 3.539 17.373 -11.984 1.00 0.00 C ATOM 596 CG PRO A 953 4.067 18.742 -11.588 1.00 0.00 C ATOM 597 CD PRO A 953 2.999 19.431 -10.754 1.00 0.00 C ATOM 0 HA PRO A 953 1.534 16.635 -11.667 1.00 0.00 H new ATOM 0 HB2 PRO A 953 4.297 16.604 -11.835 1.00 0.00 H new ATOM 0 HB3 PRO A 953 3.265 17.350 -13.039 1.00 0.00 H new ATOM 0 HG2 PRO A 953 4.992 18.644 -11.019 1.00 0.00 H new ATOM 0 HG3 PRO A 953 4.299 19.333 -12.474 1.00 0.00 H new ATOM 0 HD2 PRO A 953 3.390 19.737 -9.784 1.00 0.00 H new ATOM 0 HD3 PRO A 953 2.630 20.330 -11.247 1.00 0.00 H new ATOM 605 N MET A 954 3.472 16.629 -9.037 1.00 0.00 N ATOM 606 CA MET A 954 3.843 15.830 -7.882 1.00 0.00 C ATOM 607 C MET A 954 2.662 14.986 -7.397 1.00 0.00 C ATOM 608 O MET A 954 2.701 13.759 -7.471 1.00 0.00 O ATOM 609 CB MET A 954 4.310 16.751 -6.752 1.00 0.00 C ATOM 610 CG MET A 954 5.759 16.450 -6.364 1.00 0.00 C ATOM 611 SD MET A 954 5.946 16.535 -4.591 1.00 0.00 S ATOM 612 CE MET A 954 5.198 18.125 -4.276 1.00 0.00 C ATOM 0 H MET A 954 3.915 17.547 -9.081 1.00 0.00 H new ATOM 0 HA MET A 954 4.651 15.158 -8.173 1.00 0.00 H new ATOM 0 HB2 MET A 954 4.222 17.791 -7.066 1.00 0.00 H new ATOM 0 HB3 MET A 954 3.663 16.624 -5.884 1.00 0.00 H new ATOM 0 HG2 MET A 954 6.041 15.460 -6.721 1.00 0.00 H new ATOM 0 HG3 MET A 954 6.428 17.164 -6.843 1.00 0.00 H new ATOM 0 HE1 MET A 954 5.722 18.618 -3.457 1.00 0.00 H new ATOM 0 HE2 MET A 954 5.264 18.742 -5.172 1.00 0.00 H new ATOM 0 HE3 MET A 954 4.151 17.987 -4.006 1.00 0.00 H new ATOM 622 N VAL A 955 1.642 15.677 -6.912 1.00 0.00 N ATOM 623 CA VAL A 955 0.452 15.006 -6.415 1.00 0.00 C ATOM 624 C VAL A 955 -0.102 14.087 -7.505 1.00 0.00 C ATOM 625 O VAL A 955 -0.338 12.904 -7.263 1.00 0.00 O ATOM 626 CB VAL A 955 -0.567 16.039 -5.929 1.00 0.00 C ATOM 627 CG1 VAL A 955 -1.988 15.634 -6.322 1.00 0.00 C ATOM 628 CG2 VAL A 955 -0.455 16.250 -4.418 1.00 0.00 C ATOM 0 H VAL A 955 1.614 16.695 -6.852 1.00 0.00 H new ATOM 0 HA VAL A 955 0.696 14.381 -5.556 1.00 0.00 H new ATOM 0 HB VAL A 955 -0.342 16.987 -6.417 1.00 0.00 H new ATOM 0 HG11 VAL A 955 -2.692 16.385 -5.965 1.00 0.00 H new ATOM 0 HG12 VAL A 955 -2.058 15.558 -7.407 1.00 0.00 H new ATOM 0 HG13 VAL A 955 -2.228 14.669 -5.875 1.00 0.00 H new ATOM 0 HG21 VAL A 955 -1.190 16.989 -4.098 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.641 15.307 -3.904 1.00 0.00 H new ATOM 0 HG23 VAL A 955 0.546 16.605 -4.173 1.00 0.00 H new ATOM 638 N LYS A 956 -0.294 14.665 -8.681 1.00 0.00 N ATOM 639 CA LYS A 956 -0.816 13.912 -9.809 1.00 0.00 C ATOM 640 C LYS A 956 -0.058 12.588 -9.927 1.00 0.00 C ATOM 641 O LYS A 956 -0.617 11.587 -10.374 1.00 0.00 O ATOM 642 CB LYS A 956 -0.777 14.759 -11.083 1.00 0.00 C ATOM 643 CG LYS A 956 -2.155 14.818 -11.744 1.00 0.00 C ATOM 644 CD LYS A 956 -2.666 16.259 -11.819 1.00 0.00 C ATOM 645 CE LYS A 956 -2.485 16.832 -13.226 1.00 0.00 C ATOM 646 NZ LYS A 956 -3.760 17.392 -13.726 1.00 0.00 N ATOM 0 H LYS A 956 -0.097 15.646 -8.878 1.00 0.00 H new ATOM 0 HA LYS A 956 -1.866 13.666 -9.650 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.441 15.768 -10.843 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -0.053 14.339 -11.781 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -2.099 14.395 -12.747 1.00 0.00 H new ATOM 0 HG3 LYS A 956 -2.860 14.207 -11.179 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -3.720 16.290 -11.543 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -2.130 16.877 -11.099 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -1.720 17.609 -13.213 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -2.135 16.051 -13.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -3.619 17.777 -14.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -4.480 16.642 -13.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -4.078 18.151 -13.091 1.00 0.00 H new ATOM 660 N GLU A 957 1.202 12.625 -9.519 1.00 0.00 N ATOM 661 CA GLU A 957 2.041 11.441 -9.574 1.00 0.00 C ATOM 662 C GLU A 957 1.508 10.368 -8.622 1.00 0.00 C ATOM 663 O GLU A 957 1.343 9.213 -9.013 1.00 0.00 O ATOM 664 CB GLU A 957 3.497 11.785 -9.252 1.00 0.00 C ATOM 665 CG GLU A 957 4.459 10.932 -10.082 1.00 0.00 C ATOM 666 CD GLU A 957 4.848 9.657 -9.331 1.00 0.00 C ATOM 667 OE1 GLU A 957 3.939 9.062 -8.714 1.00 0.00 O ATOM 668 OE2 GLU A 957 6.047 9.307 -9.390 1.00 0.00 O ATOM 0 H GLU A 957 1.662 13.457 -9.149 1.00 0.00 H new ATOM 0 HA GLU A 957 2.011 11.046 -10.589 1.00 0.00 H new ATOM 0 HB2 GLU A 957 3.677 12.841 -9.452 1.00 0.00 H new ATOM 0 HB3 GLU A 957 3.686 11.624 -8.191 1.00 0.00 H new ATOM 0 HG2 GLU A 957 3.992 10.671 -11.032 1.00 0.00 H new ATOM 0 HG3 GLU A 957 5.354 11.509 -10.315 1.00 0.00 H new ATOM 675 N VAL A 958 1.254 10.787 -7.392 1.00 0.00 N ATOM 676 CA VAL A 958 0.743 9.877 -6.381 1.00 0.00 C ATOM 677 C VAL A 958 -0.412 9.064 -6.970 1.00 0.00 C ATOM 678 O VAL A 958 -0.466 7.846 -6.806 1.00 0.00 O ATOM 679 CB VAL A 958 0.346 10.657 -5.126 1.00 0.00 C ATOM 680 CG1 VAL A 958 -0.734 9.913 -4.338 1.00 0.00 C ATOM 681 CG2 VAL A 958 1.566 10.943 -4.249 1.00 0.00 C ATOM 0 H VAL A 958 1.393 11.745 -7.072 1.00 0.00 H new ATOM 0 HA VAL A 958 1.516 9.171 -6.077 1.00 0.00 H new ATOM 0 HB VAL A 958 -0.069 11.614 -5.443 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.998 10.488 -3.451 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -1.617 9.784 -4.964 1.00 0.00 H new ATOM 0 HG13 VAL A 958 -0.357 8.936 -4.037 1.00 0.00 H new ATOM 0 HG21 VAL A 958 1.256 11.498 -3.364 1.00 0.00 H new ATOM 0 HG22 VAL A 958 2.024 10.002 -3.945 1.00 0.00 H new ATOM 0 HG23 VAL A 958 2.289 11.533 -4.812 1.00 0.00 H new ATOM 691 N GLY A 959 -1.307 9.770 -7.645 1.00 0.00 N ATOM 692 CA GLY A 959 -2.457 9.130 -8.260 1.00 0.00 C ATOM 693 C GLY A 959 -2.019 8.048 -9.249 1.00 0.00 C ATOM 694 O GLY A 959 -2.594 6.961 -9.281 1.00 0.00 O ATOM 0 H GLY A 959 -1.259 10.780 -7.780 1.00 0.00 H new ATOM 0 HA2 GLY A 959 -3.088 8.689 -7.488 1.00 0.00 H new ATOM 0 HA3 GLY A 959 -3.060 9.877 -8.776 1.00 0.00 H new ATOM 698 N LEU A 960 -1.004 8.384 -10.032 1.00 0.00 N ATOM 699 CA LEU A 960 -0.482 7.454 -11.020 1.00 0.00 C ATOM 700 C LEU A 960 0.029 6.198 -10.312 1.00 0.00 C ATOM 701 O LEU A 960 -0.421 5.091 -10.604 1.00 0.00 O ATOM 702 CB LEU A 960 0.571 8.138 -11.894 1.00 0.00 C ATOM 703 CG LEU A 960 0.274 8.177 -13.395 1.00 0.00 C ATOM 704 CD1 LEU A 960 0.715 9.509 -14.006 1.00 0.00 C ATOM 705 CD2 LEU A 960 0.904 6.981 -14.110 1.00 0.00 C ATOM 0 H LEU A 960 -0.529 9.286 -10.003 1.00 0.00 H new ATOM 0 HA LEU A 960 -1.272 7.137 -11.701 1.00 0.00 H new ATOM 0 HB2 LEU A 960 0.697 9.162 -11.542 1.00 0.00 H new ATOM 0 HB3 LEU A 960 1.524 7.630 -11.745 1.00 0.00 H new ATOM 0 HG LEU A 960 -0.805 8.101 -13.532 1.00 0.00 H new ATOM 0 HD11 LEU A 960 0.493 9.511 -15.073 1.00 0.00 H new ATOM 0 HD12 LEU A 960 0.180 10.326 -13.522 1.00 0.00 H new ATOM 0 HD13 LEU A 960 1.787 9.640 -13.858 1.00 0.00 H new ATOM 0 HD21 LEU A 960 0.678 7.033 -15.175 1.00 0.00 H new ATOM 0 HD22 LEU A 960 1.984 7.000 -13.967 1.00 0.00 H new ATOM 0 HD23 LEU A 960 0.500 6.056 -13.698 1.00 0.00 H new ATOM 717 N ALA A 961 0.961 6.411 -9.394 1.00 0.00 N ATOM 718 CA ALA A 961 1.537 5.310 -8.643 1.00 0.00 C ATOM 719 C ALA A 961 0.412 4.426 -8.099 1.00 0.00 C ATOM 720 O ALA A 961 0.463 3.203 -8.225 1.00 0.00 O ATOM 721 CB ALA A 961 2.433 5.862 -7.532 1.00 0.00 C ATOM 0 H ALA A 961 1.331 7.331 -9.154 1.00 0.00 H new ATOM 0 HA ALA A 961 2.161 4.691 -9.288 1.00 0.00 H new ATOM 0 HB1 ALA A 961 2.865 5.035 -6.968 1.00 0.00 H new ATOM 0 HB2 ALA A 961 3.232 6.458 -7.972 1.00 0.00 H new ATOM 0 HB3 ALA A 961 1.841 6.486 -6.863 1.00 0.00 H new ATOM 727 N LEU A 962 -0.576 5.079 -7.505 1.00 0.00 N ATOM 728 CA LEU A 962 -1.711 4.368 -6.941 1.00 0.00 C ATOM 729 C LEU A 962 -2.376 3.529 -8.034 1.00 0.00 C ATOM 730 O LEU A 962 -2.583 2.329 -7.861 1.00 0.00 O ATOM 731 CB LEU A 962 -2.664 5.344 -6.249 1.00 0.00 C ATOM 732 CG LEU A 962 -2.860 5.137 -4.745 1.00 0.00 C ATOM 733 CD1 LEU A 962 -3.242 3.689 -4.436 1.00 0.00 C ATOM 734 CD2 LEU A 962 -1.621 5.582 -3.965 1.00 0.00 C ATOM 0 H LEU A 962 -0.614 6.093 -7.402 1.00 0.00 H new ATOM 0 HA LEU A 962 -1.381 3.677 -6.165 1.00 0.00 H new ATOM 0 HB2 LEU A 962 -2.296 6.357 -6.411 1.00 0.00 H new ATOM 0 HB3 LEU A 962 -3.637 5.277 -6.735 1.00 0.00 H new ATOM 0 HG LEU A 962 -3.689 5.765 -4.419 1.00 0.00 H new ATOM 0 HD11 LEU A 962 -3.375 3.569 -3.361 1.00 0.00 H new ATOM 0 HD12 LEU A 962 -4.173 3.441 -4.947 1.00 0.00 H new ATOM 0 HD13 LEU A 962 -2.451 3.023 -4.780 1.00 0.00 H new ATOM 0 HD21 LEU A 962 -1.786 5.425 -2.899 1.00 0.00 H new ATOM 0 HD22 LEU A 962 -0.759 4.999 -4.289 1.00 0.00 H new ATOM 0 HD23 LEU A 962 -1.435 6.640 -4.151 1.00 0.00 H new ATOM 746 N ARG A 963 -2.691 4.195 -9.136 1.00 0.00 N ATOM 747 CA ARG A 963 -3.329 3.526 -10.257 1.00 0.00 C ATOM 748 C ARG A 963 -2.593 2.225 -10.588 1.00 0.00 C ATOM 749 O ARG A 963 -3.200 1.156 -10.623 1.00 0.00 O ATOM 750 CB ARG A 963 -3.346 4.423 -11.497 1.00 0.00 C ATOM 751 CG ARG A 963 -4.511 4.060 -12.420 1.00 0.00 C ATOM 752 CD ARG A 963 -5.442 5.257 -12.623 1.00 0.00 C ATOM 753 NE ARG A 963 -4.971 6.079 -13.760 1.00 0.00 N ATOM 754 CZ ARG A 963 -5.578 7.196 -14.181 1.00 0.00 C ATOM 755 NH1 ARG A 963 -6.684 7.632 -13.563 1.00 0.00 N ATOM 756 NH2 ARG A 963 -5.078 7.878 -15.221 1.00 0.00 N ATOM 0 H ARG A 963 -2.516 5.190 -9.276 1.00 0.00 H new ATOM 0 HA ARG A 963 -4.356 3.304 -9.969 1.00 0.00 H new ATOM 0 HB2 ARG A 963 -3.429 5.467 -11.194 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -2.404 4.321 -12.037 1.00 0.00 H new ATOM 0 HG2 ARG A 963 -4.126 3.726 -13.384 1.00 0.00 H new ATOM 0 HG3 ARG A 963 -5.071 3.227 -11.995 1.00 0.00 H new ATOM 0 HD2 ARG A 963 -6.458 4.910 -12.811 1.00 0.00 H new ATOM 0 HD3 ARG A 963 -5.474 5.861 -11.716 1.00 0.00 H new ATOM 0 HE ARG A 963 -4.132 5.776 -14.254 1.00 0.00 H new ATOM 0 HH11 ARG A 963 -7.064 7.113 -12.771 1.00 0.00 H new ATOM 0 HH12 ARG A 963 -7.146 8.483 -13.884 1.00 0.00 H new ATOM 0 HH21 ARG A 963 -4.236 7.546 -15.691 1.00 0.00 H new ATOM 0 HH22 ARG A 963 -5.540 8.729 -15.542 1.00 0.00 H new ATOM 770 N THR A 964 -1.296 2.360 -10.821 1.00 0.00 N ATOM 771 CA THR A 964 -0.471 1.209 -11.147 1.00 0.00 C ATOM 772 C THR A 964 -0.468 0.210 -9.988 1.00 0.00 C ATOM 773 O THR A 964 -0.565 -0.997 -10.205 1.00 0.00 O ATOM 774 CB THR A 964 0.924 1.716 -11.515 1.00 0.00 C ATOM 775 OG1 THR A 964 0.742 2.344 -12.782 1.00 0.00 O ATOM 776 CG2 THR A 964 1.905 0.577 -11.802 1.00 0.00 C ATOM 0 H THR A 964 -0.796 3.249 -10.791 1.00 0.00 H new ATOM 0 HA THR A 964 -0.871 0.665 -12.003 1.00 0.00 H new ATOM 0 HB THR A 964 1.311 2.333 -10.704 1.00 0.00 H new ATOM 0 HG1 THR A 964 1.598 2.703 -13.095 1.00 0.00 H new ATOM 0 HG21 THR A 964 2.880 0.992 -12.058 1.00 0.00 H new ATOM 0 HG22 THR A 964 2.000 -0.053 -10.918 1.00 0.00 H new ATOM 0 HG23 THR A 964 1.535 -0.021 -12.635 1.00 0.00 H new ATOM 784 N LEU A 965 -0.355 0.749 -8.784 1.00 0.00 N ATOM 785 CA LEU A 965 -0.337 -0.080 -7.591 1.00 0.00 C ATOM 786 C LEU A 965 -1.510 -1.061 -7.640 1.00 0.00 C ATOM 787 O LEU A 965 -1.334 -2.256 -7.408 1.00 0.00 O ATOM 788 CB LEU A 965 -0.317 0.791 -6.333 1.00 0.00 C ATOM 789 CG LEU A 965 -0.807 0.123 -5.047 1.00 0.00 C ATOM 790 CD1 LEU A 965 -0.019 0.624 -3.834 1.00 0.00 C ATOM 791 CD2 LEU A 965 -2.315 0.315 -4.869 1.00 0.00 C ATOM 0 H LEU A 965 -0.275 1.751 -8.608 1.00 0.00 H new ATOM 0 HA LEU A 965 0.576 -0.674 -7.554 1.00 0.00 H new ATOM 0 HB2 LEU A 965 0.703 1.139 -6.172 1.00 0.00 H new ATOM 0 HB3 LEU A 965 -0.930 1.674 -6.517 1.00 0.00 H new ATOM 0 HG LEU A 965 -0.626 -0.949 -5.129 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -0.387 0.133 -2.933 1.00 0.00 H new ATOM 0 HD12 LEU A 965 1.038 0.394 -3.966 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -0.146 1.702 -3.738 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -2.637 -0.170 -3.947 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -2.543 1.380 -4.818 1.00 0.00 H new ATOM 0 HD23 LEU A 965 -2.841 -0.128 -5.715 1.00 0.00 H new ATOM 803 N LEU A 966 -2.681 -0.520 -7.944 1.00 0.00 N ATOM 804 CA LEU A 966 -3.882 -1.333 -8.026 1.00 0.00 C ATOM 805 C LEU A 966 -3.624 -2.524 -8.952 1.00 0.00 C ATOM 806 O LEU A 966 -3.718 -3.675 -8.530 1.00 0.00 O ATOM 807 CB LEU A 966 -5.080 -0.478 -8.443 1.00 0.00 C ATOM 808 CG LEU A 966 -5.768 0.304 -7.322 1.00 0.00 C ATOM 809 CD1 LEU A 966 -5.225 1.731 -7.236 1.00 0.00 C ATOM 810 CD2 LEU A 966 -7.289 0.278 -7.489 1.00 0.00 C ATOM 0 H LEU A 966 -2.823 0.472 -8.136 1.00 0.00 H new ATOM 0 HA LEU A 966 -4.135 -1.739 -7.047 1.00 0.00 H new ATOM 0 HB2 LEU A 966 -4.749 0.230 -9.203 1.00 0.00 H new ATOM 0 HB3 LEU A 966 -5.819 -1.127 -8.913 1.00 0.00 H new ATOM 0 HG LEU A 966 -5.540 -0.185 -6.375 1.00 0.00 H new ATOM 0 HD11 LEU A 966 -5.731 2.265 -6.431 1.00 0.00 H new ATOM 0 HD12 LEU A 966 -4.154 1.701 -7.035 1.00 0.00 H new ATOM 0 HD13 LEU A 966 -5.403 2.245 -8.180 1.00 0.00 H new ATOM 0 HD21 LEU A 966 -7.754 0.841 -6.679 1.00 0.00 H new ATOM 0 HD22 LEU A 966 -7.558 0.728 -8.445 1.00 0.00 H new ATOM 0 HD23 LEU A 966 -7.640 -0.753 -7.462 1.00 0.00 H new ATOM 822 N ALA A 967 -3.305 -2.205 -10.198 1.00 0.00 N ATOM 823 CA ALA A 967 -3.033 -3.234 -11.188 1.00 0.00 C ATOM 824 C ALA A 967 -2.011 -4.222 -10.622 1.00 0.00 C ATOM 825 O ALA A 967 -2.278 -5.421 -10.547 1.00 0.00 O ATOM 826 CB ALA A 967 -2.554 -2.580 -12.485 1.00 0.00 C ATOM 0 H ALA A 967 -3.229 -1.249 -10.545 1.00 0.00 H new ATOM 0 HA ALA A 967 -3.940 -3.793 -11.420 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -2.350 -3.351 -13.228 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -3.327 -1.909 -12.861 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.644 -2.013 -12.292 1.00 0.00 H new ATOM 832 N THR A 968 -0.863 -3.683 -10.238 1.00 0.00 N ATOM 833 CA THR A 968 0.199 -4.503 -9.681 1.00 0.00 C ATOM 834 C THR A 968 -0.334 -5.357 -8.529 1.00 0.00 C ATOM 835 O THR A 968 0.031 -6.524 -8.395 1.00 0.00 O ATOM 836 CB THR A 968 1.345 -3.577 -9.270 1.00 0.00 C ATOM 837 OG1 THR A 968 1.602 -2.803 -10.439 1.00 0.00 O ATOM 838 CG2 THR A 968 2.653 -4.334 -9.030 1.00 0.00 C ATOM 0 H THR A 968 -0.645 -2.689 -10.302 1.00 0.00 H new ATOM 0 HA THR A 968 0.580 -5.209 -10.418 1.00 0.00 H new ATOM 0 HB THR A 968 1.067 -3.036 -8.365 1.00 0.00 H new ATOM 0 HG1 THR A 968 1.025 -2.011 -10.440 1.00 0.00 H new ATOM 0 HG21 THR A 968 3.433 -3.630 -8.741 1.00 0.00 H new ATOM 0 HG22 THR A 968 2.510 -5.064 -8.233 1.00 0.00 H new ATOM 0 HG23 THR A 968 2.949 -4.848 -9.944 1.00 0.00 H new ATOM 846 N VAL A 969 -1.190 -4.742 -7.726 1.00 0.00 N ATOM 847 CA VAL A 969 -1.778 -5.431 -6.589 1.00 0.00 C ATOM 848 C VAL A 969 -2.638 -6.593 -7.092 1.00 0.00 C ATOM 849 O VAL A 969 -2.697 -7.645 -6.458 1.00 0.00 O ATOM 850 CB VAL A 969 -2.558 -4.440 -5.723 1.00 0.00 C ATOM 851 CG1 VAL A 969 -3.534 -5.171 -4.798 1.00 0.00 C ATOM 852 CG2 VAL A 969 -1.609 -3.546 -4.922 1.00 0.00 C ATOM 0 H VAL A 969 -1.491 -3.774 -7.840 1.00 0.00 H new ATOM 0 HA VAL A 969 -1.000 -5.854 -5.954 1.00 0.00 H new ATOM 0 HB VAL A 969 -3.140 -3.801 -6.387 1.00 0.00 H new ATOM 0 HG11 VAL A 969 -4.076 -4.444 -4.193 1.00 0.00 H new ATOM 0 HG12 VAL A 969 -4.242 -5.745 -5.396 1.00 0.00 H new ATOM 0 HG13 VAL A 969 -2.980 -5.846 -4.145 1.00 0.00 H new ATOM 0 HG21 VAL A 969 -2.189 -2.851 -4.315 1.00 0.00 H new ATOM 0 HG22 VAL A 969 -0.988 -4.164 -4.273 1.00 0.00 H new ATOM 0 HG23 VAL A 969 -0.972 -2.986 -5.607 1.00 0.00 H new ATOM 862 N ASP A 970 -3.283 -6.362 -8.225 1.00 0.00 N ATOM 863 CA ASP A 970 -4.137 -7.376 -8.820 1.00 0.00 C ATOM 864 C ASP A 970 -3.353 -8.683 -8.953 1.00 0.00 C ATOM 865 O ASP A 970 -3.891 -9.762 -8.708 1.00 0.00 O ATOM 866 CB ASP A 970 -4.599 -6.957 -10.217 1.00 0.00 C ATOM 867 CG ASP A 970 -5.805 -7.728 -10.758 1.00 0.00 C ATOM 868 OD1 ASP A 970 -6.770 -7.890 -9.980 1.00 0.00 O ATOM 869 OD2 ASP A 970 -5.735 -8.138 -11.936 1.00 0.00 O ATOM 0 H ASP A 970 -3.232 -5.487 -8.747 1.00 0.00 H new ATOM 0 HA ASP A 970 -5.007 -7.504 -8.176 1.00 0.00 H new ATOM 0 HB2 ASP A 970 -4.844 -5.895 -10.199 1.00 0.00 H new ATOM 0 HB3 ASP A 970 -3.767 -7.080 -10.911 1.00 0.00 H new ATOM 874 N GLU A 971 -2.094 -8.543 -9.342 1.00 0.00 N ATOM 875 CA GLU A 971 -1.230 -9.699 -9.511 1.00 0.00 C ATOM 876 C GLU A 971 -0.860 -10.289 -8.149 1.00 0.00 C ATOM 877 O GLU A 971 -0.471 -11.453 -8.057 1.00 0.00 O ATOM 878 CB GLU A 971 0.023 -9.336 -10.310 1.00 0.00 C ATOM 879 CG GLU A 971 -0.290 -9.230 -11.803 1.00 0.00 C ATOM 880 CD GLU A 971 0.921 -9.634 -12.647 1.00 0.00 C ATOM 881 OE1 GLU A 971 2.026 -9.151 -12.320 1.00 0.00 O ATOM 882 OE2 GLU A 971 0.713 -10.415 -13.600 1.00 0.00 O ATOM 0 H GLU A 971 -1.652 -7.647 -9.545 1.00 0.00 H new ATOM 0 HA GLU A 971 -1.775 -10.455 -10.077 1.00 0.00 H new ATOM 0 HB2 GLU A 971 0.426 -8.389 -9.951 1.00 0.00 H new ATOM 0 HB3 GLU A 971 0.793 -10.091 -10.149 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.138 -9.870 -12.047 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -0.582 -8.208 -12.045 1.00 0.00 H new ATOM 889 N SER A 972 -0.995 -9.460 -7.124 1.00 0.00 N ATOM 890 CA SER A 972 -0.680 -9.885 -5.771 1.00 0.00 C ATOM 891 C SER A 972 -1.888 -10.586 -5.148 1.00 0.00 C ATOM 892 O SER A 972 -1.732 -11.477 -4.314 1.00 0.00 O ATOM 893 CB SER A 972 -0.251 -8.698 -4.907 1.00 0.00 C ATOM 894 OG SER A 972 0.896 -8.999 -4.117 1.00 0.00 O ATOM 0 H SER A 972 -1.318 -8.496 -7.204 1.00 0.00 H new ATOM 0 HA SER A 972 0.154 -10.586 -5.818 1.00 0.00 H new ATOM 0 HB2 SER A 972 -0.036 -7.843 -5.547 1.00 0.00 H new ATOM 0 HB3 SER A 972 -1.075 -8.408 -4.254 1.00 0.00 H new ATOM 0 HG SER A 972 0.868 -8.478 -3.288 1.00 0.00 H new ATOM 900 N LEU A 973 -3.067 -10.156 -5.575 1.00 0.00 N ATOM 901 CA LEU A 973 -4.301 -10.732 -5.069 1.00 0.00 C ATOM 902 C LEU A 973 -4.131 -12.245 -4.920 1.00 0.00 C ATOM 903 O LEU A 973 -4.409 -12.803 -3.860 1.00 0.00 O ATOM 904 CB LEU A 973 -5.482 -10.330 -5.956 1.00 0.00 C ATOM 905 CG LEU A 973 -6.589 -9.523 -5.275 1.00 0.00 C ATOM 906 CD1 LEU A 973 -7.970 -9.967 -5.760 1.00 0.00 C ATOM 907 CD2 LEU A 973 -6.464 -9.599 -3.752 1.00 0.00 C ATOM 0 H LEU A 973 -3.193 -9.416 -6.265 1.00 0.00 H new ATOM 0 HA LEU A 973 -4.527 -10.338 -4.078 1.00 0.00 H new ATOM 0 HB2 LEU A 973 -5.099 -9.748 -6.795 1.00 0.00 H new ATOM 0 HB3 LEU A 973 -5.923 -11.236 -6.372 1.00 0.00 H new ATOM 0 HG LEU A 973 -6.471 -8.477 -5.556 1.00 0.00 H new ATOM 0 HD11 LEU A 973 -8.738 -9.377 -5.260 1.00 0.00 H new ATOM 0 HD12 LEU A 973 -8.042 -9.818 -6.837 1.00 0.00 H new ATOM 0 HD13 LEU A 973 -8.115 -11.022 -5.529 1.00 0.00 H new ATOM 0 HD21 LEU A 973 -7.263 -9.017 -3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 973 -6.541 -10.638 -3.432 1.00 0.00 H new ATOM 0 HD23 LEU A 973 -5.499 -9.196 -3.446 1.00 0.00 H new ATOM 919 N PRO A 974 -3.661 -12.882 -6.026 1.00 0.00 N ATOM 920 CA PRO A 974 -3.450 -14.319 -6.028 1.00 0.00 C ATOM 921 C PRO A 974 -2.193 -14.690 -5.239 1.00 0.00 C ATOM 922 O PRO A 974 -2.152 -15.728 -4.580 1.00 0.00 O ATOM 923 CB PRO A 974 -3.363 -14.702 -7.497 1.00 0.00 C ATOM 924 CG PRO A 974 -3.064 -13.414 -8.246 1.00 0.00 C ATOM 925 CD PRO A 974 -3.320 -12.253 -7.299 1.00 0.00 C ATOM 0 HA PRO A 974 -4.256 -14.863 -5.535 1.00 0.00 H new ATOM 0 HB2 PRO A 974 -2.579 -15.441 -7.662 1.00 0.00 H new ATOM 0 HB3 PRO A 974 -4.297 -15.146 -7.841 1.00 0.00 H new ATOM 0 HG2 PRO A 974 -2.030 -13.404 -8.591 1.00 0.00 H new ATOM 0 HG3 PRO A 974 -3.696 -13.331 -9.130 1.00 0.00 H new ATOM 0 HD2 PRO A 974 -2.439 -11.618 -7.204 1.00 0.00 H new ATOM 0 HD3 PRO A 974 -4.132 -11.620 -7.658 1.00 0.00 H new ATOM 933 N VAL A 975 -1.197 -13.821 -5.331 1.00 0.00 N ATOM 934 CA VAL A 975 0.058 -14.044 -4.633 1.00 0.00 C ATOM 935 C VAL A 975 -0.232 -14.441 -3.185 1.00 0.00 C ATOM 936 O VAL A 975 0.562 -15.141 -2.558 1.00 0.00 O ATOM 937 CB VAL A 975 0.947 -12.804 -4.746 1.00 0.00 C ATOM 938 CG1 VAL A 975 2.099 -12.861 -3.741 1.00 0.00 C ATOM 939 CG2 VAL A 975 1.472 -12.634 -6.173 1.00 0.00 C ATOM 0 H VAL A 975 -1.234 -12.961 -5.878 1.00 0.00 H new ATOM 0 HA VAL A 975 0.609 -14.866 -5.091 1.00 0.00 H new ATOM 0 HB VAL A 975 0.338 -11.932 -4.507 1.00 0.00 H new ATOM 0 HG11 VAL A 975 2.715 -11.968 -3.843 1.00 0.00 H new ATOM 0 HG12 VAL A 975 1.697 -12.911 -2.729 1.00 0.00 H new ATOM 0 HG13 VAL A 975 2.707 -13.745 -3.934 1.00 0.00 H new ATOM 0 HG21 VAL A 975 2.101 -11.745 -6.226 1.00 0.00 H new ATOM 0 HG22 VAL A 975 2.057 -13.510 -6.452 1.00 0.00 H new ATOM 0 HG23 VAL A 975 0.632 -12.525 -6.859 1.00 0.00 H new ATOM 949 N LEU A 976 -1.373 -13.977 -2.694 1.00 0.00 N ATOM 950 CA LEU A 976 -1.778 -14.276 -1.331 1.00 0.00 C ATOM 951 C LEU A 976 -2.970 -15.234 -1.356 1.00 0.00 C ATOM 952 O LEU A 976 -3.676 -15.326 -2.359 1.00 0.00 O ATOM 953 CB LEU A 976 -2.043 -12.983 -0.556 1.00 0.00 C ATOM 954 CG LEU A 976 -0.910 -11.955 -0.559 1.00 0.00 C ATOM 955 CD1 LEU A 976 0.428 -12.613 -0.216 1.00 0.00 C ATOM 956 CD2 LEU A 976 -0.855 -11.204 -1.890 1.00 0.00 C ATOM 0 H LEU A 976 -2.029 -13.396 -3.216 1.00 0.00 H new ATOM 0 HA LEU A 976 -0.974 -14.782 -0.796 1.00 0.00 H new ATOM 0 HB2 LEU A 976 -2.935 -12.512 -0.968 1.00 0.00 H new ATOM 0 HB3 LEU A 976 -2.269 -13.243 0.478 1.00 0.00 H new ATOM 0 HG LEU A 976 -1.115 -11.218 0.218 1.00 0.00 H new ATOM 0 HD11 LEU A 976 1.216 -11.860 -0.225 1.00 0.00 H new ATOM 0 HD12 LEU A 976 0.368 -13.064 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 976 0.654 -13.384 -0.953 1.00 0.00 H new ATOM 0 HD21 LEU A 976 -0.041 -10.479 -1.866 1.00 0.00 H new ATOM 0 HD22 LEU A 976 -0.686 -11.913 -2.701 1.00 0.00 H new ATOM 0 HD23 LEU A 976 -1.799 -10.684 -2.054 1.00 0.00 H new ATOM 968 N PRO A 977 -3.164 -15.940 -0.210 1.00 0.00 N ATOM 969 CA PRO A 977 -4.259 -16.888 -0.092 1.00 0.00 C ATOM 970 C PRO A 977 -5.594 -16.163 0.089 1.00 0.00 C ATOM 971 O PRO A 977 -5.691 -14.963 -0.161 1.00 0.00 O ATOM 972 CB PRO A 977 -3.893 -17.765 1.095 1.00 0.00 C ATOM 973 CG PRO A 977 -2.847 -16.990 1.879 1.00 0.00 C ATOM 974 CD PRO A 977 -2.348 -15.857 0.998 1.00 0.00 C ATOM 0 HA PRO A 977 -4.393 -17.491 -0.990 1.00 0.00 H new ATOM 0 HB2 PRO A 977 -4.768 -17.973 1.711 1.00 0.00 H new ATOM 0 HB3 PRO A 977 -3.500 -18.726 0.764 1.00 0.00 H new ATOM 0 HG2 PRO A 977 -3.275 -16.596 2.801 1.00 0.00 H new ATOM 0 HG3 PRO A 977 -2.022 -17.643 2.164 1.00 0.00 H new ATOM 0 HD2 PRO A 977 -2.466 -14.891 1.490 1.00 0.00 H new ATOM 0 HD3 PRO A 977 -1.288 -15.971 0.769 1.00 0.00 H new ATOM 982 N ALA A 978 -6.589 -16.923 0.523 1.00 0.00 N ATOM 983 CA ALA A 978 -7.914 -16.368 0.740 1.00 0.00 C ATOM 984 C ALA A 978 -7.899 -15.500 2.000 1.00 0.00 C ATOM 985 O ALA A 978 -6.891 -15.437 2.702 1.00 0.00 O ATOM 986 CB ALA A 978 -8.936 -17.504 0.827 1.00 0.00 C ATOM 0 H ALA A 978 -6.504 -17.918 0.730 1.00 0.00 H new ATOM 0 HA ALA A 978 -8.204 -15.731 -0.096 1.00 0.00 H new ATOM 0 HB1 ALA A 978 -9.930 -17.087 0.990 1.00 0.00 H new ATOM 0 HB2 ALA A 978 -8.929 -18.072 -0.103 1.00 0.00 H new ATOM 0 HB3 ALA A 978 -8.678 -18.163 1.656 1.00 0.00 H new ATOM 992 N SER A 979 -9.028 -14.852 2.248 1.00 0.00 N ATOM 993 CA SER A 979 -9.157 -13.991 3.411 1.00 0.00 C ATOM 994 C SER A 979 -8.204 -12.800 3.289 1.00 0.00 C ATOM 995 O SER A 979 -7.848 -12.180 4.289 1.00 0.00 O ATOM 996 CB SER A 979 -8.878 -14.764 4.702 1.00 0.00 C ATOM 997 OG SER A 979 -9.891 -14.552 5.681 1.00 0.00 O ATOM 0 H SER A 979 -9.862 -14.906 1.663 1.00 0.00 H new ATOM 0 HA SER A 979 -10.183 -13.624 3.453 1.00 0.00 H new ATOM 0 HB2 SER A 979 -8.807 -15.829 4.479 1.00 0.00 H new ATOM 0 HB3 SER A 979 -7.913 -14.458 5.107 1.00 0.00 H new ATOM 0 HG SER A 979 -9.677 -15.064 6.489 1.00 0.00 H new ATOM 1003 N THR A 980 -7.818 -12.517 2.053 1.00 0.00 N ATOM 1004 CA THR A 980 -6.913 -11.411 1.787 1.00 0.00 C ATOM 1005 C THR A 980 -7.619 -10.331 0.965 1.00 0.00 C ATOM 1006 O THR A 980 -7.687 -9.175 1.380 1.00 0.00 O ATOM 1007 CB THR A 980 -5.665 -11.976 1.105 1.00 0.00 C ATOM 1008 OG1 THR A 980 -5.596 -13.322 1.568 1.00 0.00 O ATOM 1009 CG2 THR A 980 -4.375 -11.336 1.624 1.00 0.00 C ATOM 0 H THR A 980 -8.115 -13.034 1.225 1.00 0.00 H new ATOM 0 HA THR A 980 -6.603 -10.922 2.710 1.00 0.00 H new ATOM 0 HB THR A 980 -5.738 -11.823 0.028 1.00 0.00 H new ATOM 0 HG1 THR A 980 -5.145 -13.876 0.897 1.00 0.00 H new ATOM 0 HG21 THR A 980 -3.519 -11.772 1.108 1.00 0.00 H new ATOM 0 HG22 THR A 980 -4.402 -10.262 1.439 1.00 0.00 H new ATOM 0 HG23 THR A 980 -4.284 -11.518 2.695 1.00 0.00 H new ATOM 1017 N HIS A 981 -8.126 -10.746 -0.187 1.00 0.00 N ATOM 1018 CA HIS A 981 -8.823 -9.828 -1.071 1.00 0.00 C ATOM 1019 C HIS A 981 -9.850 -9.025 -0.270 1.00 0.00 C ATOM 1020 O HIS A 981 -10.244 -7.933 -0.677 1.00 0.00 O ATOM 1021 CB HIS A 981 -9.446 -10.578 -2.251 1.00 0.00 C ATOM 1022 CG HIS A 981 -10.018 -11.927 -1.888 1.00 0.00 C ATOM 1023 ND1 HIS A 981 -10.540 -12.798 -2.828 1.00 0.00 N ATOM 1024 CD2 HIS A 981 -10.142 -12.547 -0.679 1.00 0.00 C ATOM 1025 CE1 HIS A 981 -10.958 -13.888 -2.202 1.00 0.00 C ATOM 1026 NE2 HIS A 981 -10.711 -13.731 -0.870 1.00 0.00 N ATOM 0 H HIS A 981 -8.068 -11.705 -0.528 1.00 0.00 H new ATOM 0 HA HIS A 981 -8.114 -9.120 -1.499 1.00 0.00 H new ATOM 0 HB2 HIS A 981 -10.236 -9.964 -2.682 1.00 0.00 H new ATOM 0 HB3 HIS A 981 -8.689 -10.712 -3.024 1.00 0.00 H new ATOM 0 HD2 HIS A 981 -9.830 -12.143 0.273 1.00 0.00 H new ATOM 0 HE1 HIS A 981 -11.415 -14.750 -2.665 1.00 0.00 H new ATOM 0 HE2 HIS A 981 -10.928 -14.411 -0.141 1.00 0.00 H new ATOM 1034 N ARG A 982 -10.255 -9.597 0.854 1.00 0.00 N ATOM 1035 CA ARG A 982 -11.228 -8.948 1.716 1.00 0.00 C ATOM 1036 C ARG A 982 -10.620 -7.700 2.358 1.00 0.00 C ATOM 1037 O ARG A 982 -10.865 -6.582 1.906 1.00 0.00 O ATOM 1038 CB ARG A 982 -11.709 -9.896 2.816 1.00 0.00 C ATOM 1039 CG ARG A 982 -13.126 -10.398 2.527 1.00 0.00 C ATOM 1040 CD ARG A 982 -14.161 -9.610 3.332 1.00 0.00 C ATOM 1041 NE ARG A 982 -15.513 -9.831 2.772 1.00 0.00 N ATOM 1042 CZ ARG A 982 -16.284 -10.887 3.064 1.00 0.00 C ATOM 1043 NH1 ARG A 982 -15.841 -11.826 3.912 1.00 0.00 N ATOM 1044 NH2 ARG A 982 -17.497 -11.005 2.508 1.00 0.00 N ATOM 0 H ARG A 982 -9.927 -10.503 1.188 1.00 0.00 H new ATOM 0 HA ARG A 982 -12.080 -8.664 1.098 1.00 0.00 H new ATOM 0 HB2 ARG A 982 -11.028 -10.744 2.894 1.00 0.00 H new ATOM 0 HB3 ARG A 982 -11.690 -9.383 3.777 1.00 0.00 H new ATOM 0 HG2 ARG A 982 -13.339 -10.303 1.462 1.00 0.00 H new ATOM 0 HG3 ARG A 982 -13.198 -11.457 2.774 1.00 0.00 H new ATOM 0 HD2 ARG A 982 -14.136 -9.921 4.376 1.00 0.00 H new ATOM 0 HD3 ARG A 982 -13.919 -8.548 3.310 1.00 0.00 H new ATOM 0 HE ARG A 982 -15.881 -9.136 2.123 1.00 0.00 H new ATOM 0 HH11 ARG A 982 -14.917 -11.736 4.335 1.00 0.00 H new ATOM 0 HH12 ARG A 982 -16.428 -12.630 4.134 1.00 0.00 H new ATOM 0 HH21 ARG A 982 -17.834 -10.291 1.862 1.00 0.00 H new ATOM 0 HH22 ARG A 982 -18.084 -11.809 2.730 1.00 0.00 H new ATOM 1058 N GLU A 983 -9.838 -7.932 3.403 1.00 0.00 N ATOM 1059 CA GLU A 983 -9.193 -6.840 4.112 1.00 0.00 C ATOM 1060 C GLU A 983 -8.370 -5.990 3.141 1.00 0.00 C ATOM 1061 O GLU A 983 -8.068 -4.832 3.427 1.00 0.00 O ATOM 1062 CB GLU A 983 -8.322 -7.367 5.253 1.00 0.00 C ATOM 1063 CG GLU A 983 -9.180 -7.802 6.443 1.00 0.00 C ATOM 1064 CD GLU A 983 -8.310 -8.122 7.659 1.00 0.00 C ATOM 1065 OE1 GLU A 983 -7.475 -9.044 7.533 1.00 0.00 O ATOM 1066 OE2 GLU A 983 -8.499 -7.438 8.688 1.00 0.00 O ATOM 0 H GLU A 983 -9.637 -8.860 3.775 1.00 0.00 H new ATOM 0 HA GLU A 983 -9.966 -6.209 4.551 1.00 0.00 H new ATOM 0 HB2 GLU A 983 -7.727 -8.210 4.902 1.00 0.00 H new ATOM 0 HB3 GLU A 983 -7.622 -6.593 5.568 1.00 0.00 H new ATOM 0 HG2 GLU A 983 -9.886 -7.011 6.695 1.00 0.00 H new ATOM 0 HG3 GLU A 983 -9.767 -8.679 6.171 1.00 0.00 H new ATOM 1073 N ILE A 984 -8.031 -6.597 2.014 1.00 0.00 N ATOM 1074 CA ILE A 984 -7.249 -5.910 1.000 1.00 0.00 C ATOM 1075 C ILE A 984 -8.132 -4.881 0.291 1.00 0.00 C ATOM 1076 O ILE A 984 -7.676 -3.786 -0.034 1.00 0.00 O ATOM 1077 CB ILE A 984 -6.598 -6.919 0.051 1.00 0.00 C ATOM 1078 CG1 ILE A 984 -5.355 -7.545 0.686 1.00 0.00 C ATOM 1079 CG2 ILE A 984 -6.289 -6.277 -1.303 1.00 0.00 C ATOM 1080 CD1 ILE A 984 -4.428 -8.128 -0.383 1.00 0.00 C ATOM 0 H ILE A 984 -8.283 -7.557 1.780 1.00 0.00 H new ATOM 0 HA ILE A 984 -6.426 -5.362 1.460 1.00 0.00 H new ATOM 0 HB ILE A 984 -7.308 -7.726 -0.130 1.00 0.00 H new ATOM 0 HG12 ILE A 984 -4.820 -6.793 1.265 1.00 0.00 H new ATOM 0 HG13 ILE A 984 -5.653 -8.330 1.381 1.00 0.00 H new ATOM 0 HG21 ILE A 984 -5.827 -7.015 -1.959 1.00 0.00 H new ATOM 0 HG22 ILE A 984 -7.214 -5.918 -1.755 1.00 0.00 H new ATOM 0 HG23 ILE A 984 -5.606 -5.440 -1.161 1.00 0.00 H new ATOM 0 HD11 ILE A 984 -3.552 -8.567 0.095 1.00 0.00 H new ATOM 0 HD12 ILE A 984 -4.958 -8.897 -0.944 1.00 0.00 H new ATOM 0 HD13 ILE A 984 -4.112 -7.336 -1.062 1.00 0.00 H new ATOM 1092 N GLU A 985 -9.380 -5.269 0.074 1.00 0.00 N ATOM 1093 CA GLU A 985 -10.331 -4.393 -0.590 1.00 0.00 C ATOM 1094 C GLU A 985 -10.563 -3.132 0.244 1.00 0.00 C ATOM 1095 O GLU A 985 -10.644 -2.031 -0.298 1.00 0.00 O ATOM 1096 CB GLU A 985 -11.649 -5.121 -0.861 1.00 0.00 C ATOM 1097 CG GLU A 985 -12.290 -4.629 -2.161 1.00 0.00 C ATOM 1098 CD GLU A 985 -13.397 -3.613 -1.876 1.00 0.00 C ATOM 1099 OE1 GLU A 985 -14.548 -4.064 -1.688 1.00 0.00 O ATOM 1100 OE2 GLU A 985 -13.068 -2.407 -1.852 1.00 0.00 O ATOM 0 H GLU A 985 -9.755 -6.178 0.346 1.00 0.00 H new ATOM 0 HA GLU A 985 -9.913 -4.097 -1.552 1.00 0.00 H new ATOM 0 HB2 GLU A 985 -11.470 -6.194 -0.923 1.00 0.00 H new ATOM 0 HB3 GLU A 985 -12.335 -4.960 -0.029 1.00 0.00 H new ATOM 0 HG2 GLU A 985 -11.530 -4.175 -2.796 1.00 0.00 H new ATOM 0 HG3 GLU A 985 -12.701 -5.475 -2.711 1.00 0.00 H new ATOM 1107 N MET A 986 -10.663 -3.334 1.550 1.00 0.00 N ATOM 1108 CA MET A 986 -10.884 -2.227 2.464 1.00 0.00 C ATOM 1109 C MET A 986 -9.615 -1.387 2.625 1.00 0.00 C ATOM 1110 O MET A 986 -9.688 -0.198 2.929 1.00 0.00 O ATOM 1111 CB MET A 986 -11.313 -2.769 3.829 1.00 0.00 C ATOM 1112 CG MET A 986 -12.838 -2.783 3.958 1.00 0.00 C ATOM 1113 SD MET A 986 -13.364 -4.256 4.818 1.00 0.00 S ATOM 1114 CE MET A 986 -13.341 -5.427 3.471 1.00 0.00 C ATOM 0 H MET A 986 -10.595 -4.249 1.997 1.00 0.00 H new ATOM 0 HA MET A 986 -11.668 -1.592 2.052 1.00 0.00 H new ATOM 0 HB2 MET A 986 -10.924 -3.778 3.962 1.00 0.00 H new ATOM 0 HB3 MET A 986 -10.883 -2.154 4.620 1.00 0.00 H new ATOM 0 HG2 MET A 986 -13.174 -1.897 4.498 1.00 0.00 H new ATOM 0 HG3 MET A 986 -13.295 -2.746 2.969 1.00 0.00 H new ATOM 0 HE1 MET A 986 -14.357 -5.761 3.262 1.00 0.00 H new ATOM 0 HE2 MET A 986 -12.926 -4.951 2.583 1.00 0.00 H new ATOM 0 HE3 MET A 986 -12.726 -6.284 3.745 1.00 0.00 H new ATOM 1124 N ALA A 987 -8.481 -2.039 2.413 1.00 0.00 N ATOM 1125 CA ALA A 987 -7.198 -1.368 2.530 1.00 0.00 C ATOM 1126 C ALA A 987 -6.910 -0.598 1.239 1.00 0.00 C ATOM 1127 O ALA A 987 -6.158 0.375 1.247 1.00 0.00 O ATOM 1128 CB ALA A 987 -6.111 -2.395 2.851 1.00 0.00 C ATOM 0 H ALA A 987 -8.424 -3.026 2.161 1.00 0.00 H new ATOM 0 HA ALA A 987 -7.216 -0.647 3.347 1.00 0.00 H new ATOM 0 HB1 ALA A 987 -5.149 -1.891 2.939 1.00 0.00 H new ATOM 0 HB2 ALA A 987 -6.347 -2.893 3.792 1.00 0.00 H new ATOM 0 HB3 ALA A 987 -6.062 -3.135 2.052 1.00 0.00 H new ATOM 1134 N GLN A 988 -7.523 -1.064 0.161 1.00 0.00 N ATOM 1135 CA GLN A 988 -7.341 -0.432 -1.135 1.00 0.00 C ATOM 1136 C GLN A 988 -8.199 0.831 -1.233 1.00 0.00 C ATOM 1137 O GLN A 988 -7.732 1.867 -1.706 1.00 0.00 O ATOM 1138 CB GLN A 988 -7.667 -1.405 -2.270 1.00 0.00 C ATOM 1139 CG GLN A 988 -6.457 -2.280 -2.606 1.00 0.00 C ATOM 1140 CD GLN A 988 -6.044 -2.106 -4.069 1.00 0.00 C ATOM 1141 OE1 GLN A 988 -5.116 -1.386 -4.397 1.00 0.00 O ATOM 1142 NE2 GLN A 988 -6.783 -2.804 -4.926 1.00 0.00 N ATOM 0 H GLN A 988 -8.146 -1.872 0.158 1.00 0.00 H new ATOM 0 HA GLN A 988 -6.294 -0.146 -1.235 1.00 0.00 H new ATOM 0 HB2 GLN A 988 -8.508 -2.036 -1.983 1.00 0.00 H new ATOM 0 HB3 GLN A 988 -7.974 -0.848 -3.155 1.00 0.00 H new ATOM 0 HG2 GLN A 988 -5.623 -2.018 -1.955 1.00 0.00 H new ATOM 0 HG3 GLN A 988 -6.695 -3.326 -2.414 1.00 0.00 H new ATOM 0 HE21 GLN A 988 -7.546 -3.388 -4.584 1.00 0.00 H new ATOM 0 HE22 GLN A 988 -6.587 -2.756 -5.926 1.00 0.00 H new ATOM 1151 N LYS A 989 -9.437 0.705 -0.780 1.00 0.00 N ATOM 1152 CA LYS A 989 -10.363 1.824 -0.811 1.00 0.00 C ATOM 1153 C LYS A 989 -9.834 2.944 0.087 1.00 0.00 C ATOM 1154 O LYS A 989 -9.966 4.122 -0.241 1.00 0.00 O ATOM 1155 CB LYS A 989 -11.776 1.360 -0.449 1.00 0.00 C ATOM 1156 CG LYS A 989 -12.805 1.913 -1.437 1.00 0.00 C ATOM 1157 CD LYS A 989 -14.230 1.667 -0.939 1.00 0.00 C ATOM 1158 CE LYS A 989 -15.121 1.135 -2.064 1.00 0.00 C ATOM 1159 NZ LYS A 989 -15.519 2.233 -2.973 1.00 0.00 N ATOM 0 H LYS A 989 -9.821 -0.155 -0.389 1.00 0.00 H new ATOM 0 HA LYS A 989 -10.435 2.231 -1.819 1.00 0.00 H new ATOM 0 HB2 LYS A 989 -11.816 0.271 -0.449 1.00 0.00 H new ATOM 0 HB3 LYS A 989 -12.023 1.688 0.561 1.00 0.00 H new ATOM 0 HG2 LYS A 989 -12.644 2.982 -1.575 1.00 0.00 H new ATOM 0 HG3 LYS A 989 -12.670 1.442 -2.410 1.00 0.00 H new ATOM 0 HD2 LYS A 989 -14.213 0.953 -0.116 1.00 0.00 H new ATOM 0 HD3 LYS A 989 -14.647 2.595 -0.548 1.00 0.00 H new ATOM 0 HE2 LYS A 989 -14.589 0.366 -2.624 1.00 0.00 H new ATOM 0 HE3 LYS A 989 -16.009 0.665 -1.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 -16.123 1.855 -3.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 -16.045 2.953 -2.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 -14.669 2.663 -3.390 1.00 0.00 H new ATOM 1173 N LEU A 990 -9.246 2.537 1.202 1.00 0.00 N ATOM 1174 CA LEU A 990 -8.696 3.491 2.149 1.00 0.00 C ATOM 1175 C LEU A 990 -7.630 4.338 1.452 1.00 0.00 C ATOM 1176 O LEU A 990 -7.645 5.565 1.550 1.00 0.00 O ATOM 1177 CB LEU A 990 -8.189 2.772 3.401 1.00 0.00 C ATOM 1178 CG LEU A 990 -8.625 3.370 4.741 1.00 0.00 C ATOM 1179 CD1 LEU A 990 -8.339 2.403 5.891 1.00 0.00 C ATOM 1180 CD2 LEU A 990 -7.977 4.738 4.967 1.00 0.00 C ATOM 0 H LEU A 990 -9.139 1.559 1.471 1.00 0.00 H new ATOM 0 HA LEU A 990 -9.471 4.175 2.495 1.00 0.00 H new ATOM 0 HB2 LEU A 990 -8.525 1.736 3.362 1.00 0.00 H new ATOM 0 HB3 LEU A 990 -7.100 2.756 3.370 1.00 0.00 H new ATOM 0 HG LEU A 990 -9.703 3.525 4.712 1.00 0.00 H new ATOM 0 HD11 LEU A 990 -8.658 2.852 6.832 1.00 0.00 H new ATOM 0 HD12 LEU A 990 -8.885 1.473 5.729 1.00 0.00 H new ATOM 0 HD13 LEU A 990 -7.270 2.194 5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 990 -8.303 5.141 5.926 1.00 0.00 H new ATOM 0 HD22 LEU A 990 -6.892 4.631 4.968 1.00 0.00 H new ATOM 0 HD23 LEU A 990 -8.274 5.418 4.168 1.00 0.00 H new ATOM 1192 N LEU A 991 -6.729 3.651 0.765 1.00 0.00 N ATOM 1193 CA LEU A 991 -5.657 4.325 0.052 1.00 0.00 C ATOM 1194 C LEU A 991 -6.257 5.362 -0.899 1.00 0.00 C ATOM 1195 O LEU A 991 -6.059 6.563 -0.719 1.00 0.00 O ATOM 1196 CB LEU A 991 -4.751 3.306 -0.641 1.00 0.00 C ATOM 1197 CG LEU A 991 -3.334 3.780 -0.966 1.00 0.00 C ATOM 1198 CD1 LEU A 991 -2.658 4.376 0.270 1.00 0.00 C ATOM 1199 CD2 LEU A 991 -2.506 2.652 -1.585 1.00 0.00 C ATOM 0 H LEU A 991 -6.719 2.634 0.687 1.00 0.00 H new ATOM 0 HA LEU A 991 -5.016 4.864 0.749 1.00 0.00 H new ATOM 0 HB2 LEU A 991 -4.681 2.422 -0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 991 -5.231 2.995 -1.569 1.00 0.00 H new ATOM 0 HG LEU A 991 -3.402 4.574 -1.710 1.00 0.00 H new ATOM 0 HD11 LEU A 991 -1.652 4.705 0.011 1.00 0.00 H new ATOM 0 HD12 LEU A 991 -3.238 5.227 0.627 1.00 0.00 H new ATOM 0 HD13 LEU A 991 -2.602 3.621 1.054 1.00 0.00 H new ATOM 0 HD21 LEU A 991 -1.503 3.016 -1.806 1.00 0.00 H new ATOM 0 HD22 LEU A 991 -2.443 1.820 -0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 991 -2.981 2.315 -2.506 1.00 0.00 H new ATOM 1211 N ASN A 992 -6.978 4.861 -1.891 1.00 0.00 N ATOM 1212 CA ASN A 992 -7.608 5.730 -2.871 1.00 0.00 C ATOM 1213 C ASN A 992 -8.382 6.832 -2.147 1.00 0.00 C ATOM 1214 O ASN A 992 -8.338 7.994 -2.549 1.00 0.00 O ATOM 1215 CB ASN A 992 -8.596 4.952 -3.742 1.00 0.00 C ATOM 1216 CG ASN A 992 -9.247 5.865 -4.783 1.00 0.00 C ATOM 1217 OD1 ASN A 992 -10.229 6.542 -4.525 1.00 0.00 O ATOM 1218 ND2 ASN A 992 -8.647 5.846 -5.970 1.00 0.00 N ATOM 0 H ASN A 992 -7.140 3.865 -2.037 1.00 0.00 H new ATOM 0 HA ASN A 992 -6.825 6.150 -3.502 1.00 0.00 H new ATOM 0 HB2 ASN A 992 -8.078 4.134 -4.243 1.00 0.00 H new ATOM 0 HB3 ASN A 992 -9.366 4.504 -3.114 1.00 0.00 H new ATOM 0 HD21 ASN A 992 -9.006 6.422 -6.732 1.00 0.00 H new ATOM 0 HD22 ASN A 992 -7.828 5.256 -6.118 1.00 0.00 H new ATOM 1225 N SER A 993 -9.073 6.430 -1.091 1.00 0.00 N ATOM 1226 CA SER A 993 -9.856 7.369 -0.306 1.00 0.00 C ATOM 1227 C SER A 993 -9.000 8.582 0.064 1.00 0.00 C ATOM 1228 O SER A 993 -9.224 9.682 -0.440 1.00 0.00 O ATOM 1229 CB SER A 993 -10.410 6.705 0.956 1.00 0.00 C ATOM 1230 OG SER A 993 -11.785 6.359 0.817 1.00 0.00 O ATOM 0 H SER A 993 -9.107 5.466 -0.760 1.00 0.00 H new ATOM 0 HA SER A 993 -10.701 7.699 -0.910 1.00 0.00 H new ATOM 0 HB2 SER A 993 -9.831 5.808 1.178 1.00 0.00 H new ATOM 0 HB3 SER A 993 -10.290 7.380 1.803 1.00 0.00 H new ATOM 0 HG SER A 993 -12.101 5.936 1.643 1.00 0.00 H new ATOM 1236 N ASP A 994 -8.038 8.342 0.943 1.00 0.00 N ATOM 1237 CA ASP A 994 -7.148 9.401 1.387 1.00 0.00 C ATOM 1238 C ASP A 994 -6.535 10.091 0.166 1.00 0.00 C ATOM 1239 O ASP A 994 -6.325 11.303 0.174 1.00 0.00 O ATOM 1240 CB ASP A 994 -6.005 8.840 2.236 1.00 0.00 C ATOM 1241 CG ASP A 994 -6.325 8.678 3.723 1.00 0.00 C ATOM 1242 OD1 ASP A 994 -6.935 7.642 4.063 1.00 0.00 O ATOM 1243 OD2 ASP A 994 -5.951 9.595 4.487 1.00 0.00 O ATOM 0 H ASP A 994 -7.856 7.429 1.360 1.00 0.00 H new ATOM 0 HA ASP A 994 -7.730 10.103 1.984 1.00 0.00 H new ATOM 0 HB2 ASP A 994 -5.716 7.869 1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 994 -5.141 9.497 2.135 1.00 0.00 H new ATOM 1248 N LEU A 995 -6.265 9.289 -0.854 1.00 0.00 N ATOM 1249 CA LEU A 995 -5.681 9.807 -2.079 1.00 0.00 C ATOM 1250 C LEU A 995 -6.550 10.949 -2.610 1.00 0.00 C ATOM 1251 O LEU A 995 -6.078 12.075 -2.761 1.00 0.00 O ATOM 1252 CB LEU A 995 -5.464 8.679 -3.089 1.00 0.00 C ATOM 1253 CG LEU A 995 -5.863 8.985 -4.534 1.00 0.00 C ATOM 1254 CD1 LEU A 995 -5.019 10.126 -5.105 1.00 0.00 C ATOM 1255 CD2 LEU A 995 -5.789 7.728 -5.402 1.00 0.00 C ATOM 0 H LEU A 995 -6.440 8.284 -0.857 1.00 0.00 H new ATOM 0 HA LEU A 995 -4.692 10.222 -1.883 1.00 0.00 H new ATOM 0 HB2 LEU A 995 -4.409 8.404 -3.075 1.00 0.00 H new ATOM 0 HB3 LEU A 995 -6.026 7.806 -2.755 1.00 0.00 H new ATOM 0 HG LEU A 995 -6.901 9.318 -4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 995 -5.322 10.324 -6.133 1.00 0.00 H new ATOM 0 HD12 LEU A 995 -5.166 11.023 -4.504 1.00 0.00 H new ATOM 0 HD13 LEU A 995 -3.966 9.845 -5.085 1.00 0.00 H new ATOM 0 HD21 LEU A 995 -6.078 7.974 -6.424 1.00 0.00 H new ATOM 0 HD22 LEU A 995 -4.770 7.341 -5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 995 -6.467 6.972 -5.006 1.00 0.00 H new ATOM 1267 N ALA A 996 -7.805 10.619 -2.879 1.00 0.00 N ATOM 1268 CA ALA A 996 -8.744 11.603 -3.390 1.00 0.00 C ATOM 1269 C ALA A 996 -8.658 12.873 -2.541 1.00 0.00 C ATOM 1270 O ALA A 996 -8.517 13.973 -3.075 1.00 0.00 O ATOM 1271 CB ALA A 996 -10.152 11.006 -3.404 1.00 0.00 C ATOM 0 H ALA A 996 -8.193 9.684 -2.753 1.00 0.00 H new ATOM 0 HA ALA A 996 -8.495 11.875 -4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 996 -10.856 11.744 -3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 996 -10.167 10.124 -4.044 1.00 0.00 H new ATOM 0 HB3 ALA A 996 -10.438 10.724 -2.391 1.00 0.00 H new ATOM 1277 N GLU A 997 -8.746 12.680 -1.233 1.00 0.00 N ATOM 1278 CA GLU A 997 -8.679 13.796 -0.306 1.00 0.00 C ATOM 1279 C GLU A 997 -7.348 14.535 -0.458 1.00 0.00 C ATOM 1280 O GLU A 997 -7.274 15.742 -0.233 1.00 0.00 O ATOM 1281 CB GLU A 997 -8.883 13.324 1.135 1.00 0.00 C ATOM 1282 CG GLU A 997 -9.066 14.513 2.081 1.00 0.00 C ATOM 1283 CD GLU A 997 -10.463 15.120 1.933 1.00 0.00 C ATOM 1284 OE1 GLU A 997 -11.429 14.327 1.934 1.00 0.00 O ATOM 1285 OE2 GLU A 997 -10.533 16.363 1.824 1.00 0.00 O ATOM 0 H GLU A 997 -8.863 11.767 -0.794 1.00 0.00 H new ATOM 0 HA GLU A 997 -9.485 14.490 -0.544 1.00 0.00 H new ATOM 0 HB2 GLU A 997 -9.757 12.674 1.188 1.00 0.00 H new ATOM 0 HB3 GLU A 997 -8.025 12.731 1.452 1.00 0.00 H new ATOM 0 HG2 GLU A 997 -8.913 14.190 3.111 1.00 0.00 H new ATOM 0 HG3 GLU A 997 -8.312 15.271 1.869 1.00 0.00 H new ATOM 1292 N LEU A 998 -6.329 13.779 -0.840 1.00 0.00 N ATOM 1293 CA LEU A 998 -5.004 14.347 -1.025 1.00 0.00 C ATOM 1294 C LEU A 998 -4.985 15.178 -2.310 1.00 0.00 C ATOM 1295 O LEU A 998 -4.503 16.309 -2.315 1.00 0.00 O ATOM 1296 CB LEU A 998 -3.940 13.248 -0.988 1.00 0.00 C ATOM 1297 CG LEU A 998 -2.610 13.579 -1.668 1.00 0.00 C ATOM 1298 CD1 LEU A 998 -2.671 13.275 -3.166 1.00 0.00 C ATOM 1299 CD2 LEU A 998 -2.199 15.027 -1.393 1.00 0.00 C ATOM 0 H LEU A 998 -6.394 12.778 -1.026 1.00 0.00 H new ATOM 0 HA LEU A 998 -4.761 15.022 -0.204 1.00 0.00 H new ATOM 0 HB2 LEU A 998 -3.740 12.998 0.054 1.00 0.00 H new ATOM 0 HB3 LEU A 998 -4.352 12.355 -1.457 1.00 0.00 H new ATOM 0 HG LEU A 998 -1.838 12.939 -1.240 1.00 0.00 H new ATOM 0 HD11 LEU A 998 -1.713 13.519 -3.626 1.00 0.00 H new ATOM 0 HD12 LEU A 998 -2.886 12.217 -3.314 1.00 0.00 H new ATOM 0 HD13 LEU A 998 -3.458 13.873 -3.627 1.00 0.00 H new ATOM 0 HD21 LEU A 998 -1.250 15.236 -1.888 1.00 0.00 H new ATOM 0 HD22 LEU A 998 -2.965 15.702 -1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 998 -2.089 15.176 -0.319 1.00 0.00 H new ATOM 1311 N ILE A 999 -5.516 14.584 -3.369 1.00 0.00 N ATOM 1312 CA ILE A 999 -5.566 15.255 -4.657 1.00 0.00 C ATOM 1313 C ILE A 999 -6.146 16.658 -4.473 1.00 0.00 C ATOM 1314 O ILE A 999 -5.579 17.637 -4.957 1.00 0.00 O ATOM 1315 CB ILE A 999 -6.326 14.403 -5.675 1.00 0.00 C ATOM 1316 CG1 ILE A 999 -5.658 13.039 -5.857 1.00 0.00 C ATOM 1317 CG2 ILE A 999 -6.482 15.146 -7.004 1.00 0.00 C ATOM 1318 CD1 ILE A 999 -4.198 13.196 -6.288 1.00 0.00 C ATOM 0 H ILE A 999 -5.915 13.645 -3.361 1.00 0.00 H new ATOM 0 HA ILE A 999 -4.562 15.376 -5.064 1.00 0.00 H new ATOM 0 HB ILE A 999 -7.328 14.221 -5.287 1.00 0.00 H new ATOM 0 HG12 ILE A 999 -5.707 12.479 -4.923 1.00 0.00 H new ATOM 0 HG13 ILE A 999 -6.201 12.461 -6.604 1.00 0.00 H new ATOM 0 HG21 ILE A 999 -7.026 14.518 -7.710 1.00 0.00 H new ATOM 0 HG22 ILE A 999 -7.035 16.071 -6.841 1.00 0.00 H new ATOM 0 HG23 ILE A 999 -5.497 15.378 -7.409 1.00 0.00 H new ATOM 0 HD11 ILE A 999 -3.747 12.211 -6.410 1.00 0.00 H new ATOM 0 HD12 ILE A 999 -4.154 13.735 -7.234 1.00 0.00 H new ATOM 0 HD13 ILE A 999 -3.652 13.753 -5.527 1.00 0.00 H new ATOM 1330 N ASN A1000 -7.270 16.712 -3.774 1.00 0.00 N ATOM 1331 CA ASN A1000 -7.934 17.980 -3.521 1.00 0.00 C ATOM 1332 C ASN A1000 -7.048 18.843 -2.620 1.00 0.00 C ATOM 1333 O ASN A1000 -6.991 20.061 -2.783 1.00 0.00 O ATOM 1334 CB ASN A1000 -9.271 17.769 -2.807 1.00 0.00 C ATOM 1335 CG ASN A1000 -10.233 18.923 -3.094 1.00 0.00 C ATOM 1336 OD1 ASN A1000 -9.989 19.776 -3.931 1.00 0.00 O ATOM 1337 ND2 ASN A1000 -11.339 18.902 -2.355 1.00 0.00 N ATOM 0 H ASN A1000 -7.738 15.898 -3.375 1.00 0.00 H new ATOM 0 HA ASN A1000 -8.111 18.466 -4.481 1.00 0.00 H new ATOM 0 HB2 ASN A1000 -9.717 16.829 -3.133 1.00 0.00 H new ATOM 0 HB3 ASN A1000 -9.105 17.688 -1.733 1.00 0.00 H new ATOM 0 HD21 ASN A1000 -12.044 19.629 -2.472 1.00 0.00 H new ATOM 0 HD22 ASN A1000 -11.482 18.159 -1.671 1.00 0.00 H new ATOM 1344 N LYS A1001 -6.379 18.179 -1.689 1.00 0.00 N ATOM 1345 CA LYS A1001 -5.499 18.870 -0.763 1.00 0.00 C ATOM 1346 C LYS A1001 -4.466 19.677 -1.552 1.00 0.00 C ATOM 1347 O LYS A1001 -4.025 20.734 -1.104 1.00 0.00 O ATOM 1348 CB LYS A1001 -4.880 17.881 0.227 1.00 0.00 C ATOM 1349 CG LYS A1001 -4.803 18.486 1.631 1.00 0.00 C ATOM 1350 CD LYS A1001 -5.814 17.823 2.569 1.00 0.00 C ATOM 1351 CE LYS A1001 -5.125 16.816 3.493 1.00 0.00 C ATOM 1352 NZ LYS A1001 -6.124 15.924 4.122 1.00 0.00 N ATOM 0 H LYS A1001 -6.429 17.169 -1.556 1.00 0.00 H new ATOM 0 HA LYS A1001 -6.064 19.580 -0.159 1.00 0.00 H new ATOM 0 HB2 LYS A1001 -5.474 16.967 0.253 1.00 0.00 H new ATOM 0 HB3 LYS A1001 -3.881 17.603 -0.108 1.00 0.00 H new ATOM 0 HG2 LYS A1001 -3.796 18.362 2.030 1.00 0.00 H new ATOM 0 HG3 LYS A1001 -4.996 19.557 1.580 1.00 0.00 H new ATOM 0 HD2 LYS A1001 -6.316 18.585 3.165 1.00 0.00 H new ATOM 0 HD3 LYS A1001 -6.582 17.318 1.983 1.00 0.00 H new ATOM 0 HE2 LYS A1001 -4.407 16.225 2.925 1.00 0.00 H new ATOM 0 HE3 LYS A1001 -4.564 17.345 4.264 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 -5.675 15.387 4.891 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 -6.904 16.494 4.507 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 -6.496 15.263 3.410 1.00 0.00 H new ATOM 1366 N MET A1002 -4.112 19.148 -2.714 1.00 0.00 N ATOM 1367 CA MET A1002 -3.139 19.806 -3.570 1.00 0.00 C ATOM 1368 C MET A1002 -3.794 20.924 -4.384 1.00 0.00 C ATOM 1369 O MET A1002 -3.199 21.983 -4.582 1.00 0.00 O ATOM 1370 CB MET A1002 -2.518 18.780 -4.520 1.00 0.00 C ATOM 1371 CG MET A1002 -1.578 19.457 -5.520 1.00 0.00 C ATOM 1372 SD MET A1002 -1.933 18.887 -7.174 1.00 0.00 S ATOM 1373 CE MET A1002 -3.222 20.035 -7.627 1.00 0.00 C ATOM 0 H MET A1002 -4.481 18.272 -3.083 1.00 0.00 H new ATOM 0 HA MET A1002 -2.366 20.245 -2.940 1.00 0.00 H new ATOM 0 HB2 MET A1002 -1.968 18.034 -3.946 1.00 0.00 H new ATOM 0 HB3 MET A1002 -3.306 18.252 -5.057 1.00 0.00 H new ATOM 0 HG2 MET A1002 -1.695 20.539 -5.467 1.00 0.00 H new ATOM 0 HG3 MET A1002 -0.542 19.236 -5.265 1.00 0.00 H new ATOM 0 HE1 MET A1002 -3.340 20.041 -8.711 1.00 0.00 H new ATOM 0 HE2 MET A1002 -4.160 19.731 -7.162 1.00 0.00 H new ATOM 0 HE3 MET A1002 -2.955 21.035 -7.285 1.00 0.00 H new ATOM 1383 N LYS A1003 -5.010 20.652 -4.834 1.00 0.00 N ATOM 1384 CA LYS A1003 -5.751 21.622 -5.622 1.00 0.00 C ATOM 1385 C LYS A1003 -5.899 22.917 -4.821 1.00 0.00 C ATOM 1386 O LYS A1003 -5.545 23.992 -5.301 1.00 0.00 O ATOM 1387 CB LYS A1003 -7.084 21.030 -6.085 1.00 0.00 C ATOM 1388 CG LYS A1003 -6.974 20.479 -7.508 1.00 0.00 C ATOM 1389 CD LYS A1003 -8.345 20.061 -8.042 1.00 0.00 C ATOM 1390 CE LYS A1003 -9.207 21.285 -8.358 1.00 0.00 C ATOM 1391 NZ LYS A1003 -10.187 20.968 -9.422 1.00 0.00 N ATOM 0 H LYS A1003 -5.501 19.773 -4.668 1.00 0.00 H new ATOM 0 HA LYS A1003 -5.205 21.870 -6.532 1.00 0.00 H new ATOM 0 HB2 LYS A1003 -7.388 20.234 -5.405 1.00 0.00 H new ATOM 0 HB3 LYS A1003 -7.859 21.795 -6.046 1.00 0.00 H new ATOM 0 HG2 LYS A1003 -6.540 21.235 -8.162 1.00 0.00 H new ATOM 0 HG3 LYS A1003 -6.299 19.623 -7.519 1.00 0.00 H new ATOM 0 HD2 LYS A1003 -8.220 19.458 -8.941 1.00 0.00 H new ATOM 0 HD3 LYS A1003 -8.851 19.436 -7.306 1.00 0.00 H new ATOM 0 HE2 LYS A1003 -9.730 21.611 -7.459 1.00 0.00 H new ATOM 0 HE3 LYS A1003 -8.572 22.112 -8.675 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 -10.764 21.809 -9.624 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 -9.682 20.679 -10.284 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 -10.804 20.193 -9.106 1.00 0.00 H new ATOM 1405 N LEU A1004 -6.423 22.771 -3.612 1.00 0.00 N ATOM 1406 CA LEU A1004 -6.623 23.916 -2.740 1.00 0.00 C ATOM 1407 C LEU A1004 -5.264 24.519 -2.379 1.00 0.00 C ATOM 1408 O LEU A1004 -5.134 25.736 -2.253 1.00 0.00 O ATOM 1409 CB LEU A1004 -7.464 23.523 -1.524 1.00 0.00 C ATOM 1410 CG LEU A1004 -6.909 22.385 -0.664 1.00 0.00 C ATOM 1411 CD1 LEU A1004 -5.838 22.899 0.301 1.00 0.00 C ATOM 1412 CD2 LEU A1004 -8.035 21.651 0.067 1.00 0.00 C ATOM 0 H LEU A1004 -6.715 21.877 -3.216 1.00 0.00 H new ATOM 0 HA LEU A1004 -7.191 24.692 -3.254 1.00 0.00 H new ATOM 0 HB2 LEU A1004 -7.587 24.403 -0.892 1.00 0.00 H new ATOM 0 HB3 LEU A1004 -8.457 23.239 -1.871 1.00 0.00 H new ATOM 0 HG LEU A1004 -6.428 21.662 -1.323 1.00 0.00 H new ATOM 0 HD11 LEU A1004 -5.460 22.070 0.900 1.00 0.00 H new ATOM 0 HD12 LEU A1004 -5.018 23.340 -0.266 1.00 0.00 H new ATOM 0 HD13 LEU A1004 -6.272 23.653 0.957 1.00 0.00 H new ATOM 0 HD21 LEU A1004 -7.614 20.847 0.671 1.00 0.00 H new ATOM 0 HD22 LEU A1004 -8.566 22.350 0.713 1.00 0.00 H new ATOM 0 HD23 LEU A1004 -8.729 21.232 -0.661 1.00 0.00 H new ATOM 1424 N ALA A1005 -4.285 23.640 -2.223 1.00 0.00 N ATOM 1425 CA ALA A1005 -2.940 24.071 -1.878 1.00 0.00 C ATOM 1426 C ALA A1005 -2.304 24.757 -3.089 1.00 0.00 C ATOM 1427 O ALA A1005 -1.209 25.310 -2.989 1.00 0.00 O ATOM 1428 CB ALA A1005 -2.127 22.868 -1.395 1.00 0.00 C ATOM 0 H ALA A1005 -4.396 22.632 -2.329 1.00 0.00 H new ATOM 0 HA ALA A1005 -2.965 24.795 -1.064 1.00 0.00 H new ATOM 0 HB1 ALA A1005 -1.119 23.191 -1.136 1.00 0.00 H new ATOM 0 HB2 ALA A1005 -2.606 22.434 -0.517 1.00 0.00 H new ATOM 0 HB3 ALA A1005 -2.077 22.121 -2.187 1.00 0.00 H new ATOM 1434 N GLN A1006 -3.016 24.698 -4.204 1.00 0.00 N ATOM 1435 CA GLN A1006 -2.534 25.307 -5.433 1.00 0.00 C ATOM 1436 C GLN A1006 -3.201 26.667 -5.648 1.00 0.00 C ATOM 1437 O GLN A1006 -2.719 27.481 -6.434 1.00 0.00 O ATOM 1438 CB GLN A1006 -2.770 24.385 -6.631 1.00 0.00 C ATOM 1439 CG GLN A1006 -1.470 24.142 -7.400 1.00 0.00 C ATOM 1440 CD GLN A1006 -1.460 24.918 -8.719 1.00 0.00 C ATOM 1441 OE1 GLN A1006 -0.514 25.613 -9.053 1.00 0.00 O ATOM 1442 NE2 GLN A1006 -2.562 24.762 -9.447 1.00 0.00 N ATOM 0 H GLN A1006 -3.923 24.238 -4.283 1.00 0.00 H new ATOM 0 HA GLN A1006 -1.459 25.462 -5.342 1.00 0.00 H new ATOM 0 HB2 GLN A1006 -3.177 23.434 -6.288 1.00 0.00 H new ATOM 0 HB3 GLN A1006 -3.512 24.828 -7.295 1.00 0.00 H new ATOM 0 HG2 GLN A1006 -0.620 24.445 -6.789 1.00 0.00 H new ATOM 0 HG3 GLN A1006 -1.355 23.077 -7.600 1.00 0.00 H new ATOM 0 HE21 GLN A1006 -3.317 24.165 -9.108 1.00 0.00 H new ATOM 0 HE22 GLN A1006 -2.652 25.239 -10.344 1.00 0.00 H new ATOM 1451 N GLN A1007 -4.299 26.872 -4.935 1.00 0.00 N ATOM 1452 CA GLN A1007 -5.036 28.120 -5.038 1.00 0.00 C ATOM 1453 C GLN A1007 -4.781 28.990 -3.806 1.00 0.00 C ATOM 1454 O GLN A1007 -4.664 30.210 -3.917 1.00 0.00 O ATOM 1455 CB GLN A1007 -6.532 27.859 -5.225 1.00 0.00 C ATOM 1456 CG GLN A1007 -7.177 28.951 -6.081 1.00 0.00 C ATOM 1457 CD GLN A1007 -7.515 30.181 -5.236 1.00 0.00 C ATOM 1458 OE1 GLN A1007 -6.711 31.079 -5.050 1.00 0.00 O ATOM 1459 NE2 GLN A1007 -8.748 30.172 -4.737 1.00 0.00 N ATOM 0 H GLN A1007 -4.696 26.195 -4.284 1.00 0.00 H new ATOM 0 HA GLN A1007 -4.682 28.657 -5.918 1.00 0.00 H new ATOM 0 HB2 GLN A1007 -6.679 26.888 -5.697 1.00 0.00 H new ATOM 0 HB3 GLN A1007 -7.022 27.818 -4.252 1.00 0.00 H new ATOM 0 HG2 GLN A1007 -6.500 29.234 -6.887 1.00 0.00 H new ATOM 0 HG3 GLN A1007 -8.084 28.565 -6.547 1.00 0.00 H new ATOM 0 HE21 GLN A1007 -9.371 29.388 -4.931 1.00 0.00 H new ATOM 0 HE22 GLN A1007 -9.070 30.949 -4.160 1.00 0.00 H new ATOM 1468 N TYR A1008 -4.703 28.330 -2.660 1.00 0.00 N ATOM 1469 CA TYR A1008 -4.464 29.028 -1.408 1.00 0.00 C ATOM 1470 C TYR A1008 -3.021 29.529 -1.327 1.00 0.00 C ATOM 1471 O TYR A1008 -2.709 30.406 -0.523 1.00 0.00 O ATOM 1472 CB TYR A1008 -4.698 28.000 -0.300 1.00 0.00 C ATOM 1473 CG TYR A1008 -6.170 27.799 0.062 1.00 0.00 C ATOM 1474 CD1 TYR A1008 -6.985 28.893 0.271 1.00 0.00 C ATOM 1475 CD2 TYR A1008 -6.684 26.523 0.180 1.00 0.00 C ATOM 1476 CE1 TYR A1008 -8.371 28.704 0.613 1.00 0.00 C ATOM 1477 CE2 TYR A1008 -8.070 26.334 0.522 1.00 0.00 C ATOM 1478 CZ TYR A1008 -8.845 27.434 0.721 1.00 0.00 C ATOM 1479 OH TYR A1008 -10.155 27.255 1.043 1.00 0.00 O ATOM 0 H TYR A1008 -4.801 27.319 -2.572 1.00 0.00 H new ATOM 0 HA TYR A1008 -5.121 29.893 -1.320 1.00 0.00 H new ATOM 0 HB2 TYR A1008 -4.277 27.044 -0.611 1.00 0.00 H new ATOM 0 HB3 TYR A1008 -4.155 28.312 0.592 1.00 0.00 H new ATOM 0 HD1 TYR A1008 -6.583 29.891 0.178 1.00 0.00 H new ATOM 0 HD2 TYR A1008 -6.047 25.667 0.016 1.00 0.00 H new ATOM 0 HE1 TYR A1008 -9.019 29.552 0.780 1.00 0.00 H new ATOM 0 HE2 TYR A1008 -8.485 25.341 0.618 1.00 0.00 H new ATOM 0 HH TYR A1008 -10.354 26.296 1.084 1.00 0.00 H new ATOM 1489 N VAL A1009 -2.179 28.951 -2.171 1.00 0.00 N ATOM 1490 CA VAL A1009 -0.776 29.328 -2.204 1.00 0.00 C ATOM 1491 C VAL A1009 -0.656 30.845 -2.047 1.00 0.00 C ATOM 1492 O VAL A1009 -0.145 31.329 -1.039 1.00 0.00 O ATOM 1493 CB VAL A1009 -0.125 28.806 -3.487 1.00 0.00 C ATOM 1494 CG1 VAL A1009 -0.995 29.112 -4.707 1.00 0.00 C ATOM 1495 CG2 VAL A1009 1.283 29.380 -3.660 1.00 0.00 C ATOM 0 H VAL A1009 -2.441 28.224 -2.837 1.00 0.00 H new ATOM 0 HA VAL A1009 -0.238 28.872 -1.373 1.00 0.00 H new ATOM 0 HB VAL A1009 -0.037 27.723 -3.401 1.00 0.00 H new ATOM 0 HG11 VAL A1009 -0.509 28.730 -5.605 1.00 0.00 H new ATOM 0 HG12 VAL A1009 -1.968 28.634 -4.589 1.00 0.00 H new ATOM 0 HG13 VAL A1009 -1.129 30.190 -4.797 1.00 0.00 H new ATOM 0 HG21 VAL A1009 1.723 28.993 -4.579 1.00 0.00 H new ATOM 0 HG22 VAL A1009 1.229 30.467 -3.713 1.00 0.00 H new ATOM 0 HG23 VAL A1009 1.901 29.089 -2.811 1.00 0.00 H new ATOM 1505 N MET A1010 -1.136 31.552 -3.060 1.00 0.00 N ATOM 1506 CA MET A1010 -1.089 33.004 -3.046 1.00 0.00 C ATOM 1507 C MET A1010 -1.498 33.554 -1.678 1.00 0.00 C ATOM 1508 O MET A1010 -0.720 34.249 -1.027 1.00 0.00 O ATOM 1509 CB MET A1010 -2.029 33.556 -4.120 1.00 0.00 C ATOM 1510 CG MET A1010 -1.755 35.038 -4.380 1.00 0.00 C ATOM 1511 SD MET A1010 -3.259 35.980 -4.186 1.00 0.00 S ATOM 1512 CE MET A1010 -3.716 35.496 -2.530 1.00 0.00 C ATOM 0 H MET A1010 -1.559 31.146 -3.895 1.00 0.00 H new ATOM 0 HA MET A1010 -0.065 33.317 -3.251 1.00 0.00 H new ATOM 0 HB2 MET A1010 -1.902 32.992 -5.044 1.00 0.00 H new ATOM 0 HB3 MET A1010 -3.064 33.424 -3.805 1.00 0.00 H new ATOM 0 HG2 MET A1010 -0.996 35.403 -3.688 1.00 0.00 H new ATOM 0 HG3 MET A1010 -1.359 35.172 -5.387 1.00 0.00 H new ATOM 0 HE1 MET A1010 -4.473 36.180 -2.147 1.00 0.00 H new ATOM 0 HE2 MET A1010 -4.117 34.482 -2.545 1.00 0.00 H new ATOM 0 HE3 MET A1010 -2.838 35.530 -1.886 1.00 0.00 H new ATOM 1522 N THR A1011 -2.718 33.221 -1.284 1.00 0.00 N ATOM 1523 CA THR A1011 -3.240 33.673 -0.005 1.00 0.00 C ATOM 1524 C THR A1011 -2.130 33.688 1.049 1.00 0.00 C ATOM 1525 O THR A1011 -1.578 34.743 1.359 1.00 0.00 O ATOM 1526 CB THR A1011 -4.419 32.773 0.369 1.00 0.00 C ATOM 1527 OG1 THR A1011 -5.322 32.913 -0.725 1.00 0.00 O ATOM 1528 CG2 THR A1011 -5.204 33.305 1.570 1.00 0.00 C ATOM 0 H THR A1011 -3.360 32.644 -1.827 1.00 0.00 H new ATOM 0 HA THR A1011 -3.602 34.699 -0.066 1.00 0.00 H new ATOM 0 HB THR A1011 -4.054 31.770 0.589 1.00 0.00 H new ATOM 0 HG1 THR A1011 -6.116 32.361 -0.567 1.00 0.00 H new ATOM 0 HG21 THR A1011 -6.030 32.629 1.793 1.00 0.00 H new ATOM 0 HG22 THR A1011 -4.545 33.371 2.435 1.00 0.00 H new ATOM 0 HG23 THR A1011 -5.598 34.294 1.338 1.00 0.00 H new ATOM 1536 N SER A1012 -1.836 32.506 1.570 1.00 0.00 N ATOM 1537 CA SER A1012 -0.802 32.371 2.582 1.00 0.00 C ATOM 1538 C SER A1012 -1.095 31.160 3.470 1.00 0.00 C ATOM 1539 O SER A1012 -0.205 30.657 4.154 1.00 0.00 O ATOM 1540 CB SER A1012 -0.694 33.638 3.431 1.00 0.00 C ATOM 1541 OG SER A1012 0.274 34.547 2.913 1.00 0.00 O ATOM 0 H SER A1012 -2.296 31.633 1.310 1.00 0.00 H new ATOM 0 HA SER A1012 0.153 32.222 2.078 1.00 0.00 H new ATOM 0 HB2 SER A1012 -1.666 34.129 3.474 1.00 0.00 H new ATOM 0 HB3 SER A1012 -0.428 33.368 4.453 1.00 0.00 H new ATOM 0 HG SER A1012 -0.112 35.043 2.161 1.00 0.00 H new ATOM 1547 N LEU A1013 -2.347 30.726 3.430 1.00 0.00 N ATOM 1548 CA LEU A1013 -2.768 29.584 4.223 1.00 0.00 C ATOM 1549 C LEU A1013 -1.981 28.347 3.786 1.00 0.00 C ATOM 1550 O LEU A1013 -2.006 27.319 4.462 1.00 0.00 O ATOM 1551 CB LEU A1013 -4.286 29.406 4.143 1.00 0.00 C ATOM 1552 CG LEU A1013 -5.101 30.686 3.951 1.00 0.00 C ATOM 1553 CD1 LEU A1013 -6.600 30.406 4.081 1.00 0.00 C ATOM 1554 CD2 LEU A1013 -4.637 31.782 4.914 1.00 0.00 C ATOM 0 H LEU A1013 -3.083 31.145 2.861 1.00 0.00 H new ATOM 0 HA LEU A1013 -2.544 29.749 5.277 1.00 0.00 H new ATOM 0 HB2 LEU A1013 -4.510 28.729 3.318 1.00 0.00 H new ATOM 0 HB3 LEU A1013 -4.623 28.917 5.057 1.00 0.00 H new ATOM 0 HG LEU A1013 -4.928 31.052 2.939 1.00 0.00 H new ATOM 0 HD11 LEU A1013 -7.157 31.332 3.940 1.00 0.00 H new ATOM 0 HD12 LEU A1013 -6.902 29.683 3.324 1.00 0.00 H new ATOM 0 HD13 LEU A1013 -6.810 30.003 5.072 1.00 0.00 H new ATOM 0 HD21 LEU A1013 -5.233 32.681 4.756 1.00 0.00 H new ATOM 0 HD22 LEU A1013 -4.761 31.440 5.941 1.00 0.00 H new ATOM 0 HD23 LEU A1013 -3.586 32.006 4.731 1.00 0.00 H new ATOM 1566 N GLN A1014 -1.299 28.486 2.658 1.00 0.00 N ATOM 1567 CA GLN A1014 -0.506 27.393 2.123 1.00 0.00 C ATOM 1568 C GLN A1014 0.110 26.577 3.262 1.00 0.00 C ATOM 1569 O GLN A1014 -0.316 25.454 3.527 1.00 0.00 O ATOM 1570 CB GLN A1014 0.575 27.913 1.174 1.00 0.00 C ATOM 1571 CG GLN A1014 1.105 26.792 0.278 1.00 0.00 C ATOM 1572 CD GLN A1014 2.524 27.098 -0.203 1.00 0.00 C ATOM 1573 OE1 GLN A1014 3.358 27.609 0.527 1.00 0.00 O ATOM 1574 NE2 GLN A1014 2.752 26.759 -1.469 1.00 0.00 N ATOM 0 H GLN A1014 -1.280 29.340 2.100 1.00 0.00 H new ATOM 0 HA GLN A1014 -1.163 26.740 1.549 1.00 0.00 H new ATOM 0 HB2 GLN A1014 0.168 28.714 0.557 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.395 28.341 1.751 1.00 0.00 H new ATOM 0 HG2 GLN A1014 1.098 25.850 0.826 1.00 0.00 H new ATOM 0 HG3 GLN A1014 0.446 26.666 -0.581 1.00 0.00 H new ATOM 0 HE21 GLN A1014 2.010 26.335 -2.025 1.00 0.00 H new ATOM 0 HE22 GLN A1014 3.669 26.923 -1.884 1.00 0.00 H new ATOM 1583 N GLN A1015 1.103 27.174 3.905 1.00 0.00 N ATOM 1584 CA GLN A1015 1.782 26.517 5.008 1.00 0.00 C ATOM 1585 C GLN A1015 0.772 25.777 5.888 1.00 0.00 C ATOM 1586 O GLN A1015 1.029 24.656 6.326 1.00 0.00 O ATOM 1587 CB GLN A1015 2.592 27.522 5.830 1.00 0.00 C ATOM 1588 CG GLN A1015 1.939 28.905 5.803 1.00 0.00 C ATOM 1589 CD GLN A1015 2.037 29.584 7.171 1.00 0.00 C ATOM 1590 OE1 GLN A1015 2.828 29.213 8.022 1.00 0.00 O ATOM 1591 NE2 GLN A1015 1.190 30.597 7.333 1.00 0.00 N ATOM 0 H GLN A1015 1.453 28.106 3.683 1.00 0.00 H new ATOM 0 HA GLN A1015 2.480 25.787 4.597 1.00 0.00 H new ATOM 0 HB2 GLN A1015 2.673 27.174 6.860 1.00 0.00 H new ATOM 0 HB3 GLN A1015 3.606 27.587 5.435 1.00 0.00 H new ATOM 0 HG2 GLN A1015 2.424 29.525 5.049 1.00 0.00 H new ATOM 0 HG3 GLN A1015 0.892 28.811 5.514 1.00 0.00 H new ATOM 0 HE21 GLN A1015 0.554 30.855 6.579 1.00 0.00 H new ATOM 0 HE22 GLN A1015 1.177 31.115 8.211 1.00 0.00 H new ATOM 1600 N GLU A1016 -0.355 26.434 6.120 1.00 0.00 N ATOM 1601 CA GLU A1016 -1.405 25.852 6.939 1.00 0.00 C ATOM 1602 C GLU A1016 -1.972 24.601 6.265 1.00 0.00 C ATOM 1603 O GLU A1016 -2.061 23.543 6.887 1.00 0.00 O ATOM 1604 CB GLU A1016 -2.509 26.872 7.221 1.00 0.00 C ATOM 1605 CG GLU A1016 -3.390 26.420 8.387 1.00 0.00 C ATOM 1606 CD GLU A1016 -4.787 27.035 8.290 1.00 0.00 C ATOM 1607 OE1 GLU A1016 -5.552 26.570 7.418 1.00 0.00 O ATOM 1608 OE2 GLU A1016 -5.059 27.956 9.091 1.00 0.00 O ATOM 0 H GLU A1016 -0.564 27.363 5.755 1.00 0.00 H new ATOM 0 HA GLU A1016 -0.973 25.560 7.896 1.00 0.00 H new ATOM 0 HB2 GLU A1016 -2.064 27.840 7.451 1.00 0.00 H new ATOM 0 HB3 GLU A1016 -3.121 27.006 6.329 1.00 0.00 H new ATOM 0 HG2 GLU A1016 -3.467 25.333 8.389 1.00 0.00 H new ATOM 0 HG3 GLU A1016 -2.927 26.708 9.331 1.00 0.00 H new ATOM 1615 N TYR A1017 -2.343 24.764 5.004 1.00 0.00 N ATOM 1616 CA TYR A1017 -2.899 23.661 4.239 1.00 0.00 C ATOM 1617 C TYR A1017 -1.835 22.599 3.954 1.00 0.00 C ATOM 1618 O TYR A1017 -2.155 21.424 3.783 1.00 0.00 O ATOM 1619 CB TYR A1017 -3.371 24.262 2.914 1.00 0.00 C ATOM 1620 CG TYR A1017 -4.740 24.941 2.990 1.00 0.00 C ATOM 1621 CD1 TYR A1017 -5.857 24.205 3.331 1.00 0.00 C ATOM 1622 CD2 TYR A1017 -4.859 26.289 2.719 1.00 0.00 C ATOM 1623 CE1 TYR A1017 -7.145 24.843 3.404 1.00 0.00 C ATOM 1624 CE2 TYR A1017 -6.147 26.927 2.791 1.00 0.00 C ATOM 1625 CZ TYR A1017 -7.227 26.173 3.130 1.00 0.00 C ATOM 1626 OH TYR A1017 -8.444 26.776 3.198 1.00 0.00 O ATOM 0 H TYR A1017 -2.270 25.643 4.493 1.00 0.00 H new ATOM 0 HA TYR A1017 -3.707 23.180 4.791 1.00 0.00 H new ATOM 0 HB2 TYR A1017 -2.634 24.990 2.574 1.00 0.00 H new ATOM 0 HB3 TYR A1017 -3.409 23.473 2.163 1.00 0.00 H new ATOM 0 HD1 TYR A1017 -5.764 23.150 3.543 1.00 0.00 H new ATOM 0 HD2 TYR A1017 -3.985 26.865 2.453 1.00 0.00 H new ATOM 0 HE1 TYR A1017 -8.026 24.279 3.670 1.00 0.00 H new ATOM 0 HE2 TYR A1017 -6.254 27.981 2.581 1.00 0.00 H new ATOM 0 HH TYR A1017 -8.939 26.608 2.369 1.00 0.00 H new ATOM 1636 N LYS A1018 -0.591 23.052 3.910 1.00 0.00 N ATOM 1637 CA LYS A1018 0.523 22.156 3.648 1.00 0.00 C ATOM 1638 C LYS A1018 0.654 21.161 4.803 1.00 0.00 C ATOM 1639 O LYS A1018 0.857 19.969 4.580 1.00 0.00 O ATOM 1640 CB LYS A1018 1.800 22.953 3.375 1.00 0.00 C ATOM 1641 CG LYS A1018 1.691 23.730 2.062 1.00 0.00 C ATOM 1642 CD LYS A1018 1.985 22.825 0.864 1.00 0.00 C ATOM 1643 CE LYS A1018 2.378 23.651 -0.363 1.00 0.00 C ATOM 1644 NZ LYS A1018 1.202 23.884 -1.230 1.00 0.00 N ATOM 0 H LYS A1018 -0.329 24.028 4.051 1.00 0.00 H new ATOM 0 HA LYS A1018 0.339 21.574 2.745 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.984 23.645 4.197 1.00 0.00 H new ATOM 0 HB3 LYS A1018 2.653 22.276 3.331 1.00 0.00 H new ATOM 0 HG2 LYS A1018 0.690 24.152 1.967 1.00 0.00 H new ATOM 0 HG3 LYS A1018 2.390 24.566 2.071 1.00 0.00 H new ATOM 0 HD2 LYS A1018 2.790 22.134 1.115 1.00 0.00 H new ATOM 0 HD3 LYS A1018 1.106 22.222 0.635 1.00 0.00 H new ATOM 0 HE2 LYS A1018 2.798 24.606 -0.046 1.00 0.00 H new ATOM 0 HE3 LYS A1018 3.154 23.131 -0.925 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 1.483 24.460 -2.049 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 0.828 22.972 -1.561 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 0.467 24.384 -0.691 1.00 0.00 H new ATOM 1658 N LYS A1019 0.532 21.688 6.012 1.00 0.00 N ATOM 1659 CA LYS A1019 0.634 20.861 7.203 1.00 0.00 C ATOM 1660 C LYS A1019 -0.447 19.779 7.161 1.00 0.00 C ATOM 1661 O LYS A1019 -0.185 18.622 7.486 1.00 0.00 O ATOM 1662 CB LYS A1019 0.589 21.728 8.463 1.00 0.00 C ATOM 1663 CG LYS A1019 1.953 21.762 9.154 1.00 0.00 C ATOM 1664 CD LYS A1019 2.920 22.688 8.413 1.00 0.00 C ATOM 1665 CE LYS A1019 3.780 21.902 7.421 1.00 0.00 C ATOM 1666 NZ LYS A1019 5.217 22.097 7.712 1.00 0.00 N ATOM 0 H LYS A1019 0.363 22.678 6.193 1.00 0.00 H new ATOM 0 HA LYS A1019 1.596 20.350 7.231 1.00 0.00 H new ATOM 0 HB2 LYS A1019 0.285 22.741 8.201 1.00 0.00 H new ATOM 0 HB3 LYS A1019 -0.161 21.338 9.151 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.835 22.102 10.183 1.00 0.00 H new ATOM 0 HG3 LYS A1019 2.368 20.755 9.196 1.00 0.00 H new ATOM 0 HD2 LYS A1019 2.358 23.457 7.883 1.00 0.00 H new ATOM 0 HD3 LYS A1019 3.562 23.199 9.131 1.00 0.00 H new ATOM 0 HE2 LYS A1019 3.532 20.842 7.477 1.00 0.00 H new ATOM 0 HE3 LYS A1019 3.562 22.228 6.404 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 5.786 21.557 7.029 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 5.453 23.107 7.636 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 5.424 21.765 8.675 1.00 0.00 H new ATOM 1680 N GLN A1020 -1.639 20.194 6.759 1.00 0.00 N ATOM 1681 CA GLN A1020 -2.761 19.275 6.671 1.00 0.00 C ATOM 1682 C GLN A1020 -2.367 18.032 5.870 1.00 0.00 C ATOM 1683 O GLN A1020 -2.556 16.907 6.329 1.00 0.00 O ATOM 1684 CB GLN A1020 -3.984 19.959 6.057 1.00 0.00 C ATOM 1685 CG GLN A1020 -4.409 21.172 6.887 1.00 0.00 C ATOM 1686 CD GLN A1020 -4.676 20.774 8.341 1.00 0.00 C ATOM 1687 OE1 GLN A1020 -3.777 20.674 9.159 1.00 0.00 O ATOM 1688 NE2 GLN A1020 -5.959 20.554 8.614 1.00 0.00 N ATOM 0 H GLN A1020 -1.852 21.155 6.490 1.00 0.00 H new ATOM 0 HA GLN A1020 -3.030 18.963 7.680 1.00 0.00 H new ATOM 0 HB2 GLN A1020 -3.756 20.273 5.038 1.00 0.00 H new ATOM 0 HB3 GLN A1020 -4.809 19.249 5.995 1.00 0.00 H new ATOM 0 HG2 GLN A1020 -3.629 21.933 6.852 1.00 0.00 H new ATOM 0 HG3 GLN A1020 -5.307 21.615 6.457 1.00 0.00 H new ATOM 0 HE21 GLN A1020 -6.661 20.656 7.881 1.00 0.00 H new ATOM 0 HE22 GLN A1020 -6.241 20.284 9.556 1.00 0.00 H new ATOM 1697 N MET A1021 -1.828 18.278 4.685 1.00 0.00 N ATOM 1698 CA MET A1021 -1.406 17.193 3.815 1.00 0.00 C ATOM 1699 C MET A1021 -0.573 16.166 4.584 1.00 0.00 C ATOM 1700 O MET A1021 -0.916 14.985 4.620 1.00 0.00 O ATOM 1701 CB MET A1021 -0.579 17.758 2.658 1.00 0.00 C ATOM 1702 CG MET A1021 -0.964 17.096 1.334 1.00 0.00 C ATOM 1703 SD MET A1021 -0.070 15.564 1.134 1.00 0.00 S ATOM 1704 CE MET A1021 1.607 16.170 1.228 1.00 0.00 C ATOM 0 H MET A1021 -1.674 19.213 4.307 1.00 0.00 H new ATOM 0 HA MET A1021 -2.296 16.696 3.428 1.00 0.00 H new ATOM 0 HB2 MET A1021 -0.733 18.835 2.588 1.00 0.00 H new ATOM 0 HB3 MET A1021 0.482 17.599 2.853 1.00 0.00 H new ATOM 0 HG2 MET A1021 -2.037 16.906 1.312 1.00 0.00 H new ATOM 0 HG3 MET A1021 -0.742 17.767 0.504 1.00 0.00 H new ATOM 0 HE1 MET A1021 2.283 15.441 0.780 1.00 0.00 H new ATOM 0 HE2 MET A1021 1.683 17.115 0.690 1.00 0.00 H new ATOM 0 HE3 MET A1021 1.880 16.324 2.272 1.00 0.00 H new ATOM 1714 N LEU A1022 0.505 16.653 5.181 1.00 0.00 N ATOM 1715 CA LEU A1022 1.389 15.791 5.948 1.00 0.00 C ATOM 1716 C LEU A1022 0.551 14.822 6.784 1.00 0.00 C ATOM 1717 O LEU A1022 0.795 13.616 6.773 1.00 0.00 O ATOM 1718 CB LEU A1022 2.368 16.628 6.773 1.00 0.00 C ATOM 1719 CG LEU A1022 3.385 15.843 7.605 1.00 0.00 C ATOM 1720 CD1 LEU A1022 2.697 15.093 8.747 1.00 0.00 C ATOM 1721 CD2 LEU A1022 4.212 14.908 6.721 1.00 0.00 C ATOM 0 H LEU A1022 0.786 17.633 5.149 1.00 0.00 H new ATOM 0 HA LEU A1022 2.005 15.186 5.282 1.00 0.00 H new ATOM 0 HB2 LEU A1022 2.913 17.286 6.096 1.00 0.00 H new ATOM 0 HB3 LEU A1022 1.794 17.266 7.445 1.00 0.00 H new ATOM 0 HG LEU A1022 4.077 16.553 8.057 1.00 0.00 H new ATOM 0 HD11 LEU A1022 3.442 14.544 9.322 1.00 0.00 H new ATOM 0 HD12 LEU A1022 2.190 15.806 9.397 1.00 0.00 H new ATOM 0 HD13 LEU A1022 1.968 14.394 8.336 1.00 0.00 H new ATOM 0 HD21 LEU A1022 4.927 14.362 7.337 1.00 0.00 H new ATOM 0 HD22 LEU A1022 3.550 14.201 6.220 1.00 0.00 H new ATOM 0 HD23 LEU A1022 4.749 15.493 5.975 1.00 0.00 H new ATOM 1733 N THR A1023 -0.419 15.385 7.489 1.00 0.00 N ATOM 1734 CA THR A1023 -1.294 14.586 8.329 1.00 0.00 C ATOM 1735 C THR A1023 -1.779 13.349 7.570 1.00 0.00 C ATOM 1736 O THR A1023 -1.667 12.228 8.065 1.00 0.00 O ATOM 1737 CB THR A1023 -2.433 15.484 8.816 1.00 0.00 C ATOM 1738 OG1 THR A1023 -1.795 16.725 9.106 1.00 0.00 O ATOM 1739 CG2 THR A1023 -3.000 15.032 10.163 1.00 0.00 C ATOM 0 H THR A1023 -0.618 16.385 7.496 1.00 0.00 H new ATOM 0 HA THR A1023 -0.764 14.206 9.202 1.00 0.00 H new ATOM 0 HB THR A1023 -3.230 15.495 8.073 1.00 0.00 H new ATOM 0 HG1 THR A1023 -2.461 17.368 9.427 1.00 0.00 H new ATOM 0 HG21 THR A1023 -3.805 15.703 10.463 1.00 0.00 H new ATOM 0 HG22 THR A1023 -3.388 14.017 10.072 1.00 0.00 H new ATOM 0 HG23 THR A1023 -2.211 15.053 10.915 1.00 0.00 H new ATOM 1747 N ALA A1024 -2.307 13.594 6.379 1.00 0.00 N ATOM 1748 CA ALA A1024 -2.809 12.514 5.547 1.00 0.00 C ATOM 1749 C ALA A1024 -1.657 11.573 5.190 1.00 0.00 C ATOM 1750 O ALA A1024 -1.805 10.353 5.252 1.00 0.00 O ATOM 1751 CB ALA A1024 -3.489 13.099 4.307 1.00 0.00 C ATOM 0 H ALA A1024 -2.398 14.524 5.971 1.00 0.00 H new ATOM 0 HA ALA A1024 -3.556 11.931 6.085 1.00 0.00 H new ATOM 0 HB1 ALA A1024 -3.866 12.289 3.682 1.00 0.00 H new ATOM 0 HB2 ALA A1024 -4.318 13.737 4.613 1.00 0.00 H new ATOM 0 HB3 ALA A1024 -2.768 13.689 3.741 1.00 0.00 H new ATOM 1757 N ALA A1025 -0.535 12.175 4.825 1.00 0.00 N ATOM 1758 CA ALA A1025 0.642 11.406 4.459 1.00 0.00 C ATOM 1759 C ALA A1025 0.927 10.367 5.546 1.00 0.00 C ATOM 1760 O ALA A1025 1.378 9.262 5.251 1.00 0.00 O ATOM 1761 CB ALA A1025 1.823 12.353 4.235 1.00 0.00 C ATOM 0 H ALA A1025 -0.416 13.187 4.775 1.00 0.00 H new ATOM 0 HA ALA A1025 0.473 10.869 3.526 1.00 0.00 H new ATOM 0 HB1 ALA A1025 2.706 11.775 3.960 1.00 0.00 H new ATOM 0 HB2 ALA A1025 1.583 13.051 3.433 1.00 0.00 H new ATOM 0 HB3 ALA A1025 2.023 12.908 5.152 1.00 0.00 H new ATOM 1767 N HIS A1026 0.650 10.760 6.781 1.00 0.00 N ATOM 1768 CA HIS A1026 0.870 9.877 7.914 1.00 0.00 C ATOM 1769 C HIS A1026 -0.056 8.664 7.807 1.00 0.00 C ATOM 1770 O HIS A1026 0.405 7.523 7.815 1.00 0.00 O ATOM 1771 CB HIS A1026 0.705 10.634 9.233 1.00 0.00 C ATOM 1772 CG HIS A1026 1.002 9.804 10.459 1.00 0.00 C ATOM 1773 ND1 HIS A1026 0.035 9.058 11.111 1.00 0.00 N ATOM 1774 CD2 HIS A1026 2.165 9.609 11.143 1.00 0.00 C ATOM 1775 CE1 HIS A1026 0.603 8.446 12.141 1.00 0.00 C ATOM 1776 NE2 HIS A1026 1.923 8.790 12.159 1.00 0.00 N ATOM 0 H HIS A1026 0.275 11.678 7.022 1.00 0.00 H new ATOM 0 HA HIS A1026 1.896 9.510 7.899 1.00 0.00 H new ATOM 0 HB2 HIS A1026 1.364 11.502 9.226 1.00 0.00 H new ATOM 0 HB3 HIS A1026 -0.316 11.009 9.299 1.00 0.00 H new ATOM 0 HD2 HIS A1026 3.122 10.047 10.899 1.00 0.00 H new ATOM 0 HE1 HIS A1026 0.108 7.791 12.842 1.00 0.00 H new ATOM 0 HE2 HIS A1026 2.611 8.470 12.841 1.00 0.00 H new ATOM 1784 N ALA A1027 -1.346 8.951 7.708 1.00 0.00 N ATOM 1785 CA ALA A1027 -2.341 7.898 7.600 1.00 0.00 C ATOM 1786 C ALA A1027 -2.137 7.143 6.284 1.00 0.00 C ATOM 1787 O ALA A1027 -2.339 5.931 6.222 1.00 0.00 O ATOM 1788 CB ALA A1027 -3.741 8.504 7.712 1.00 0.00 C ATOM 0 H ALA A1027 -1.725 9.898 7.700 1.00 0.00 H new ATOM 0 HA ALA A1027 -2.230 7.181 8.413 1.00 0.00 H new ATOM 0 HB1 ALA A1027 -4.487 7.714 7.631 1.00 0.00 H new ATOM 0 HB2 ALA A1027 -3.845 9.004 8.675 1.00 0.00 H new ATOM 0 HB3 ALA A1027 -3.890 9.227 6.910 1.00 0.00 H new ATOM 1794 N LEU A1028 -1.739 7.891 5.266 1.00 0.00 N ATOM 1795 CA LEU A1028 -1.505 7.308 3.955 1.00 0.00 C ATOM 1796 C LEU A1028 -0.485 6.174 4.081 1.00 0.00 C ATOM 1797 O LEU A1028 -0.820 5.007 3.884 1.00 0.00 O ATOM 1798 CB LEU A1028 -1.102 8.389 2.951 1.00 0.00 C ATOM 1799 CG LEU A1028 -2.249 9.063 2.195 1.00 0.00 C ATOM 1800 CD1 LEU A1028 -1.718 9.914 1.040 1.00 0.00 C ATOM 1801 CD2 LEU A1028 -3.275 8.032 1.723 1.00 0.00 C ATOM 0 H LEU A1028 -1.572 8.896 5.322 1.00 0.00 H new ATOM 0 HA LEU A1028 -2.423 6.870 3.564 1.00 0.00 H new ATOM 0 HB2 LEU A1028 -0.541 9.158 3.481 1.00 0.00 H new ATOM 0 HB3 LEU A1028 -0.424 7.945 2.222 1.00 0.00 H new ATOM 0 HG LEU A1028 -2.762 9.736 2.882 1.00 0.00 H new ATOM 0 HD11 LEU A1028 -2.553 10.382 0.519 1.00 0.00 H new ATOM 0 HD12 LEU A1028 -1.056 10.686 1.432 1.00 0.00 H new ATOM 0 HD13 LEU A1028 -1.166 9.281 0.345 1.00 0.00 H new ATOM 0 HD21 LEU A1028 -4.079 8.537 1.189 1.00 0.00 H new ATOM 0 HD22 LEU A1028 -2.792 7.316 1.058 1.00 0.00 H new ATOM 0 HD23 LEU A1028 -3.686 7.507 2.585 1.00 0.00 H new ATOM 1813 N ALA A1029 0.740 6.557 4.409 1.00 0.00 N ATOM 1814 CA ALA A1029 1.812 5.588 4.563 1.00 0.00 C ATOM 1815 C ALA A1029 1.263 4.332 5.243 1.00 0.00 C ATOM 1816 O ALA A1029 1.576 3.214 4.836 1.00 0.00 O ATOM 1817 CB ALA A1029 2.963 6.220 5.347 1.00 0.00 C ATOM 0 H ALA A1029 1.014 7.526 4.573 1.00 0.00 H new ATOM 0 HA ALA A1029 2.205 5.292 3.590 1.00 0.00 H new ATOM 0 HB1 ALA A1029 3.767 5.493 5.462 1.00 0.00 H new ATOM 0 HB2 ALA A1029 3.336 7.091 4.808 1.00 0.00 H new ATOM 0 HB3 ALA A1029 2.608 6.527 6.331 1.00 0.00 H new ATOM 1823 N VAL A1030 0.455 4.558 6.268 1.00 0.00 N ATOM 1824 CA VAL A1030 -0.140 3.459 7.009 1.00 0.00 C ATOM 1825 C VAL A1030 -1.168 2.751 6.124 1.00 0.00 C ATOM 1826 O VAL A1030 -1.150 1.527 6.003 1.00 0.00 O ATOM 1827 CB VAL A1030 -0.735 3.973 8.322 1.00 0.00 C ATOM 1828 CG1 VAL A1030 -1.656 2.927 8.954 1.00 0.00 C ATOM 1829 CG2 VAL A1030 0.368 4.393 9.296 1.00 0.00 C ATOM 0 H VAL A1030 0.198 5.487 6.603 1.00 0.00 H new ATOM 0 HA VAL A1030 0.619 2.725 7.278 1.00 0.00 H new ATOM 0 HB VAL A1030 -1.335 4.854 8.095 1.00 0.00 H new ATOM 0 HG11 VAL A1030 -2.065 3.318 9.886 1.00 0.00 H new ATOM 0 HG12 VAL A1030 -2.471 2.698 8.268 1.00 0.00 H new ATOM 0 HG13 VAL A1030 -1.089 2.019 9.160 1.00 0.00 H new ATOM 0 HG21 VAL A1030 -0.082 4.754 10.221 1.00 0.00 H new ATOM 0 HG22 VAL A1030 1.007 3.537 9.513 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.965 5.187 8.849 1.00 0.00 H new ATOM 1839 N ASP A1031 -2.040 3.551 5.528 1.00 0.00 N ATOM 1840 CA ASP A1031 -3.074 3.016 4.658 1.00 0.00 C ATOM 1841 C ASP A1031 -2.464 1.953 3.743 1.00 0.00 C ATOM 1842 O ASP A1031 -2.824 0.779 3.822 1.00 0.00 O ATOM 1843 CB ASP A1031 -3.673 4.113 3.776 1.00 0.00 C ATOM 1844 CG ASP A1031 -4.465 5.186 4.525 1.00 0.00 C ATOM 1845 OD1 ASP A1031 -4.589 5.040 5.761 1.00 0.00 O ATOM 1846 OD2 ASP A1031 -4.928 6.128 3.846 1.00 0.00 O ATOM 0 H ASP A1031 -2.052 4.566 5.630 1.00 0.00 H new ATOM 0 HA ASP A1031 -3.857 2.591 5.286 1.00 0.00 H new ATOM 0 HB2 ASP A1031 -2.866 4.597 3.226 1.00 0.00 H new ATOM 0 HB3 ASP A1031 -4.328 3.648 3.039 1.00 0.00 H new ATOM 1851 N ALA A1032 -1.550 2.401 2.895 1.00 0.00 N ATOM 1852 CA ALA A1032 -0.887 1.503 1.965 1.00 0.00 C ATOM 1853 C ALA A1032 -0.254 0.347 2.743 1.00 0.00 C ATOM 1854 O ALA A1032 -0.058 -0.738 2.199 1.00 0.00 O ATOM 1855 CB ALA A1032 0.141 2.285 1.145 1.00 0.00 C ATOM 0 H ALA A1032 -1.253 3.375 2.833 1.00 0.00 H new ATOM 0 HA ALA A1032 -1.606 1.076 1.265 1.00 0.00 H new ATOM 0 HB1 ALA A1032 0.638 1.611 0.447 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -0.363 3.076 0.589 1.00 0.00 H new ATOM 0 HB3 ALA A1032 0.881 2.726 1.814 1.00 0.00 H new ATOM 1861 N LYS A1033 0.047 0.620 4.004 1.00 0.00 N ATOM 1862 CA LYS A1033 0.654 -0.384 4.862 1.00 0.00 C ATOM 1863 C LYS A1033 -0.391 -1.443 5.217 1.00 0.00 C ATOM 1864 O LYS A1033 -0.251 -2.608 4.846 1.00 0.00 O ATOM 1865 CB LYS A1033 1.301 0.275 6.082 1.00 0.00 C ATOM 1866 CG LYS A1033 2.728 -0.237 6.289 1.00 0.00 C ATOM 1867 CD LYS A1033 3.752 0.864 6.006 1.00 0.00 C ATOM 1868 CE LYS A1033 3.998 1.716 7.253 1.00 0.00 C ATOM 1869 NZ LYS A1033 4.661 2.988 6.889 1.00 0.00 N ATOM 0 H LYS A1033 -0.118 1.521 4.452 1.00 0.00 H new ATOM 0 HA LYS A1033 1.462 -0.895 4.339 1.00 0.00 H new ATOM 0 HB2 LYS A1033 1.314 1.357 5.951 1.00 0.00 H new ATOM 0 HB3 LYS A1033 0.704 0.069 6.971 1.00 0.00 H new ATOM 0 HG2 LYS A1033 2.845 -0.593 7.312 1.00 0.00 H new ATOM 0 HG3 LYS A1033 2.912 -1.087 5.632 1.00 0.00 H new ATOM 0 HD2 LYS A1033 4.690 0.417 5.675 1.00 0.00 H new ATOM 0 HD3 LYS A1033 3.396 1.497 5.193 1.00 0.00 H new ATOM 0 HE2 LYS A1033 3.051 1.922 7.752 1.00 0.00 H new ATOM 0 HE3 LYS A1033 4.618 1.165 7.960 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 5.218 3.333 7.697 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 5.290 2.831 6.076 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 3.941 3.695 6.638 1.00 0.00 H new ATOM 1883 N ASN A1034 -1.416 -1.002 5.932 1.00 0.00 N ATOM 1884 CA ASN A1034 -2.484 -1.898 6.341 1.00 0.00 C ATOM 1885 C ASN A1034 -2.810 -2.855 5.193 1.00 0.00 C ATOM 1886 O ASN A1034 -3.201 -3.998 5.424 1.00 0.00 O ATOM 1887 CB ASN A1034 -3.756 -1.119 6.682 1.00 0.00 C ATOM 1888 CG ASN A1034 -4.069 -1.207 8.177 1.00 0.00 C ATOM 1889 OD1 ASN A1034 -3.403 -1.890 8.938 1.00 0.00 O ATOM 1890 ND2 ASN A1034 -5.117 -0.479 8.554 1.00 0.00 N ATOM 0 H ASN A1034 -1.529 -0.036 6.238 1.00 0.00 H new ATOM 0 HA ASN A1034 -2.147 -2.443 7.223 1.00 0.00 H new ATOM 0 HB2 ASN A1034 -3.636 -0.075 6.393 1.00 0.00 H new ATOM 0 HB3 ASN A1034 -4.594 -1.514 6.108 1.00 0.00 H new ATOM 0 HD21 ASN A1034 -5.407 -0.470 9.532 1.00 0.00 H new ATOM 0 HD22 ASN A1034 -5.631 0.070 7.865 1.00 0.00 H new ATOM 1897 N LEU A1035 -2.636 -2.353 3.979 1.00 0.00 N ATOM 1898 CA LEU A1035 -2.906 -3.149 2.794 1.00 0.00 C ATOM 1899 C LEU A1035 -1.974 -4.362 2.776 1.00 0.00 C ATOM 1900 O LEU A1035 -2.415 -5.491 2.983 1.00 0.00 O ATOM 1901 CB LEU A1035 -2.814 -2.284 1.535 1.00 0.00 C ATOM 1902 CG LEU A1035 -2.621 -3.037 0.217 1.00 0.00 C ATOM 1903 CD1 LEU A1035 -3.586 -4.219 0.115 1.00 0.00 C ATOM 1904 CD2 LEU A1035 -2.746 -2.090 -0.979 1.00 0.00 C ATOM 0 H LEU A1035 -2.311 -1.405 3.791 1.00 0.00 H new ATOM 0 HA LEU A1035 -3.927 -3.531 2.816 1.00 0.00 H new ATOM 0 HB2 LEU A1035 -3.724 -1.688 1.460 1.00 0.00 H new ATOM 0 HB3 LEU A1035 -1.985 -1.587 1.657 1.00 0.00 H new ATOM 0 HG LEU A1035 -1.610 -3.444 0.201 1.00 0.00 H new ATOM 0 HD11 LEU A1035 -3.428 -4.737 -0.831 1.00 0.00 H new ATOM 0 HD12 LEU A1035 -3.406 -4.908 0.940 1.00 0.00 H new ATOM 0 HD13 LEU A1035 -4.613 -3.856 0.163 1.00 0.00 H new ATOM 0 HD21 LEU A1035 -2.605 -2.650 -1.903 1.00 0.00 H new ATOM 0 HD22 LEU A1035 -3.736 -1.633 -0.979 1.00 0.00 H new ATOM 0 HD23 LEU A1035 -1.987 -1.311 -0.907 1.00 0.00 H new ATOM 1916 N LEU A1036 -0.702 -4.087 2.528 1.00 0.00 N ATOM 1917 CA LEU A1036 0.296 -5.142 2.480 1.00 0.00 C ATOM 1918 C LEU A1036 0.371 -5.829 3.846 1.00 0.00 C ATOM 1919 O LEU A1036 0.522 -7.047 3.924 1.00 0.00 O ATOM 1920 CB LEU A1036 1.638 -4.589 1.996 1.00 0.00 C ATOM 1921 CG LEU A1036 2.424 -5.482 1.034 1.00 0.00 C ATOM 1922 CD1 LEU A1036 2.553 -4.826 -0.342 1.00 0.00 C ATOM 1923 CD2 LEU A1036 3.786 -5.856 1.622 1.00 0.00 C ATOM 0 H LEU A1036 -0.339 -3.149 2.358 1.00 0.00 H new ATOM 0 HA LEU A1036 0.011 -5.903 1.754 1.00 0.00 H new ATOM 0 HB2 LEU A1036 1.459 -3.632 1.507 1.00 0.00 H new ATOM 0 HB3 LEU A1036 2.262 -4.390 2.867 1.00 0.00 H new ATOM 0 HG LEU A1036 1.868 -6.409 0.897 1.00 0.00 H new ATOM 0 HD11 LEU A1036 3.116 -5.482 -1.006 1.00 0.00 H new ATOM 0 HD12 LEU A1036 1.560 -4.654 -0.758 1.00 0.00 H new ATOM 0 HD13 LEU A1036 3.075 -3.874 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A1036 4.324 -6.491 0.918 1.00 0.00 H new ATOM 0 HD22 LEU A1036 4.363 -4.950 1.808 1.00 0.00 H new ATOM 0 HD23 LEU A1036 3.642 -6.394 2.559 1.00 0.00 H new ATOM 1935 N ASP A1037 0.262 -5.018 4.887 1.00 0.00 N ATOM 1936 CA ASP A1037 0.315 -5.532 6.245 1.00 0.00 C ATOM 1937 C ASP A1037 -0.548 -6.792 6.343 1.00 0.00 C ATOM 1938 O ASP A1037 -0.145 -7.779 6.956 1.00 0.00 O ATOM 1939 CB ASP A1037 -0.228 -4.508 7.244 1.00 0.00 C ATOM 1940 CG ASP A1037 0.342 -4.620 8.659 1.00 0.00 C ATOM 1941 OD1 ASP A1037 0.127 -5.687 9.275 1.00 0.00 O ATOM 1942 OD2 ASP A1037 0.979 -3.637 9.094 1.00 0.00 O ATOM 0 H ASP A1037 0.137 -4.008 4.818 1.00 0.00 H new ATOM 0 HA ASP A1037 1.356 -5.750 6.482 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -0.022 -3.507 6.864 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -1.312 -4.613 7.296 1.00 0.00 H new ATOM 1947 N VAL A1038 -1.720 -6.716 5.729 1.00 0.00 N ATOM 1948 CA VAL A1038 -2.643 -7.838 5.740 1.00 0.00 C ATOM 1949 C VAL A1038 -2.092 -8.955 4.852 1.00 0.00 C ATOM 1950 O VAL A1038 -2.291 -10.135 5.136 1.00 0.00 O ATOM 1951 CB VAL A1038 -4.038 -7.372 5.317 1.00 0.00 C ATOM 1952 CG1 VAL A1038 -4.921 -8.561 4.935 1.00 0.00 C ATOM 1953 CG2 VAL A1038 -4.692 -6.533 6.417 1.00 0.00 C ATOM 0 H VAL A1038 -2.051 -5.896 5.221 1.00 0.00 H new ATOM 0 HA VAL A1038 -2.741 -8.242 6.748 1.00 0.00 H new ATOM 0 HB VAL A1038 -3.928 -6.741 4.435 1.00 0.00 H new ATOM 0 HG11 VAL A1038 -5.907 -8.202 4.638 1.00 0.00 H new ATOM 0 HG12 VAL A1038 -4.466 -9.100 4.104 1.00 0.00 H new ATOM 0 HG13 VAL A1038 -5.021 -9.230 5.790 1.00 0.00 H new ATOM 0 HG21 VAL A1038 -5.682 -6.214 6.091 1.00 0.00 H new ATOM 0 HG22 VAL A1038 -4.783 -7.130 7.324 1.00 0.00 H new ATOM 0 HG23 VAL A1038 -4.077 -5.656 6.620 1.00 0.00 H new ATOM 1963 N ILE A1039 -1.409 -8.544 3.793 1.00 0.00 N ATOM 1964 CA ILE A1039 -0.827 -9.495 2.862 1.00 0.00 C ATOM 1965 C ILE A1039 0.228 -10.332 3.587 1.00 0.00 C ATOM 1966 O ILE A1039 0.226 -11.559 3.491 1.00 0.00 O ATOM 1967 CB ILE A1039 -0.295 -8.774 1.622 1.00 0.00 C ATOM 1968 CG1 ILE A1039 -1.429 -8.447 0.648 1.00 0.00 C ATOM 1969 CG2 ILE A1039 0.819 -9.583 0.953 1.00 0.00 C ATOM 1970 CD1 ILE A1039 -0.940 -7.532 -0.476 1.00 0.00 C ATOM 0 H ILE A1039 -1.246 -7.565 3.560 1.00 0.00 H new ATOM 0 HA ILE A1039 -1.587 -10.186 2.498 1.00 0.00 H new ATOM 0 HB ILE A1039 0.140 -7.826 1.939 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -1.826 -9.369 0.224 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.246 -7.965 1.185 1.00 0.00 H new ATOM 0 HG21 ILE A1039 1.180 -9.048 0.074 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.640 -9.721 1.656 1.00 0.00 H new ATOM 0 HG23 ILE A1039 0.431 -10.556 0.652 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.766 -7.315 -1.154 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -0.566 -6.601 -0.050 1.00 0.00 H new ATOM 0 HD13 ILE A1039 -0.139 -8.027 -1.026 1.00 0.00 H new ATOM 1982 N ASP A1040 1.104 -9.636 4.296 1.00 0.00 N ATOM 1983 CA ASP A1040 2.163 -10.300 5.037 1.00 0.00 C ATOM 1984 C ASP A1040 1.559 -11.417 5.892 1.00 0.00 C ATOM 1985 O ASP A1040 2.087 -12.527 5.932 1.00 0.00 O ATOM 1986 CB ASP A1040 2.877 -9.322 5.973 1.00 0.00 C ATOM 1987 CG ASP A1040 4.405 -9.371 5.915 1.00 0.00 C ATOM 1988 OD1 ASP A1040 4.942 -10.495 6.018 1.00 0.00 O ATOM 1989 OD2 ASP A1040 5.002 -8.282 5.770 1.00 0.00 O ATOM 0 H ASP A1040 1.102 -8.619 4.373 1.00 0.00 H new ATOM 0 HA ASP A1040 2.878 -10.699 4.318 1.00 0.00 H new ATOM 0 HB2 ASP A1040 2.552 -8.310 5.733 1.00 0.00 H new ATOM 0 HB3 ASP A1040 2.560 -9.525 6.996 1.00 0.00 H new ATOM 1994 N GLN A1041 0.461 -11.084 6.553 1.00 0.00 N ATOM 1995 CA GLN A1041 -0.220 -12.044 7.405 1.00 0.00 C ATOM 1996 C GLN A1041 -0.962 -13.076 6.552 1.00 0.00 C ATOM 1997 O GLN A1041 -1.276 -14.167 7.026 1.00 0.00 O ATOM 1998 CB GLN A1041 -1.177 -11.341 8.369 1.00 0.00 C ATOM 1999 CG GLN A1041 -0.502 -11.078 9.717 1.00 0.00 C ATOM 2000 CD GLN A1041 -1.530 -11.062 10.851 1.00 0.00 C ATOM 2001 OE1 GLN A1041 -2.290 -11.995 11.048 1.00 0.00 O ATOM 2002 NE2 GLN A1041 -1.510 -9.951 11.582 1.00 0.00 N ATOM 0 H GLN A1041 0.025 -10.162 6.516 1.00 0.00 H new ATOM 0 HA GLN A1041 0.528 -12.564 8.003 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -1.509 -10.398 7.934 1.00 0.00 H new ATOM 0 HB3 GLN A1041 -2.066 -11.954 8.517 1.00 0.00 H new ATOM 0 HG2 GLN A1041 0.246 -11.848 9.910 1.00 0.00 H new ATOM 0 HG3 GLN A1041 0.024 -10.124 9.684 1.00 0.00 H new ATOM 0 HE21 GLN A1041 -0.847 -9.208 11.362 1.00 0.00 H new ATOM 0 HE22 GLN A1041 -2.158 -9.842 12.362 1.00 0.00 H new ATOM 2011 N ALA A1042 -1.219 -12.695 5.310 1.00 0.00 N ATOM 2012 CA ALA A1042 -1.917 -13.574 4.387 1.00 0.00 C ATOM 2013 C ALA A1042 -0.925 -14.577 3.794 1.00 0.00 C ATOM 2014 O ALA A1042 -1.134 -15.786 3.879 1.00 0.00 O ATOM 2015 CB ALA A1042 -2.613 -12.737 3.312 1.00 0.00 C ATOM 0 H ALA A1042 -0.957 -11.789 4.921 1.00 0.00 H new ATOM 0 HA ALA A1042 -2.688 -14.142 4.908 1.00 0.00 H new ATOM 0 HB1 ALA A1042 -3.136 -13.396 2.620 1.00 0.00 H new ATOM 0 HB2 ALA A1042 -3.329 -12.063 3.782 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -1.870 -12.155 2.767 1.00 0.00 H new ATOM 2021 N ARG A1043 0.133 -14.037 3.207 1.00 0.00 N ATOM 2022 CA ARG A1043 1.158 -14.869 2.601 1.00 0.00 C ATOM 2023 C ARG A1043 1.520 -16.028 3.531 1.00 0.00 C ATOM 2024 O ARG A1043 1.676 -17.163 3.084 1.00 0.00 O ATOM 2025 CB ARG A1043 2.418 -14.056 2.295 1.00 0.00 C ATOM 2026 CG ARG A1043 3.402 -14.868 1.450 1.00 0.00 C ATOM 2027 CD ARG A1043 4.485 -13.966 0.854 1.00 0.00 C ATOM 2028 NE ARG A1043 5.744 -14.115 1.618 1.00 0.00 N ATOM 2029 CZ ARG A1043 6.429 -15.263 1.721 1.00 0.00 C ATOM 2030 NH1 ARG A1043 5.980 -16.368 1.110 1.00 0.00 N ATOM 2031 NH2 ARG A1043 7.562 -15.305 2.435 1.00 0.00 N ATOM 0 H ARG A1043 0.302 -13.034 3.138 1.00 0.00 H new ATOM 0 HA ARG A1043 0.757 -15.261 1.666 1.00 0.00 H new ATOM 0 HB2 ARG A1043 2.146 -13.143 1.766 1.00 0.00 H new ATOM 0 HB3 ARG A1043 2.896 -13.754 3.227 1.00 0.00 H new ATOM 0 HG2 ARG A1043 3.864 -15.640 2.065 1.00 0.00 H new ATOM 0 HG3 ARG A1043 2.866 -15.377 0.649 1.00 0.00 H new ATOM 0 HD2 ARG A1043 4.651 -14.226 -0.191 1.00 0.00 H new ATOM 0 HD3 ARG A1043 4.157 -12.927 0.876 1.00 0.00 H new ATOM 0 HE ARG A1043 6.113 -13.293 2.096 1.00 0.00 H new ATOM 0 HH11 ARG A1043 5.117 -16.336 0.567 1.00 0.00 H new ATOM 0 HH12 ARG A1043 6.501 -17.241 1.188 1.00 0.00 H new ATOM 0 HH21 ARG A1043 7.903 -14.464 2.900 1.00 0.00 H new ATOM 0 HH22 ARG A1043 8.083 -16.178 2.514 1.00 0.00 H new ATOM 2045 N LEU A1044 1.643 -15.702 4.810 1.00 0.00 N ATOM 2046 CA LEU A1044 1.984 -16.702 5.807 1.00 0.00 C ATOM 2047 C LEU A1044 0.782 -17.623 6.032 1.00 0.00 C ATOM 2048 O LEU A1044 0.948 -18.810 6.306 1.00 0.00 O ATOM 2049 CB LEU A1044 2.492 -16.032 7.086 1.00 0.00 C ATOM 2050 CG LEU A1044 1.518 -15.073 7.773 1.00 0.00 C ATOM 2051 CD1 LEU A1044 0.459 -15.842 8.565 1.00 0.00 C ATOM 2052 CD2 LEU A1044 2.267 -14.065 8.647 1.00 0.00 C ATOM 0 H LEU A1044 1.513 -14.760 5.178 1.00 0.00 H new ATOM 0 HA LEU A1044 2.804 -17.327 5.454 1.00 0.00 H new ATOM 0 HB2 LEU A1044 2.765 -16.812 7.797 1.00 0.00 H new ATOM 0 HB3 LEU A1044 3.404 -15.484 6.848 1.00 0.00 H new ATOM 0 HG LEU A1044 0.995 -14.506 7.002 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -0.221 -15.137 9.044 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -0.103 -16.487 7.890 1.00 0.00 H new ATOM 0 HD13 LEU A1044 0.945 -16.451 9.327 1.00 0.00 H new ATOM 0 HD21 LEU A1044 1.552 -13.395 9.124 1.00 0.00 H new ATOM 0 HD22 LEU A1044 2.833 -14.597 9.412 1.00 0.00 H new ATOM 0 HD23 LEU A1044 2.951 -13.484 8.028 1.00 0.00 H new ATOM 2064 N LYS A1045 -0.401 -17.040 5.907 1.00 0.00 N ATOM 2065 CA LYS A1045 -1.630 -17.793 6.093 1.00 0.00 C ATOM 2066 C LYS A1045 -1.579 -19.062 5.240 1.00 0.00 C ATOM 2067 O LYS A1045 -2.294 -20.025 5.511 1.00 0.00 O ATOM 2068 CB LYS A1045 -2.847 -16.910 5.809 1.00 0.00 C ATOM 2069 CG LYS A1045 -4.134 -17.579 6.297 1.00 0.00 C ATOM 2070 CD LYS A1045 -4.999 -18.028 5.118 1.00 0.00 C ATOM 2071 CE LYS A1045 -6.418 -18.369 5.577 1.00 0.00 C ATOM 2072 NZ LYS A1045 -6.454 -19.714 6.194 1.00 0.00 N ATOM 0 H LYS A1045 -0.535 -16.055 5.679 1.00 0.00 H new ATOM 0 HA LYS A1045 -1.730 -18.110 7.131 1.00 0.00 H new ATOM 0 HB2 LYS A1045 -2.724 -15.946 6.302 1.00 0.00 H new ATOM 0 HB3 LYS A1045 -2.917 -16.714 4.739 1.00 0.00 H new ATOM 0 HG2 LYS A1045 -3.888 -18.439 6.920 1.00 0.00 H new ATOM 0 HG3 LYS A1045 -4.696 -16.884 6.921 1.00 0.00 H new ATOM 0 HD2 LYS A1045 -5.036 -17.238 4.368 1.00 0.00 H new ATOM 0 HD3 LYS A1045 -4.548 -18.899 4.642 1.00 0.00 H new ATOM 0 HE2 LYS A1045 -6.764 -17.624 6.294 1.00 0.00 H new ATOM 0 HE3 LYS A1045 -7.100 -18.334 4.727 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 -7.424 -19.930 6.500 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 -6.144 -20.423 5.499 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 -5.819 -19.735 7.017 1.00 0.00 H new ATOM 2086 N MET A1046 -0.726 -19.022 4.226 1.00 0.00 N ATOM 2087 CA MET A1046 -0.572 -20.157 3.332 1.00 0.00 C ATOM 2088 C MET A1046 0.538 -21.091 3.817 1.00 0.00 C ATOM 2089 O MET A1046 0.523 -22.285 3.523 1.00 0.00 O ATOM 2090 CB MET A1046 -0.241 -19.657 1.925 1.00 0.00 C ATOM 2091 CG MET A1046 0.340 -20.782 1.066 1.00 0.00 C ATOM 2092 SD MET A1046 0.597 -20.205 -0.604 1.00 0.00 S ATOM 2093 CE MET A1046 1.538 -18.724 -0.278 1.00 0.00 C ATOM 0 H MET A1046 -0.135 -18.221 4.004 1.00 0.00 H new ATOM 0 HA MET A1046 -1.509 -20.714 3.318 1.00 0.00 H new ATOM 0 HB2 MET A1046 -1.142 -19.263 1.454 1.00 0.00 H new ATOM 0 HB3 MET A1046 0.473 -18.835 1.986 1.00 0.00 H new ATOM 0 HG2 MET A1046 1.284 -21.124 1.490 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.337 -21.636 1.064 1.00 0.00 H new ATOM 0 HE1 MET A1046 2.187 -18.511 -1.127 1.00 0.00 H new ATOM 0 HE2 MET A1046 0.857 -17.887 -0.123 1.00 0.00 H new ATOM 0 HE3 MET A1046 2.145 -18.868 0.616 1.00 0.00 H new ATOM 2103 N ILE A1047 1.476 -20.511 4.552 1.00 0.00 N ATOM 2104 CA ILE A1047 2.592 -21.276 5.081 1.00 0.00 C ATOM 2105 C ILE A1047 2.075 -22.602 5.643 1.00 0.00 C ATOM 2106 O ILE A1047 2.532 -23.671 5.241 1.00 0.00 O ATOM 2107 CB ILE A1047 3.380 -20.444 6.095 1.00 0.00 C ATOM 2108 CG1 ILE A1047 4.117 -19.294 5.405 1.00 0.00 C ATOM 2109 CG2 ILE A1047 4.329 -21.326 6.909 1.00 0.00 C ATOM 2110 CD1 ILE A1047 5.490 -19.745 4.903 1.00 0.00 C ATOM 0 H ILE A1047 1.486 -19.520 4.793 1.00 0.00 H new ATOM 0 HA ILE A1047 3.297 -21.519 4.286 1.00 0.00 H new ATOM 0 HB ILE A1047 2.673 -20.000 6.796 1.00 0.00 H new ATOM 0 HG12 ILE A1047 3.523 -18.927 4.568 1.00 0.00 H new ATOM 0 HG13 ILE A1047 4.235 -18.464 6.101 1.00 0.00 H new ATOM 0 HG21 ILE A1047 4.877 -20.710 7.622 1.00 0.00 H new ATOM 0 HG22 ILE A1047 3.754 -22.079 7.447 1.00 0.00 H new ATOM 0 HG23 ILE A1047 5.033 -21.818 6.238 1.00 0.00 H new ATOM 0 HD11 ILE A1047 5.992 -18.909 4.417 1.00 0.00 H new ATOM 0 HD12 ILE A1047 6.090 -20.089 5.745 1.00 0.00 H new ATOM 0 HD13 ILE A1047 5.367 -20.559 4.189 1.00 0.00 H new