USER MOD reduce.3.24.130724 H: found=0, std=0, add=1432, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1434 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 51 ASN : amide:sc= -3.62! C(o=-6.3!,f=-6.3!) USER MOD Set 1.2: B 70 SER OG : rot 180:sc= -2.68! USER MOD Set 2.1: A 70 SER OG : rot 172:sc= -4.6! USER MOD Set 2.2: B 51 ASN : amide:sc= -6.83! C(o=-11!,f=-12!) USER MOD Single : A 6 ASN :FLIP amide:sc= -7.29! C(o=-9.2!,f=-7.3!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 HIS : no HD1:sc= -1.19 X(o=-1.2,f=-1.5) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -140:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0.151 USER MOD Single : A 45 LYS NZ :NH3+ 163:sc= -0.187 (180deg=-0.933) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot -75:sc= 0.609 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.0897 K(o=-0.09,f=-1.2) USER MOD Single : A 65 ASN :FLIP amide:sc= -2.65! C(o=-3.2!,f=-2.6!) USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 68 THR OG1 : rot -130:sc= -0.578 USER MOD Single : A 79 SER OG : rot -162:sc= -3.29! USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 6 ASN :FLIP amide:sc= -5.93! C(o=-7.3!,f=-5.9!) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ -157:sc= -0.195 (180deg=-1.03) USER MOD Single : B 15 ASN : amide:sc= -2.33! C(o=-2.3!,f=-3.4!) USER MOD Single : B 19 HIS : no HD1:sc= -2.35 X(o=-2.4,f=-2.6!) USER MOD Single : B 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 29 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot -130:sc=-0.00101 USER MOD Single : B 44 SER OG : rot 82:sc= 0.802 USER MOD Single : B 45 LYS NZ :NH3+ 158:sc= -0.153 (180deg=-1.02) USER MOD Single : B 50 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 84:sc= 0.473 USER MOD Single : B 54 LYS NZ :NH3+ 150:sc= -0.137 (180deg=-0.708) USER MOD Single : B 62 GLN : amide:sc= -0.0646 K(o=-0.065,f=-0.93) USER MOD Single : B 65 ASN :FLIP amide:sc= -2.55! C(o=-3.3!,f=-2.6!) USER MOD Single : B 67 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 68 THR OG1 : rot -125:sc= -1.38 USER MOD Single : B 79 SER OG : rot -121:sc= -1.46 USER MOD Single : B 80 TYR OH : rot 180:sc= 0 USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 89 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N ASN A 6 15.824 -0.129 -10.410 1.00 0.26 N ATOM 91 CA ASN A 6 16.007 -1.357 -9.585 1.00 0.26 C ATOM 92 C ASN A 6 14.673 -1.858 -9.041 1.00 0.24 C ATOM 93 O ASN A 6 14.150 -1.334 -8.079 1.00 0.26 O ATOM 94 CB ASN A 6 16.925 -1.032 -8.413 1.00 0.35 C ATOM 95 CG ASN A 6 17.595 -2.308 -7.894 1.00 0.93 C ATOM 96 OD1 ASN A 6 17.936 -2.382 -6.638 1.00 1.72 O flip ATOM 97 ND2 ASN A 6 17.815 -3.246 -8.635 1.00 1.39 N flip ATOM 0 HA ASN A 6 16.441 -2.135 -10.213 1.00 0.26 H new ATOM 0 HB2 ASN A 6 17.685 -0.315 -8.725 1.00 0.35 H new ATOM 0 HB3 ASN A 6 16.353 -0.562 -7.613 1.00 0.35 H new ATOM 0 HD21 ASN A 6 17.550 -3.192 -9.618 1.00 1.39 H new ATOM 0 HD22 ASN A 6 18.265 -4.087 -8.273 1.00 1.39 H new ATOM 104 N GLU A 7 14.137 -2.891 -9.626 1.00 0.25 N ATOM 105 CA GLU A 7 12.857 -3.446 -9.115 1.00 0.28 C ATOM 106 C GLU A 7 13.176 -4.534 -8.092 1.00 0.28 C ATOM 107 O GLU A 7 13.926 -5.448 -8.375 1.00 0.30 O ATOM 108 CB GLU A 7 12.048 -4.029 -10.272 1.00 0.35 C ATOM 109 CG GLU A 7 12.726 -5.302 -10.784 1.00 0.44 C ATOM 110 CD GLU A 7 12.321 -5.546 -12.239 1.00 0.75 C ATOM 111 OE1 GLU A 7 11.312 -6.199 -12.451 1.00 1.12 O ATOM 112 OE2 GLU A 7 13.027 -5.077 -13.116 1.00 1.44 O ATOM 0 H GLU A 7 14.530 -3.373 -10.434 1.00 0.25 H new ATOM 0 HA GLU A 7 12.267 -2.660 -8.644 1.00 0.28 H new ATOM 0 HB2 GLU A 7 11.033 -4.253 -9.943 1.00 0.35 H new ATOM 0 HB3 GLU A 7 11.968 -3.299 -11.077 1.00 0.35 H new ATOM 0 HG2 GLU A 7 13.809 -5.206 -10.708 1.00 0.44 H new ATOM 0 HG3 GLU A 7 12.438 -6.153 -10.167 1.00 0.44 H new ATOM 119 N ILE A 8 12.644 -4.417 -6.896 1.00 0.28 N ATOM 120 CA ILE A 8 12.958 -5.438 -5.829 1.00 0.31 C ATOM 121 C ILE A 8 11.695 -5.832 -5.048 1.00 0.28 C ATOM 122 O ILE A 8 10.752 -5.086 -4.954 1.00 0.28 O ATOM 123 CB ILE A 8 13.984 -4.843 -4.848 1.00 0.35 C ATOM 124 CG1 ILE A 8 15.084 -4.111 -5.626 1.00 0.42 C ATOM 125 CG2 ILE A 8 14.623 -5.957 -4.006 1.00 0.56 C ATOM 126 CD1 ILE A 8 16.120 -3.546 -4.649 1.00 1.11 C ATOM 0 H ILE A 8 12.012 -3.669 -6.610 1.00 0.28 H new ATOM 0 HA ILE A 8 13.359 -6.328 -6.314 1.00 0.31 H new ATOM 0 HB ILE A 8 13.469 -4.143 -4.190 1.00 0.35 H new ATOM 0 HG12 ILE A 8 15.565 -4.795 -6.325 1.00 0.42 H new ATOM 0 HG13 ILE A 8 14.650 -3.305 -6.217 1.00 0.42 H new ATOM 0 HG21 ILE A 8 15.347 -5.522 -3.316 1.00 0.56 H new ATOM 0 HG22 ILE A 8 13.849 -6.475 -3.440 1.00 0.56 H new ATOM 0 HG23 ILE A 8 15.128 -6.665 -4.663 1.00 0.56 H new ATOM 0 HD11 ILE A 8 16.900 -3.027 -5.206 1.00 1.11 H new ATOM 0 HD12 ILE A 8 15.634 -2.848 -3.967 1.00 1.11 H new ATOM 0 HD13 ILE A 8 16.564 -4.361 -4.078 1.00 1.11 H new ATOM 138 N VAL A 9 11.691 -7.015 -4.486 1.00 0.28 N ATOM 139 CA VAL A 9 10.521 -7.499 -3.690 1.00 0.27 C ATOM 140 C VAL A 9 10.901 -7.493 -2.201 1.00 0.24 C ATOM 141 O VAL A 9 11.993 -7.879 -1.834 1.00 0.25 O ATOM 142 CB VAL A 9 10.190 -8.933 -4.133 1.00 0.30 C ATOM 143 CG1 VAL A 9 8.926 -9.447 -3.432 1.00 1.35 C ATOM 144 CG2 VAL A 9 9.967 -8.956 -5.646 1.00 1.27 C ATOM 0 H VAL A 9 12.464 -7.678 -4.547 1.00 0.28 H new ATOM 0 HA VAL A 9 9.656 -6.855 -3.848 1.00 0.27 H new ATOM 0 HB VAL A 9 11.026 -9.579 -3.863 1.00 0.30 H new ATOM 0 HG11 VAL A 9 8.714 -10.464 -3.763 1.00 1.35 H new ATOM 0 HG12 VAL A 9 9.081 -9.442 -2.353 1.00 1.35 H new ATOM 0 HG13 VAL A 9 8.084 -8.801 -3.681 1.00 1.35 H new ATOM 0 HG21 VAL A 9 9.732 -9.972 -5.964 1.00 1.27 H new ATOM 0 HG22 VAL A 9 9.139 -8.295 -5.902 1.00 1.27 H new ATOM 0 HG23 VAL A 9 10.871 -8.618 -6.152 1.00 1.27 H new ATOM 154 N VAL A 10 10.013 -7.072 -1.340 1.00 0.23 N ATOM 155 CA VAL A 10 10.342 -7.061 0.118 1.00 0.22 C ATOM 156 C VAL A 10 9.910 -8.393 0.727 1.00 0.20 C ATOM 157 O VAL A 10 9.144 -9.126 0.132 1.00 0.20 O ATOM 158 CB VAL A 10 9.598 -5.909 0.815 1.00 0.23 C ATOM 159 CG1 VAL A 10 8.185 -6.360 1.201 1.00 0.33 C ATOM 160 CG2 VAL A 10 10.354 -5.496 2.082 1.00 0.39 C ATOM 0 H VAL A 10 9.080 -6.737 -1.579 1.00 0.23 H new ATOM 0 HA VAL A 10 11.414 -6.919 0.252 1.00 0.22 H new ATOM 0 HB VAL A 10 9.538 -5.063 0.131 1.00 0.23 H new ATOM 0 HG11 VAL A 10 7.663 -5.540 1.694 1.00 0.33 H new ATOM 0 HG12 VAL A 10 7.638 -6.651 0.304 1.00 0.33 H new ATOM 0 HG13 VAL A 10 8.247 -7.211 1.880 1.00 0.33 H new ATOM 0 HG21 VAL A 10 9.824 -4.680 2.572 1.00 0.39 H new ATOM 0 HG22 VAL A 10 10.419 -6.346 2.761 1.00 0.39 H new ATOM 0 HG23 VAL A 10 11.359 -5.167 1.815 1.00 0.39 H new ATOM 170 N ARG A 11 10.404 -8.708 1.901 1.00 0.20 N ATOM 171 CA ARG A 11 10.038 -9.998 2.564 1.00 0.19 C ATOM 172 C ARG A 11 9.592 -9.739 3.994 1.00 0.22 C ATOM 173 O ARG A 11 9.852 -8.701 4.568 1.00 0.22 O ATOM 174 CB ARG A 11 11.250 -10.933 2.612 1.00 0.20 C ATOM 175 CG ARG A 11 12.281 -10.524 1.563 1.00 0.30 C ATOM 176 CD ARG A 11 13.211 -11.703 1.281 1.00 0.34 C ATOM 177 NE ARG A 11 14.330 -11.255 0.407 1.00 1.17 N ATOM 178 CZ ARG A 11 14.120 -11.032 -0.863 1.00 1.42 C ATOM 179 NH1 ARG A 11 12.928 -11.202 -1.367 1.00 1.51 N ATOM 180 NH2 ARG A 11 15.101 -10.639 -1.628 1.00 2.27 N ATOM 0 H ARG A 11 11.049 -8.122 2.431 1.00 0.20 H new ATOM 0 HA ARG A 11 9.232 -10.456 1.990 1.00 0.19 H new ATOM 0 HB2 ARG A 11 11.700 -10.904 3.604 1.00 0.20 H new ATOM 0 HB3 ARG A 11 10.932 -11.961 2.437 1.00 0.20 H new ATOM 0 HG2 ARG A 11 11.780 -10.214 0.646 1.00 0.30 H new ATOM 0 HG3 ARG A 11 12.857 -9.669 1.917 1.00 0.30 H new ATOM 0 HD2 ARG A 11 13.603 -12.102 2.216 1.00 0.34 H new ATOM 0 HD3 ARG A 11 12.658 -12.509 0.798 1.00 0.34 H new ATOM 0 HE ARG A 11 15.262 -11.122 0.800 1.00 1.17 H new ATOM 0 HH11 ARG A 11 12.161 -11.509 -0.769 1.00 1.51 H new ATOM 0 HH12 ARG A 11 12.764 -11.028 -2.359 1.00 1.51 H new ATOM 0 HH21 ARG A 11 16.033 -10.506 -1.235 1.00 2.27 H new ATOM 0 HH22 ARG A 11 14.936 -10.465 -2.619 1.00 2.27 H new ATOM 194 N LYS A 12 8.943 -10.701 4.575 1.00 0.27 N ATOM 195 CA LYS A 12 8.490 -10.565 5.978 1.00 0.32 C ATOM 196 C LYS A 12 9.534 -11.201 6.876 1.00 0.35 C ATOM 197 O LYS A 12 9.582 -10.964 8.066 1.00 0.43 O ATOM 198 CB LYS A 12 7.154 -11.285 6.163 1.00 0.35 C ATOM 199 CG LYS A 12 7.278 -12.767 5.752 1.00 0.38 C ATOM 200 CD LYS A 12 7.457 -13.670 6.980 1.00 1.05 C ATOM 201 CE LYS A 12 7.372 -15.129 6.536 1.00 1.03 C ATOM 202 NZ LYS A 12 7.636 -16.019 7.701 1.00 1.78 N ATOM 0 H LYS A 12 8.704 -11.588 4.131 1.00 0.27 H new ATOM 0 HA LYS A 12 8.361 -9.512 6.229 1.00 0.32 H new ATOM 0 HB2 LYS A 12 6.838 -11.215 7.204 1.00 0.35 H new ATOM 0 HB3 LYS A 12 6.385 -10.798 5.563 1.00 0.35 H new ATOM 0 HG2 LYS A 12 6.388 -13.070 5.201 1.00 0.38 H new ATOM 0 HG3 LYS A 12 8.127 -12.891 5.079 1.00 0.38 H new ATOM 0 HD2 LYS A 12 8.419 -13.475 7.454 1.00 1.05 H new ATOM 0 HD3 LYS A 12 6.687 -13.456 7.721 1.00 1.05 H new ATOM 0 HE2 LYS A 12 6.385 -15.337 6.122 1.00 1.03 H new ATOM 0 HE3 LYS A 12 8.097 -15.322 5.745 1.00 1.03 H new ATOM 0 HZ1 LYS A 12 7.578 -17.013 7.399 1.00 1.78 H new ATOM 0 HZ2 LYS A 12 8.586 -15.826 8.077 1.00 1.78 H new ATOM 0 HZ3 LYS A 12 6.928 -15.841 8.442 1.00 1.78 H new ATOM 216 N THR A 13 10.377 -12.012 6.306 1.00 0.34 N ATOM 217 CA THR A 13 11.427 -12.665 7.123 1.00 0.44 C ATOM 218 C THR A 13 12.481 -11.620 7.476 1.00 0.58 C ATOM 219 O THR A 13 12.930 -11.534 8.602 1.00 1.08 O ATOM 220 CB THR A 13 12.069 -13.834 6.353 1.00 0.48 C ATOM 221 OG1 THR A 13 13.242 -14.253 7.036 1.00 1.24 O ATOM 222 CG2 THR A 13 12.441 -13.414 4.925 1.00 1.01 C ATOM 0 H THR A 13 10.383 -12.249 5.314 1.00 0.34 H new ATOM 0 HA THR A 13 10.984 -13.071 8.032 1.00 0.44 H new ATOM 0 HB THR A 13 11.349 -14.650 6.298 1.00 0.48 H new ATOM 0 HG1 THR A 13 13.654 -14.998 6.551 1.00 1.24 H new ATOM 0 HG21 THR A 13 12.892 -14.258 4.403 1.00 1.01 H new ATOM 0 HG22 THR A 13 11.544 -13.097 4.394 1.00 1.01 H new ATOM 0 HG23 THR A 13 13.152 -12.588 4.962 1.00 1.01 H new ATOM 230 N LYS A 14 12.882 -10.822 6.525 1.00 0.35 N ATOM 231 CA LYS A 14 13.903 -9.779 6.793 1.00 0.43 C ATOM 232 C LYS A 14 13.254 -8.619 7.546 1.00 0.57 C ATOM 233 O LYS A 14 12.101 -8.302 7.337 1.00 1.34 O ATOM 234 CB LYS A 14 14.433 -9.286 5.440 1.00 0.39 C ATOM 235 CG LYS A 14 15.957 -9.386 5.384 1.00 0.60 C ATOM 236 CD LYS A 14 16.416 -9.114 3.951 1.00 0.86 C ATOM 237 CE LYS A 14 16.510 -10.435 3.183 1.00 1.06 C ATOM 238 NZ LYS A 14 17.840 -11.057 3.434 1.00 1.41 N ATOM 0 H LYS A 14 12.540 -10.851 5.564 1.00 0.35 H new ATOM 0 HA LYS A 14 14.717 -10.180 7.397 1.00 0.43 H new ATOM 0 HB2 LYS A 14 13.996 -9.878 4.636 1.00 0.39 H new ATOM 0 HB3 LYS A 14 14.126 -8.253 5.279 1.00 0.39 H new ATOM 0 HG2 LYS A 14 16.408 -8.667 6.068 1.00 0.60 H new ATOM 0 HG3 LYS A 14 16.282 -10.376 5.703 1.00 0.60 H new ATOM 0 HD2 LYS A 14 15.715 -8.442 3.455 1.00 0.86 H new ATOM 0 HD3 LYS A 14 17.385 -8.615 3.957 1.00 0.86 H new ATOM 0 HE2 LYS A 14 15.715 -11.110 3.499 1.00 1.06 H new ATOM 0 HE3 LYS A 14 16.374 -10.259 2.116 1.00 1.06 H new ATOM 0 HZ1 LYS A 14 17.907 -11.955 2.914 1.00 1.41 H new ATOM 0 HZ2 LYS A 14 18.591 -10.413 3.112 1.00 1.41 H new ATOM 0 HZ3 LYS A 14 17.952 -11.238 4.452 1.00 1.41 H new ATOM 252 N ASN A 15 13.982 -7.977 8.418 1.00 0.43 N ATOM 253 CA ASN A 15 13.396 -6.834 9.170 1.00 0.33 C ATOM 254 C ASN A 15 13.166 -5.679 8.200 1.00 0.24 C ATOM 255 O ASN A 15 13.444 -5.790 7.022 1.00 0.24 O ATOM 256 CB ASN A 15 14.362 -6.395 10.272 1.00 0.47 C ATOM 257 CG ASN A 15 14.111 -7.230 11.529 1.00 0.56 C ATOM 258 OD1 ASN A 15 14.726 -8.261 11.719 1.00 1.23 O ATOM 259 ND2 ASN A 15 13.227 -6.827 12.399 1.00 1.25 N ATOM 0 H ASN A 15 14.953 -8.194 8.641 1.00 0.43 H new ATOM 0 HA ASN A 15 12.451 -7.132 9.624 1.00 0.33 H new ATOM 0 HB2 ASN A 15 15.392 -6.520 9.939 1.00 0.47 H new ATOM 0 HB3 ASN A 15 14.224 -5.336 10.492 1.00 0.47 H new ATOM 0 HD21 ASN A 15 13.051 -7.377 13.240 1.00 1.25 H new ATOM 0 HD22 ASN A 15 12.711 -5.962 12.239 1.00 1.25 H new ATOM 266 N VAL A 16 12.665 -4.571 8.667 1.00 0.24 N ATOM 267 CA VAL A 16 12.430 -3.431 7.746 1.00 0.22 C ATOM 268 C VAL A 16 13.753 -2.715 7.474 1.00 0.23 C ATOM 269 O VAL A 16 14.106 -2.452 6.341 1.00 0.25 O ATOM 270 CB VAL A 16 11.438 -2.460 8.389 1.00 0.29 C ATOM 271 CG1 VAL A 16 10.134 -3.200 8.692 1.00 0.31 C ATOM 272 CG2 VAL A 16 12.021 -1.916 9.695 1.00 0.49 C ATOM 0 H VAL A 16 12.410 -4.408 9.641 1.00 0.24 H new ATOM 0 HA VAL A 16 12.020 -3.797 6.804 1.00 0.22 H new ATOM 0 HB VAL A 16 11.246 -1.633 7.705 1.00 0.29 H new ATOM 0 HG11 VAL A 16 9.423 -2.512 9.151 1.00 0.31 H new ATOM 0 HG12 VAL A 16 9.714 -3.591 7.765 1.00 0.31 H new ATOM 0 HG13 VAL A 16 10.334 -4.024 9.376 1.00 0.31 H new ATOM 0 HG21 VAL A 16 11.312 -1.225 10.150 1.00 0.49 H new ATOM 0 HG22 VAL A 16 12.213 -2.742 10.380 1.00 0.49 H new ATOM 0 HG23 VAL A 16 12.954 -1.393 9.487 1.00 0.49 H new ATOM 282 N GLU A 17 14.483 -2.379 8.502 1.00 0.27 N ATOM 283 CA GLU A 17 15.770 -1.663 8.302 1.00 0.33 C ATOM 284 C GLU A 17 16.706 -2.481 7.411 1.00 0.34 C ATOM 285 O GLU A 17 17.627 -1.951 6.827 1.00 0.37 O ATOM 286 CB GLU A 17 16.435 -1.432 9.661 1.00 0.39 C ATOM 287 CG GLU A 17 17.008 -2.750 10.185 1.00 0.86 C ATOM 288 CD GLU A 17 16.901 -2.783 11.711 1.00 1.03 C ATOM 289 OE1 GLU A 17 17.054 -1.736 12.319 1.00 1.56 O ATOM 290 OE2 GLU A 17 16.668 -3.854 12.246 1.00 1.41 O ATOM 0 H GLU A 17 14.241 -2.571 9.474 1.00 0.27 H new ATOM 0 HA GLU A 17 15.571 -0.708 7.816 1.00 0.33 H new ATOM 0 HB2 GLU A 17 17.229 -0.691 9.567 1.00 0.39 H new ATOM 0 HB3 GLU A 17 15.709 -1.033 10.369 1.00 0.39 H new ATOM 0 HG2 GLU A 17 16.466 -3.591 9.754 1.00 0.86 H new ATOM 0 HG3 GLU A 17 18.050 -2.852 9.881 1.00 0.86 H new ATOM 297 N ASP A 18 16.488 -3.759 7.276 1.00 0.35 N ATOM 298 CA ASP A 18 17.388 -4.549 6.400 1.00 0.38 C ATOM 299 C ASP A 18 17.149 -4.119 4.960 1.00 0.35 C ATOM 300 O ASP A 18 18.038 -4.139 4.132 1.00 0.34 O ATOM 301 CB ASP A 18 17.070 -6.033 6.551 1.00 0.46 C ATOM 302 CG ASP A 18 18.275 -6.860 6.101 1.00 0.66 C ATOM 303 OD1 ASP A 18 18.626 -6.773 4.936 1.00 1.27 O ATOM 304 OD2 ASP A 18 18.822 -7.571 6.928 1.00 1.38 O ATOM 0 H ASP A 18 15.737 -4.282 7.727 1.00 0.35 H new ATOM 0 HA ASP A 18 18.429 -4.380 6.675 1.00 0.38 H new ATOM 0 HB2 ASP A 18 16.827 -6.260 7.589 1.00 0.46 H new ATOM 0 HB3 ASP A 18 16.195 -6.291 5.955 1.00 0.46 H new ATOM 309 N HIS A 19 15.949 -3.711 4.665 1.00 0.34 N ATOM 310 CA HIS A 19 15.641 -3.255 3.283 1.00 0.33 C ATOM 311 C HIS A 19 15.925 -1.755 3.178 1.00 0.28 C ATOM 312 O HIS A 19 16.204 -1.242 2.112 1.00 0.27 O ATOM 313 CB HIS A 19 14.172 -3.530 2.956 1.00 0.36 C ATOM 314 CG HIS A 19 14.080 -4.750 2.082 1.00 0.53 C ATOM 315 ND1 HIS A 19 14.384 -6.021 2.549 1.00 1.22 N ATOM 316 CD2 HIS A 19 13.730 -4.908 0.764 1.00 1.43 C ATOM 317 CE1 HIS A 19 14.214 -6.880 1.526 1.00 1.27 C ATOM 318 NE2 HIS A 19 13.817 -6.251 0.419 1.00 1.40 N ATOM 0 H HIS A 19 15.168 -3.673 5.320 1.00 0.34 H new ATOM 0 HA HIS A 19 16.265 -3.798 2.573 1.00 0.33 H new ATOM 0 HB2 HIS A 19 13.605 -3.682 3.874 1.00 0.36 H new ATOM 0 HB3 HIS A 19 13.733 -2.671 2.449 1.00 0.36 H new ATOM 0 HD2 HIS A 19 13.433 -4.111 0.098 1.00 1.43 H new ATOM 0 HE1 HIS A 19 14.379 -7.945 1.594 1.00 1.27 H new ATOM 0 HE2 HIS A 19 13.619 -6.668 -0.490 1.00 1.40 H new ATOM 327 N VAL A 20 15.903 -1.050 4.281 1.00 0.26 N ATOM 328 CA VAL A 20 16.219 0.404 4.227 1.00 0.24 C ATOM 329 C VAL A 20 17.737 0.515 4.136 1.00 0.23 C ATOM 330 O VAL A 20 18.289 1.443 3.578 1.00 0.22 O ATOM 331 CB VAL A 20 15.675 1.108 5.490 1.00 0.25 C ATOM 332 CG1 VAL A 20 16.778 1.300 6.542 1.00 0.29 C ATOM 333 CG2 VAL A 20 15.117 2.481 5.106 1.00 0.29 C ATOM 0 H VAL A 20 15.682 -1.417 5.207 1.00 0.26 H new ATOM 0 HA VAL A 20 15.753 0.888 3.369 1.00 0.24 H new ATOM 0 HB VAL A 20 14.892 0.480 5.916 1.00 0.25 H new ATOM 0 HG11 VAL A 20 16.363 1.798 7.418 1.00 0.29 H new ATOM 0 HG12 VAL A 20 17.177 0.328 6.832 1.00 0.29 H new ATOM 0 HG13 VAL A 20 17.578 1.910 6.123 1.00 0.29 H new ATOM 0 HG21 VAL A 20 14.733 2.979 5.996 1.00 0.29 H new ATOM 0 HG22 VAL A 20 15.910 3.086 4.665 1.00 0.29 H new ATOM 0 HG23 VAL A 20 14.311 2.357 4.383 1.00 0.29 H new ATOM 343 N LEU A 21 18.400 -0.470 4.672 1.00 0.25 N ATOM 344 CA LEU A 21 19.882 -0.505 4.626 1.00 0.27 C ATOM 345 C LEU A 21 20.304 -0.897 3.212 1.00 0.27 C ATOM 346 O LEU A 21 21.139 -0.267 2.593 1.00 0.28 O ATOM 347 CB LEU A 21 20.397 -1.562 5.610 1.00 0.32 C ATOM 348 CG LEU A 21 20.360 -1.020 7.045 1.00 0.34 C ATOM 349 CD1 LEU A 21 20.441 -2.191 8.027 1.00 0.41 C ATOM 350 CD2 LEU A 21 21.545 -0.075 7.301 1.00 0.34 C ATOM 0 H LEU A 21 17.968 -1.263 5.147 1.00 0.25 H new ATOM 0 HA LEU A 21 20.291 0.469 4.894 1.00 0.27 H new ATOM 0 HB2 LEU A 21 19.787 -2.462 5.539 1.00 0.32 H new ATOM 0 HB3 LEU A 21 21.416 -1.846 5.348 1.00 0.32 H new ATOM 0 HG LEU A 21 19.431 -0.468 7.184 1.00 0.34 H new ATOM 0 HD11 LEU A 21 20.415 -1.812 9.049 1.00 0.41 H new ATOM 0 HD12 LEU A 21 19.595 -2.860 7.867 1.00 0.41 H new ATOM 0 HD13 LEU A 21 21.371 -2.737 7.866 1.00 0.41 H new ATOM 0 HD21 LEU A 21 21.499 0.297 8.324 1.00 0.34 H new ATOM 0 HD22 LEU A 21 22.480 -0.616 7.153 1.00 0.34 H new ATOM 0 HD23 LEU A 21 21.498 0.764 6.607 1.00 0.34 H new ATOM 362 N ASP A 22 19.717 -1.939 2.697 1.00 0.28 N ATOM 363 CA ASP A 22 20.065 -2.386 1.324 1.00 0.31 C ATOM 364 C ASP A 22 19.609 -1.333 0.310 1.00 0.29 C ATOM 365 O ASP A 22 20.115 -1.261 -0.792 1.00 0.31 O ATOM 366 CB ASP A 22 19.364 -3.714 1.028 1.00 0.36 C ATOM 367 CG ASP A 22 20.144 -4.476 -0.044 1.00 0.44 C ATOM 368 OD1 ASP A 22 20.978 -3.864 -0.690 1.00 1.22 O ATOM 369 OD2 ASP A 22 19.894 -5.660 -0.202 1.00 1.01 O ATOM 0 H ASP A 22 19.009 -2.501 3.170 1.00 0.28 H new ATOM 0 HA ASP A 22 21.144 -2.518 1.249 1.00 0.31 H new ATOM 0 HB2 ASP A 22 19.296 -4.312 1.937 1.00 0.36 H new ATOM 0 HB3 ASP A 22 18.344 -3.531 0.690 1.00 0.36 H new ATOM 374 N VAL A 23 18.663 -0.508 0.675 1.00 0.27 N ATOM 375 CA VAL A 23 18.183 0.545 -0.266 1.00 0.27 C ATOM 376 C VAL A 23 19.171 1.714 -0.283 1.00 0.26 C ATOM 377 O VAL A 23 19.651 2.117 -1.324 1.00 0.26 O ATOM 378 CB VAL A 23 16.806 1.046 0.180 1.00 0.28 C ATOM 379 CG1 VAL A 23 16.523 2.408 -0.457 1.00 0.31 C ATOM 380 CG2 VAL A 23 15.731 0.049 -0.263 1.00 0.32 C ATOM 0 H VAL A 23 18.202 -0.518 1.585 1.00 0.27 H new ATOM 0 HA VAL A 23 18.108 0.122 -1.268 1.00 0.27 H new ATOM 0 HB VAL A 23 16.793 1.142 1.266 1.00 0.28 H new ATOM 0 HG11 VAL A 23 15.543 2.762 -0.138 1.00 0.31 H new ATOM 0 HG12 VAL A 23 17.286 3.121 -0.145 1.00 0.31 H new ATOM 0 HG13 VAL A 23 16.539 2.312 -1.543 1.00 0.31 H new ATOM 0 HG21 VAL A 23 14.751 0.406 0.054 1.00 0.32 H new ATOM 0 HG22 VAL A 23 15.748 -0.046 -1.349 1.00 0.32 H new ATOM 0 HG23 VAL A 23 15.928 -0.923 0.190 1.00 0.32 H new ATOM 390 N ILE A 24 19.476 2.269 0.863 1.00 0.25 N ATOM 391 CA ILE A 24 20.427 3.415 0.899 1.00 0.26 C ATOM 392 C ILE A 24 21.732 2.997 0.225 1.00 0.26 C ATOM 393 O ILE A 24 22.435 3.809 -0.344 1.00 0.28 O ATOM 394 CB ILE A 24 20.687 3.841 2.354 1.00 0.30 C ATOM 395 CG1 ILE A 24 21.038 5.335 2.399 1.00 0.57 C ATOM 396 CG2 ILE A 24 21.848 3.032 2.937 1.00 0.45 C ATOM 397 CD1 ILE A 24 21.258 5.771 3.851 1.00 0.58 C ATOM 0 H ILE A 24 19.109 1.978 1.769 1.00 0.25 H new ATOM 0 HA ILE A 24 20.000 4.265 0.366 1.00 0.26 H new ATOM 0 HB ILE A 24 19.788 3.657 2.942 1.00 0.30 H new ATOM 0 HG12 ILE A 24 21.937 5.525 1.812 1.00 0.57 H new ATOM 0 HG13 ILE A 24 20.235 5.921 1.951 1.00 0.57 H new ATOM 0 HG21 ILE A 24 22.025 3.340 3.967 1.00 0.45 H new ATOM 0 HG22 ILE A 24 21.600 1.971 2.913 1.00 0.45 H new ATOM 0 HG23 ILE A 24 22.747 3.208 2.346 1.00 0.45 H new ATOM 0 HD11 ILE A 24 21.507 6.832 3.879 1.00 0.58 H new ATOM 0 HD12 ILE A 24 20.348 5.597 4.425 1.00 0.58 H new ATOM 0 HD13 ILE A 24 22.076 5.195 4.284 1.00 0.58 H new ATOM 409 N VAL A 25 22.053 1.732 0.260 1.00 0.26 N ATOM 410 CA VAL A 25 23.301 1.268 -0.408 1.00 0.29 C ATOM 411 C VAL A 25 23.079 1.313 -1.922 1.00 0.29 C ATOM 412 O VAL A 25 23.922 1.751 -2.678 1.00 0.31 O ATOM 413 CB VAL A 25 23.605 -0.169 0.031 1.00 0.31 C ATOM 414 CG1 VAL A 25 24.748 -0.739 -0.813 1.00 0.41 C ATOM 415 CG2 VAL A 25 24.013 -0.181 1.508 1.00 0.36 C ATOM 0 H VAL A 25 21.507 1.003 0.720 1.00 0.26 H new ATOM 0 HA VAL A 25 24.141 1.907 -0.136 1.00 0.29 H new ATOM 0 HB VAL A 25 22.713 -0.779 -0.107 1.00 0.31 H new ATOM 0 HG11 VAL A 25 24.960 -1.760 -0.497 1.00 0.41 H new ATOM 0 HG12 VAL A 25 24.460 -0.737 -1.864 1.00 0.41 H new ATOM 0 HG13 VAL A 25 25.639 -0.126 -0.680 1.00 0.41 H new ATOM 0 HG21 VAL A 25 24.229 -1.204 1.818 1.00 0.36 H new ATOM 0 HG22 VAL A 25 24.902 0.435 1.645 1.00 0.36 H new ATOM 0 HG23 VAL A 25 23.199 0.217 2.114 1.00 0.36 H new ATOM 425 N LEU A 26 21.942 0.853 -2.362 1.00 0.29 N ATOM 426 CA LEU A 26 21.632 0.851 -3.820 1.00 0.32 C ATOM 427 C LEU A 26 21.573 2.294 -4.338 1.00 0.32 C ATOM 428 O LEU A 26 22.038 2.598 -5.421 1.00 0.35 O ATOM 429 CB LEU A 26 20.276 0.169 -4.019 1.00 0.36 C ATOM 430 CG LEU A 26 20.442 -1.355 -3.900 1.00 0.65 C ATOM 431 CD1 LEU A 26 19.065 -2.013 -3.810 1.00 0.49 C ATOM 432 CD2 LEU A 26 21.199 -1.931 -5.111 1.00 1.19 C ATOM 0 H LEU A 26 21.205 0.474 -1.767 1.00 0.29 H new ATOM 0 HA LEU A 26 22.405 0.315 -4.371 1.00 0.32 H new ATOM 0 HB2 LEU A 26 19.565 0.527 -3.274 1.00 0.36 H new ATOM 0 HB3 LEU A 26 19.869 0.425 -4.997 1.00 0.36 H new ATOM 0 HG LEU A 26 21.020 -1.564 -3.000 1.00 0.65 H new ATOM 0 HD11 LEU A 26 19.183 -3.093 -3.726 1.00 0.49 H new ATOM 0 HD12 LEU A 26 18.538 -1.636 -2.933 1.00 0.49 H new ATOM 0 HD13 LEU A 26 18.491 -1.780 -4.707 1.00 0.49 H new ATOM 0 HD21 LEU A 26 21.300 -3.010 -4.997 1.00 1.19 H new ATOM 0 HD22 LEU A 26 20.645 -1.713 -6.024 1.00 1.19 H new ATOM 0 HD23 LEU A 26 22.189 -1.478 -5.170 1.00 1.19 H new ATOM 444 N PHE A 27 21.012 3.184 -3.571 1.00 0.31 N ATOM 445 CA PHE A 27 20.930 4.606 -4.010 1.00 0.33 C ATOM 446 C PHE A 27 22.336 5.208 -3.995 1.00 0.34 C ATOM 447 O PHE A 27 22.556 6.341 -4.380 1.00 0.37 O ATOM 448 CB PHE A 27 20.003 5.373 -3.060 1.00 0.35 C ATOM 449 CG PHE A 27 20.393 6.833 -3.021 1.00 0.44 C ATOM 450 CD1 PHE A 27 20.269 7.617 -4.174 1.00 1.19 C ATOM 451 CD2 PHE A 27 20.889 7.400 -1.839 1.00 1.38 C ATOM 452 CE1 PHE A 27 20.640 8.967 -4.147 1.00 1.22 C ATOM 453 CE2 PHE A 27 21.259 8.750 -1.813 1.00 1.46 C ATOM 454 CZ PHE A 27 21.135 9.533 -2.967 1.00 0.71 C ATOM 0 H PHE A 27 20.605 2.989 -2.656 1.00 0.31 H new ATOM 0 HA PHE A 27 20.526 4.672 -5.020 1.00 0.33 H new ATOM 0 HB2 PHE A 27 18.969 5.273 -3.389 1.00 0.35 H new ATOM 0 HB3 PHE A 27 20.061 4.946 -2.059 1.00 0.35 H new ATOM 0 HD1 PHE A 27 19.887 7.180 -5.085 1.00 1.19 H new ATOM 0 HD2 PHE A 27 20.986 6.796 -0.949 1.00 1.38 H new ATOM 0 HE1 PHE A 27 20.544 9.571 -5.037 1.00 1.22 H new ATOM 0 HE2 PHE A 27 21.640 9.188 -0.902 1.00 1.46 H new ATOM 0 HZ PHE A 27 21.421 10.574 -2.946 1.00 0.71 H new ATOM 464 N ASN A 28 23.303 4.432 -3.607 1.00 0.33 N ATOM 465 CA ASN A 28 24.700 4.936 -3.612 1.00 0.36 C ATOM 466 C ASN A 28 25.315 4.606 -4.969 1.00 0.38 C ATOM 467 O ASN A 28 26.222 5.269 -5.432 1.00 0.41 O ATOM 468 CB ASN A 28 25.501 4.261 -2.498 1.00 0.35 C ATOM 469 CG ASN A 28 26.291 5.317 -1.722 1.00 0.39 C ATOM 470 OD1 ASN A 28 25.995 5.594 -0.577 1.00 1.15 O ATOM 471 ND2 ASN A 28 27.291 5.924 -2.301 1.00 0.98 N ATOM 0 H ASN A 28 23.187 3.471 -3.287 1.00 0.33 H new ATOM 0 HA ASN A 28 24.715 6.013 -3.442 1.00 0.36 H new ATOM 0 HB2 ASN A 28 24.829 3.728 -1.825 1.00 0.35 H new ATOM 0 HB3 ASN A 28 26.181 3.522 -2.922 1.00 0.35 H new ATOM 0 HD21 ASN A 28 27.823 6.630 -1.792 1.00 0.98 H new ATOM 0 HD22 ASN A 28 27.541 5.692 -3.262 1.00 0.98 H new ATOM 478 N GLN A 29 24.828 3.574 -5.607 1.00 0.38 N ATOM 479 CA GLN A 29 25.381 3.186 -6.928 1.00 0.40 C ATOM 480 C GLN A 29 24.668 3.966 -8.033 1.00 0.43 C ATOM 481 O GLN A 29 24.927 3.760 -9.202 1.00 0.51 O ATOM 482 CB GLN A 29 25.173 1.685 -7.141 1.00 0.40 C ATOM 483 CG GLN A 29 25.637 0.924 -5.897 1.00 0.38 C ATOM 484 CD GLN A 29 25.443 -0.577 -6.113 1.00 0.40 C ATOM 485 OE1 GLN A 29 24.412 -0.998 -6.793 1.00 1.17 O flip ATOM 486 NE2 GLN A 29 26.237 -1.376 -5.658 1.00 1.10 N flip ATOM 0 H GLN A 29 24.069 2.985 -5.265 1.00 0.38 H new ATOM 0 HA GLN A 29 26.446 3.415 -6.959 1.00 0.40 H new ATOM 0 HB2 GLN A 29 24.121 1.477 -7.336 1.00 0.40 H new ATOM 0 HB3 GLN A 29 25.732 1.350 -8.015 1.00 0.40 H new ATOM 0 HG2 GLN A 29 26.686 1.140 -5.696 1.00 0.38 H new ATOM 0 HG3 GLN A 29 25.071 1.252 -5.025 1.00 0.38 H new ATOM 0 HE21 GLN A 29 27.043 -1.048 -5.126 1.00 1.10 H new ATOM 0 HE22 GLN A 29 26.098 -2.375 -5.808 1.00 1.10 H new ATOM 495 N GLY A 30 23.785 4.870 -7.670 1.00 0.39 N ATOM 496 CA GLY A 30 23.061 5.686 -8.693 1.00 0.42 C ATOM 497 C GLY A 30 21.609 5.220 -8.808 1.00 0.37 C ATOM 498 O GLY A 30 20.877 5.669 -9.665 1.00 0.39 O ATOM 0 H GLY A 30 23.536 5.076 -6.703 1.00 0.39 H new ATOM 0 HA2 GLY A 30 23.092 6.740 -8.417 1.00 0.42 H new ATOM 0 HA3 GLY A 30 23.557 5.595 -9.659 1.00 0.42 H new ATOM 502 N ILE A 31 21.181 4.329 -7.954 1.00 0.33 N ATOM 503 CA ILE A 31 19.772 3.854 -8.043 1.00 0.31 C ATOM 504 C ILE A 31 18.844 4.921 -7.490 1.00 0.28 C ATOM 505 O ILE A 31 18.599 4.994 -6.303 1.00 0.30 O ATOM 506 CB ILE A 31 19.609 2.567 -7.254 1.00 0.30 C ATOM 507 CG1 ILE A 31 20.621 1.533 -7.782 1.00 0.35 C ATOM 508 CG2 ILE A 31 18.168 2.060 -7.392 1.00 0.31 C ATOM 509 CD1 ILE A 31 20.424 1.238 -9.282 1.00 0.35 C ATOM 0 H ILE A 31 21.739 3.914 -7.208 1.00 0.33 H new ATOM 0 HA ILE A 31 19.521 3.662 -9.086 1.00 0.31 H new ATOM 0 HB ILE A 31 19.804 2.739 -6.195 1.00 0.30 H new ATOM 0 HG12 ILE A 31 21.634 1.901 -7.616 1.00 0.35 H new ATOM 0 HG13 ILE A 31 20.521 0.607 -7.215 1.00 0.35 H new ATOM 0 HG21 ILE A 31 18.052 1.136 -6.825 1.00 0.31 H new ATOM 0 HG22 ILE A 31 17.479 2.812 -7.006 1.00 0.31 H new ATOM 0 HG23 ILE A 31 17.948 1.871 -8.443 1.00 0.31 H new ATOM 0 HD11 ILE A 31 21.160 0.504 -9.608 1.00 0.35 H new ATOM 0 HD12 ILE A 31 19.421 0.844 -9.447 1.00 0.35 H new ATOM 0 HD13 ILE A 31 20.551 2.158 -9.853 1.00 0.35 H new ATOM 521 N ASP A 32 18.301 5.741 -8.343 1.00 0.26 N ATOM 522 CA ASP A 32 17.375 6.784 -7.859 1.00 0.27 C ATOM 523 C ASP A 32 15.971 6.205 -7.802 1.00 0.28 C ATOM 524 O ASP A 32 15.179 6.565 -6.952 1.00 0.45 O ATOM 525 CB ASP A 32 17.405 7.987 -8.803 1.00 0.30 C ATOM 526 CG ASP A 32 18.750 8.704 -8.671 1.00 0.72 C ATOM 527 OD1 ASP A 32 19.358 8.591 -7.619 1.00 1.55 O ATOM 528 OD2 ASP A 32 19.149 9.352 -9.624 1.00 1.22 O ATOM 0 H ASP A 32 18.461 5.730 -9.350 1.00 0.26 H new ATOM 0 HA ASP A 32 17.678 7.113 -6.865 1.00 0.27 H new ATOM 0 HB2 ASP A 32 17.255 7.660 -9.832 1.00 0.30 H new ATOM 0 HB3 ASP A 32 16.591 8.671 -8.564 1.00 0.30 H new ATOM 533 N GLU A 33 15.659 5.321 -8.721 1.00 0.26 N ATOM 534 CA GLU A 33 14.307 4.715 -8.754 1.00 0.27 C ATOM 535 C GLU A 33 14.343 3.341 -8.108 1.00 0.23 C ATOM 536 O GLU A 33 15.326 2.631 -8.186 1.00 0.23 O ATOM 537 CB GLU A 33 13.820 4.573 -10.197 1.00 0.29 C ATOM 538 CG GLU A 33 14.022 5.892 -10.942 1.00 0.48 C ATOM 539 CD GLU A 33 12.703 6.333 -11.580 1.00 0.71 C ATOM 540 OE1 GLU A 33 11.694 6.298 -10.897 1.00 1.15 O ATOM 541 OE2 GLU A 33 12.726 6.698 -12.744 1.00 1.58 O ATOM 0 H GLU A 33 16.294 4.997 -9.451 1.00 0.26 H new ATOM 0 HA GLU A 33 13.625 5.365 -8.206 1.00 0.27 H new ATOM 0 HB2 GLU A 33 14.366 3.774 -10.698 1.00 0.29 H new ATOM 0 HB3 GLU A 33 12.766 4.295 -10.209 1.00 0.29 H new ATOM 0 HG2 GLU A 33 14.378 6.658 -10.254 1.00 0.48 H new ATOM 0 HG3 GLU A 33 14.786 5.773 -11.710 1.00 0.48 H new ATOM 548 N VAL A 34 13.277 2.951 -7.481 1.00 0.21 N ATOM 549 CA VAL A 34 13.261 1.607 -6.846 1.00 0.20 C ATOM 550 C VAL A 34 11.819 1.138 -6.684 1.00 0.19 C ATOM 551 O VAL A 34 10.917 1.943 -6.514 1.00 0.20 O ATOM 552 CB VAL A 34 13.953 1.675 -5.480 1.00 0.21 C ATOM 553 CG1 VAL A 34 12.942 2.049 -4.393 1.00 0.54 C ATOM 554 CG2 VAL A 34 14.563 0.310 -5.155 1.00 0.43 C ATOM 0 H VAL A 34 12.421 3.497 -7.379 1.00 0.21 H new ATOM 0 HA VAL A 34 13.796 0.898 -7.477 1.00 0.20 H new ATOM 0 HB VAL A 34 14.735 2.434 -5.514 1.00 0.21 H new ATOM 0 HG11 VAL A 34 13.446 2.094 -3.427 1.00 0.54 H new ATOM 0 HG12 VAL A 34 12.506 3.022 -4.621 1.00 0.54 H new ATOM 0 HG13 VAL A 34 12.153 1.298 -4.356 1.00 0.54 H new ATOM 0 HG21 VAL A 34 15.056 0.354 -4.184 1.00 0.43 H new ATOM 0 HG22 VAL A 34 13.776 -0.443 -5.128 1.00 0.43 H new ATOM 0 HG23 VAL A 34 15.292 0.046 -5.921 1.00 0.43 H new ATOM 564 N ILE A 35 11.601 -0.159 -6.747 1.00 0.19 N ATOM 565 CA ILE A 35 10.213 -0.707 -6.605 1.00 0.19 C ATOM 566 C ILE A 35 10.178 -1.821 -5.575 1.00 0.19 C ATOM 567 O ILE A 35 10.787 -2.857 -5.741 1.00 0.20 O ATOM 568 CB ILE A 35 9.724 -1.247 -7.943 1.00 0.19 C ATOM 569 CG1 ILE A 35 10.275 -0.360 -9.061 1.00 0.22 C ATOM 570 CG2 ILE A 35 8.194 -1.231 -7.953 1.00 0.19 C ATOM 571 CD1 ILE A 35 9.417 -0.507 -10.322 1.00 0.25 C ATOM 0 H ILE A 35 12.327 -0.861 -6.891 1.00 0.19 H new ATOM 0 HA ILE A 35 9.562 0.102 -6.276 1.00 0.19 H new ATOM 0 HB ILE A 35 10.069 -2.270 -8.096 1.00 0.19 H new ATOM 0 HG12 ILE A 35 10.285 0.681 -8.738 1.00 0.22 H new ATOM 0 HG13 ILE A 35 11.307 -0.636 -9.280 1.00 0.22 H new ATOM 0 HG21 ILE A 35 7.832 -1.616 -8.907 1.00 0.19 H new ATOM 0 HG22 ILE A 35 7.818 -1.857 -7.143 1.00 0.19 H new ATOM 0 HG23 ILE A 35 7.840 -0.209 -7.816 1.00 0.19 H new ATOM 0 HD11 ILE A 35 9.818 0.129 -11.111 1.00 0.25 H new ATOM 0 HD12 ILE A 35 9.429 -1.546 -10.651 1.00 0.25 H new ATOM 0 HD13 ILE A 35 8.392 -0.208 -10.102 1.00 0.25 H new ATOM 583 N LEU A 36 9.439 -1.609 -4.517 1.00 0.21 N ATOM 584 CA LEU A 36 9.314 -2.648 -3.460 1.00 0.23 C ATOM 585 C LEU A 36 7.989 -3.382 -3.643 1.00 0.23 C ATOM 586 O LEU A 36 6.946 -2.759 -3.685 1.00 0.24 O ATOM 587 CB LEU A 36 9.332 -1.997 -2.076 1.00 0.24 C ATOM 588 CG LEU A 36 10.710 -2.195 -1.433 1.00 0.30 C ATOM 589 CD1 LEU A 36 11.784 -1.541 -2.304 1.00 0.40 C ATOM 590 CD2 LEU A 36 10.719 -1.552 -0.045 1.00 0.30 C ATOM 0 H LEU A 36 8.914 -0.752 -4.342 1.00 0.21 H new ATOM 0 HA LEU A 36 10.150 -3.343 -3.540 1.00 0.23 H new ATOM 0 HB2 LEU A 36 9.108 -0.934 -2.160 1.00 0.24 H new ATOM 0 HB3 LEU A 36 8.559 -2.437 -1.446 1.00 0.24 H new ATOM 0 HG LEU A 36 10.918 -3.261 -1.344 1.00 0.30 H new ATOM 0 HD11 LEU A 36 12.762 -1.684 -1.844 1.00 0.40 H new ATOM 0 HD12 LEU A 36 11.778 -1.998 -3.293 1.00 0.40 H new ATOM 0 HD13 LEU A 36 11.578 -0.475 -2.396 1.00 0.40 H new ATOM 0 HD21 LEU A 36 11.698 -1.691 0.414 1.00 0.30 H new ATOM 0 HD22 LEU A 36 10.510 -0.486 -0.136 1.00 0.30 H new ATOM 0 HD23 LEU A 36 9.956 -2.020 0.578 1.00 0.30 H new ATOM 602 N LYS A 37 8.016 -4.695 -3.715 1.00 0.23 N ATOM 603 CA LYS A 37 6.749 -5.481 -3.855 1.00 0.23 C ATOM 604 C LYS A 37 6.578 -6.331 -2.595 1.00 0.18 C ATOM 605 O LYS A 37 7.538 -6.862 -2.076 1.00 0.19 O ATOM 606 CB LYS A 37 6.822 -6.392 -5.084 1.00 0.31 C ATOM 607 CG LYS A 37 7.625 -5.707 -6.193 1.00 1.23 C ATOM 608 CD LYS A 37 7.603 -6.570 -7.458 1.00 1.52 C ATOM 609 CE LYS A 37 7.042 -5.754 -8.624 1.00 2.39 C ATOM 610 NZ LYS A 37 7.150 -6.548 -9.880 1.00 2.74 N ATOM 0 H LYS A 37 8.867 -5.257 -3.682 1.00 0.23 H new ATOM 0 HA LYS A 37 5.903 -4.804 -3.979 1.00 0.23 H new ATOM 0 HB2 LYS A 37 7.289 -7.340 -4.817 1.00 0.31 H new ATOM 0 HB3 LYS A 37 5.817 -6.620 -5.439 1.00 0.31 H new ATOM 0 HG2 LYS A 37 7.204 -4.724 -6.405 1.00 1.23 H new ATOM 0 HG3 LYS A 37 8.653 -5.550 -5.866 1.00 1.23 H new ATOM 0 HD2 LYS A 37 8.610 -6.915 -7.693 1.00 1.52 H new ATOM 0 HD3 LYS A 37 6.992 -7.458 -7.295 1.00 1.52 H new ATOM 0 HE2 LYS A 37 6.001 -5.495 -8.433 1.00 2.39 H new ATOM 0 HE3 LYS A 37 7.591 -4.818 -8.724 1.00 2.39 H new ATOM 0 HZ1 LYS A 37 6.769 -5.995 -10.674 1.00 2.74 H new ATOM 0 HZ2 LYS A 37 8.148 -6.774 -10.063 1.00 2.74 H new ATOM 0 HZ3 LYS A 37 6.608 -7.430 -9.781 1.00 2.74 H new ATOM 624 N GLY A 38 5.380 -6.455 -2.081 1.00 0.18 N ATOM 625 CA GLY A 38 5.194 -7.272 -0.836 1.00 0.21 C ATOM 626 C GLY A 38 3.819 -7.946 -0.839 1.00 0.18 C ATOM 627 O GLY A 38 2.953 -7.593 -1.613 1.00 0.19 O ATOM 0 H GLY A 38 4.532 -6.034 -2.461 1.00 0.18 H new ATOM 0 HA2 GLY A 38 5.976 -8.028 -0.770 1.00 0.21 H new ATOM 0 HA3 GLY A 38 5.291 -6.634 0.043 1.00 0.21 H new ATOM 631 N THR A 39 3.625 -8.939 0.005 1.00 0.20 N ATOM 632 CA THR A 39 2.319 -9.671 0.034 1.00 0.25 C ATOM 633 C THR A 39 1.870 -9.932 1.476 1.00 0.23 C ATOM 634 O THR A 39 2.673 -10.123 2.359 1.00 0.22 O ATOM 635 CB THR A 39 2.490 -11.017 -0.675 1.00 0.28 C ATOM 636 OG1 THR A 39 3.338 -11.851 0.101 1.00 0.43 O ATOM 637 CG2 THR A 39 3.114 -10.799 -2.055 1.00 0.56 C ATOM 0 H THR A 39 4.319 -9.272 0.675 1.00 0.20 H new ATOM 0 HA THR A 39 1.567 -9.060 -0.465 1.00 0.25 H new ATOM 0 HB THR A 39 1.515 -11.491 -0.792 1.00 0.28 H new ATOM 0 HG1 THR A 39 3.941 -12.346 -0.492 1.00 0.43 H new ATOM 0 HG21 THR A 39 3.234 -11.760 -2.556 1.00 0.56 H new ATOM 0 HG22 THR A 39 2.465 -10.158 -2.651 1.00 0.56 H new ATOM 0 HG23 THR A 39 4.089 -10.324 -1.943 1.00 0.56 H new ATOM 645 N GLY A 40 0.576 -9.948 1.697 1.00 0.27 N ATOM 646 CA GLY A 40 0.007 -10.216 3.059 1.00 0.30 C ATOM 647 C GLY A 40 0.855 -9.595 4.172 1.00 0.29 C ATOM 648 O GLY A 40 0.580 -8.512 4.641 1.00 0.33 O ATOM 0 H GLY A 40 -0.125 -9.783 0.975 1.00 0.27 H new ATOM 0 HA2 GLY A 40 -1.007 -9.819 3.112 1.00 0.30 H new ATOM 0 HA3 GLY A 40 -0.064 -11.292 3.216 1.00 0.30 H new ATOM 652 N ARG A 41 1.865 -10.288 4.619 1.00 0.27 N ATOM 653 CA ARG A 41 2.705 -9.740 5.721 1.00 0.28 C ATOM 654 C ARG A 41 3.821 -8.859 5.152 1.00 0.24 C ATOM 655 O ARG A 41 4.110 -7.806 5.684 1.00 0.25 O ATOM 656 CB ARG A 41 3.309 -10.880 6.548 1.00 0.31 C ATOM 657 CG ARG A 41 3.055 -12.227 5.858 1.00 0.64 C ATOM 658 CD ARG A 41 3.697 -13.358 6.676 1.00 0.92 C ATOM 659 NE ARG A 41 2.650 -14.083 7.459 1.00 1.69 N ATOM 660 CZ ARG A 41 2.088 -15.170 6.988 1.00 2.12 C ATOM 661 NH1 ARG A 41 2.352 -15.588 5.778 1.00 2.03 N ATOM 662 NH2 ARG A 41 1.238 -15.830 7.726 1.00 3.09 N ATOM 0 H ARG A 41 2.144 -11.205 4.271 1.00 0.27 H new ATOM 0 HA ARG A 41 2.072 -9.133 6.368 1.00 0.28 H new ATOM 0 HB2 ARG A 41 4.381 -10.722 6.670 1.00 0.31 H new ATOM 0 HB3 ARG A 41 2.872 -10.886 7.546 1.00 0.31 H new ATOM 0 HG2 ARG A 41 1.983 -12.400 5.760 1.00 0.64 H new ATOM 0 HG3 ARG A 41 3.470 -12.214 4.850 1.00 0.64 H new ATOM 0 HD2 ARG A 41 4.211 -14.052 6.011 1.00 0.92 H new ATOM 0 HD3 ARG A 41 4.448 -12.948 7.351 1.00 0.92 H new ATOM 0 HE ARG A 41 2.369 -13.727 8.373 1.00 1.69 H new ATOM 0 HH11 ARG A 41 3.002 -15.067 5.189 1.00 2.03 H new ATOM 0 HH12 ARG A 41 1.908 -16.435 5.423 1.00 2.03 H new ATOM 0 HH21 ARG A 41 1.014 -15.500 8.665 1.00 3.09 H new ATOM 0 HH22 ARG A 41 0.798 -16.676 7.364 1.00 3.09 H new ATOM 676 N GLU A 42 4.467 -9.270 4.095 1.00 0.21 N ATOM 677 CA GLU A 42 5.568 -8.431 3.544 1.00 0.18 C ATOM 678 C GLU A 42 4.991 -7.112 3.014 1.00 0.17 C ATOM 679 O GLU A 42 5.688 -6.119 2.888 1.00 0.18 O ATOM 680 CB GLU A 42 6.291 -9.160 2.394 1.00 0.16 C ATOM 681 CG GLU A 42 5.862 -10.633 2.306 1.00 0.20 C ATOM 682 CD GLU A 42 6.865 -11.401 1.442 1.00 0.22 C ATOM 683 OE1 GLU A 42 7.109 -10.971 0.327 1.00 1.06 O ATOM 684 OE2 GLU A 42 7.373 -12.407 1.910 1.00 1.09 O ATOM 0 H GLU A 42 4.283 -10.140 3.594 1.00 0.21 H new ATOM 0 HA GLU A 42 6.283 -8.236 4.343 1.00 0.18 H new ATOM 0 HB2 GLU A 42 6.074 -8.659 1.450 1.00 0.16 H new ATOM 0 HB3 GLU A 42 7.369 -9.102 2.545 1.00 0.16 H new ATOM 0 HG2 GLU A 42 5.814 -11.070 3.303 1.00 0.20 H new ATOM 0 HG3 GLU A 42 4.863 -10.708 1.877 1.00 0.20 H new ATOM 691 N ILE A 43 3.723 -7.095 2.700 1.00 0.19 N ATOM 692 CA ILE A 43 3.097 -5.847 2.173 1.00 0.20 C ATOM 693 C ILE A 43 3.480 -4.645 3.068 1.00 0.22 C ATOM 694 O ILE A 43 3.964 -3.640 2.589 1.00 0.24 O ATOM 695 CB ILE A 43 1.560 -6.058 2.089 1.00 0.26 C ATOM 696 CG1 ILE A 43 0.954 -5.145 1.017 1.00 0.40 C ATOM 697 CG2 ILE A 43 0.875 -5.771 3.429 1.00 0.38 C ATOM 698 CD1 ILE A 43 -0.536 -5.454 0.857 1.00 0.87 C ATOM 0 H ILE A 43 3.093 -7.892 2.786 1.00 0.19 H new ATOM 0 HA ILE A 43 3.465 -5.624 1.171 1.00 0.20 H new ATOM 0 HB ILE A 43 1.393 -7.103 1.828 1.00 0.26 H new ATOM 0 HG12 ILE A 43 1.090 -4.100 1.296 1.00 0.40 H new ATOM 0 HG13 ILE A 43 1.469 -5.291 0.068 1.00 0.40 H new ATOM 0 HG21 ILE A 43 -0.199 -5.930 3.330 1.00 0.38 H new ATOM 0 HG22 ILE A 43 1.272 -6.441 4.191 1.00 0.38 H new ATOM 0 HG23 ILE A 43 1.064 -4.738 3.720 1.00 0.38 H new ATOM 0 HD11 ILE A 43 -0.963 -4.803 0.094 1.00 0.87 H new ATOM 0 HD12 ILE A 43 -0.662 -6.495 0.558 1.00 0.87 H new ATOM 0 HD13 ILE A 43 -1.046 -5.285 1.805 1.00 0.87 H new ATOM 710 N SER A 44 3.237 -4.728 4.349 1.00 0.24 N ATOM 711 CA SER A 44 3.549 -3.592 5.261 1.00 0.27 C ATOM 712 C SER A 44 5.065 -3.394 5.390 1.00 0.26 C ATOM 713 O SER A 44 5.530 -2.304 5.665 1.00 0.27 O ATOM 714 CB SER A 44 2.966 -3.909 6.639 1.00 0.31 C ATOM 715 OG SER A 44 2.268 -5.146 6.577 1.00 1.14 O ATOM 0 H SER A 44 2.831 -5.544 4.806 1.00 0.24 H new ATOM 0 HA SER A 44 3.117 -2.677 4.855 1.00 0.27 H new ATOM 0 HB2 SER A 44 3.763 -3.964 7.381 1.00 0.31 H new ATOM 0 HB3 SER A 44 2.292 -3.113 6.954 1.00 0.31 H new ATOM 0 HG SER A 44 1.894 -5.355 7.458 1.00 1.14 H new ATOM 721 N LYS A 45 5.847 -4.423 5.202 1.00 0.25 N ATOM 722 CA LYS A 45 7.322 -4.243 5.330 1.00 0.25 C ATOM 723 C LYS A 45 7.792 -3.221 4.295 1.00 0.23 C ATOM 724 O LYS A 45 8.613 -2.368 4.579 1.00 0.25 O ATOM 725 CB LYS A 45 8.044 -5.573 5.101 1.00 0.24 C ATOM 726 CG LYS A 45 8.273 -6.277 6.443 1.00 0.42 C ATOM 727 CD LYS A 45 6.927 -6.542 7.123 1.00 0.90 C ATOM 728 CE LYS A 45 7.116 -7.551 8.259 1.00 0.82 C ATOM 729 NZ LYS A 45 8.471 -7.380 8.857 1.00 1.86 N ATOM 0 H LYS A 45 5.535 -5.366 4.969 1.00 0.25 H new ATOM 0 HA LYS A 45 7.553 -3.889 6.335 1.00 0.25 H new ATOM 0 HB2 LYS A 45 7.453 -6.209 4.442 1.00 0.24 H new ATOM 0 HB3 LYS A 45 8.998 -5.398 4.604 1.00 0.24 H new ATOM 0 HG2 LYS A 45 8.803 -7.216 6.286 1.00 0.42 H new ATOM 0 HG3 LYS A 45 8.901 -5.660 7.086 1.00 0.42 H new ATOM 0 HD2 LYS A 45 6.516 -5.611 7.514 1.00 0.90 H new ATOM 0 HD3 LYS A 45 6.211 -6.926 6.397 1.00 0.90 H new ATOM 0 HE2 LYS A 45 6.350 -7.405 9.020 1.00 0.82 H new ATOM 0 HE3 LYS A 45 7.000 -8.567 7.881 1.00 0.82 H new ATOM 0 HZ1 LYS A 45 8.501 -7.844 9.787 1.00 1.86 H new ATOM 0 HZ2 LYS A 45 9.183 -7.810 8.233 1.00 1.86 H new ATOM 0 HZ3 LYS A 45 8.676 -6.366 8.969 1.00 1.86 H new ATOM 743 N ALA A 46 7.273 -3.288 3.098 1.00 0.22 N ATOM 744 CA ALA A 46 7.690 -2.305 2.055 1.00 0.23 C ATOM 745 C ALA A 46 7.360 -0.892 2.534 1.00 0.22 C ATOM 746 O ALA A 46 8.100 0.046 2.313 1.00 0.29 O ATOM 747 CB ALA A 46 6.924 -2.579 0.760 1.00 0.25 C ATOM 0 H ALA A 46 6.583 -3.976 2.798 1.00 0.22 H new ATOM 0 HA ALA A 46 8.761 -2.399 1.877 1.00 0.23 H new ATOM 0 HB1 ALA A 46 7.228 -1.861 -0.002 1.00 0.25 H new ATOM 0 HB2 ALA A 46 7.143 -3.589 0.415 1.00 0.25 H new ATOM 0 HB3 ALA A 46 5.854 -2.482 0.943 1.00 0.25 H new ATOM 753 N VAL A 47 6.240 -0.741 3.179 1.00 0.17 N ATOM 754 CA VAL A 47 5.820 0.600 3.676 1.00 0.17 C ATOM 755 C VAL A 47 6.853 1.161 4.648 1.00 0.17 C ATOM 756 O VAL A 47 7.487 2.162 4.384 1.00 0.16 O ATOM 757 CB VAL A 47 4.489 0.464 4.410 1.00 0.18 C ATOM 758 CG1 VAL A 47 4.003 1.845 4.873 1.00 0.22 C ATOM 759 CG2 VAL A 47 3.472 -0.175 3.470 1.00 0.20 C ATOM 0 H VAL A 47 5.588 -1.498 3.387 1.00 0.17 H new ATOM 0 HA VAL A 47 5.726 1.274 2.824 1.00 0.17 H new ATOM 0 HB VAL A 47 4.612 -0.166 5.291 1.00 0.18 H new ATOM 0 HG11 VAL A 47 3.052 1.740 5.396 1.00 0.22 H new ATOM 0 HG12 VAL A 47 4.740 2.284 5.545 1.00 0.22 H new ATOM 0 HG13 VAL A 47 3.871 2.493 4.007 1.00 0.22 H new ATOM 0 HG21 VAL A 47 2.516 -0.278 3.984 1.00 0.20 H new ATOM 0 HG22 VAL A 47 3.345 0.454 2.589 1.00 0.20 H new ATOM 0 HG23 VAL A 47 3.827 -1.159 3.164 1.00 0.20 H new ATOM 769 N ASP A 48 7.003 0.530 5.783 1.00 0.20 N ATOM 770 CA ASP A 48 7.974 1.025 6.800 1.00 0.23 C ATOM 771 C ASP A 48 9.289 1.401 6.120 1.00 0.24 C ATOM 772 O ASP A 48 9.784 2.499 6.278 1.00 0.26 O ATOM 773 CB ASP A 48 8.231 -0.070 7.834 1.00 0.26 C ATOM 774 CG ASP A 48 8.039 0.499 9.240 1.00 0.44 C ATOM 775 OD1 ASP A 48 8.865 1.297 9.652 1.00 1.26 O ATOM 776 OD2 ASP A 48 7.070 0.127 9.881 1.00 1.11 O ATOM 0 H ASP A 48 6.491 -0.311 6.049 1.00 0.20 H new ATOM 0 HA ASP A 48 7.560 1.904 7.294 1.00 0.23 H new ATOM 0 HB2 ASP A 48 7.549 -0.905 7.672 1.00 0.26 H new ATOM 0 HB3 ASP A 48 9.243 -0.459 7.723 1.00 0.26 H new ATOM 781 N VAL A 49 9.856 0.498 5.367 1.00 0.26 N ATOM 782 CA VAL A 49 11.139 0.800 4.674 1.00 0.30 C ATOM 783 C VAL A 49 11.049 2.177 4.009 1.00 0.29 C ATOM 784 O VAL A 49 11.863 3.045 4.245 1.00 0.29 O ATOM 785 CB VAL A 49 11.397 -0.271 3.611 1.00 0.37 C ATOM 786 CG1 VAL A 49 12.396 0.251 2.574 1.00 1.06 C ATOM 787 CG2 VAL A 49 11.968 -1.520 4.287 1.00 0.95 C ATOM 0 H VAL A 49 9.485 -0.438 5.202 1.00 0.26 H new ATOM 0 HA VAL A 49 11.956 0.804 5.395 1.00 0.30 H new ATOM 0 HB VAL A 49 10.461 -0.516 3.110 1.00 0.37 H new ATOM 0 HG11 VAL A 49 12.574 -0.517 1.821 1.00 1.06 H new ATOM 0 HG12 VAL A 49 11.990 1.142 2.094 1.00 1.06 H new ATOM 0 HG13 VAL A 49 13.336 0.500 3.067 1.00 1.06 H new ATOM 0 HG21 VAL A 49 12.154 -2.287 3.536 1.00 0.95 H new ATOM 0 HG22 VAL A 49 12.903 -1.268 4.787 1.00 0.95 H new ATOM 0 HG23 VAL A 49 11.254 -1.896 5.020 1.00 0.95 H new ATOM 797 N TYR A 50 10.063 2.378 3.181 1.00 0.31 N ATOM 798 CA TYR A 50 9.917 3.696 2.497 1.00 0.34 C ATOM 799 C TYR A 50 9.632 4.793 3.527 1.00 0.30 C ATOM 800 O TYR A 50 10.204 5.863 3.479 1.00 0.30 O ATOM 801 CB TYR A 50 8.762 3.628 1.496 1.00 0.29 C ATOM 802 CG TYR A 50 8.137 4.999 1.336 1.00 0.29 C ATOM 803 CD1 TYR A 50 8.945 6.115 1.075 1.00 1.27 C ATOM 804 CD2 TYR A 50 6.749 5.154 1.448 1.00 1.16 C ATOM 805 CE1 TYR A 50 8.365 7.381 0.928 1.00 1.26 C ATOM 806 CE2 TYR A 50 6.172 6.422 1.299 1.00 1.19 C ATOM 807 CZ TYR A 50 6.980 7.534 1.040 1.00 0.37 C ATOM 808 OH TYR A 50 6.410 8.783 0.893 1.00 0.43 O ATOM 0 H TYR A 50 9.350 1.687 2.947 1.00 0.31 H new ATOM 0 HA TYR A 50 10.844 3.929 1.973 1.00 0.34 H new ATOM 0 HB2 TYR A 50 9.125 3.269 0.533 1.00 0.29 H new ATOM 0 HB3 TYR A 50 8.013 2.915 1.840 1.00 0.29 H new ATOM 0 HD1 TYR A 50 10.015 5.998 0.987 1.00 1.27 H new ATOM 0 HD2 TYR A 50 6.124 4.296 1.649 1.00 1.16 H new ATOM 0 HE1 TYR A 50 8.988 8.240 0.728 1.00 1.26 H new ATOM 0 HE2 TYR A 50 5.102 6.541 1.384 1.00 1.19 H new ATOM 0 HH TYR A 50 5.438 8.714 0.999 1.00 0.43 H new ATOM 818 N ASN A 51 8.753 4.541 4.455 1.00 0.30 N ATOM 819 CA ASN A 51 8.437 5.573 5.477 1.00 0.30 C ATOM 820 C ASN A 51 9.719 5.934 6.209 1.00 0.29 C ATOM 821 O ASN A 51 10.050 7.090 6.386 1.00 0.29 O ATOM 822 CB ASN A 51 7.425 5.012 6.474 1.00 0.32 C ATOM 823 CG ASN A 51 7.003 6.116 7.444 1.00 0.61 C ATOM 824 OD1 ASN A 51 6.009 6.782 7.230 1.00 1.34 O ATOM 825 ND2 ASN A 51 7.722 6.341 8.510 1.00 1.28 N ATOM 0 H ASN A 51 8.240 3.664 4.549 1.00 0.30 H new ATOM 0 HA ASN A 51 8.015 6.456 4.998 1.00 0.30 H new ATOM 0 HB2 ASN A 51 6.554 4.624 5.946 1.00 0.32 H new ATOM 0 HB3 ASN A 51 7.862 4.178 7.023 1.00 0.32 H new ATOM 0 HD21 ASN A 51 7.450 7.076 9.163 1.00 1.28 H new ATOM 0 HD22 ASN A 51 8.556 5.782 8.690 1.00 1.28 H new ATOM 832 N SER A 52 10.441 4.944 6.634 1.00 0.30 N ATOM 833 CA SER A 52 11.708 5.211 7.357 1.00 0.30 C ATOM 834 C SER A 52 12.713 5.833 6.385 1.00 0.29 C ATOM 835 O SER A 52 13.567 6.606 6.769 1.00 0.28 O ATOM 836 CB SER A 52 12.276 3.908 7.910 1.00 0.33 C ATOM 837 OG SER A 52 12.016 2.853 6.994 1.00 1.04 O ATOM 0 H SER A 52 10.209 3.958 6.512 1.00 0.30 H new ATOM 0 HA SER A 52 11.518 5.895 8.184 1.00 0.30 H new ATOM 0 HB2 SER A 52 13.349 4.007 8.073 1.00 0.33 H new ATOM 0 HB3 SER A 52 11.826 3.684 8.877 1.00 0.33 H new ATOM 0 HG SER A 52 11.070 2.603 7.043 1.00 1.04 H new ATOM 843 N LEU A 53 12.607 5.509 5.123 1.00 0.28 N ATOM 844 CA LEU A 53 13.541 6.086 4.120 1.00 0.28 C ATOM 845 C LEU A 53 13.082 7.504 3.795 1.00 0.26 C ATOM 846 O LEU A 53 13.860 8.360 3.427 1.00 0.26 O ATOM 847 CB LEU A 53 13.520 5.236 2.849 1.00 0.28 C ATOM 848 CG LEU A 53 14.708 5.617 1.961 1.00 0.29 C ATOM 849 CD1 LEU A 53 15.933 4.774 2.329 1.00 0.44 C ATOM 850 CD2 LEU A 53 14.346 5.370 0.496 1.00 0.40 C ATOM 0 H LEU A 53 11.910 4.867 4.745 1.00 0.28 H new ATOM 0 HA LEU A 53 14.556 6.101 4.518 1.00 0.28 H new ATOM 0 HB2 LEU A 53 13.569 4.178 3.106 1.00 0.28 H new ATOM 0 HB3 LEU A 53 12.585 5.391 2.310 1.00 0.28 H new ATOM 0 HG LEU A 53 14.942 6.671 2.112 1.00 0.29 H new ATOM 0 HD11 LEU A 53 16.772 5.053 1.691 1.00 0.44 H new ATOM 0 HD12 LEU A 53 16.196 4.950 3.372 1.00 0.44 H new ATOM 0 HD13 LEU A 53 15.704 3.718 2.186 1.00 0.44 H new ATOM 0 HD21 LEU A 53 15.190 5.641 -0.138 1.00 0.40 H new ATOM 0 HD22 LEU A 53 14.108 4.316 0.353 1.00 0.40 H new ATOM 0 HD23 LEU A 53 13.481 5.977 0.227 1.00 0.40 H new ATOM 862 N LYS A 54 11.823 7.772 3.972 1.00 0.26 N ATOM 863 CA LYS A 54 11.315 9.143 3.724 1.00 0.27 C ATOM 864 C LYS A 54 11.753 9.974 4.917 1.00 0.29 C ATOM 865 O LYS A 54 12.293 11.057 4.798 1.00 0.28 O ATOM 866 CB LYS A 54 9.782 9.085 3.662 1.00 0.30 C ATOM 867 CG LYS A 54 9.198 10.305 2.928 1.00 0.55 C ATOM 868 CD LYS A 54 9.233 11.545 3.827 1.00 0.27 C ATOM 869 CE LYS A 54 8.426 12.665 3.168 1.00 0.36 C ATOM 870 NZ LYS A 54 7.170 12.887 3.939 1.00 1.00 N ATOM 0 H LYS A 54 11.122 7.098 4.279 1.00 0.26 H new ATOM 0 HA LYS A 54 11.690 9.567 2.792 1.00 0.27 H new ATOM 0 HB2 LYS A 54 9.472 8.172 3.154 1.00 0.30 H new ATOM 0 HB3 LYS A 54 9.378 9.040 4.673 1.00 0.30 H new ATOM 0 HG2 LYS A 54 9.766 10.494 2.017 1.00 0.55 H new ATOM 0 HG3 LYS A 54 8.171 10.097 2.626 1.00 0.55 H new ATOM 0 HD2 LYS A 54 8.819 11.310 4.808 1.00 0.27 H new ATOM 0 HD3 LYS A 54 10.263 11.866 3.984 1.00 0.27 H new ATOM 0 HE2 LYS A 54 9.014 13.582 3.137 1.00 0.36 H new ATOM 0 HE3 LYS A 54 8.191 12.401 2.137 1.00 0.36 H new ATOM 0 HZ1 LYS A 54 6.619 13.648 3.493 1.00 1.00 H new ATOM 0 HZ2 LYS A 54 6.608 12.012 3.947 1.00 1.00 H new ATOM 0 HZ3 LYS A 54 7.405 13.156 4.916 1.00 1.00 H new ATOM 884 N ASP A 55 11.543 9.423 6.070 1.00 0.34 N ATOM 885 CA ASP A 55 11.944 10.087 7.329 1.00 0.38 C ATOM 886 C ASP A 55 13.446 10.359 7.272 1.00 0.40 C ATOM 887 O ASP A 55 14.011 11.005 8.132 1.00 0.47 O ATOM 888 CB ASP A 55 11.629 9.134 8.482 1.00 0.43 C ATOM 889 CG ASP A 55 12.218 9.676 9.784 1.00 0.85 C ATOM 890 OD1 ASP A 55 12.405 10.878 9.871 1.00 1.48 O ATOM 891 OD2 ASP A 55 12.467 8.881 10.674 1.00 1.58 O ATOM 0 H ASP A 55 11.097 8.514 6.195 1.00 0.34 H new ATOM 0 HA ASP A 55 11.412 11.028 7.470 1.00 0.38 H new ATOM 0 HB2 ASP A 55 10.550 9.016 8.583 1.00 0.43 H new ATOM 0 HB3 ASP A 55 12.039 8.146 8.271 1.00 0.43 H new ATOM 896 N ARG A 56 14.092 9.857 6.255 1.00 0.36 N ATOM 897 CA ARG A 56 15.556 10.061 6.113 1.00 0.40 C ATOM 898 C ARG A 56 15.844 11.476 5.627 1.00 0.40 C ATOM 899 O ARG A 56 16.709 12.157 6.141 1.00 0.43 O ATOM 900 CB ARG A 56 16.081 9.079 5.075 1.00 0.44 C ATOM 901 CG ARG A 56 17.532 8.730 5.381 1.00 0.81 C ATOM 902 CD ARG A 56 17.574 7.555 6.358 1.00 0.67 C ATOM 903 NE ARG A 56 18.904 7.525 7.032 1.00 1.00 N ATOM 904 CZ ARG A 56 19.118 8.213 8.125 1.00 1.24 C ATOM 905 NH1 ARG A 56 18.163 8.923 8.666 1.00 1.52 N ATOM 906 NH2 ARG A 56 20.298 8.191 8.679 1.00 1.69 N ATOM 0 H ARG A 56 13.661 9.309 5.511 1.00 0.36 H new ATOM 0 HA ARG A 56 16.038 9.905 7.078 1.00 0.40 H new ATOM 0 HB2 ARG A 56 15.472 8.175 5.076 1.00 0.44 H new ATOM 0 HB3 ARG A 56 16.005 9.514 4.078 1.00 0.44 H new ATOM 0 HG2 ARG A 56 18.058 8.472 4.462 1.00 0.81 H new ATOM 0 HG3 ARG A 56 18.043 9.592 5.809 1.00 0.81 H new ATOM 0 HD2 ARG A 56 16.780 7.653 7.098 1.00 0.67 H new ATOM 0 HD3 ARG A 56 17.401 6.619 5.827 1.00 0.67 H new ATOM 0 HE ARG A 56 19.656 6.961 6.636 1.00 1.00 H new ATOM 0 HH11 ARG A 56 17.238 8.945 8.236 1.00 1.52 H new ATOM 0 HH12 ARG A 56 18.343 9.455 9.518 1.00 1.52 H new ATOM 0 HH21 ARG A 56 21.048 7.640 8.261 1.00 1.69 H new ATOM 0 HH22 ARG A 56 20.472 8.725 9.531 1.00 1.69 H new ATOM 920 N LEU A 57 15.136 11.920 4.629 1.00 0.38 N ATOM 921 CA LEU A 57 15.390 13.289 4.105 1.00 0.42 C ATOM 922 C LEU A 57 14.123 13.859 3.480 1.00 0.39 C ATOM 923 O LEU A 57 13.928 15.058 3.454 1.00 0.41 O ATOM 924 CB LEU A 57 16.489 13.237 3.038 1.00 0.51 C ATOM 925 CG LEU A 57 17.335 14.522 3.093 1.00 1.11 C ATOM 926 CD1 LEU A 57 18.175 14.565 4.377 1.00 1.63 C ATOM 927 CD2 LEU A 57 18.273 14.575 1.882 1.00 1.66 C ATOM 0 H LEU A 57 14.398 11.399 4.156 1.00 0.38 H new ATOM 0 HA LEU A 57 15.703 13.925 4.933 1.00 0.42 H new ATOM 0 HB2 LEU A 57 17.124 12.366 3.200 1.00 0.51 H new ATOM 0 HB3 LEU A 57 16.043 13.127 2.049 1.00 0.51 H new ATOM 0 HG LEU A 57 16.660 15.377 3.081 1.00 1.11 H new ATOM 0 HD11 LEU A 57 18.765 15.481 4.395 1.00 1.63 H new ATOM 0 HD12 LEU A 57 17.515 14.541 5.244 1.00 1.63 H new ATOM 0 HD13 LEU A 57 18.842 13.703 4.404 1.00 1.63 H new ATOM 0 HD21 LEU A 57 18.870 15.486 1.924 1.00 1.66 H new ATOM 0 HD22 LEU A 57 18.933 13.707 1.895 1.00 1.66 H new ATOM 0 HD23 LEU A 57 17.684 14.570 0.965 1.00 1.66 H new ATOM 939 N GLY A 58 13.260 13.032 2.957 1.00 0.39 N ATOM 940 CA GLY A 58 12.029 13.578 2.324 1.00 0.38 C ATOM 941 C GLY A 58 12.407 14.306 1.032 1.00 0.33 C ATOM 942 O GLY A 58 11.824 14.082 -0.010 1.00 0.31 O ATOM 0 H GLY A 58 13.352 12.016 2.940 1.00 0.39 H new ATOM 0 HA2 GLY A 58 11.328 12.771 2.109 1.00 0.38 H new ATOM 0 HA3 GLY A 58 11.527 14.263 3.008 1.00 0.38 H new ATOM 946 N ASP A 59 13.382 15.173 1.087 1.00 0.37 N ATOM 947 CA ASP A 59 13.798 15.907 -0.145 1.00 0.38 C ATOM 948 C ASP A 59 14.583 14.959 -1.049 1.00 0.30 C ATOM 949 O ASP A 59 14.312 14.832 -2.226 1.00 0.32 O ATOM 950 CB ASP A 59 14.678 17.099 0.237 1.00 0.47 C ATOM 951 CG ASP A 59 14.140 18.366 -0.432 1.00 0.57 C ATOM 952 OD1 ASP A 59 13.774 18.290 -1.593 1.00 1.38 O ATOM 953 OD2 ASP A 59 14.104 19.391 0.229 1.00 1.06 O ATOM 0 H ASP A 59 13.908 15.405 1.929 1.00 0.37 H new ATOM 0 HA ASP A 59 12.915 16.270 -0.671 1.00 0.38 H new ATOM 0 HB2 ASP A 59 14.690 17.224 1.320 1.00 0.47 H new ATOM 0 HB3 ASP A 59 15.707 16.919 -0.074 1.00 0.47 H new ATOM 958 N GLY A 60 15.551 14.287 -0.495 1.00 0.26 N ATOM 959 CA GLY A 60 16.359 13.335 -1.302 1.00 0.24 C ATOM 960 C GLY A 60 15.530 12.079 -1.556 1.00 0.23 C ATOM 961 O GLY A 60 16.058 11.015 -1.807 1.00 0.24 O ATOM 0 H GLY A 60 15.818 14.357 0.487 1.00 0.26 H new ATOM 0 HA2 GLY A 60 16.649 13.793 -2.247 1.00 0.24 H new ATOM 0 HA3 GLY A 60 17.279 13.080 -0.776 1.00 0.24 H new ATOM 965 N VAL A 61 14.229 12.198 -1.491 1.00 0.22 N ATOM 966 CA VAL A 61 13.349 11.025 -1.717 1.00 0.22 C ATOM 967 C VAL A 61 12.032 11.515 -2.316 1.00 0.22 C ATOM 968 O VAL A 61 11.513 12.547 -1.938 1.00 0.28 O ATOM 969 CB VAL A 61 13.056 10.335 -0.381 1.00 0.25 C ATOM 970 CG1 VAL A 61 11.851 9.403 -0.541 1.00 0.34 C ATOM 971 CG2 VAL A 61 14.271 9.518 0.066 1.00 0.38 C ATOM 0 H VAL A 61 13.739 13.069 -1.289 1.00 0.22 H new ATOM 0 HA VAL A 61 13.839 10.321 -2.390 1.00 0.22 H new ATOM 0 HB VAL A 61 12.838 11.094 0.370 1.00 0.25 H new ATOM 0 HG11 VAL A 61 11.642 8.912 0.409 1.00 0.34 H new ATOM 0 HG12 VAL A 61 10.981 9.983 -0.849 1.00 0.34 H new ATOM 0 HG13 VAL A 61 12.071 8.650 -1.298 1.00 0.34 H new ATOM 0 HG21 VAL A 61 14.053 9.032 1.017 1.00 0.38 H new ATOM 0 HG22 VAL A 61 14.497 8.761 -0.685 1.00 0.38 H new ATOM 0 HG23 VAL A 61 15.130 10.179 0.185 1.00 0.38 H new ATOM 981 N GLN A 62 11.509 10.794 -3.267 1.00 0.20 N ATOM 982 CA GLN A 62 10.246 11.217 -3.924 1.00 0.21 C ATOM 983 C GLN A 62 9.376 10.010 -4.256 1.00 0.22 C ATOM 984 O GLN A 62 9.846 8.961 -4.648 1.00 0.21 O ATOM 985 CB GLN A 62 10.580 11.943 -5.216 1.00 0.23 C ATOM 986 CG GLN A 62 10.323 13.435 -5.048 1.00 0.34 C ATOM 987 CD GLN A 62 8.815 13.695 -5.026 1.00 0.50 C ATOM 988 OE1 GLN A 62 8.071 13.076 -5.760 1.00 1.14 O ATOM 989 NE2 GLN A 62 8.331 14.590 -4.210 1.00 1.31 N ATOM 0 H GLN A 62 11.907 9.923 -3.619 1.00 0.20 H new ATOM 0 HA GLN A 62 9.701 11.870 -3.242 1.00 0.21 H new ATOM 0 HB2 GLN A 62 11.623 11.772 -5.482 1.00 0.23 H new ATOM 0 HB3 GLN A 62 9.974 11.550 -6.032 1.00 0.23 H new ATOM 0 HG2 GLN A 62 10.777 13.791 -4.123 1.00 0.34 H new ATOM 0 HG3 GLN A 62 10.786 13.989 -5.865 1.00 0.34 H new ATOM 0 HE21 GLN A 62 8.956 15.110 -3.594 1.00 1.31 H new ATOM 0 HE22 GLN A 62 7.327 14.770 -4.188 1.00 1.31 H new ATOM 998 N LEU A 63 8.102 10.182 -4.100 1.00 0.25 N ATOM 999 CA LEU A 63 7.130 9.091 -4.391 1.00 0.26 C ATOM 1000 C LEU A 63 6.625 9.240 -5.827 1.00 0.29 C ATOM 1001 O LEU A 63 5.698 9.980 -6.089 1.00 0.34 O ATOM 1002 CB LEU A 63 5.954 9.215 -3.416 1.00 0.29 C ATOM 1003 CG LEU A 63 5.012 8.012 -3.541 1.00 0.29 C ATOM 1004 CD1 LEU A 63 4.793 7.404 -2.155 1.00 0.49 C ATOM 1005 CD2 LEU A 63 3.663 8.470 -4.107 1.00 0.48 C ATOM 0 H LEU A 63 7.678 11.051 -3.776 1.00 0.25 H new ATOM 0 HA LEU A 63 7.606 8.117 -4.276 1.00 0.26 H new ATOM 0 HB2 LEU A 63 6.329 9.284 -2.395 1.00 0.29 H new ATOM 0 HB3 LEU A 63 5.405 10.135 -3.617 1.00 0.29 H new ATOM 0 HG LEU A 63 5.453 7.272 -4.209 1.00 0.29 H new ATOM 0 HD11 LEU A 63 4.124 6.547 -2.235 1.00 0.49 H new ATOM 0 HD12 LEU A 63 5.749 7.080 -1.744 1.00 0.49 H new ATOM 0 HD13 LEU A 63 4.349 8.151 -1.496 1.00 0.49 H new ATOM 0 HD21 LEU A 63 2.995 7.613 -4.195 1.00 0.48 H new ATOM 0 HD22 LEU A 63 3.220 9.208 -3.439 1.00 0.48 H new ATOM 0 HD23 LEU A 63 3.813 8.915 -5.091 1.00 0.48 H new ATOM 1017 N VAL A 64 7.229 8.567 -6.764 1.00 0.29 N ATOM 1018 CA VAL A 64 6.768 8.710 -8.175 1.00 0.33 C ATOM 1019 C VAL A 64 5.516 7.863 -8.408 1.00 0.32 C ATOM 1020 O VAL A 64 4.645 8.243 -9.164 1.00 0.37 O ATOM 1021 CB VAL A 64 7.863 8.281 -9.158 1.00 0.36 C ATOM 1022 CG1 VAL A 64 8.784 9.465 -9.447 1.00 1.12 C ATOM 1023 CG2 VAL A 64 8.673 7.127 -8.570 1.00 1.35 C ATOM 0 H VAL A 64 8.013 7.931 -6.619 1.00 0.29 H new ATOM 0 HA VAL A 64 6.536 9.761 -8.347 1.00 0.33 H new ATOM 0 HB VAL A 64 7.399 7.949 -10.086 1.00 0.36 H new ATOM 0 HG11 VAL A 64 9.562 9.159 -10.146 1.00 1.12 H new ATOM 0 HG12 VAL A 64 8.205 10.279 -9.883 1.00 1.12 H new ATOM 0 HG13 VAL A 64 9.243 9.804 -8.518 1.00 1.12 H new ATOM 0 HG21 VAL A 64 9.448 6.830 -9.276 1.00 1.35 H new ATOM 0 HG22 VAL A 64 9.136 7.446 -7.636 1.00 1.35 H new ATOM 0 HG23 VAL A 64 8.014 6.281 -8.378 1.00 1.35 H new ATOM 1033 N ASN A 65 5.412 6.714 -7.788 1.00 0.28 N ATOM 1034 CA ASN A 65 4.193 5.885 -8.039 1.00 0.29 C ATOM 1035 C ASN A 65 4.039 4.761 -7.014 1.00 0.26 C ATOM 1036 O ASN A 65 4.984 4.325 -6.391 1.00 0.24 O ATOM 1037 CB ASN A 65 4.301 5.261 -9.430 1.00 0.30 C ATOM 1038 CG ASN A 65 3.661 6.189 -10.463 1.00 0.38 C ATOM 1039 OD1 ASN A 65 4.425 6.875 -11.268 1.00 1.20 O flip ATOM 1040 ND2 ASN A 65 2.452 6.291 -10.540 1.00 0.98 N flip ATOM 0 H ASN A 65 6.095 6.323 -7.139 1.00 0.28 H new ATOM 0 HA ASN A 65 3.323 6.537 -7.959 1.00 0.29 H new ATOM 0 HB2 ASN A 65 5.347 5.088 -9.681 1.00 0.30 H new ATOM 0 HB3 ASN A 65 3.806 4.290 -9.443 1.00 0.30 H new ATOM 0 HD21 ASN A 65 1.854 5.755 -9.911 1.00 0.98 H new ATOM 0 HD22 ASN A 65 2.036 6.912 -11.234 1.00 0.98 H new ATOM 1047 N VAL A 66 2.822 4.293 -6.869 1.00 0.27 N ATOM 1048 CA VAL A 66 2.499 3.191 -5.919 1.00 0.25 C ATOM 1049 C VAL A 66 1.188 2.549 -6.390 1.00 0.26 C ATOM 1050 O VAL A 66 0.315 3.225 -6.897 1.00 0.29 O ATOM 1051 CB VAL A 66 2.275 3.756 -4.508 1.00 0.28 C ATOM 1052 CG1 VAL A 66 1.829 2.633 -3.568 1.00 0.85 C ATOM 1053 CG2 VAL A 66 3.564 4.376 -3.965 1.00 0.63 C ATOM 0 H VAL A 66 2.017 4.644 -7.388 1.00 0.27 H new ATOM 0 HA VAL A 66 3.318 2.472 -5.892 1.00 0.25 H new ATOM 0 HB VAL A 66 1.505 4.525 -4.564 1.00 0.28 H new ATOM 0 HG11 VAL A 66 1.671 3.037 -2.568 1.00 0.85 H new ATOM 0 HG12 VAL A 66 0.899 2.199 -3.935 1.00 0.85 H new ATOM 0 HG13 VAL A 66 2.599 1.862 -3.531 1.00 0.85 H new ATOM 0 HG21 VAL A 66 3.385 4.771 -2.965 1.00 0.63 H new ATOM 0 HG22 VAL A 66 4.343 3.615 -3.921 1.00 0.63 H new ATOM 0 HG23 VAL A 66 3.884 5.185 -4.622 1.00 0.63 H new ATOM 1063 N GLN A 67 1.029 1.264 -6.231 1.00 0.25 N ATOM 1064 CA GLN A 67 -0.238 0.610 -6.675 1.00 0.27 C ATOM 1065 C GLN A 67 -0.537 -0.571 -5.749 1.00 0.25 C ATOM 1066 O GLN A 67 0.311 -0.990 -4.986 1.00 0.25 O ATOM 1067 CB GLN A 67 -0.078 0.112 -8.115 1.00 0.28 C ATOM 1068 CG GLN A 67 -1.452 -0.202 -8.711 1.00 0.39 C ATOM 1069 CD GLN A 67 -1.296 -0.562 -10.189 1.00 0.60 C ATOM 1070 OE1 GLN A 67 -0.200 -0.799 -10.656 1.00 1.07 O ATOM 1071 NE2 GLN A 67 -2.355 -0.615 -10.951 1.00 1.41 N ATOM 0 H GLN A 67 1.719 0.639 -5.814 1.00 0.25 H new ATOM 0 HA GLN A 67 -1.060 1.325 -6.634 1.00 0.27 H new ATOM 0 HB2 GLN A 67 0.425 0.868 -8.717 1.00 0.28 H new ATOM 0 HB3 GLN A 67 0.549 -0.779 -8.134 1.00 0.28 H new ATOM 0 HG2 GLN A 67 -1.914 -1.028 -8.171 1.00 0.39 H new ATOM 0 HG3 GLN A 67 -2.112 0.658 -8.603 1.00 0.39 H new ATOM 0 HE21 GLN A 67 -3.276 -0.416 -10.559 1.00 1.41 H new ATOM 0 HE22 GLN A 67 -2.262 -0.855 -11.938 1.00 1.41 H new ATOM 1080 N THR A 68 -1.738 -1.093 -5.779 1.00 0.26 N ATOM 1081 CA THR A 68 -2.075 -2.223 -4.863 1.00 0.27 C ATOM 1082 C THR A 68 -3.079 -3.173 -5.512 1.00 0.30 C ATOM 1083 O THR A 68 -4.114 -2.778 -6.001 1.00 0.43 O ATOM 1084 CB THR A 68 -2.713 -1.662 -3.591 1.00 0.35 C ATOM 1085 OG1 THR A 68 -3.056 -0.299 -3.800 1.00 0.52 O ATOM 1086 CG2 THR A 68 -1.738 -1.769 -2.423 1.00 0.46 C ATOM 0 H THR A 68 -2.493 -0.788 -6.393 1.00 0.26 H new ATOM 0 HA THR A 68 -1.156 -2.766 -4.639 1.00 0.27 H new ATOM 0 HB THR A 68 -3.609 -2.236 -3.357 1.00 0.35 H new ATOM 0 HG1 THR A 68 -2.710 0.243 -3.060 1.00 0.52 H new ATOM 0 HG21 THR A 68 -2.203 -1.367 -1.523 1.00 0.46 H new ATOM 0 HG22 THR A 68 -1.478 -2.815 -2.261 1.00 0.46 H new ATOM 0 HG23 THR A 68 -0.835 -1.202 -2.650 1.00 0.46 H new ATOM 1094 N GLY A 69 -2.772 -4.433 -5.489 1.00 0.29 N ATOM 1095 CA GLY A 69 -3.697 -5.447 -6.071 1.00 0.38 C ATOM 1096 C GLY A 69 -3.491 -6.775 -5.353 1.00 0.31 C ATOM 1097 O GLY A 69 -2.597 -6.902 -4.545 1.00 0.40 O ATOM 0 H GLY A 69 -1.913 -4.812 -5.090 1.00 0.29 H new ATOM 0 HA2 GLY A 69 -4.731 -5.118 -5.965 1.00 0.38 H new ATOM 0 HA3 GLY A 69 -3.506 -5.562 -7.138 1.00 0.38 H new ATOM 1101 N SER A 70 -4.341 -7.740 -5.618 1.00 0.42 N ATOM 1102 CA SER A 70 -4.230 -9.073 -4.951 1.00 0.34 C ATOM 1103 C SER A 70 -3.835 -10.142 -5.964 1.00 0.32 C ATOM 1104 O SER A 70 -4.066 -10.014 -7.150 1.00 0.33 O ATOM 1105 CB SER A 70 -5.567 -9.437 -4.308 1.00 0.32 C ATOM 1106 OG SER A 70 -6.414 -10.026 -5.286 1.00 0.34 O ATOM 0 H SER A 70 -5.116 -7.657 -6.277 1.00 0.42 H new ATOM 0 HA SER A 70 -3.460 -9.020 -4.182 1.00 0.34 H new ATOM 0 HB2 SER A 70 -5.409 -10.130 -3.482 1.00 0.32 H new ATOM 0 HB3 SER A 70 -6.038 -8.546 -3.891 1.00 0.32 H new ATOM 0 HG SER A 70 -7.220 -10.377 -4.852 1.00 0.34 H new ATOM 1112 N GLU A 71 -3.251 -11.211 -5.494 1.00 0.33 N ATOM 1113 CA GLU A 71 -2.844 -12.305 -6.415 1.00 0.35 C ATOM 1114 C GLU A 71 -2.797 -13.621 -5.653 1.00 0.35 C ATOM 1115 O GLU A 71 -3.011 -13.670 -4.458 1.00 0.33 O ATOM 1116 CB GLU A 71 -1.466 -12.011 -7.010 1.00 0.45 C ATOM 1117 CG GLU A 71 -0.400 -11.975 -5.911 1.00 0.54 C ATOM 1118 CD GLU A 71 0.533 -13.176 -6.070 1.00 0.59 C ATOM 1119 OE1 GLU A 71 0.992 -13.403 -7.178 1.00 1.12 O ATOM 1120 OE2 GLU A 71 0.777 -13.845 -5.084 1.00 1.29 O ATOM 0 H GLU A 71 -3.039 -11.372 -4.509 1.00 0.33 H new ATOM 0 HA GLU A 71 -3.572 -12.375 -7.224 1.00 0.35 H new ATOM 0 HB2 GLU A 71 -1.212 -12.774 -7.746 1.00 0.45 H new ATOM 0 HB3 GLU A 71 -1.487 -11.056 -7.535 1.00 0.45 H new ATOM 0 HG2 GLU A 71 0.169 -11.048 -5.971 1.00 0.54 H new ATOM 0 HG3 GLU A 71 -0.873 -11.995 -4.929 1.00 0.54 H new ATOM 1127 N VAL A 72 -2.537 -14.693 -6.338 1.00 0.43 N ATOM 1128 CA VAL A 72 -2.497 -16.009 -5.659 1.00 0.51 C ATOM 1129 C VAL A 72 -1.098 -16.291 -5.112 1.00 0.58 C ATOM 1130 O VAL A 72 -0.106 -16.148 -5.799 1.00 0.93 O ATOM 1131 CB VAL A 72 -2.883 -17.107 -6.651 1.00 0.64 C ATOM 1132 CG1 VAL A 72 -2.875 -18.464 -5.944 1.00 0.49 C ATOM 1133 CG2 VAL A 72 -4.283 -16.826 -7.201 1.00 1.02 C ATOM 0 H VAL A 72 -2.350 -14.714 -7.341 1.00 0.43 H new ATOM 0 HA VAL A 72 -3.202 -15.993 -4.828 1.00 0.51 H new ATOM 0 HB VAL A 72 -2.165 -17.123 -7.471 1.00 0.64 H new ATOM 0 HG11 VAL A 72 -3.150 -19.245 -6.653 1.00 0.49 H new ATOM 0 HG12 VAL A 72 -1.878 -18.664 -5.552 1.00 0.49 H new ATOM 0 HG13 VAL A 72 -3.591 -18.450 -5.123 1.00 0.49 H new ATOM 0 HG21 VAL A 72 -4.560 -17.608 -7.908 1.00 1.02 H new ATOM 0 HG22 VAL A 72 -5.000 -16.809 -6.380 1.00 1.02 H new ATOM 0 HG23 VAL A 72 -4.288 -15.861 -7.707 1.00 1.02 H new ATOM 1143 N ARG A 73 -1.021 -16.721 -3.883 1.00 0.44 N ATOM 1144 CA ARG A 73 0.297 -17.052 -3.279 1.00 0.48 C ATOM 1145 C ARG A 73 0.119 -18.260 -2.359 1.00 0.54 C ATOM 1146 O ARG A 73 -0.353 -18.133 -1.247 1.00 0.55 O ATOM 1147 CB ARG A 73 0.810 -15.861 -2.474 1.00 0.43 C ATOM 1148 CG ARG A 73 2.315 -15.998 -2.246 1.00 0.53 C ATOM 1149 CD ARG A 73 2.816 -14.794 -1.447 1.00 0.62 C ATOM 1150 NE ARG A 73 4.284 -14.641 -1.647 1.00 0.89 N ATOM 1151 CZ ARG A 73 5.106 -15.514 -1.134 1.00 1.42 C ATOM 1152 NH1 ARG A 73 4.642 -16.521 -0.447 1.00 2.23 N ATOM 1153 NH2 ARG A 73 6.393 -15.380 -1.307 1.00 1.70 N ATOM 0 H ARG A 73 -1.823 -16.858 -3.267 1.00 0.44 H new ATOM 0 HA ARG A 73 1.019 -17.282 -4.062 1.00 0.48 H new ATOM 0 HB2 ARG A 73 0.597 -14.933 -3.005 1.00 0.43 H new ATOM 0 HB3 ARG A 73 0.292 -15.807 -1.517 1.00 0.43 H new ATOM 0 HG2 ARG A 73 2.531 -16.921 -1.708 1.00 0.53 H new ATOM 0 HG3 ARG A 73 2.836 -16.057 -3.202 1.00 0.53 H new ATOM 0 HD2 ARG A 73 2.298 -13.890 -1.768 1.00 0.62 H new ATOM 0 HD3 ARG A 73 2.595 -14.929 -0.388 1.00 0.62 H new ATOM 0 HE ARG A 73 4.646 -13.854 -2.185 1.00 0.89 H new ATOM 0 HH11 ARG A 73 3.637 -16.626 -0.311 1.00 2.23 H new ATOM 0 HH12 ARG A 73 5.285 -17.204 -0.046 1.00 2.23 H new ATOM 0 HH21 ARG A 73 6.756 -14.592 -1.844 1.00 1.70 H new ATOM 0 HH22 ARG A 73 7.035 -16.063 -0.906 1.00 1.70 H new ATOM 1167 N ASP A 74 0.477 -19.427 -2.846 1.00 0.60 N ATOM 1168 CA ASP A 74 0.338 -20.694 -2.060 1.00 0.68 C ATOM 1169 C ASP A 74 -1.075 -21.258 -2.238 1.00 0.68 C ATOM 1170 O ASP A 74 -1.684 -21.738 -1.302 1.00 0.69 O ATOM 1171 CB ASP A 74 0.616 -20.451 -0.574 1.00 0.68 C ATOM 1172 CG ASP A 74 1.176 -21.726 0.058 1.00 0.79 C ATOM 1173 OD1 ASP A 74 0.383 -22.562 0.460 1.00 1.38 O ATOM 1174 OD2 ASP A 74 2.388 -21.846 0.129 1.00 1.27 O ATOM 0 H ASP A 74 0.869 -19.555 -3.779 1.00 0.60 H new ATOM 0 HA ASP A 74 1.069 -21.412 -2.432 1.00 0.68 H new ATOM 0 HB2 ASP A 74 1.326 -19.632 -0.456 1.00 0.68 H new ATOM 0 HB3 ASP A 74 -0.301 -20.154 -0.066 1.00 0.68 H new ATOM 1179 N ARG A 75 -1.604 -21.193 -3.436 1.00 0.67 N ATOM 1180 CA ARG A 75 -2.982 -21.715 -3.699 1.00 0.69 C ATOM 1181 C ARG A 75 -3.979 -20.948 -2.823 1.00 0.59 C ATOM 1182 O ARG A 75 -4.948 -21.482 -2.319 1.00 0.64 O ATOM 1183 CB ARG A 75 -3.045 -23.232 -3.423 1.00 0.79 C ATOM 1184 CG ARG A 75 -2.853 -23.988 -4.738 1.00 0.87 C ATOM 1185 CD ARG A 75 -1.543 -23.551 -5.393 1.00 0.85 C ATOM 1186 NE ARG A 75 -0.932 -24.713 -6.097 1.00 1.25 N ATOM 1187 CZ ARG A 75 0.210 -24.578 -6.714 1.00 1.89 C ATOM 1188 NH1 ARG A 75 0.821 -23.425 -6.711 1.00 2.62 N ATOM 1189 NH2 ARG A 75 0.741 -25.597 -7.333 1.00 2.29 N ATOM 0 H ARG A 75 -1.135 -20.797 -4.251 1.00 0.67 H new ATOM 0 HA ARG A 75 -3.242 -21.563 -4.747 1.00 0.69 H new ATOM 0 HB2 ARG A 75 -2.272 -23.517 -2.709 1.00 0.79 H new ATOM 0 HB3 ARG A 75 -4.004 -23.493 -2.976 1.00 0.79 H new ATOM 0 HG2 ARG A 75 -2.838 -25.062 -4.553 1.00 0.87 H new ATOM 0 HG3 ARG A 75 -3.690 -23.791 -5.408 1.00 0.87 H new ATOM 0 HD2 ARG A 75 -1.728 -22.741 -6.098 1.00 0.85 H new ATOM 0 HD3 ARG A 75 -0.857 -23.166 -4.639 1.00 0.85 H new ATOM 0 HE ARG A 75 -1.407 -25.616 -6.097 1.00 1.25 H new ATOM 0 HH11 ARG A 75 0.406 -22.629 -6.226 1.00 2.62 H new ATOM 0 HH12 ARG A 75 1.714 -23.320 -7.193 1.00 2.62 H new ATOM 0 HH21 ARG A 75 0.263 -26.498 -7.334 1.00 2.29 H new ATOM 0 HH22 ARG A 75 1.634 -25.492 -7.815 1.00 2.29 H new ATOM 1203 N ARG A 76 -3.749 -19.679 -2.657 1.00 0.46 N ATOM 1204 CA ARG A 76 -4.672 -18.854 -1.835 1.00 0.38 C ATOM 1205 C ARG A 76 -4.558 -17.399 -2.280 1.00 0.34 C ATOM 1206 O ARG A 76 -3.516 -16.960 -2.720 1.00 0.34 O ATOM 1207 CB ARG A 76 -4.284 -18.965 -0.362 1.00 0.37 C ATOM 1208 CG ARG A 76 -5.542 -18.872 0.508 1.00 0.63 C ATOM 1209 CD ARG A 76 -6.228 -20.239 0.572 1.00 1.28 C ATOM 1210 NE ARG A 76 -5.806 -20.951 1.811 1.00 1.50 N ATOM 1211 CZ ARG A 76 -5.971 -22.241 1.912 1.00 2.36 C ATOM 1212 NH1 ARG A 76 -6.502 -22.911 0.925 1.00 3.15 N ATOM 1213 NH2 ARG A 76 -5.606 -22.864 2.999 1.00 2.82 N ATOM 0 H ARG A 76 -2.958 -19.175 -3.057 1.00 0.46 H new ATOM 0 HA ARG A 76 -5.696 -19.205 -1.964 1.00 0.38 H new ATOM 0 HB2 ARG A 76 -3.773 -19.910 -0.180 1.00 0.37 H new ATOM 0 HB3 ARG A 76 -3.587 -18.170 -0.098 1.00 0.37 H new ATOM 0 HG2 ARG A 76 -5.278 -18.540 1.512 1.00 0.63 H new ATOM 0 HG3 ARG A 76 -6.226 -18.130 0.097 1.00 0.63 H new ATOM 0 HD2 ARG A 76 -7.311 -20.115 0.562 1.00 1.28 H new ATOM 0 HD3 ARG A 76 -5.967 -20.830 -0.306 1.00 1.28 H new ATOM 0 HE ARG A 76 -5.388 -20.429 2.581 1.00 1.50 H new ATOM 0 HH11 ARG A 76 -6.788 -22.426 0.075 1.00 3.15 H new ATOM 0 HH12 ARG A 76 -6.631 -23.920 1.004 1.00 3.15 H new ATOM 0 HH21 ARG A 76 -5.191 -22.342 3.771 1.00 2.82 H new ATOM 0 HH22 ARG A 76 -5.736 -23.873 3.077 1.00 2.82 H new ATOM 1227 N ARG A 77 -5.617 -16.647 -2.180 1.00 0.32 N ATOM 1228 CA ARG A 77 -5.543 -15.227 -2.616 1.00 0.31 C ATOM 1229 C ARG A 77 -4.958 -14.383 -1.503 1.00 0.27 C ATOM 1230 O ARG A 77 -5.218 -14.589 -0.334 1.00 0.29 O ATOM 1231 CB ARG A 77 -6.935 -14.705 -2.973 1.00 0.34 C ATOM 1232 CG ARG A 77 -6.819 -13.287 -3.552 1.00 0.58 C ATOM 1233 CD ARG A 77 -7.375 -13.261 -4.975 1.00 0.47 C ATOM 1234 NE ARG A 77 -8.744 -13.849 -4.990 1.00 1.21 N ATOM 1235 CZ ARG A 77 -9.230 -14.344 -6.096 1.00 1.57 C ATOM 1236 NH1 ARG A 77 -8.530 -14.300 -7.196 1.00 1.85 N ATOM 1237 NH2 ARG A 77 -10.420 -14.880 -6.102 1.00 2.44 N ATOM 0 H ARG A 77 -6.522 -16.950 -1.819 1.00 0.32 H new ATOM 0 HA ARG A 77 -4.906 -15.165 -3.498 1.00 0.31 H new ATOM 0 HB2 ARG A 77 -7.408 -15.367 -3.698 1.00 0.34 H new ATOM 0 HB3 ARG A 77 -7.570 -14.696 -2.087 1.00 0.34 H new ATOM 0 HG2 ARG A 77 -7.366 -12.583 -2.925 1.00 0.58 H new ATOM 0 HG3 ARG A 77 -5.776 -12.969 -3.553 1.00 0.58 H new ATOM 0 HD2 ARG A 77 -7.405 -12.236 -5.345 1.00 0.47 H new ATOM 0 HD3 ARG A 77 -6.720 -13.822 -5.642 1.00 0.47 H new ATOM 0 HE ARG A 77 -9.302 -13.865 -4.136 1.00 1.21 H new ATOM 0 HH11 ARG A 77 -7.601 -13.878 -7.193 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -8.911 -14.687 -8.059 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -10.969 -14.912 -5.243 1.00 2.44 H new ATOM 0 HH22 ARG A 77 -10.801 -15.267 -6.966 1.00 2.44 H new ATOM 1251 N ILE A 78 -4.141 -13.448 -1.871 1.00 0.23 N ATOM 1252 CA ILE A 78 -3.489 -12.589 -0.868 1.00 0.20 C ATOM 1253 C ILE A 78 -3.356 -11.172 -1.430 1.00 0.19 C ATOM 1254 O ILE A 78 -3.377 -10.962 -2.626 1.00 0.21 O ATOM 1255 CB ILE A 78 -2.122 -13.182 -0.573 1.00 0.20 C ATOM 1256 CG1 ILE A 78 -1.328 -12.220 0.268 1.00 0.21 C ATOM 1257 CG2 ILE A 78 -1.370 -13.446 -1.877 1.00 0.23 C ATOM 1258 CD1 ILE A 78 -0.209 -12.982 0.976 1.00 0.23 C ATOM 0 H ILE A 78 -3.896 -13.242 -2.839 1.00 0.23 H new ATOM 0 HA ILE A 78 -4.074 -12.538 0.050 1.00 0.20 H new ATOM 0 HB ILE A 78 -2.254 -14.122 -0.037 1.00 0.20 H new ATOM 0 HG12 ILE A 78 -0.909 -11.431 -0.357 1.00 0.21 H new ATOM 0 HG13 ILE A 78 -1.976 -11.737 1.000 1.00 0.21 H new ATOM 0 HG21 ILE A 78 -0.392 -13.871 -1.653 1.00 0.23 H new ATOM 0 HG22 ILE A 78 -1.938 -14.146 -2.489 1.00 0.23 H new ATOM 0 HG23 ILE A 78 -1.243 -12.509 -2.420 1.00 0.23 H new ATOM 0 HD11 ILE A 78 0.371 -12.291 1.588 1.00 0.23 H new ATOM 0 HD12 ILE A 78 -0.641 -13.755 1.612 1.00 0.23 H new ATOM 0 HD13 ILE A 78 0.442 -13.444 0.234 1.00 0.23 H new ATOM 1270 N SER A 79 -3.243 -10.203 -0.576 1.00 0.20 N ATOM 1271 CA SER A 79 -3.137 -8.798 -1.046 1.00 0.22 C ATOM 1272 C SER A 79 -1.666 -8.458 -1.306 1.00 0.19 C ATOM 1273 O SER A 79 -0.780 -9.023 -0.696 1.00 0.22 O ATOM 1274 CB SER A 79 -3.693 -7.872 0.035 1.00 0.28 C ATOM 1275 OG SER A 79 -2.747 -6.856 0.315 1.00 0.74 O ATOM 0 H SER A 79 -3.219 -10.323 0.437 1.00 0.20 H new ATOM 0 HA SER A 79 -3.704 -8.671 -1.968 1.00 0.22 H new ATOM 0 HB2 SER A 79 -4.632 -7.429 -0.298 1.00 0.28 H new ATOM 0 HB3 SER A 79 -3.912 -8.440 0.939 1.00 0.28 H new ATOM 0 HG SER A 79 -2.957 -6.442 1.178 1.00 0.74 H new ATOM 1281 N TYR A 80 -1.392 -7.532 -2.196 1.00 0.19 N ATOM 1282 CA TYR A 80 0.033 -7.165 -2.462 1.00 0.25 C ATOM 1283 C TYR A 80 0.143 -5.687 -2.809 1.00 0.22 C ATOM 1284 O TYR A 80 -0.780 -5.075 -3.310 1.00 0.21 O ATOM 1285 CB TYR A 80 0.640 -8.043 -3.583 1.00 0.40 C ATOM 1286 CG TYR A 80 0.097 -7.671 -4.951 1.00 0.93 C ATOM 1287 CD1 TYR A 80 0.538 -6.509 -5.605 1.00 1.68 C ATOM 1288 CD2 TYR A 80 -0.840 -8.505 -5.577 1.00 1.82 C ATOM 1289 CE1 TYR A 80 0.032 -6.185 -6.871 1.00 2.66 C ATOM 1290 CE2 TYR A 80 -1.339 -8.170 -6.843 1.00 2.78 C ATOM 1291 CZ TYR A 80 -0.905 -7.012 -7.485 1.00 3.08 C ATOM 1292 OH TYR A 80 -1.400 -6.686 -8.731 1.00 4.16 O ATOM 0 H TYR A 80 -2.085 -7.021 -2.743 1.00 0.19 H new ATOM 0 HA TYR A 80 0.606 -7.351 -1.554 1.00 0.25 H new ATOM 0 HB2 TYR A 80 1.725 -7.935 -3.581 1.00 0.40 H new ATOM 0 HB3 TYR A 80 0.424 -9.092 -3.380 1.00 0.40 H new ATOM 0 HD1 TYR A 80 1.266 -5.866 -5.133 1.00 1.68 H new ATOM 0 HD2 TYR A 80 -1.177 -9.405 -5.084 1.00 1.82 H new ATOM 0 HE1 TYR A 80 0.370 -5.290 -7.372 1.00 2.66 H new ATOM 0 HE2 TYR A 80 -2.063 -8.812 -7.323 1.00 2.78 H new ATOM 0 HH TYR A 80 -2.043 -7.368 -9.016 1.00 4.16 H new ATOM 1302 N ILE A 81 1.284 -5.117 -2.509 1.00 0.25 N ATOM 1303 CA ILE A 81 1.519 -3.665 -2.768 1.00 0.27 C ATOM 1304 C ILE A 81 2.707 -3.450 -3.677 1.00 0.25 C ATOM 1305 O ILE A 81 3.753 -4.038 -3.495 1.00 0.26 O ATOM 1306 CB ILE A 81 1.863 -2.944 -1.466 1.00 0.34 C ATOM 1307 CG1 ILE A 81 2.156 -1.475 -1.781 1.00 0.76 C ATOM 1308 CG2 ILE A 81 3.132 -3.563 -0.866 1.00 0.92 C ATOM 1309 CD1 ILE A 81 2.012 -0.634 -0.519 1.00 0.69 C ATOM 0 H ILE A 81 2.074 -5.606 -2.089 1.00 0.25 H new ATOM 0 HA ILE A 81 0.605 -3.282 -3.222 1.00 0.27 H new ATOM 0 HB ILE A 81 1.031 -3.032 -0.767 1.00 0.34 H new ATOM 0 HG12 ILE A 81 3.165 -1.374 -2.182 1.00 0.76 H new ATOM 0 HG13 ILE A 81 1.471 -1.115 -2.548 1.00 0.76 H new ATOM 0 HG21 ILE A 81 3.382 -3.052 0.064 1.00 0.92 H new ATOM 0 HG22 ILE A 81 2.961 -4.620 -0.664 1.00 0.92 H new ATOM 0 HG23 ILE A 81 3.957 -3.457 -1.571 1.00 0.92 H new ATOM 0 HD11 ILE A 81 2.222 0.410 -0.752 1.00 0.69 H new ATOM 0 HD12 ILE A 81 0.995 -0.723 -0.136 1.00 0.69 H new ATOM 0 HD13 ILE A 81 2.716 -0.986 0.235 1.00 0.69 H new ATOM 1321 N LEU A 82 2.562 -2.552 -4.607 1.00 0.25 N ATOM 1322 CA LEU A 82 3.678 -2.186 -5.508 1.00 0.25 C ATOM 1323 C LEU A 82 4.070 -0.770 -5.099 1.00 0.25 C ATOM 1324 O LEU A 82 3.363 0.167 -5.402 1.00 0.29 O ATOM 1325 CB LEU A 82 3.189 -2.188 -6.958 1.00 0.29 C ATOM 1326 CG LEU A 82 2.338 -3.434 -7.210 1.00 0.32 C ATOM 1327 CD1 LEU A 82 1.882 -3.466 -8.676 1.00 0.36 C ATOM 1328 CD2 LEU A 82 3.173 -4.684 -6.907 1.00 0.32 C ATOM 0 H LEU A 82 1.694 -2.046 -4.782 1.00 0.25 H new ATOM 0 HA LEU A 82 4.514 -2.882 -5.436 1.00 0.25 H new ATOM 0 HB2 LEU A 82 2.605 -1.290 -7.157 1.00 0.29 H new ATOM 0 HB3 LEU A 82 4.040 -2.172 -7.639 1.00 0.29 H new ATOM 0 HG LEU A 82 1.461 -3.411 -6.564 1.00 0.32 H new ATOM 0 HD11 LEU A 82 1.276 -4.356 -8.849 1.00 0.36 H new ATOM 0 HD12 LEU A 82 1.290 -2.576 -8.893 1.00 0.36 H new ATOM 0 HD13 LEU A 82 2.755 -3.489 -9.328 1.00 0.36 H new ATOM 0 HD21 LEU A 82 2.571 -5.575 -7.085 1.00 0.32 H new ATOM 0 HD22 LEU A 82 4.049 -4.702 -7.555 1.00 0.32 H new ATOM 0 HD23 LEU A 82 3.493 -4.664 -5.865 1.00 0.32 H new ATOM 1340 N LEU A 83 5.170 -0.611 -4.402 1.00 0.22 N ATOM 1341 CA LEU A 83 5.596 0.749 -3.949 1.00 0.23 C ATOM 1342 C LEU A 83 6.789 1.223 -4.768 1.00 0.21 C ATOM 1343 O LEU A 83 7.829 0.598 -4.772 1.00 0.20 O ATOM 1344 CB LEU A 83 5.983 0.690 -2.472 1.00 0.23 C ATOM 1345 CG LEU A 83 5.946 2.101 -1.872 1.00 0.52 C ATOM 1346 CD1 LEU A 83 4.624 2.313 -1.130 1.00 0.52 C ATOM 1347 CD2 LEU A 83 7.102 2.275 -0.887 1.00 0.98 C ATOM 0 H LEU A 83 5.793 -1.370 -4.127 1.00 0.22 H new ATOM 0 HA LEU A 83 4.771 1.448 -4.087 1.00 0.23 H new ATOM 0 HB2 LEU A 83 5.298 0.037 -1.932 1.00 0.23 H new ATOM 0 HB3 LEU A 83 6.981 0.264 -2.364 1.00 0.23 H new ATOM 0 HG LEU A 83 6.037 2.830 -2.677 1.00 0.52 H new ATOM 0 HD11 LEU A 83 4.602 3.317 -0.705 1.00 0.52 H new ATOM 0 HD12 LEU A 83 3.793 2.195 -1.826 1.00 0.52 H new ATOM 0 HD13 LEU A 83 4.534 1.578 -0.330 1.00 0.52 H new ATOM 0 HD21 LEU A 83 7.071 3.279 -0.464 1.00 0.98 H new ATOM 0 HD22 LEU A 83 7.012 1.541 -0.087 1.00 0.98 H new ATOM 0 HD23 LEU A 83 8.049 2.130 -1.408 1.00 0.98 H new ATOM 1359 N ARG A 84 6.648 2.329 -5.450 1.00 0.22 N ATOM 1360 CA ARG A 84 7.765 2.869 -6.270 1.00 0.21 C ATOM 1361 C ARG A 84 8.393 4.050 -5.534 1.00 0.21 C ATOM 1362 O ARG A 84 7.843 4.553 -4.575 1.00 0.23 O ATOM 1363 CB ARG A 84 7.216 3.311 -7.623 1.00 0.23 C ATOM 1364 CG ARG A 84 8.242 3.005 -8.717 1.00 0.25 C ATOM 1365 CD ARG A 84 7.794 3.633 -10.036 1.00 0.31 C ATOM 1366 NE ARG A 84 8.843 3.422 -11.073 1.00 0.40 N ATOM 1367 CZ ARG A 84 8.580 3.674 -12.326 1.00 0.48 C ATOM 1368 NH1 ARG A 84 7.398 4.110 -12.669 1.00 0.49 N ATOM 1369 NH2 ARG A 84 9.497 3.492 -13.236 1.00 0.58 N ATOM 0 H ARG A 84 5.794 2.886 -5.472 1.00 0.22 H new ATOM 0 HA ARG A 84 8.527 2.106 -6.430 1.00 0.21 H new ATOM 0 HB2 ARG A 84 6.280 2.794 -7.833 1.00 0.23 H new ATOM 0 HB3 ARG A 84 6.994 4.378 -7.606 1.00 0.23 H new ATOM 0 HG2 ARG A 84 9.219 3.395 -8.431 1.00 0.25 H new ATOM 0 HG3 ARG A 84 8.351 1.927 -8.835 1.00 0.25 H new ATOM 0 HD2 ARG A 84 6.853 3.189 -10.361 1.00 0.31 H new ATOM 0 HD3 ARG A 84 7.613 4.699 -9.900 1.00 0.31 H new ATOM 0 HE ARG A 84 9.766 3.081 -10.804 1.00 0.40 H new ATOM 0 HH11 ARG A 84 6.681 4.253 -11.958 1.00 0.49 H new ATOM 0 HH12 ARG A 84 7.192 4.307 -13.648 1.00 0.49 H new ATOM 0 HH21 ARG A 84 10.421 3.152 -12.968 1.00 0.58 H new ATOM 0 HH22 ARG A 84 9.290 3.689 -14.215 1.00 0.58 H new ATOM 1383 N LEU A 85 9.530 4.510 -5.976 1.00 0.20 N ATOM 1384 CA LEU A 85 10.157 5.673 -5.283 1.00 0.21 C ATOM 1385 C LEU A 85 11.171 6.337 -6.197 1.00 0.21 C ATOM 1386 O LEU A 85 11.629 5.746 -7.145 1.00 0.22 O ATOM 1387 CB LEU A 85 10.868 5.202 -4.009 1.00 0.23 C ATOM 1388 CG LEU A 85 10.702 6.240 -2.891 1.00 0.53 C ATOM 1389 CD1 LEU A 85 9.370 6.029 -2.169 1.00 1.39 C ATOM 1390 CD2 LEU A 85 11.840 6.085 -1.880 1.00 0.94 C ATOM 0 H LEU A 85 10.046 4.139 -6.774 1.00 0.20 H new ATOM 0 HA LEU A 85 9.375 6.387 -5.024 1.00 0.21 H new ATOM 0 HB2 LEU A 85 10.458 4.244 -3.689 1.00 0.23 H new ATOM 0 HB3 LEU A 85 11.927 5.043 -4.213 1.00 0.23 H new ATOM 0 HG LEU A 85 10.723 7.237 -3.331 1.00 0.53 H new ATOM 0 HD11 LEU A 85 9.263 6.771 -1.378 1.00 1.39 H new ATOM 0 HD12 LEU A 85 8.550 6.136 -2.879 1.00 1.39 H new ATOM 0 HD13 LEU A 85 9.346 5.030 -1.734 1.00 1.39 H new ATOM 0 HD21 LEU A 85 11.723 6.822 -1.085 1.00 0.94 H new ATOM 0 HD22 LEU A 85 11.813 5.083 -1.453 1.00 0.94 H new ATOM 0 HD23 LEU A 85 12.795 6.240 -2.381 1.00 0.94 H new ATOM 1402 N LYS A 86 11.505 7.568 -5.912 1.00 0.22 N ATOM 1403 CA LYS A 86 12.490 8.307 -6.755 1.00 0.24 C ATOM 1404 C LYS A 86 13.379 9.177 -5.860 1.00 0.23 C ATOM 1405 O LYS A 86 12.929 9.713 -4.877 1.00 0.28 O ATOM 1406 CB LYS A 86 11.728 9.202 -7.729 1.00 0.27 C ATOM 1407 CG LYS A 86 12.706 10.023 -8.579 1.00 0.38 C ATOM 1408 CD LYS A 86 12.799 11.467 -8.066 1.00 0.72 C ATOM 1409 CE LYS A 86 13.639 12.293 -9.042 1.00 0.72 C ATOM 1410 NZ LYS A 86 12.776 13.319 -9.694 1.00 1.42 N ATOM 0 H LYS A 86 11.134 8.098 -5.123 1.00 0.22 H new ATOM 0 HA LYS A 86 13.112 7.600 -7.304 1.00 0.24 H new ATOM 0 HB2 LYS A 86 11.098 8.592 -8.376 1.00 0.27 H new ATOM 0 HB3 LYS A 86 11.067 9.870 -7.177 1.00 0.27 H new ATOM 0 HG2 LYS A 86 13.692 9.560 -8.555 1.00 0.38 H new ATOM 0 HG3 LYS A 86 12.379 10.023 -9.619 1.00 0.38 H new ATOM 0 HD2 LYS A 86 11.802 11.897 -7.971 1.00 0.72 H new ATOM 0 HD3 LYS A 86 13.250 11.485 -7.074 1.00 0.72 H new ATOM 0 HE2 LYS A 86 14.461 12.776 -8.513 1.00 0.72 H new ATOM 0 HE3 LYS A 86 14.083 11.644 -9.796 1.00 0.72 H new ATOM 0 HZ1 LYS A 86 13.346 13.881 -10.358 1.00 1.42 H new ATOM 0 HZ2 LYS A 86 12.007 12.848 -10.211 1.00 1.42 H new ATOM 0 HZ3 LYS A 86 12.372 13.945 -8.968 1.00 1.42 H new ATOM 1424 N ARG A 87 14.631 9.331 -6.212 1.00 0.24 N ATOM 1425 CA ARG A 87 15.553 10.190 -5.394 1.00 0.24 C ATOM 1426 C ARG A 87 15.792 11.507 -6.119 1.00 0.26 C ATOM 1427 O ARG A 87 16.032 11.521 -7.310 1.00 0.28 O ATOM 1428 CB ARG A 87 16.908 9.505 -5.219 1.00 0.27 C ATOM 1429 CG ARG A 87 16.753 8.202 -4.420 1.00 0.62 C ATOM 1430 CD ARG A 87 16.610 8.491 -2.917 1.00 0.43 C ATOM 1431 NE ARG A 87 16.800 7.217 -2.161 1.00 0.48 N ATOM 1432 CZ ARG A 87 17.349 7.214 -0.971 1.00 0.80 C ATOM 1433 NH1 ARG A 87 17.684 8.333 -0.382 1.00 1.64 N ATOM 1434 NH2 ARG A 87 17.547 6.080 -0.356 1.00 0.86 N ATOM 0 H ARG A 87 15.059 8.900 -7.031 1.00 0.24 H new ATOM 0 HA ARG A 87 15.091 10.356 -4.421 1.00 0.24 H new ATOM 0 HB2 ARG A 87 17.342 9.290 -6.195 1.00 0.27 H new ATOM 0 HB3 ARG A 87 17.597 10.175 -4.704 1.00 0.27 H new ATOM 0 HG2 ARG A 87 15.878 7.656 -4.774 1.00 0.62 H new ATOM 0 HG3 ARG A 87 17.619 7.562 -4.590 1.00 0.62 H new ATOM 0 HD2 ARG A 87 17.348 9.230 -2.603 1.00 0.43 H new ATOM 0 HD3 ARG A 87 15.627 8.912 -2.706 1.00 0.43 H new ATOM 0 HE ARG A 87 16.498 6.336 -2.577 1.00 0.48 H new ATOM 0 HH11 ARG A 87 17.519 9.225 -0.849 1.00 1.64 H new ATOM 0 HH12 ARG A 87 18.110 8.314 0.544 1.00 1.64 H new ATOM 0 HH21 ARG A 87 17.275 5.204 -0.802 1.00 0.86 H new ATOM 0 HH22 ARG A 87 17.974 6.070 0.570 1.00 0.86 H new ATOM 1448 N VAL A 88 15.762 12.609 -5.410 1.00 0.27 N ATOM 1449 CA VAL A 88 16.020 13.936 -6.048 1.00 0.30 C ATOM 1450 C VAL A 88 17.398 14.416 -5.592 1.00 0.31 C ATOM 1451 O VAL A 88 17.924 15.399 -6.073 1.00 0.35 O ATOM 1452 CB VAL A 88 14.958 14.940 -5.584 1.00 0.31 C ATOM 1453 CG1 VAL A 88 14.991 16.184 -6.475 1.00 0.49 C ATOM 1454 CG2 VAL A 88 13.572 14.300 -5.671 1.00 0.63 C ATOM 0 H VAL A 88 15.568 12.645 -4.409 1.00 0.27 H new ATOM 0 HA VAL A 88 15.982 13.850 -7.134 1.00 0.30 H new ATOM 0 HB VAL A 88 15.168 15.225 -4.553 1.00 0.31 H new ATOM 0 HG11 VAL A 88 14.234 16.892 -6.139 1.00 0.49 H new ATOM 0 HG12 VAL A 88 15.975 16.649 -6.415 1.00 0.49 H new ATOM 0 HG13 VAL A 88 14.788 15.898 -7.507 1.00 0.49 H new ATOM 0 HG21 VAL A 88 12.819 15.016 -5.341 1.00 0.63 H new ATOM 0 HG22 VAL A 88 13.369 14.010 -6.702 1.00 0.63 H new ATOM 0 HG23 VAL A 88 13.538 13.417 -5.032 1.00 0.63 H new ATOM 1464 N TYR A 89 17.990 13.711 -4.668 1.00 0.31 N ATOM 1465 CA TYR A 89 19.337 14.106 -4.176 1.00 0.37 C ATOM 1466 C TYR A 89 20.013 12.901 -3.521 1.00 0.49 C ATOM 1467 O TYR A 89 19.584 11.790 -3.786 1.00 1.12 O ATOM 1468 CB TYR A 89 19.196 15.234 -3.151 1.00 0.35 C ATOM 1469 CG TYR A 89 20.313 16.232 -3.341 1.00 0.51 C ATOM 1470 CD1 TYR A 89 20.148 17.308 -4.221 1.00 1.46 C ATOM 1471 CD2 TYR A 89 21.514 16.082 -2.636 1.00 1.13 C ATOM 1472 CE1 TYR A 89 21.183 18.234 -4.396 1.00 1.76 C ATOM 1473 CE2 TYR A 89 22.549 17.008 -2.811 1.00 1.28 C ATOM 1474 CZ TYR A 89 22.384 18.084 -3.691 1.00 1.27 C ATOM 1475 OH TYR A 89 23.404 18.997 -3.864 1.00 1.67 O ATOM 1476 OXT TYR A 89 20.948 13.109 -2.765 1.00 1.00 O ATOM 0 H TYR A 89 17.597 12.877 -4.232 1.00 0.31 H new ATOM 0 HA TYR A 89 19.943 14.452 -5.013 1.00 0.37 H new ATOM 0 HB2 TYR A 89 18.231 15.727 -3.267 1.00 0.35 H new ATOM 0 HB3 TYR A 89 19.226 14.827 -2.140 1.00 0.35 H new ATOM 0 HD1 TYR A 89 19.222 17.424 -4.765 1.00 1.46 H new ATOM 0 HD2 TYR A 89 21.641 15.252 -1.957 1.00 1.13 H new ATOM 0 HE1 TYR A 89 21.056 19.064 -5.075 1.00 1.76 H new ATOM 0 HE2 TYR A 89 23.475 16.892 -2.267 1.00 1.28 H new ATOM 0 HH TYR A 89 24.166 18.747 -3.300 1.00 1.67 H new ATOM 1576 N ASN B 6 -16.151 9.866 1.286 1.00 0.33 N ATOM 1577 CA ASN B 6 -16.306 8.972 2.467 1.00 0.35 C ATOM 1578 C ASN B 6 -14.963 8.391 2.906 1.00 0.29 C ATOM 1579 O ASN B 6 -14.468 7.439 2.336 1.00 0.32 O ATOM 1580 CB ASN B 6 -17.248 7.833 2.104 1.00 0.52 C ATOM 1581 CG ASN B 6 -17.790 7.176 3.377 1.00 0.62 C ATOM 1582 OD1 ASN B 6 -18.296 5.975 3.311 1.00 1.46 O flip ATOM 1583 ND2 ASN B 6 -17.756 7.760 4.442 1.00 0.99 N flip ATOM 0 HA ASN B 6 -16.710 9.558 3.292 1.00 0.35 H new ATOM 0 HB2 ASN B 6 -18.073 8.211 1.500 1.00 0.52 H new ATOM 0 HB3 ASN B 6 -16.722 7.094 1.499 1.00 0.52 H new ATOM 0 HD21 ASN B 6 -17.361 8.699 4.496 1.00 0.99 H new ATOM 0 HD22 ASN B 6 -18.122 7.311 5.282 1.00 0.99 H new ATOM 1590 N GLU B 7 -14.393 8.933 3.943 1.00 0.28 N ATOM 1591 CA GLU B 7 -13.106 8.392 4.453 1.00 0.30 C ATOM 1592 C GLU B 7 -13.413 7.367 5.546 1.00 0.32 C ATOM 1593 O GLU B 7 -14.078 7.676 6.516 1.00 0.37 O ATOM 1594 CB GLU B 7 -12.266 9.531 5.022 1.00 0.36 C ATOM 1595 CG GLU B 7 -12.933 10.078 6.286 1.00 0.53 C ATOM 1596 CD GLU B 7 -12.513 11.533 6.499 1.00 0.76 C ATOM 1597 OE1 GLU B 7 -11.475 11.746 7.103 1.00 1.08 O ATOM 1598 OE2 GLU B 7 -13.236 12.409 6.055 1.00 1.49 O ATOM 0 H GLU B 7 -14.764 9.730 4.461 1.00 0.28 H new ATOM 0 HA GLU B 7 -12.548 7.915 3.647 1.00 0.30 H new ATOM 0 HB2 GLU B 7 -11.262 9.176 5.253 1.00 0.36 H new ATOM 0 HB3 GLU B 7 -12.161 10.324 4.282 1.00 0.36 H new ATOM 0 HG2 GLU B 7 -14.017 10.011 6.195 1.00 0.53 H new ATOM 0 HG3 GLU B 7 -12.648 9.477 7.149 1.00 0.53 H new ATOM 1605 N ILE B 8 -12.965 6.145 5.377 1.00 0.33 N ATOM 1606 CA ILE B 8 -13.258 5.077 6.387 1.00 0.38 C ATOM 1607 C ILE B 8 -11.987 4.281 6.691 1.00 0.34 C ATOM 1608 O ILE B 8 -11.120 4.138 5.860 1.00 0.34 O ATOM 1609 CB ILE B 8 -14.312 4.122 5.810 1.00 0.42 C ATOM 1610 CG1 ILE B 8 -15.504 4.920 5.270 1.00 0.47 C ATOM 1611 CG2 ILE B 8 -14.802 3.158 6.896 1.00 0.62 C ATOM 1612 CD1 ILE B 8 -16.493 3.964 4.600 1.00 1.17 C ATOM 0 H ILE B 8 -12.407 5.840 4.580 1.00 0.33 H new ATOM 0 HA ILE B 8 -13.624 5.540 7.304 1.00 0.38 H new ATOM 0 HB ILE B 8 -13.857 3.553 4.999 1.00 0.42 H new ATOM 0 HG12 ILE B 8 -15.994 5.458 6.082 1.00 0.47 H new ATOM 0 HG13 ILE B 8 -15.161 5.667 4.554 1.00 0.47 H new ATOM 0 HG21 ILE B 8 -15.549 2.485 6.475 1.00 0.62 H new ATOM 0 HG22 ILE B 8 -13.961 2.576 7.272 1.00 0.62 H new ATOM 0 HG23 ILE B 8 -15.245 3.726 7.714 1.00 0.62 H new ATOM 0 HD11 ILE B 8 -17.342 4.529 4.215 1.00 1.17 H new ATOM 0 HD12 ILE B 8 -15.999 3.447 3.778 1.00 1.17 H new ATOM 0 HD13 ILE B 8 -16.844 3.234 5.329 1.00 1.17 H new ATOM 1624 N VAL B 9 -11.881 3.752 7.879 1.00 0.32 N ATOM 1625 CA VAL B 9 -10.686 2.944 8.253 1.00 0.30 C ATOM 1626 C VAL B 9 -11.036 1.457 8.137 1.00 0.27 C ATOM 1627 O VAL B 9 -12.110 1.038 8.521 1.00 0.28 O ATOM 1628 CB VAL B 9 -10.301 3.262 9.699 1.00 0.34 C ATOM 1629 CG1 VAL B 9 -9.098 2.413 10.117 1.00 1.37 C ATOM 1630 CG2 VAL B 9 -9.947 4.746 9.816 1.00 1.27 C ATOM 0 H VAL B 9 -12.580 3.847 8.615 1.00 0.32 H new ATOM 0 HA VAL B 9 -9.853 3.180 7.591 1.00 0.30 H new ATOM 0 HB VAL B 9 -11.142 3.034 10.354 1.00 0.34 H new ATOM 0 HG11 VAL B 9 -8.830 2.645 11.148 1.00 1.37 H new ATOM 0 HG12 VAL B 9 -9.353 1.356 10.037 1.00 1.37 H new ATOM 0 HG13 VAL B 9 -8.253 2.632 9.464 1.00 1.37 H new ATOM 0 HG21 VAL B 9 -9.672 4.974 10.846 1.00 1.27 H new ATOM 0 HG22 VAL B 9 -9.108 4.973 9.158 1.00 1.27 H new ATOM 0 HG23 VAL B 9 -10.808 5.349 9.528 1.00 1.27 H new ATOM 1640 N VAL B 10 -10.147 0.653 7.622 1.00 0.24 N ATOM 1641 CA VAL B 10 -10.452 -0.803 7.504 1.00 0.22 C ATOM 1642 C VAL B 10 -9.985 -1.501 8.780 1.00 0.20 C ATOM 1643 O VAL B 10 -9.179 -0.967 9.517 1.00 0.21 O ATOM 1644 CB VAL B 10 -9.725 -1.389 6.288 1.00 0.22 C ATOM 1645 CG1 VAL B 10 -8.294 -1.768 6.673 1.00 0.34 C ATOM 1646 CG2 VAL B 10 -10.467 -2.636 5.804 1.00 0.37 C ATOM 0 H VAL B 10 -9.229 0.937 7.280 1.00 0.24 H new ATOM 0 HA VAL B 10 -11.524 -0.952 7.372 1.00 0.22 H new ATOM 0 HB VAL B 10 -9.699 -0.645 5.492 1.00 0.22 H new ATOM 0 HG11 VAL B 10 -7.782 -2.184 5.805 1.00 0.34 H new ATOM 0 HG12 VAL B 10 -7.763 -0.881 7.017 1.00 0.34 H new ATOM 0 HG13 VAL B 10 -8.316 -2.510 7.471 1.00 0.34 H new ATOM 0 HG21 VAL B 10 -9.951 -3.054 4.939 1.00 0.37 H new ATOM 0 HG22 VAL B 10 -10.494 -3.377 6.603 1.00 0.37 H new ATOM 0 HG23 VAL B 10 -11.486 -2.368 5.524 1.00 0.37 H new ATOM 1656 N ARG B 11 -10.504 -2.675 9.051 1.00 0.19 N ATOM 1657 CA ARG B 11 -10.118 -3.412 10.293 1.00 0.20 C ATOM 1658 C ARG B 11 -9.745 -4.851 9.965 1.00 0.21 C ATOM 1659 O ARG B 11 -9.997 -5.349 8.886 1.00 0.22 O ATOM 1660 CB ARG B 11 -11.298 -3.430 11.265 1.00 0.22 C ATOM 1661 CG ARG B 11 -11.999 -2.073 11.247 1.00 0.51 C ATOM 1662 CD ARG B 11 -12.930 -1.966 12.455 1.00 0.49 C ATOM 1663 NE ARG B 11 -14.138 -1.179 12.082 1.00 1.28 N ATOM 1664 CZ ARG B 11 -14.026 0.085 11.783 1.00 1.53 C ATOM 1665 NH1 ARG B 11 -12.858 0.664 11.826 1.00 1.59 N ATOM 1666 NH2 ARG B 11 -15.083 0.772 11.445 1.00 2.37 N ATOM 0 H ARG B 11 -11.182 -3.156 8.460 1.00 0.19 H new ATOM 0 HA ARG B 11 -9.262 -2.906 10.740 1.00 0.20 H new ATOM 0 HB2 ARG B 11 -11.999 -4.216 10.986 1.00 0.22 H new ATOM 0 HB3 ARG B 11 -10.949 -3.657 12.272 1.00 0.22 H new ATOM 0 HG2 ARG B 11 -11.262 -1.270 11.270 1.00 0.51 H new ATOM 0 HG3 ARG B 11 -12.568 -1.957 10.324 1.00 0.51 H new ATOM 0 HD2 ARG B 11 -13.221 -2.961 12.793 1.00 0.49 H new ATOM 0 HD3 ARG B 11 -12.412 -1.486 13.285 1.00 0.49 H new ATOM 0 HE ARG B 11 -15.053 -1.629 12.060 1.00 1.28 H new ATOM 0 HH11 ARG B 11 -12.033 0.128 12.093 1.00 1.59 H new ATOM 0 HH12 ARG B 11 -12.770 1.653 11.592 1.00 1.59 H new ATOM 0 HH21 ARG B 11 -15.997 0.320 11.415 1.00 2.37 H new ATOM 0 HH22 ARG B 11 -14.995 1.761 11.211 1.00 2.37 H new ATOM 1680 N LYS B 12 -9.158 -5.516 10.917 1.00 0.22 N ATOM 1681 CA LYS B 12 -8.758 -6.934 10.734 1.00 0.25 C ATOM 1682 C LYS B 12 -9.730 -7.813 11.505 1.00 0.25 C ATOM 1683 O LYS B 12 -9.656 -9.025 11.470 1.00 0.31 O ATOM 1684 CB LYS B 12 -7.346 -7.139 11.287 1.00 0.31 C ATOM 1685 CG LYS B 12 -7.285 -6.724 12.770 1.00 0.43 C ATOM 1686 CD LYS B 12 -7.331 -7.958 13.680 1.00 1.00 C ATOM 1687 CE LYS B 12 -7.139 -7.520 15.133 1.00 0.99 C ATOM 1688 NZ LYS B 12 -7.364 -8.684 16.037 1.00 1.75 N ATOM 0 H LYS B 12 -8.934 -5.127 11.833 1.00 0.22 H new ATOM 0 HA LYS B 12 -8.773 -7.193 9.675 1.00 0.25 H new ATOM 0 HB2 LYS B 12 -7.056 -8.185 11.183 1.00 0.31 H new ATOM 0 HB3 LYS B 12 -6.633 -6.551 10.709 1.00 0.31 H new ATOM 0 HG2 LYS B 12 -6.371 -6.161 12.958 1.00 0.43 H new ATOM 0 HG3 LYS B 12 -8.120 -6.063 13.003 1.00 0.43 H new ATOM 0 HD2 LYS B 12 -8.285 -8.473 13.566 1.00 1.00 H new ATOM 0 HD3 LYS B 12 -6.551 -8.664 13.395 1.00 1.00 H new ATOM 0 HE2 LYS B 12 -6.133 -7.125 15.275 1.00 0.99 H new ATOM 0 HE3 LYS B 12 -7.834 -6.717 15.377 1.00 0.99 H new ATOM 0 HZ1 LYS B 12 -7.234 -8.387 17.025 1.00 1.75 H new ATOM 0 HZ2 LYS B 12 -8.332 -9.042 15.908 1.00 1.75 H new ATOM 0 HZ3 LYS B 12 -6.684 -9.437 15.809 1.00 1.75 H new ATOM 1702 N THR B 13 -10.627 -7.206 12.226 1.00 0.25 N ATOM 1703 CA THR B 13 -11.587 -8.004 13.028 1.00 0.36 C ATOM 1704 C THR B 13 -12.764 -8.451 12.162 1.00 0.49 C ATOM 1705 O THR B 13 -13.356 -9.485 12.399 1.00 0.91 O ATOM 1706 CB THR B 13 -12.103 -7.169 14.203 1.00 0.45 C ATOM 1707 OG1 THR B 13 -13.157 -7.869 14.850 1.00 1.19 O ATOM 1708 CG2 THR B 13 -12.622 -5.821 13.697 1.00 1.07 C ATOM 0 H THR B 13 -10.736 -6.194 12.294 1.00 0.25 H new ATOM 0 HA THR B 13 -11.073 -8.887 13.407 1.00 0.36 H new ATOM 0 HB THR B 13 -11.289 -6.997 14.907 1.00 0.45 H new ATOM 0 HG1 THR B 13 -13.488 -7.337 15.604 1.00 1.19 H new ATOM 0 HG21 THR B 13 -12.987 -5.233 14.539 1.00 1.07 H new ATOM 0 HG22 THR B 13 -11.814 -5.283 13.202 1.00 1.07 H new ATOM 0 HG23 THR B 13 -13.435 -5.986 12.990 1.00 1.07 H new ATOM 1716 N LYS B 14 -13.111 -7.699 11.154 1.00 0.31 N ATOM 1717 CA LYS B 14 -14.245 -8.112 10.284 1.00 0.38 C ATOM 1718 C LYS B 14 -13.743 -9.095 9.228 1.00 0.44 C ATOM 1719 O LYS B 14 -13.324 -10.194 9.532 1.00 1.02 O ATOM 1720 CB LYS B 14 -14.834 -6.880 9.605 1.00 0.41 C ATOM 1721 CG LYS B 14 -15.658 -6.086 10.620 1.00 0.68 C ATOM 1722 CD LYS B 14 -15.365 -4.593 10.472 1.00 0.90 C ATOM 1723 CE LYS B 14 -16.166 -3.811 11.514 1.00 1.34 C ATOM 1724 NZ LYS B 14 -17.571 -4.311 11.551 1.00 1.47 N ATOM 0 H LYS B 14 -12.660 -6.821 10.897 1.00 0.31 H new ATOM 0 HA LYS B 14 -15.014 -8.595 10.887 1.00 0.38 H new ATOM 0 HB2 LYS B 14 -14.036 -6.257 9.201 1.00 0.41 H new ATOM 0 HB3 LYS B 14 -15.461 -7.179 8.765 1.00 0.41 H new ATOM 0 HG2 LYS B 14 -16.721 -6.274 10.466 1.00 0.68 H new ATOM 0 HG3 LYS B 14 -15.419 -6.414 11.632 1.00 0.68 H new ATOM 0 HD2 LYS B 14 -14.299 -4.406 10.602 1.00 0.90 H new ATOM 0 HD3 LYS B 14 -15.628 -4.258 9.469 1.00 0.90 H new ATOM 0 HE2 LYS B 14 -15.706 -3.919 12.496 1.00 1.34 H new ATOM 0 HE3 LYS B 14 -16.155 -2.748 11.272 1.00 1.34 H new ATOM 0 HZ1 LYS B 14 -18.192 -3.572 11.937 1.00 1.47 H new ATOM 0 HZ2 LYS B 14 -17.879 -4.553 10.588 1.00 1.47 H new ATOM 0 HZ3 LYS B 14 -17.623 -5.157 12.154 1.00 1.47 H new ATOM 1738 N ASN B 15 -13.775 -8.702 7.988 1.00 0.41 N ATOM 1739 CA ASN B 15 -13.299 -9.595 6.902 1.00 0.31 C ATOM 1740 C ASN B 15 -13.140 -8.744 5.650 1.00 0.26 C ATOM 1741 O ASN B 15 -13.497 -7.583 5.643 1.00 0.30 O ATOM 1742 CB ASN B 15 -14.327 -10.703 6.650 1.00 0.39 C ATOM 1743 CG ASN B 15 -13.969 -11.937 7.481 1.00 0.53 C ATOM 1744 OD1 ASN B 15 -14.421 -12.083 8.599 1.00 1.22 O ATOM 1745 ND2 ASN B 15 -13.172 -12.840 6.977 1.00 1.21 N ATOM 0 H ASN B 15 -14.114 -7.791 7.679 1.00 0.41 H new ATOM 0 HA ASN B 15 -12.352 -10.062 7.174 1.00 0.31 H new ATOM 0 HB2 ASN B 15 -15.325 -10.353 6.913 1.00 0.39 H new ATOM 0 HB3 ASN B 15 -14.348 -10.959 5.591 1.00 0.39 H new ATOM 0 HD21 ASN B 15 -12.929 -13.667 7.522 1.00 1.21 H new ATOM 0 HD22 ASN B 15 -12.792 -12.718 6.038 1.00 1.21 H new ATOM 1752 N VAL B 16 -12.612 -9.280 4.591 1.00 0.24 N ATOM 1753 CA VAL B 16 -12.453 -8.448 3.375 1.00 0.25 C ATOM 1754 C VAL B 16 -13.830 -8.182 2.767 1.00 0.24 C ATOM 1755 O VAL B 16 -14.189 -7.054 2.494 1.00 0.25 O ATOM 1756 CB VAL B 16 -11.555 -9.176 2.370 1.00 0.28 C ATOM 1757 CG1 VAL B 16 -10.211 -9.486 3.030 1.00 0.26 C ATOM 1758 CG2 VAL B 16 -12.213 -10.487 1.934 1.00 0.45 C ATOM 0 H VAL B 16 -12.288 -10.244 4.515 1.00 0.24 H new ATOM 0 HA VAL B 16 -11.988 -7.497 3.632 1.00 0.25 H new ATOM 0 HB VAL B 16 -11.406 -8.541 1.497 1.00 0.28 H new ATOM 0 HG11 VAL B 16 -9.568 -10.004 2.319 1.00 0.26 H new ATOM 0 HG12 VAL B 16 -9.734 -8.556 3.339 1.00 0.26 H new ATOM 0 HG13 VAL B 16 -10.372 -10.119 3.903 1.00 0.26 H new ATOM 0 HG21 VAL B 16 -11.568 -10.998 1.219 1.00 0.45 H new ATOM 0 HG22 VAL B 16 -12.366 -11.124 2.805 1.00 0.45 H new ATOM 0 HG23 VAL B 16 -13.174 -10.274 1.467 1.00 0.45 H new ATOM 1768 N GLU B 17 -14.601 -9.208 2.541 1.00 0.24 N ATOM 1769 CA GLU B 17 -15.946 -9.014 1.938 1.00 0.27 C ATOM 1770 C GLU B 17 -16.824 -8.183 2.870 1.00 0.28 C ATOM 1771 O GLU B 17 -17.742 -7.523 2.442 1.00 0.30 O ATOM 1772 CB GLU B 17 -16.600 -10.377 1.713 1.00 0.37 C ATOM 1773 CG GLU B 17 -17.100 -10.928 3.049 1.00 0.79 C ATOM 1774 CD GLU B 17 -17.083 -12.457 3.010 1.00 1.09 C ATOM 1775 OE1 GLU B 17 -17.302 -13.005 1.942 1.00 1.53 O ATOM 1776 OE2 GLU B 17 -16.850 -13.054 4.048 1.00 1.70 O ATOM 0 H GLU B 17 -14.356 -10.176 2.749 1.00 0.24 H new ATOM 0 HA GLU B 17 -15.838 -8.491 0.988 1.00 0.27 H new ATOM 0 HB2 GLU B 17 -17.430 -10.283 1.012 1.00 0.37 H new ATOM 0 HB3 GLU B 17 -15.883 -11.067 1.268 1.00 0.37 H new ATOM 0 HG2 GLU B 17 -16.469 -10.568 3.862 1.00 0.79 H new ATOM 0 HG3 GLU B 17 -18.110 -10.570 3.247 1.00 0.79 H new ATOM 1783 N ASP B 18 -16.554 -8.187 4.140 1.00 0.29 N ATOM 1784 CA ASP B 18 -17.391 -7.376 5.054 1.00 0.35 C ATOM 1785 C ASP B 18 -17.224 -5.908 4.682 1.00 0.32 C ATOM 1786 O ASP B 18 -18.163 -5.135 4.694 1.00 0.32 O ATOM 1787 CB ASP B 18 -16.907 -7.601 6.478 1.00 0.43 C ATOM 1788 CG ASP B 18 -17.632 -6.647 7.429 1.00 0.66 C ATOM 1789 OD1 ASP B 18 -17.495 -5.448 7.253 1.00 1.46 O ATOM 1790 OD2 ASP B 18 -18.314 -7.133 8.316 1.00 1.19 O ATOM 0 H ASP B 18 -15.798 -8.711 4.581 1.00 0.29 H new ATOM 0 HA ASP B 18 -18.441 -7.659 4.975 1.00 0.35 H new ATOM 0 HB2 ASP B 18 -17.090 -8.634 6.775 1.00 0.43 H new ATOM 0 HB3 ASP B 18 -15.831 -7.438 6.536 1.00 0.43 H new ATOM 1795 N HIS B 19 -16.029 -5.529 4.334 1.00 0.31 N ATOM 1796 CA HIS B 19 -15.785 -4.114 3.937 1.00 0.31 C ATOM 1797 C HIS B 19 -16.143 -3.919 2.458 1.00 0.27 C ATOM 1798 O HIS B 19 -16.439 -2.822 2.027 1.00 0.30 O ATOM 1799 CB HIS B 19 -14.314 -3.759 4.157 1.00 0.35 C ATOM 1800 CG HIS B 19 -14.183 -2.913 5.393 1.00 0.49 C ATOM 1801 ND1 HIS B 19 -14.432 -3.414 6.664 1.00 1.21 N ATOM 1802 CD2 HIS B 19 -13.837 -1.596 5.570 1.00 1.40 C ATOM 1803 CE1 HIS B 19 -14.233 -2.412 7.541 1.00 1.22 C ATOM 1804 NE2 HIS B 19 -13.870 -1.286 6.925 1.00 1.39 N ATOM 0 H HIS B 19 -15.210 -6.136 4.307 1.00 0.31 H new ATOM 0 HA HIS B 19 -16.409 -3.462 4.548 1.00 0.31 H new ATOM 0 HB2 HIS B 19 -13.721 -4.668 4.261 1.00 0.35 H new ATOM 0 HB3 HIS B 19 -13.925 -3.221 3.292 1.00 0.35 H new ATOM 0 HD2 HIS B 19 -13.579 -0.907 4.779 1.00 1.40 H new ATOM 0 HE1 HIS B 19 -14.352 -2.508 8.610 1.00 1.22 H new ATOM 0 HE2 HIS B 19 -13.661 -0.386 7.357 1.00 1.39 H new ATOM 1813 N VAL B 20 -16.154 -4.969 1.676 1.00 0.23 N ATOM 1814 CA VAL B 20 -16.529 -4.809 0.241 1.00 0.22 C ATOM 1815 C VAL B 20 -18.051 -4.698 0.185 1.00 0.22 C ATOM 1816 O VAL B 20 -18.621 -4.026 -0.651 1.00 0.23 O ATOM 1817 CB VAL B 20 -16.020 -6.018 -0.576 1.00 0.25 C ATOM 1818 CG1 VAL B 20 -17.137 -7.043 -0.817 1.00 0.34 C ATOM 1819 CG2 VAL B 20 -15.498 -5.538 -1.931 1.00 0.34 C ATOM 0 H VAL B 20 -15.922 -5.919 1.966 1.00 0.23 H new ATOM 0 HA VAL B 20 -16.075 -3.918 -0.192 1.00 0.22 H new ATOM 0 HB VAL B 20 -15.224 -6.495 -0.004 1.00 0.25 H new ATOM 0 HG11 VAL B 20 -16.744 -7.880 -1.394 1.00 0.34 H new ATOM 0 HG12 VAL B 20 -17.510 -7.406 0.141 1.00 0.34 H new ATOM 0 HG13 VAL B 20 -17.951 -6.572 -1.369 1.00 0.34 H new ATOM 0 HG21 VAL B 20 -15.139 -6.392 -2.506 1.00 0.34 H new ATOM 0 HG22 VAL B 20 -16.302 -5.045 -2.477 1.00 0.34 H new ATOM 0 HG23 VAL B 20 -14.680 -4.835 -1.777 1.00 0.34 H new ATOM 1829 N LEU B 21 -18.695 -5.349 1.109 1.00 0.23 N ATOM 1830 CA LEU B 21 -20.178 -5.298 1.181 1.00 0.26 C ATOM 1831 C LEU B 21 -20.587 -3.901 1.643 1.00 0.26 C ATOM 1832 O LEU B 21 -21.438 -3.256 1.059 1.00 0.27 O ATOM 1833 CB LEU B 21 -20.668 -6.326 2.202 1.00 0.29 C ATOM 1834 CG LEU B 21 -20.651 -7.734 1.585 1.00 0.32 C ATOM 1835 CD1 LEU B 21 -20.946 -8.766 2.674 1.00 0.36 C ATOM 1836 CD2 LEU B 21 -21.705 -7.858 0.472 1.00 0.38 C ATOM 0 H LEU B 21 -18.251 -5.922 1.827 1.00 0.23 H new ATOM 0 HA LEU B 21 -20.612 -5.518 0.206 1.00 0.26 H new ATOM 0 HB2 LEU B 21 -20.033 -6.301 3.088 1.00 0.29 H new ATOM 0 HB3 LEU B 21 -21.678 -6.075 2.526 1.00 0.29 H new ATOM 0 HG LEU B 21 -19.666 -7.912 1.153 1.00 0.32 H new ATOM 0 HD11 LEU B 21 -20.935 -9.766 2.240 1.00 0.36 H new ATOM 0 HD12 LEU B 21 -20.187 -8.700 3.453 1.00 0.36 H new ATOM 0 HD13 LEU B 21 -21.927 -8.569 3.106 1.00 0.36 H new ATOM 0 HD21 LEU B 21 -21.673 -8.863 0.051 1.00 0.38 H new ATOM 0 HD22 LEU B 21 -22.695 -7.669 0.886 1.00 0.38 H new ATOM 0 HD23 LEU B 21 -21.494 -7.130 -0.311 1.00 0.38 H new ATOM 1848 N ASP B 22 -19.973 -3.427 2.688 1.00 0.27 N ATOM 1849 CA ASP B 22 -20.311 -2.073 3.199 1.00 0.30 C ATOM 1850 C ASP B 22 -19.913 -1.012 2.168 1.00 0.28 C ATOM 1851 O ASP B 22 -20.479 0.061 2.123 1.00 0.31 O ATOM 1852 CB ASP B 22 -19.555 -1.820 4.505 1.00 0.33 C ATOM 1853 CG ASP B 22 -20.292 -0.759 5.325 1.00 0.42 C ATOM 1854 OD1 ASP B 22 -21.139 -0.085 4.761 1.00 1.21 O ATOM 1855 OD2 ASP B 22 -19.998 -0.638 6.503 1.00 1.00 O ATOM 0 H ASP B 22 -19.250 -3.920 3.211 1.00 0.27 H new ATOM 0 HA ASP B 22 -21.385 -2.015 3.378 1.00 0.30 H new ATOM 0 HB2 ASP B 22 -19.475 -2.745 5.076 1.00 0.33 H new ATOM 0 HB3 ASP B 22 -18.539 -1.488 4.291 1.00 0.33 H new ATOM 1860 N VAL B 23 -18.946 -1.301 1.337 1.00 0.26 N ATOM 1861 CA VAL B 23 -18.520 -0.304 0.311 1.00 0.27 C ATOM 1862 C VAL B 23 -19.533 -0.268 -0.838 1.00 0.26 C ATOM 1863 O VAL B 23 -20.044 0.777 -1.190 1.00 0.28 O ATOM 1864 CB VAL B 23 -17.134 -0.675 -0.229 1.00 0.26 C ATOM 1865 CG1 VAL B 23 -16.946 -0.085 -1.629 1.00 0.29 C ATOM 1866 CG2 VAL B 23 -16.059 -0.107 0.702 1.00 0.30 C ATOM 0 H VAL B 23 -18.434 -2.183 1.324 1.00 0.26 H new ATOM 0 HA VAL B 23 -18.473 0.682 0.773 1.00 0.27 H new ATOM 0 HB VAL B 23 -17.048 -1.760 -0.279 1.00 0.26 H new ATOM 0 HG11 VAL B 23 -15.959 -0.352 -2.007 1.00 0.29 H new ATOM 0 HG12 VAL B 23 -17.710 -0.482 -2.297 1.00 0.29 H new ATOM 0 HG13 VAL B 23 -17.035 1.000 -1.581 1.00 0.29 H new ATOM 0 HG21 VAL B 23 -15.072 -0.369 0.321 1.00 0.30 H new ATOM 0 HG22 VAL B 23 -16.154 0.978 0.748 1.00 0.30 H new ATOM 0 HG23 VAL B 23 -16.185 -0.525 1.701 1.00 0.30 H new ATOM 1876 N ILE B 24 -19.822 -1.395 -1.432 1.00 0.23 N ATOM 1877 CA ILE B 24 -20.796 -1.404 -2.562 1.00 0.25 C ATOM 1878 C ILE B 24 -22.107 -0.768 -2.102 1.00 0.26 C ATOM 1879 O ILE B 24 -22.831 -0.186 -2.884 1.00 0.28 O ATOM 1880 CB ILE B 24 -21.035 -2.847 -3.037 1.00 0.27 C ATOM 1881 CG1 ILE B 24 -21.392 -2.842 -4.529 1.00 0.46 C ATOM 1882 CG2 ILE B 24 -22.184 -3.478 -2.244 1.00 0.36 C ATOM 1883 CD1 ILE B 24 -21.615 -4.278 -5.013 1.00 0.69 C ATOM 0 H ILE B 24 -19.429 -2.304 -1.186 1.00 0.23 H new ATOM 0 HA ILE B 24 -20.395 -0.829 -3.397 1.00 0.25 H new ATOM 0 HB ILE B 24 -20.127 -3.428 -2.877 1.00 0.27 H new ATOM 0 HG12 ILE B 24 -22.291 -2.249 -4.695 1.00 0.46 H new ATOM 0 HG13 ILE B 24 -20.591 -2.375 -5.103 1.00 0.46 H new ATOM 0 HG21 ILE B 24 -22.345 -4.500 -2.588 1.00 0.36 H new ATOM 0 HG22 ILE B 24 -21.932 -3.488 -1.184 1.00 0.36 H new ATOM 0 HG23 ILE B 24 -23.093 -2.896 -2.396 1.00 0.36 H new ATOM 0 HD11 ILE B 24 -21.868 -4.269 -6.073 1.00 0.69 H new ATOM 0 HD12 ILE B 24 -20.705 -4.858 -4.862 1.00 0.69 H new ATOM 0 HD13 ILE B 24 -22.431 -4.730 -4.449 1.00 0.69 H new ATOM 1895 N VAL B 25 -22.412 -0.857 -0.836 1.00 0.27 N ATOM 1896 CA VAL B 25 -23.669 -0.234 -0.338 1.00 0.30 C ATOM 1897 C VAL B 25 -23.484 1.286 -0.310 1.00 0.30 C ATOM 1898 O VAL B 25 -24.354 2.038 -0.701 1.00 0.32 O ATOM 1899 CB VAL B 25 -23.969 -0.749 1.073 1.00 0.33 C ATOM 1900 CG1 VAL B 25 -25.025 0.139 1.736 1.00 0.42 C ATOM 1901 CG2 VAL B 25 -24.496 -2.185 0.993 1.00 0.37 C ATOM 0 H VAL B 25 -21.849 -1.331 -0.130 1.00 0.27 H new ATOM 0 HA VAL B 25 -24.502 -0.491 -0.993 1.00 0.30 H new ATOM 0 HB VAL B 25 -23.053 -0.726 1.663 1.00 0.33 H new ATOM 0 HG11 VAL B 25 -25.234 -0.232 2.739 1.00 0.42 H new ATOM 0 HG12 VAL B 25 -24.654 1.162 1.798 1.00 0.42 H new ATOM 0 HG13 VAL B 25 -25.940 0.120 1.144 1.00 0.42 H new ATOM 0 HG21 VAL B 25 -24.709 -2.551 1.997 1.00 0.37 H new ATOM 0 HG22 VAL B 25 -25.409 -2.205 0.398 1.00 0.37 H new ATOM 0 HG23 VAL B 25 -23.745 -2.823 0.526 1.00 0.37 H new ATOM 1911 N LEU B 26 -22.352 1.738 0.155 1.00 0.30 N ATOM 1912 CA LEU B 26 -22.093 3.204 0.221 1.00 0.32 C ATOM 1913 C LEU B 26 -22.112 3.792 -1.195 1.00 0.31 C ATOM 1914 O LEU B 26 -22.732 4.808 -1.455 1.00 0.33 O ATOM 1915 CB LEU B 26 -20.719 3.432 0.858 1.00 0.35 C ATOM 1916 CG LEU B 26 -20.832 3.350 2.389 1.00 0.61 C ATOM 1917 CD1 LEU B 26 -19.482 2.939 2.979 1.00 0.47 C ATOM 1918 CD2 LEU B 26 -21.236 4.711 2.976 1.00 1.15 C ATOM 0 H LEU B 26 -21.590 1.151 0.494 1.00 0.30 H new ATOM 0 HA LEU B 26 -22.863 3.693 0.818 1.00 0.32 H new ATOM 0 HB2 LEU B 26 -20.012 2.685 0.496 1.00 0.35 H new ATOM 0 HB3 LEU B 26 -20.330 4.407 0.565 1.00 0.35 H new ATOM 0 HG LEU B 26 -21.594 2.612 2.640 1.00 0.61 H new ATOM 0 HD11 LEU B 26 -19.562 2.881 4.065 1.00 0.47 H new ATOM 0 HD12 LEU B 26 -19.193 1.965 2.584 1.00 0.47 H new ATOM 0 HD13 LEU B 26 -18.727 3.678 2.710 1.00 0.47 H new ATOM 0 HD21 LEU B 26 -21.311 4.632 4.061 1.00 1.15 H new ATOM 0 HD22 LEU B 26 -20.484 5.456 2.717 1.00 1.15 H new ATOM 0 HD23 LEU B 26 -22.201 5.012 2.567 1.00 1.15 H new ATOM 1930 N PHE B 27 -21.456 3.152 -2.117 1.00 0.29 N ATOM 1931 CA PHE B 27 -21.461 3.661 -3.514 1.00 0.31 C ATOM 1932 C PHE B 27 -22.913 3.828 -3.942 1.00 0.32 C ATOM 1933 O PHE B 27 -23.306 4.847 -4.471 1.00 0.34 O ATOM 1934 CB PHE B 27 -20.749 2.655 -4.416 1.00 0.32 C ATOM 1935 CG PHE B 27 -21.239 2.787 -5.840 1.00 0.42 C ATOM 1936 CD1 PHE B 27 -21.155 4.021 -6.496 1.00 1.18 C ATOM 1937 CD2 PHE B 27 -21.769 1.674 -6.510 1.00 1.37 C ATOM 1938 CE1 PHE B 27 -21.600 4.144 -7.818 1.00 1.22 C ATOM 1939 CE2 PHE B 27 -22.214 1.798 -7.830 1.00 1.46 C ATOM 1940 CZ PHE B 27 -22.130 3.032 -8.485 1.00 0.70 C ATOM 0 H PHE B 27 -20.917 2.300 -1.965 1.00 0.29 H new ATOM 0 HA PHE B 27 -20.942 4.617 -3.587 1.00 0.31 H new ATOM 0 HB2 PHE B 27 -19.672 2.821 -4.378 1.00 0.32 H new ATOM 0 HB3 PHE B 27 -20.928 1.642 -4.055 1.00 0.32 H new ATOM 0 HD1 PHE B 27 -20.747 4.879 -5.982 1.00 1.18 H new ATOM 0 HD2 PHE B 27 -21.833 0.721 -6.006 1.00 1.37 H new ATOM 0 HE1 PHE B 27 -21.535 5.096 -8.323 1.00 1.22 H new ATOM 0 HE2 PHE B 27 -22.623 0.941 -8.344 1.00 1.46 H new ATOM 0 HZ PHE B 27 -22.474 3.127 -9.504 1.00 0.70 H new ATOM 1950 N ASN B 28 -23.709 2.828 -3.704 1.00 0.31 N ATOM 1951 CA ASN B 28 -25.147 2.911 -4.076 1.00 0.34 C ATOM 1952 C ASN B 28 -25.717 4.260 -3.625 1.00 0.35 C ATOM 1953 O ASN B 28 -26.623 4.792 -4.235 1.00 0.36 O ATOM 1954 CB ASN B 28 -25.917 1.781 -3.392 1.00 0.36 C ATOM 1955 CG ASN B 28 -26.774 1.048 -4.425 1.00 0.43 C ATOM 1956 OD1 ASN B 28 -26.492 -0.082 -4.773 1.00 1.17 O ATOM 1957 ND2 ASN B 28 -27.817 1.646 -4.932 1.00 0.97 N ATOM 0 H ASN B 28 -23.425 1.952 -3.266 1.00 0.31 H new ATOM 0 HA ASN B 28 -25.246 2.818 -5.157 1.00 0.34 H new ATOM 0 HB2 ASN B 28 -25.222 1.086 -2.922 1.00 0.36 H new ATOM 0 HB3 ASN B 28 -26.549 2.184 -2.600 1.00 0.36 H new ATOM 0 HD21 ASN B 28 -28.396 1.165 -5.621 1.00 0.97 H new ATOM 0 HD22 ASN B 28 -28.053 2.594 -4.640 1.00 0.97 H new ATOM 1964 N GLN B 29 -25.210 4.815 -2.552 1.00 0.35 N ATOM 1965 CA GLN B 29 -25.749 6.117 -2.070 1.00 0.38 C ATOM 1966 C GLN B 29 -25.071 7.270 -2.809 1.00 0.39 C ATOM 1967 O GLN B 29 -25.298 8.423 -2.499 1.00 0.44 O ATOM 1968 CB GLN B 29 -25.485 6.257 -0.569 1.00 0.39 C ATOM 1969 CG GLN B 29 -26.013 5.023 0.163 1.00 0.39 C ATOM 1970 CD GLN B 29 -25.794 5.190 1.668 1.00 0.42 C ATOM 1971 OE1 GLN B 29 -24.815 5.941 2.093 1.00 1.12 O flip ATOM 1972 NE2 GLN B 29 -26.521 4.631 2.465 1.00 1.17 N flip ATOM 0 H GLN B 29 -24.451 4.423 -1.994 1.00 0.35 H new ATOM 0 HA GLN B 29 -26.822 6.148 -2.260 1.00 0.38 H new ATOM 0 HB2 GLN B 29 -24.416 6.371 -0.387 1.00 0.39 H new ATOM 0 HB3 GLN B 29 -25.971 7.155 -0.186 1.00 0.39 H new ATOM 0 HG2 GLN B 29 -27.074 4.888 -0.048 1.00 0.39 H new ATOM 0 HG3 GLN B 29 -25.501 4.129 -0.193 1.00 0.39 H new ATOM 0 HE21 GLN B 29 -27.286 4.044 2.133 1.00 1.17 H new ATOM 0 HE22 GLN B 29 -26.366 4.749 3.466 1.00 1.17 H new ATOM 1981 N GLY B 30 -24.247 6.972 -3.782 1.00 0.35 N ATOM 1982 CA GLY B 30 -23.557 8.053 -4.546 1.00 0.38 C ATOM 1983 C GLY B 30 -22.125 8.219 -4.036 1.00 0.34 C ATOM 1984 O GLY B 30 -21.416 9.109 -4.454 1.00 0.36 O ATOM 0 H GLY B 30 -24.022 6.023 -4.080 1.00 0.35 H new ATOM 0 HA2 GLY B 30 -23.548 7.810 -5.609 1.00 0.38 H new ATOM 0 HA3 GLY B 30 -24.102 8.991 -4.438 1.00 0.38 H new ATOM 1988 N ILE B 31 -21.684 7.365 -3.149 1.00 0.31 N ATOM 1989 CA ILE B 31 -20.289 7.496 -2.639 1.00 0.29 C ATOM 1990 C ILE B 31 -19.331 6.979 -3.706 1.00 0.26 C ATOM 1991 O ILE B 31 -18.955 5.824 -3.715 1.00 0.25 O ATOM 1992 CB ILE B 31 -20.129 6.686 -1.348 1.00 0.29 C ATOM 1993 CG1 ILE B 31 -21.146 7.161 -0.287 1.00 0.41 C ATOM 1994 CG2 ILE B 31 -18.704 6.844 -0.817 1.00 0.31 C ATOM 1995 CD1 ILE B 31 -21.038 8.670 -0.045 1.00 0.59 C ATOM 0 H ILE B 31 -22.223 6.591 -2.760 1.00 0.31 H new ATOM 0 HA ILE B 31 -20.067 8.541 -2.421 1.00 0.29 H new ATOM 0 HB ILE B 31 -20.318 5.634 -1.563 1.00 0.29 H new ATOM 0 HG12 ILE B 31 -22.156 6.915 -0.613 1.00 0.41 H new ATOM 0 HG13 ILE B 31 -20.974 6.628 0.648 1.00 0.41 H new ATOM 0 HG21 ILE B 31 -18.592 6.267 0.101 1.00 0.31 H new ATOM 0 HG22 ILE B 31 -17.996 6.481 -1.562 1.00 0.31 H new ATOM 0 HG23 ILE B 31 -18.507 7.896 -0.611 1.00 0.31 H new ATOM 0 HD11 ILE B 31 -21.767 8.971 0.707 1.00 0.59 H new ATOM 0 HD12 ILE B 31 -20.035 8.911 0.306 1.00 0.59 H new ATOM 0 HD13 ILE B 31 -21.235 9.203 -0.975 1.00 0.59 H new ATOM 2007 N ASP B 32 -18.913 7.834 -4.601 1.00 0.27 N ATOM 2008 CA ASP B 32 -17.966 7.400 -5.657 1.00 0.27 C ATOM 2009 C ASP B 32 -16.546 7.449 -5.106 1.00 0.27 C ATOM 2010 O ASP B 32 -15.725 6.601 -5.392 1.00 0.29 O ATOM 2011 CB ASP B 32 -18.081 8.334 -6.864 1.00 0.29 C ATOM 2012 CG ASP B 32 -19.474 8.200 -7.484 1.00 0.66 C ATOM 2013 OD1 ASP B 32 -20.056 7.135 -7.362 1.00 1.46 O ATOM 2014 OD2 ASP B 32 -19.935 9.166 -8.070 1.00 1.25 O ATOM 0 H ASP B 32 -19.190 8.815 -4.643 1.00 0.27 H new ATOM 0 HA ASP B 32 -18.204 6.382 -5.967 1.00 0.27 H new ATOM 0 HB2 ASP B 32 -17.906 9.365 -6.557 1.00 0.29 H new ATOM 0 HB3 ASP B 32 -17.318 8.087 -7.602 1.00 0.29 H new ATOM 2019 N GLU B 33 -16.250 8.454 -4.325 1.00 0.27 N ATOM 2020 CA GLU B 33 -14.890 8.582 -3.758 1.00 0.28 C ATOM 2021 C GLU B 33 -14.848 7.934 -2.380 1.00 0.26 C ATOM 2022 O GLU B 33 -15.786 8.021 -1.612 1.00 0.28 O ATOM 2023 CB GLU B 33 -14.512 10.057 -3.644 1.00 0.30 C ATOM 2024 CG GLU B 33 -13.659 10.445 -4.852 1.00 0.60 C ATOM 2025 CD GLU B 33 -13.617 11.966 -4.989 1.00 0.49 C ATOM 2026 OE1 GLU B 33 -14.665 12.552 -5.205 1.00 1.20 O ATOM 2027 OE2 GLU B 33 -12.537 12.520 -4.879 1.00 1.08 O ATOM 0 H GLU B 33 -16.901 9.193 -4.058 1.00 0.27 H new ATOM 0 HA GLU B 33 -14.179 8.081 -4.415 1.00 0.28 H new ATOM 0 HB2 GLU B 33 -15.410 10.674 -3.603 1.00 0.30 H new ATOM 0 HB3 GLU B 33 -13.961 10.234 -2.721 1.00 0.30 H new ATOM 0 HG2 GLU B 33 -12.649 10.053 -4.736 1.00 0.60 H new ATOM 0 HG3 GLU B 33 -14.071 10.000 -5.758 1.00 0.60 H new ATOM 2034 N VAL B 34 -13.769 7.284 -2.060 1.00 0.25 N ATOM 2035 CA VAL B 34 -13.674 6.631 -0.726 1.00 0.24 C ATOM 2036 C VAL B 34 -12.205 6.476 -0.332 1.00 0.24 C ATOM 2037 O VAL B 34 -11.340 6.356 -1.184 1.00 0.33 O ATOM 2038 CB VAL B 34 -14.349 5.256 -0.789 1.00 0.24 C ATOM 2039 CG1 VAL B 34 -13.381 4.224 -1.371 1.00 0.49 C ATOM 2040 CG2 VAL B 34 -14.761 4.819 0.619 1.00 0.35 C ATOM 0 H VAL B 34 -12.951 7.176 -2.660 1.00 0.25 H new ATOM 0 HA VAL B 34 -14.176 7.246 0.021 1.00 0.24 H new ATOM 0 HB VAL B 34 -15.231 5.325 -1.426 1.00 0.24 H new ATOM 0 HG11 VAL B 34 -13.869 3.250 -1.412 1.00 0.49 H new ATOM 0 HG12 VAL B 34 -13.089 4.526 -2.377 1.00 0.49 H new ATOM 0 HG13 VAL B 34 -12.495 4.160 -0.739 1.00 0.49 H new ATOM 0 HG21 VAL B 34 -15.241 3.841 0.571 1.00 0.35 H new ATOM 0 HG22 VAL B 34 -13.877 4.759 1.254 1.00 0.35 H new ATOM 0 HG23 VAL B 34 -15.459 5.545 1.036 1.00 0.35 H new ATOM 2050 N ILE B 35 -11.927 6.484 0.951 1.00 0.20 N ATOM 2051 CA ILE B 35 -10.514 6.341 1.431 1.00 0.21 C ATOM 2052 C ILE B 35 -10.431 5.252 2.496 1.00 0.21 C ATOM 2053 O ILE B 35 -10.940 5.395 3.589 1.00 0.23 O ATOM 2054 CB ILE B 35 -10.034 7.666 2.023 1.00 0.25 C ATOM 2055 CG1 ILE B 35 -10.690 8.825 1.269 1.00 0.26 C ATOM 2056 CG2 ILE B 35 -8.512 7.763 1.887 1.00 0.31 C ATOM 2057 CD1 ILE B 35 -9.998 10.139 1.638 1.00 0.31 C ATOM 0 H ILE B 35 -12.622 6.584 1.691 1.00 0.20 H new ATOM 0 HA ILE B 35 -9.881 6.067 0.587 1.00 0.21 H new ATOM 0 HB ILE B 35 -10.307 7.716 3.077 1.00 0.25 H new ATOM 0 HG12 ILE B 35 -10.622 8.657 0.194 1.00 0.26 H new ATOM 0 HG13 ILE B 35 -11.750 8.879 1.517 1.00 0.26 H new ATOM 0 HG21 ILE B 35 -8.168 8.708 2.309 1.00 0.31 H new ATOM 0 HG22 ILE B 35 -8.045 6.936 2.422 1.00 0.31 H new ATOM 0 HG23 ILE B 35 -8.237 7.715 0.833 1.00 0.31 H new ATOM 0 HD11 ILE B 35 -10.468 10.962 1.099 1.00 0.31 H new ATOM 0 HD12 ILE B 35 -10.089 10.309 2.711 1.00 0.31 H new ATOM 0 HD13 ILE B 35 -8.944 10.083 1.367 1.00 0.31 H new ATOM 2069 N LEU B 36 -9.769 4.167 2.186 1.00 0.23 N ATOM 2070 CA LEU B 36 -9.626 3.069 3.180 1.00 0.26 C ATOM 2071 C LEU B 36 -8.294 3.224 3.911 1.00 0.24 C ATOM 2072 O LEU B 36 -7.272 3.408 3.279 1.00 0.26 O ATOM 2073 CB LEU B 36 -9.637 1.717 2.467 1.00 0.30 C ATOM 2074 CG LEU B 36 -10.913 0.950 2.834 1.00 0.40 C ATOM 2075 CD1 LEU B 36 -12.143 1.723 2.352 1.00 0.46 C ATOM 2076 CD2 LEU B 36 -10.886 -0.428 2.170 1.00 0.48 C ATOM 0 H LEU B 36 -9.322 3.997 1.285 1.00 0.23 H new ATOM 0 HA LEU B 36 -10.454 3.118 3.887 1.00 0.26 H new ATOM 0 HB2 LEU B 36 -9.587 1.864 1.388 1.00 0.30 H new ATOM 0 HB3 LEU B 36 -8.758 1.138 2.751 1.00 0.30 H new ATOM 0 HG LEU B 36 -10.964 0.835 3.917 1.00 0.40 H new ATOM 0 HD11 LEU B 36 -13.046 1.172 2.616 1.00 0.46 H new ATOM 0 HD12 LEU B 36 -12.165 2.704 2.826 1.00 0.46 H new ATOM 0 HD13 LEU B 36 -12.096 1.844 1.270 1.00 0.46 H new ATOM 0 HD21 LEU B 36 -11.792 -0.975 2.430 1.00 0.48 H new ATOM 0 HD22 LEU B 36 -10.831 -0.309 1.088 1.00 0.48 H new ATOM 0 HD23 LEU B 36 -10.015 -0.983 2.519 1.00 0.48 H new ATOM 2088 N LYS B 37 -8.289 3.122 5.225 1.00 0.23 N ATOM 2089 CA LYS B 37 -7.007 3.231 5.997 1.00 0.23 C ATOM 2090 C LYS B 37 -6.819 1.947 6.808 1.00 0.21 C ATOM 2091 O LYS B 37 -7.764 1.410 7.351 1.00 0.20 O ATOM 2092 CB LYS B 37 -7.057 4.428 6.948 1.00 0.29 C ATOM 2093 CG LYS B 37 -8.045 5.470 6.423 1.00 1.26 C ATOM 2094 CD LYS B 37 -7.963 6.731 7.286 1.00 1.50 C ATOM 2095 CE LYS B 37 -7.406 7.889 6.454 1.00 2.39 C ATOM 2096 NZ LYS B 37 -7.385 9.129 7.281 1.00 2.74 N ATOM 0 H LYS B 37 -9.121 2.968 5.795 1.00 0.23 H new ATOM 0 HA LYS B 37 -6.177 3.371 5.305 1.00 0.23 H new ATOM 0 HB2 LYS B 37 -7.356 4.100 7.944 1.00 0.29 H new ATOM 0 HB3 LYS B 37 -6.065 4.870 7.042 1.00 0.29 H new ATOM 0 HG2 LYS B 37 -7.818 5.712 5.385 1.00 1.26 H new ATOM 0 HG3 LYS B 37 -9.058 5.068 6.442 1.00 1.26 H new ATOM 0 HD2 LYS B 37 -8.951 6.987 7.668 1.00 1.50 H new ATOM 0 HD3 LYS B 37 -7.324 6.551 8.150 1.00 1.50 H new ATOM 0 HE2 LYS B 37 -6.400 7.652 6.109 1.00 2.39 H new ATOM 0 HE3 LYS B 37 -8.020 8.041 5.566 1.00 2.39 H new ATOM 0 HZ1 LYS B 37 -7.007 9.916 6.717 1.00 2.74 H new ATOM 0 HZ2 LYS B 37 -8.352 9.357 7.589 1.00 2.74 H new ATOM 0 HZ3 LYS B 37 -6.782 8.980 8.115 1.00 2.74 H new ATOM 2110 N GLY B 38 -5.613 1.441 6.890 1.00 0.21 N ATOM 2111 CA GLY B 38 -5.393 0.176 7.670 1.00 0.22 C ATOM 2112 C GLY B 38 -4.010 0.191 8.323 1.00 0.22 C ATOM 2113 O GLY B 38 -3.168 0.990 7.971 1.00 0.24 O ATOM 0 H GLY B 38 -4.780 1.840 6.458 1.00 0.21 H new ATOM 0 HA2 GLY B 38 -6.163 0.073 8.435 1.00 0.22 H new ATOM 0 HA3 GLY B 38 -5.482 -0.687 7.010 1.00 0.22 H new ATOM 2117 N THR B 39 -3.780 -0.679 9.289 1.00 0.22 N ATOM 2118 CA THR B 39 -2.457 -0.707 9.992 1.00 0.25 C ATOM 2119 C THR B 39 -1.964 -2.148 10.165 1.00 0.23 C ATOM 2120 O THR B 39 -2.736 -3.054 10.361 1.00 0.20 O ATOM 2121 CB THR B 39 -2.605 -0.075 11.381 1.00 0.28 C ATOM 2122 OG1 THR B 39 -3.587 -0.788 12.121 1.00 0.29 O ATOM 2123 CG2 THR B 39 -3.026 1.390 11.252 1.00 0.49 C ATOM 0 H THR B 39 -4.455 -1.369 9.617 1.00 0.22 H new ATOM 0 HA THR B 39 -1.738 -0.150 9.391 1.00 0.25 H new ATOM 0 HB THR B 39 -1.647 -0.123 11.898 1.00 0.28 H new ATOM 0 HG1 THR B 39 -4.230 -0.156 12.504 1.00 0.29 H new ATOM 0 HG21 THR B 39 -3.128 1.828 12.245 1.00 0.49 H new ATOM 0 HG22 THR B 39 -2.270 1.938 10.690 1.00 0.49 H new ATOM 0 HG23 THR B 39 -3.981 1.450 10.729 1.00 0.49 H new ATOM 2131 N GLY B 40 -0.668 -2.343 10.108 1.00 0.25 N ATOM 2132 CA GLY B 40 -0.059 -3.704 10.290 1.00 0.26 C ATOM 2133 C GLY B 40 -0.917 -4.820 9.682 1.00 0.25 C ATOM 2134 O GLY B 40 -0.678 -5.266 8.580 1.00 0.28 O ATOM 0 H GLY B 40 0.010 -1.600 9.939 1.00 0.25 H new ATOM 0 HA2 GLY B 40 0.930 -3.720 9.831 1.00 0.26 H new ATOM 0 HA3 GLY B 40 0.080 -3.896 11.354 1.00 0.26 H new ATOM 2138 N ARG B 41 -1.893 -5.294 10.405 1.00 0.23 N ATOM 2139 CA ARG B 41 -2.743 -6.396 9.873 1.00 0.24 C ATOM 2140 C ARG B 41 -3.862 -5.832 8.997 1.00 0.22 C ATOM 2141 O ARG B 41 -4.133 -6.344 7.930 1.00 0.26 O ATOM 2142 CB ARG B 41 -3.347 -7.203 11.024 1.00 0.24 C ATOM 2143 CG ARG B 41 -2.926 -6.604 12.368 1.00 0.61 C ATOM 2144 CD ARG B 41 -3.515 -7.450 13.500 1.00 0.94 C ATOM 2145 NE ARG B 41 -2.440 -8.279 14.120 1.00 1.74 N ATOM 2146 CZ ARG B 41 -1.753 -7.830 15.139 1.00 2.19 C ATOM 2147 NH1 ARG B 41 -1.953 -6.623 15.600 1.00 2.10 N ATOM 2148 NH2 ARG B 41 -0.848 -8.591 15.691 1.00 3.16 N ATOM 0 H ARG B 41 -2.139 -4.967 11.339 1.00 0.23 H new ATOM 0 HA ARG B 41 -2.116 -7.051 9.268 1.00 0.24 H new ATOM 0 HB2 ARG B 41 -4.434 -7.207 10.944 1.00 0.24 H new ATOM 0 HB3 ARG B 41 -3.019 -8.241 10.961 1.00 0.24 H new ATOM 0 HG2 ARG B 41 -1.839 -6.578 12.444 1.00 0.61 H new ATOM 0 HG3 ARG B 41 -3.275 -5.575 12.447 1.00 0.61 H new ATOM 0 HD2 ARG B 41 -3.969 -6.804 14.252 1.00 0.94 H new ATOM 0 HD3 ARG B 41 -4.306 -8.093 13.113 1.00 0.94 H new ATOM 0 HE ARG B 41 -2.239 -9.206 13.745 1.00 1.74 H new ATOM 0 HH11 ARG B 41 -2.651 -6.020 15.165 1.00 2.10 H new ATOM 0 HH12 ARG B 41 -1.411 -6.284 16.395 1.00 2.10 H new ATOM 0 HH21 ARG B 41 -0.680 -9.529 15.328 1.00 3.16 H new ATOM 0 HH22 ARG B 41 -0.309 -8.248 16.486 1.00 3.16 H new ATOM 2162 N GLU B 42 -4.530 -4.798 9.429 1.00 0.18 N ATOM 2163 CA GLU B 42 -5.635 -4.247 8.598 1.00 0.17 C ATOM 2164 C GLU B 42 -5.047 -3.652 7.316 1.00 0.18 C ATOM 2165 O GLU B 42 -5.716 -3.547 6.305 1.00 0.19 O ATOM 2166 CB GLU B 42 -6.413 -3.155 9.360 1.00 0.16 C ATOM 2167 CG GLU B 42 -5.921 -3.018 10.811 1.00 0.16 C ATOM 2168 CD GLU B 42 -6.924 -2.183 11.609 1.00 0.63 C ATOM 2169 OE1 GLU B 42 -7.186 -1.062 11.205 1.00 1.29 O ATOM 2170 OE2 GLU B 42 -7.413 -2.678 12.611 1.00 1.38 O ATOM 0 H GLU B 42 -4.361 -4.316 10.312 1.00 0.18 H new ATOM 0 HA GLU B 42 -6.327 -5.055 8.359 1.00 0.17 H new ATOM 0 HB2 GLU B 42 -6.300 -2.201 8.845 1.00 0.16 H new ATOM 0 HB3 GLU B 42 -7.476 -3.395 9.357 1.00 0.16 H new ATOM 0 HG2 GLU B 42 -5.809 -4.003 11.264 1.00 0.16 H new ATOM 0 HG3 GLU B 42 -4.939 -2.545 10.831 1.00 0.16 H new ATOM 2177 N ILE B 43 -3.797 -3.274 7.342 1.00 0.19 N ATOM 2178 CA ILE B 43 -3.166 -2.702 6.119 1.00 0.23 C ATOM 2179 C ILE B 43 -3.359 -3.680 4.952 1.00 0.26 C ATOM 2180 O ILE B 43 -3.271 -3.324 3.794 1.00 0.30 O ATOM 2181 CB ILE B 43 -1.667 -2.500 6.387 1.00 0.30 C ATOM 2182 CG1 ILE B 43 -1.119 -1.390 5.489 1.00 0.34 C ATOM 2183 CG2 ILE B 43 -0.906 -3.797 6.096 1.00 0.39 C ATOM 2184 CD1 ILE B 43 0.346 -1.140 5.828 1.00 0.85 C ATOM 0 H ILE B 43 -3.187 -3.337 8.157 1.00 0.19 H new ATOM 0 HA ILE B 43 -3.625 -1.746 5.867 1.00 0.23 H new ATOM 0 HB ILE B 43 -1.534 -2.223 7.433 1.00 0.30 H new ATOM 0 HG12 ILE B 43 -1.218 -1.673 4.441 1.00 0.34 H new ATOM 0 HG13 ILE B 43 -1.697 -0.476 5.628 1.00 0.34 H new ATOM 0 HG21 ILE B 43 0.156 -3.646 6.288 1.00 0.39 H new ATOM 0 HG22 ILE B 43 -1.282 -4.592 6.740 1.00 0.39 H new ATOM 0 HG23 ILE B 43 -1.050 -4.077 5.052 1.00 0.39 H new ATOM 0 HD11 ILE B 43 0.738 -0.349 5.188 1.00 0.85 H new ATOM 0 HD12 ILE B 43 0.432 -0.838 6.872 1.00 0.85 H new ATOM 0 HD13 ILE B 43 0.918 -2.054 5.666 1.00 0.85 H new ATOM 2196 N SER B 44 -3.612 -4.916 5.275 1.00 0.27 N ATOM 2197 CA SER B 44 -3.805 -5.949 4.214 1.00 0.31 C ATOM 2198 C SER B 44 -5.291 -6.086 3.874 1.00 0.30 C ATOM 2199 O SER B 44 -5.660 -6.331 2.740 1.00 0.32 O ATOM 2200 CB SER B 44 -3.268 -7.294 4.701 1.00 0.36 C ATOM 2201 OG SER B 44 -2.398 -7.081 5.805 1.00 1.12 O ATOM 0 H SER B 44 -3.694 -5.260 6.232 1.00 0.27 H new ATOM 0 HA SER B 44 -3.262 -5.641 3.320 1.00 0.31 H new ATOM 0 HB2 SER B 44 -4.093 -7.944 4.994 1.00 0.36 H new ATOM 0 HB3 SER B 44 -2.735 -7.799 3.895 1.00 0.36 H new ATOM 0 HG SER B 44 -2.927 -6.976 6.623 1.00 1.12 H new ATOM 2207 N LYS B 45 -6.146 -5.932 4.844 1.00 0.26 N ATOM 2208 CA LYS B 45 -7.605 -6.058 4.567 1.00 0.26 C ATOM 2209 C LYS B 45 -8.070 -4.921 3.655 1.00 0.25 C ATOM 2210 O LYS B 45 -9.050 -5.047 2.945 1.00 0.27 O ATOM 2211 CB LYS B 45 -8.384 -6.017 5.880 1.00 0.26 C ATOM 2212 CG LYS B 45 -8.502 -7.432 6.447 1.00 0.40 C ATOM 2213 CD LYS B 45 -7.103 -8.004 6.687 1.00 0.91 C ATOM 2214 CE LYS B 45 -7.183 -9.137 7.711 1.00 0.81 C ATOM 2215 NZ LYS B 45 -8.465 -9.877 7.534 1.00 1.87 N ATOM 0 H LYS B 45 -5.901 -5.725 5.812 1.00 0.26 H new ATOM 0 HA LYS B 45 -7.789 -7.009 4.067 1.00 0.26 H new ATOM 0 HB2 LYS B 45 -7.878 -5.368 6.595 1.00 0.26 H new ATOM 0 HB3 LYS B 45 -9.376 -5.596 5.714 1.00 0.26 H new ATOM 0 HG2 LYS B 45 -9.065 -7.415 7.380 1.00 0.40 H new ATOM 0 HG3 LYS B 45 -9.053 -8.068 5.754 1.00 0.40 H new ATOM 0 HD2 LYS B 45 -6.685 -8.374 5.751 1.00 0.91 H new ATOM 0 HD3 LYS B 45 -6.435 -7.221 7.047 1.00 0.91 H new ATOM 0 HE2 LYS B 45 -6.339 -9.815 7.586 1.00 0.81 H new ATOM 0 HE3 LYS B 45 -7.120 -8.733 8.722 1.00 0.81 H new ATOM 0 HZ1 LYS B 45 -8.374 -10.831 7.938 1.00 1.87 H new ATOM 0 HZ2 LYS B 45 -9.230 -9.367 8.019 1.00 1.87 H new ATOM 0 HZ3 LYS B 45 -8.686 -9.950 6.520 1.00 1.87 H new ATOM 2229 N ALA B 46 -7.386 -3.810 3.664 1.00 0.22 N ATOM 2230 CA ALA B 46 -7.807 -2.672 2.798 1.00 0.21 C ATOM 2231 C ALA B 46 -7.478 -2.979 1.334 1.00 0.19 C ATOM 2232 O ALA B 46 -8.286 -2.776 0.449 1.00 0.22 O ATOM 2233 CB ALA B 46 -7.061 -1.410 3.231 1.00 0.26 C ATOM 0 H ALA B 46 -6.556 -3.641 4.232 1.00 0.22 H new ATOM 0 HA ALA B 46 -8.882 -2.521 2.898 1.00 0.21 H new ATOM 0 HB1 ALA B 46 -7.365 -0.574 2.601 1.00 0.26 H new ATOM 0 HB2 ALA B 46 -7.298 -1.186 4.271 1.00 0.26 H new ATOM 0 HB3 ALA B 46 -5.987 -1.569 3.130 1.00 0.26 H new ATOM 2239 N VAL B 47 -6.297 -3.466 1.074 1.00 0.18 N ATOM 2240 CA VAL B 47 -5.909 -3.787 -0.331 1.00 0.18 C ATOM 2241 C VAL B 47 -6.838 -4.867 -0.888 1.00 0.18 C ATOM 2242 O VAL B 47 -7.328 -4.766 -1.995 1.00 0.19 O ATOM 2243 CB VAL B 47 -4.465 -4.302 -0.350 1.00 0.24 C ATOM 2244 CG1 VAL B 47 -4.077 -4.701 -1.777 1.00 0.28 C ATOM 2245 CG2 VAL B 47 -3.520 -3.208 0.154 1.00 0.27 C ATOM 0 H VAL B 47 -5.581 -3.657 1.775 1.00 0.18 H new ATOM 0 HA VAL B 47 -5.990 -2.889 -0.944 1.00 0.18 H new ATOM 0 HB VAL B 47 -4.386 -5.173 0.301 1.00 0.24 H new ATOM 0 HG11 VAL B 47 -3.050 -5.066 -1.786 1.00 0.28 H new ATOM 0 HG12 VAL B 47 -4.745 -5.487 -2.129 1.00 0.28 H new ATOM 0 HG13 VAL B 47 -4.159 -3.834 -2.432 1.00 0.28 H new ATOM 0 HG21 VAL B 47 -2.495 -3.578 0.139 1.00 0.27 H new ATOM 0 HG22 VAL B 47 -3.600 -2.333 -0.491 1.00 0.27 H new ATOM 0 HG23 VAL B 47 -3.792 -2.933 1.173 1.00 0.27 H new ATOM 2255 N ASP B 48 -7.084 -5.901 -0.132 1.00 0.20 N ATOM 2256 CA ASP B 48 -7.979 -6.984 -0.626 1.00 0.23 C ATOM 2257 C ASP B 48 -9.342 -6.394 -0.986 1.00 0.26 C ATOM 2258 O ASP B 48 -9.814 -6.538 -2.097 1.00 0.30 O ATOM 2259 CB ASP B 48 -8.154 -8.036 0.469 1.00 0.24 C ATOM 2260 CG ASP B 48 -8.353 -9.412 -0.170 1.00 0.41 C ATOM 2261 OD1 ASP B 48 -9.341 -9.585 -0.864 1.00 1.25 O ATOM 2262 OD2 ASP B 48 -7.513 -10.270 0.046 1.00 1.08 O ATOM 0 H ASP B 48 -6.705 -6.043 0.804 1.00 0.20 H new ATOM 0 HA ASP B 48 -7.538 -7.446 -1.509 1.00 0.23 H new ATOM 0 HB2 ASP B 48 -7.279 -8.048 1.119 1.00 0.24 H new ATOM 0 HB3 ASP B 48 -9.012 -7.786 1.094 1.00 0.24 H new ATOM 2267 N VAL B 49 -9.976 -5.737 -0.051 1.00 0.26 N ATOM 2268 CA VAL B 49 -11.315 -5.133 -0.319 1.00 0.32 C ATOM 2269 C VAL B 49 -11.311 -4.434 -1.680 1.00 0.31 C ATOM 2270 O VAL B 49 -12.191 -4.631 -2.494 1.00 0.31 O ATOM 2271 CB VAL B 49 -11.628 -4.107 0.771 1.00 0.39 C ATOM 2272 CG1 VAL B 49 -12.715 -3.148 0.281 1.00 1.06 C ATOM 2273 CG2 VAL B 49 -12.111 -4.834 2.026 1.00 0.96 C ATOM 0 H VAL B 49 -9.621 -5.592 0.894 1.00 0.26 H new ATOM 0 HA VAL B 49 -12.070 -5.919 -0.322 1.00 0.32 H new ATOM 0 HB VAL B 49 -10.728 -3.538 1.003 1.00 0.39 H new ATOM 0 HG11 VAL B 49 -12.935 -2.419 1.061 1.00 1.06 H new ATOM 0 HG12 VAL B 49 -12.367 -2.630 -0.613 1.00 1.06 H new ATOM 0 HG13 VAL B 49 -13.618 -3.711 0.046 1.00 1.06 H new ATOM 0 HG21 VAL B 49 -12.335 -4.105 2.805 1.00 0.96 H new ATOM 0 HG22 VAL B 49 -13.010 -5.404 1.793 1.00 0.96 H new ATOM 0 HG23 VAL B 49 -11.332 -5.512 2.376 1.00 0.96 H new ATOM 2283 N TYR B 50 -10.332 -3.614 -1.925 1.00 0.33 N ATOM 2284 CA TYR B 50 -10.277 -2.894 -3.226 1.00 0.36 C ATOM 2285 C TYR B 50 -9.999 -3.875 -4.363 1.00 0.32 C ATOM 2286 O TYR B 50 -10.718 -3.920 -5.342 1.00 0.32 O ATOM 2287 CB TYR B 50 -9.173 -1.846 -3.192 1.00 0.36 C ATOM 2288 CG TYR B 50 -8.693 -1.560 -4.600 1.00 0.34 C ATOM 2289 CD1 TYR B 50 -9.619 -1.324 -5.627 1.00 1.25 C ATOM 2290 CD2 TYR B 50 -7.321 -1.522 -4.879 1.00 1.21 C ATOM 2291 CE1 TYR B 50 -9.172 -1.054 -6.926 1.00 1.21 C ATOM 2292 CE2 TYR B 50 -6.878 -1.250 -6.180 1.00 1.28 C ATOM 2293 CZ TYR B 50 -7.802 -1.017 -7.202 1.00 0.46 C ATOM 2294 OH TYR B 50 -7.363 -0.749 -8.482 1.00 0.55 O ATOM 0 H TYR B 50 -9.567 -3.410 -1.282 1.00 0.33 H new ATOM 0 HA TYR B 50 -11.239 -2.410 -3.394 1.00 0.36 H new ATOM 0 HB2 TYR B 50 -9.543 -0.930 -2.731 1.00 0.36 H new ATOM 0 HB3 TYR B 50 -8.343 -2.199 -2.580 1.00 0.36 H new ATOM 0 HD1 TYR B 50 -10.678 -1.351 -5.415 1.00 1.25 H new ATOM 0 HD2 TYR B 50 -6.605 -1.702 -4.091 1.00 1.21 H new ATOM 0 HE1 TYR B 50 -9.886 -0.874 -7.716 1.00 1.21 H new ATOM 0 HE2 TYR B 50 -5.820 -1.220 -6.394 1.00 1.28 H new ATOM 0 HH TYR B 50 -6.383 -0.760 -8.501 1.00 0.55 H new ATOM 2304 N ASN B 51 -8.962 -4.658 -4.254 1.00 0.32 N ATOM 2305 CA ASN B 51 -8.658 -5.620 -5.345 1.00 0.30 C ATOM 2306 C ASN B 51 -9.926 -6.400 -5.670 1.00 0.29 C ATOM 2307 O ASN B 51 -10.287 -6.572 -6.818 1.00 0.30 O ATOM 2308 CB ASN B 51 -7.556 -6.584 -4.903 1.00 0.31 C ATOM 2309 CG ASN B 51 -7.402 -7.682 -5.957 1.00 0.65 C ATOM 2310 OD1 ASN B 51 -6.481 -7.655 -6.749 1.00 1.41 O ATOM 2311 ND2 ASN B 51 -8.274 -8.652 -6.004 1.00 1.19 N ATOM 0 H ASN B 51 -8.318 -4.673 -3.463 1.00 0.32 H new ATOM 0 HA ASN B 51 -8.313 -5.081 -6.227 1.00 0.30 H new ATOM 0 HB2 ASN B 51 -6.615 -6.048 -4.777 1.00 0.31 H new ATOM 0 HB3 ASN B 51 -7.805 -7.022 -3.936 1.00 0.31 H new ATOM 0 HD21 ASN B 51 -8.182 -9.387 -6.705 1.00 1.19 H new ATOM 0 HD22 ASN B 51 -9.047 -8.675 -5.339 1.00 1.19 H new ATOM 2318 N SER B 52 -10.611 -6.866 -4.666 1.00 0.29 N ATOM 2319 CA SER B 52 -11.862 -7.627 -4.922 1.00 0.31 C ATOM 2320 C SER B 52 -12.925 -6.675 -5.477 1.00 0.29 C ATOM 2321 O SER B 52 -13.701 -7.035 -6.339 1.00 0.33 O ATOM 2322 CB SER B 52 -12.374 -8.255 -3.629 1.00 0.34 C ATOM 2323 OG SER B 52 -11.333 -8.266 -2.662 1.00 0.65 O ATOM 0 H SER B 52 -10.360 -6.754 -3.684 1.00 0.29 H new ATOM 0 HA SER B 52 -11.656 -8.419 -5.642 1.00 0.31 H new ATOM 0 HB2 SER B 52 -13.228 -7.692 -3.253 1.00 0.34 H new ATOM 0 HB3 SER B 52 -12.720 -9.271 -3.818 1.00 0.34 H new ATOM 0 HG SER B 52 -11.296 -7.397 -2.211 1.00 0.65 H new ATOM 2329 N LEU B 53 -12.961 -5.460 -4.992 1.00 0.27 N ATOM 2330 CA LEU B 53 -13.965 -4.483 -5.492 1.00 0.27 C ATOM 2331 C LEU B 53 -13.662 -4.171 -6.959 1.00 0.27 C ATOM 2332 O LEU B 53 -14.540 -3.845 -7.735 1.00 0.30 O ATOM 2333 CB LEU B 53 -13.876 -3.187 -4.678 1.00 0.27 C ATOM 2334 CG LEU B 53 -15.076 -2.282 -5.002 1.00 0.32 C ATOM 2335 CD1 LEU B 53 -16.268 -2.634 -4.108 1.00 0.53 C ATOM 2336 CD2 LEU B 53 -14.697 -0.818 -4.766 1.00 0.38 C ATOM 0 H LEU B 53 -12.335 -5.105 -4.269 1.00 0.27 H new ATOM 0 HA LEU B 53 -14.965 -4.905 -5.394 1.00 0.27 H new ATOM 0 HB2 LEU B 53 -13.860 -3.417 -3.613 1.00 0.27 H new ATOM 0 HB3 LEU B 53 -12.945 -2.667 -4.906 1.00 0.27 H new ATOM 0 HG LEU B 53 -15.351 -2.434 -6.046 1.00 0.32 H new ATOM 0 HD11 LEU B 53 -17.109 -1.984 -4.350 1.00 0.53 H new ATOM 0 HD12 LEU B 53 -16.553 -3.673 -4.274 1.00 0.53 H new ATOM 0 HD13 LEU B 53 -15.992 -2.496 -3.063 1.00 0.53 H new ATOM 0 HD21 LEU B 53 -15.550 -0.180 -4.997 1.00 0.38 H new ATOM 0 HD22 LEU B 53 -14.412 -0.680 -3.723 1.00 0.38 H new ATOM 0 HD23 LEU B 53 -13.859 -0.551 -5.410 1.00 0.38 H new ATOM 2348 N LYS B 54 -12.425 -4.301 -7.353 1.00 0.28 N ATOM 2349 CA LYS B 54 -12.056 -4.035 -8.768 1.00 0.32 C ATOM 2350 C LYS B 54 -12.537 -5.220 -9.603 1.00 0.34 C ATOM 2351 O LYS B 54 -13.033 -5.074 -10.703 1.00 0.36 O ATOM 2352 CB LYS B 54 -10.517 -3.842 -8.829 1.00 0.34 C ATOM 2353 CG LYS B 54 -9.834 -4.648 -9.954 1.00 0.96 C ATOM 2354 CD LYS B 54 -10.339 -4.196 -11.323 1.00 0.49 C ATOM 2355 CE LYS B 54 -9.280 -3.317 -11.996 1.00 0.49 C ATOM 2356 NZ LYS B 54 -8.067 -4.131 -12.290 1.00 0.99 N ATOM 0 H LYS B 54 -11.651 -4.582 -6.751 1.00 0.28 H new ATOM 0 HA LYS B 54 -12.521 -3.133 -9.166 1.00 0.32 H new ATOM 0 HB2 LYS B 54 -10.298 -2.783 -8.968 1.00 0.34 H new ATOM 0 HB3 LYS B 54 -10.085 -4.134 -7.872 1.00 0.34 H new ATOM 0 HG2 LYS B 54 -8.753 -4.517 -9.898 1.00 0.96 H new ATOM 0 HG3 LYS B 54 -10.034 -5.711 -9.820 1.00 0.96 H new ATOM 0 HD2 LYS B 54 -10.556 -5.063 -11.946 1.00 0.49 H new ATOM 0 HD3 LYS B 54 -11.271 -3.641 -11.213 1.00 0.49 H new ATOM 0 HE2 LYS B 54 -9.678 -2.893 -12.918 1.00 0.49 H new ATOM 0 HE3 LYS B 54 -9.021 -2.481 -11.346 1.00 0.49 H new ATOM 0 HZ1 LYS B 54 -7.592 -3.753 -13.134 1.00 0.99 H new ATOM 0 HZ2 LYS B 54 -7.417 -4.090 -11.479 1.00 0.99 H new ATOM 0 HZ3 LYS B 54 -8.345 -5.118 -12.462 1.00 0.99 H new ATOM 2370 N ASP B 55 -12.405 -6.389 -9.060 1.00 0.41 N ATOM 2371 CA ASP B 55 -12.855 -7.616 -9.766 1.00 0.47 C ATOM 2372 C ASP B 55 -14.328 -7.472 -10.122 1.00 0.47 C ATOM 2373 O ASP B 55 -14.903 -8.302 -10.797 1.00 0.52 O ATOM 2374 CB ASP B 55 -12.702 -8.800 -8.816 1.00 0.51 C ATOM 2375 CG ASP B 55 -11.621 -9.750 -9.333 1.00 0.66 C ATOM 2376 OD1 ASP B 55 -11.633 -10.040 -10.519 1.00 1.46 O ATOM 2377 OD2 ASP B 55 -10.805 -10.176 -8.535 1.00 1.23 O ATOM 0 H ASP B 55 -11.997 -6.552 -8.140 1.00 0.41 H new ATOM 0 HA ASP B 55 -12.265 -7.767 -10.670 1.00 0.47 H new ATOM 0 HB2 ASP B 55 -12.439 -8.445 -7.819 1.00 0.51 H new ATOM 0 HB3 ASP B 55 -13.650 -9.330 -8.726 1.00 0.51 H new ATOM 2382 N ARG B 56 -14.951 -6.440 -9.637 1.00 0.42 N ATOM 2383 CA ARG B 56 -16.399 -6.253 -9.905 1.00 0.44 C ATOM 2384 C ARG B 56 -16.616 -5.603 -11.266 1.00 0.43 C ATOM 2385 O ARG B 56 -17.537 -5.953 -11.977 1.00 0.51 O ATOM 2386 CB ARG B 56 -17.007 -5.367 -8.814 1.00 0.54 C ATOM 2387 CG ARG B 56 -16.608 -5.887 -7.423 1.00 0.50 C ATOM 2388 CD ARG B 56 -17.228 -7.261 -7.152 1.00 0.64 C ATOM 2389 NE ARG B 56 -18.670 -7.263 -7.542 1.00 1.01 N ATOM 2390 CZ ARG B 56 -19.268 -8.381 -7.869 1.00 1.27 C ATOM 2391 NH1 ARG B 56 -18.609 -9.509 -7.876 1.00 1.51 N ATOM 2392 NH2 ARG B 56 -20.534 -8.372 -8.186 1.00 1.71 N ATOM 0 H ARG B 56 -14.518 -5.715 -9.064 1.00 0.42 H new ATOM 0 HA ARG B 56 -16.883 -7.230 -9.905 1.00 0.44 H new ATOM 0 HB2 ARG B 56 -16.665 -4.339 -8.938 1.00 0.54 H new ATOM 0 HB3 ARG B 56 -18.093 -5.355 -8.908 1.00 0.54 H new ATOM 0 HG2 ARG B 56 -15.522 -5.954 -7.354 1.00 0.50 H new ATOM 0 HG3 ARG B 56 -16.933 -5.180 -6.660 1.00 0.50 H new ATOM 0 HD2 ARG B 56 -16.691 -8.027 -7.712 1.00 0.64 H new ATOM 0 HD3 ARG B 56 -17.129 -7.511 -6.096 1.00 0.64 H new ATOM 0 HE ARG B 56 -19.193 -6.387 -7.554 1.00 1.01 H new ATOM 0 HH11 ARG B 56 -17.620 -9.524 -7.625 1.00 1.51 H new ATOM 0 HH12 ARG B 56 -19.083 -10.375 -8.132 1.00 1.51 H new ATOM 0 HH21 ARG B 56 -21.055 -7.495 -8.179 1.00 1.71 H new ATOM 0 HH22 ARG B 56 -21.002 -9.242 -8.441 1.00 1.71 H new ATOM 2406 N LEU B 57 -15.804 -4.655 -11.646 1.00 0.41 N ATOM 2407 CA LEU B 57 -16.043 -4.022 -12.973 1.00 0.48 C ATOM 2408 C LEU B 57 -14.784 -3.368 -13.548 1.00 0.43 C ATOM 2409 O LEU B 57 -14.594 -3.364 -14.748 1.00 0.44 O ATOM 2410 CB LEU B 57 -17.149 -2.969 -12.834 1.00 0.58 C ATOM 2411 CG LEU B 57 -18.119 -3.046 -14.028 1.00 1.20 C ATOM 2412 CD1 LEU B 57 -19.150 -4.168 -13.823 1.00 1.70 C ATOM 2413 CD2 LEU B 57 -18.861 -1.714 -14.160 1.00 1.77 C ATOM 0 H LEU B 57 -15.009 -4.300 -11.114 1.00 0.41 H new ATOM 0 HA LEU B 57 -16.342 -4.809 -13.665 1.00 0.48 H new ATOM 0 HB2 LEU B 57 -17.695 -3.127 -11.904 1.00 0.58 H new ATOM 0 HB3 LEU B 57 -16.707 -1.974 -12.780 1.00 0.58 H new ATOM 0 HG LEU B 57 -17.543 -3.255 -14.929 1.00 1.20 H new ATOM 0 HD11 LEU B 57 -19.824 -4.203 -14.679 1.00 1.70 H new ATOM 0 HD12 LEU B 57 -18.634 -5.123 -13.728 1.00 1.70 H new ATOM 0 HD13 LEU B 57 -19.724 -3.974 -12.917 1.00 1.70 H new ATOM 0 HD21 LEU B 57 -19.549 -1.763 -15.004 1.00 1.77 H new ATOM 0 HD22 LEU B 57 -19.421 -1.517 -13.246 1.00 1.77 H new ATOM 0 HD23 LEU B 57 -18.142 -0.912 -14.324 1.00 1.77 H new ATOM 2425 N GLY B 58 -13.931 -2.791 -12.748 1.00 0.39 N ATOM 2426 CA GLY B 58 -12.730 -2.132 -13.341 1.00 0.36 C ATOM 2427 C GLY B 58 -13.156 -0.820 -13.990 1.00 0.35 C ATOM 2428 O GLY B 58 -12.639 0.234 -13.676 1.00 0.35 O ATOM 0 H GLY B 58 -14.008 -2.746 -11.732 1.00 0.39 H new ATOM 0 HA2 GLY B 58 -11.983 -1.946 -12.569 1.00 0.36 H new ATOM 0 HA3 GLY B 58 -12.268 -2.786 -14.081 1.00 0.36 H new ATOM 2432 N ASP B 59 -14.105 -0.866 -14.882 1.00 0.40 N ATOM 2433 CA ASP B 59 -14.568 0.389 -15.530 1.00 0.44 C ATOM 2434 C ASP B 59 -15.367 1.196 -14.511 1.00 0.38 C ATOM 2435 O ASP B 59 -15.150 2.376 -14.323 1.00 0.40 O ATOM 2436 CB ASP B 59 -15.457 0.049 -16.726 1.00 0.53 C ATOM 2437 CG ASP B 59 -14.925 0.751 -17.976 1.00 0.63 C ATOM 2438 OD1 ASP B 59 -14.550 1.907 -17.867 1.00 1.40 O ATOM 2439 OD2 ASP B 59 -14.900 0.121 -19.020 1.00 1.11 O ATOM 0 H ASP B 59 -14.578 -1.716 -15.189 1.00 0.40 H new ATOM 0 HA ASP B 59 -13.712 0.969 -15.876 1.00 0.44 H new ATOM 0 HB2 ASP B 59 -15.476 -1.030 -16.883 1.00 0.53 H new ATOM 0 HB3 ASP B 59 -16.483 0.361 -16.530 1.00 0.53 H new ATOM 2444 N GLY B 60 -16.289 0.558 -13.849 1.00 0.34 N ATOM 2445 CA GLY B 60 -17.109 1.269 -12.837 1.00 0.31 C ATOM 2446 C GLY B 60 -16.281 1.457 -11.572 1.00 0.29 C ATOM 2447 O GLY B 60 -16.811 1.573 -10.493 1.00 0.28 O ATOM 0 H GLY B 60 -16.510 -0.431 -13.967 1.00 0.34 H new ATOM 0 HA2 GLY B 60 -17.430 2.236 -13.224 1.00 0.31 H new ATOM 0 HA3 GLY B 60 -18.011 0.699 -12.615 1.00 0.31 H new ATOM 2451 N VAL B 61 -14.981 1.476 -11.697 1.00 0.29 N ATOM 2452 CA VAL B 61 -14.112 1.644 -10.501 1.00 0.28 C ATOM 2453 C VAL B 61 -12.794 2.287 -10.938 1.00 0.30 C ATOM 2454 O VAL B 61 -12.272 1.985 -11.994 1.00 0.46 O ATOM 2455 CB VAL B 61 -13.824 0.270 -9.881 1.00 0.30 C ATOM 2456 CG1 VAL B 61 -12.595 0.361 -8.975 1.00 0.44 C ATOM 2457 CG2 VAL B 61 -15.027 -0.203 -9.054 1.00 0.39 C ATOM 0 H VAL B 61 -14.483 1.382 -12.582 1.00 0.29 H new ATOM 0 HA VAL B 61 -14.611 2.275 -9.765 1.00 0.28 H new ATOM 0 HB VAL B 61 -13.638 -0.444 -10.684 1.00 0.30 H new ATOM 0 HG11 VAL B 61 -12.393 -0.616 -8.536 1.00 0.44 H new ATOM 0 HG12 VAL B 61 -11.734 0.680 -9.561 1.00 0.44 H new ATOM 0 HG13 VAL B 61 -12.781 1.084 -8.181 1.00 0.44 H new ATOM 0 HG21 VAL B 61 -14.809 -1.179 -8.620 1.00 0.39 H new ATOM 0 HG22 VAL B 61 -15.224 0.513 -8.256 1.00 0.39 H new ATOM 0 HG23 VAL B 61 -15.903 -0.280 -9.698 1.00 0.39 H new ATOM 2467 N GLN B 62 -12.272 3.196 -10.151 1.00 0.28 N ATOM 2468 CA GLN B 62 -11.007 3.884 -10.540 1.00 0.30 C ATOM 2469 C GLN B 62 -10.121 4.164 -9.327 1.00 0.29 C ATOM 2470 O GLN B 62 -10.577 4.509 -8.257 1.00 0.27 O ATOM 2471 CB GLN B 62 -11.353 5.211 -11.194 1.00 0.31 C ATOM 2472 CG GLN B 62 -10.973 5.166 -12.668 1.00 0.41 C ATOM 2473 CD GLN B 62 -9.451 5.110 -12.810 1.00 0.56 C ATOM 2474 OE1 GLN B 62 -8.735 5.743 -12.060 1.00 1.26 O ATOM 2475 NE2 GLN B 62 -8.924 4.371 -13.748 1.00 1.42 N ATOM 0 H GLN B 62 -12.668 3.489 -9.258 1.00 0.28 H new ATOM 0 HA GLN B 62 -10.464 3.232 -11.224 1.00 0.30 H new ATOM 0 HB2 GLN B 62 -12.419 5.413 -11.088 1.00 0.31 H new ATOM 0 HB3 GLN B 62 -10.823 6.023 -10.696 1.00 0.31 H new ATOM 0 HG2 GLN B 62 -11.424 4.294 -13.143 1.00 0.41 H new ATOM 0 HG3 GLN B 62 -11.363 6.045 -13.180 1.00 0.41 H new ATOM 0 HE21 GLN B 62 -9.526 3.840 -14.377 1.00 1.42 H new ATOM 0 HE22 GLN B 62 -7.910 4.325 -13.852 1.00 1.42 H new ATOM 2484 N LEU B 63 -8.845 4.015 -9.522 1.00 0.33 N ATOM 2485 CA LEU B 63 -7.853 4.258 -8.433 1.00 0.33 C ATOM 2486 C LEU B 63 -7.372 5.709 -8.500 1.00 0.34 C ATOM 2487 O LEU B 63 -6.469 6.036 -9.245 1.00 0.39 O ATOM 2488 CB LEU B 63 -6.668 3.311 -8.647 1.00 0.36 C ATOM 2489 CG LEU B 63 -5.682 3.397 -7.473 1.00 0.36 C ATOM 2490 CD1 LEU B 63 -5.383 1.989 -6.951 1.00 0.54 C ATOM 2491 CD2 LEU B 63 -4.373 4.044 -7.942 1.00 0.52 C ATOM 0 H LEU B 63 -8.434 3.728 -10.410 1.00 0.33 H new ATOM 0 HA LEU B 63 -8.305 4.079 -7.458 1.00 0.33 H new ATOM 0 HB2 LEU B 63 -7.029 2.288 -8.751 1.00 0.36 H new ATOM 0 HB3 LEU B 63 -6.157 3.565 -9.576 1.00 0.36 H new ATOM 0 HG LEU B 63 -6.124 3.999 -6.680 1.00 0.36 H new ATOM 0 HD11 LEU B 63 -4.683 2.051 -6.118 1.00 0.54 H new ATOM 0 HD12 LEU B 63 -6.308 1.522 -6.614 1.00 0.54 H new ATOM 0 HD13 LEU B 63 -4.944 1.390 -7.749 1.00 0.54 H new ATOM 0 HD21 LEU B 63 -3.676 4.103 -7.106 1.00 0.52 H new ATOM 0 HD22 LEU B 63 -3.934 3.442 -8.738 1.00 0.52 H new ATOM 0 HD23 LEU B 63 -4.577 5.047 -8.316 1.00 0.52 H new ATOM 2503 N VAL B 64 -7.978 6.590 -7.754 1.00 0.33 N ATOM 2504 CA VAL B 64 -7.559 8.021 -7.808 1.00 0.37 C ATOM 2505 C VAL B 64 -6.230 8.219 -7.076 1.00 0.36 C ATOM 2506 O VAL B 64 -5.390 8.979 -7.512 1.00 0.41 O ATOM 2507 CB VAL B 64 -8.625 8.907 -7.162 1.00 0.41 C ATOM 2508 CG1 VAL B 64 -9.531 9.489 -8.249 1.00 1.08 C ATOM 2509 CG2 VAL B 64 -9.459 8.077 -6.190 1.00 1.43 C ATOM 0 H VAL B 64 -8.743 6.384 -7.111 1.00 0.33 H new ATOM 0 HA VAL B 64 -7.437 8.301 -8.854 1.00 0.37 H new ATOM 0 HB VAL B 64 -8.142 9.720 -6.619 1.00 0.41 H new ATOM 0 HG11 VAL B 64 -10.291 10.121 -7.789 1.00 1.08 H new ATOM 0 HG12 VAL B 64 -8.934 10.084 -8.940 1.00 1.08 H new ATOM 0 HG13 VAL B 64 -10.014 8.677 -8.793 1.00 1.08 H new ATOM 0 HG21 VAL B 64 -10.218 8.709 -5.730 1.00 1.43 H new ATOM 0 HG22 VAL B 64 -9.943 7.263 -6.729 1.00 1.43 H new ATOM 0 HG23 VAL B 64 -8.812 7.665 -5.415 1.00 1.43 H new ATOM 2519 N ASN B 65 -6.029 7.564 -5.962 1.00 0.32 N ATOM 2520 CA ASN B 65 -4.741 7.776 -5.238 1.00 0.34 C ATOM 2521 C ASN B 65 -4.491 6.690 -4.194 1.00 0.30 C ATOM 2522 O ASN B 65 -5.370 5.945 -3.815 1.00 0.28 O ATOM 2523 CB ASN B 65 -4.786 9.131 -4.530 1.00 0.36 C ATOM 2524 CG ASN B 65 -4.295 10.225 -5.480 1.00 0.48 C ATOM 2525 OD1 ASN B 65 -5.163 11.015 -6.050 1.00 1.28 O flip ATOM 2526 ND2 ASN B 65 -3.109 10.362 -5.706 1.00 1.09 N flip ATOM 0 H ASN B 65 -6.681 6.909 -5.531 1.00 0.32 H new ATOM 0 HA ASN B 65 -3.934 7.740 -5.970 1.00 0.34 H new ATOM 0 HB2 ASN B 65 -5.803 9.348 -4.204 1.00 0.36 H new ATOM 0 HB3 ASN B 65 -4.163 9.106 -3.636 1.00 0.36 H new ATOM 0 HD21 ASN B 65 -2.430 9.745 -5.260 1.00 1.09 H new ATOM 0 HD22 ASN B 65 -2.792 11.094 -6.341 1.00 1.09 H new ATOM 2533 N VAL B 66 -3.269 6.615 -3.739 1.00 0.29 N ATOM 2534 CA VAL B 66 -2.873 5.606 -2.722 1.00 0.26 C ATOM 2535 C VAL B 66 -1.569 6.081 -2.078 1.00 0.27 C ATOM 2536 O VAL B 66 -0.715 6.636 -2.740 1.00 0.31 O ATOM 2537 CB VAL B 66 -2.609 4.259 -3.403 1.00 0.30 C ATOM 2538 CG1 VAL B 66 -1.989 3.293 -2.393 1.00 0.90 C ATOM 2539 CG2 VAL B 66 -3.914 3.666 -3.935 1.00 0.66 C ATOM 0 H VAL B 66 -2.512 7.228 -4.040 1.00 0.29 H new ATOM 0 HA VAL B 66 -3.665 5.491 -1.982 1.00 0.26 H new ATOM 0 HB VAL B 66 -1.925 4.414 -4.238 1.00 0.30 H new ATOM 0 HG11 VAL B 66 -1.800 2.334 -2.875 1.00 0.90 H new ATOM 0 HG12 VAL B 66 -1.049 3.705 -2.025 1.00 0.90 H new ATOM 0 HG13 VAL B 66 -2.675 3.150 -1.558 1.00 0.90 H new ATOM 0 HG21 VAL B 66 -3.710 2.709 -4.416 1.00 0.66 H new ATOM 0 HG22 VAL B 66 -4.609 3.516 -3.109 1.00 0.66 H new ATOM 0 HG23 VAL B 66 -4.355 4.350 -4.660 1.00 0.66 H new ATOM 2549 N GLN B 67 -1.396 5.870 -0.804 1.00 0.25 N ATOM 2550 CA GLN B 67 -0.136 6.312 -0.143 1.00 0.28 C ATOM 2551 C GLN B 67 0.192 5.336 0.985 1.00 0.25 C ATOM 2552 O GLN B 67 -0.633 4.535 1.378 1.00 0.23 O ATOM 2553 CB GLN B 67 -0.320 7.721 0.429 1.00 0.29 C ATOM 2554 CG GLN B 67 1.049 8.338 0.731 1.00 0.37 C ATOM 2555 CD GLN B 67 0.866 9.788 1.183 1.00 0.64 C ATOM 2556 OE1 GLN B 67 -0.229 10.203 1.505 1.00 1.11 O ATOM 2557 NE2 GLN B 67 1.902 10.582 1.220 1.00 1.44 N ATOM 0 H GLN B 67 -2.071 5.411 -0.192 1.00 0.25 H new ATOM 0 HA GLN B 67 0.678 6.329 -0.868 1.00 0.28 H new ATOM 0 HB2 GLN B 67 -0.862 8.345 -0.282 1.00 0.29 H new ATOM 0 HB3 GLN B 67 -0.920 7.679 1.338 1.00 0.29 H new ATOM 0 HG2 GLN B 67 1.555 7.765 1.508 1.00 0.37 H new ATOM 0 HG3 GLN B 67 1.681 8.299 -0.156 1.00 0.37 H new ATOM 0 HE21 GLN B 67 2.822 10.233 0.950 1.00 1.44 H new ATOM 0 HE22 GLN B 67 1.792 11.551 1.519 1.00 1.44 H new ATOM 2566 N THR B 68 1.394 5.369 1.492 1.00 0.26 N ATOM 2567 CA THR B 68 1.762 4.412 2.571 1.00 0.26 C ATOM 2568 C THR B 68 2.790 5.043 3.509 1.00 0.25 C ATOM 2569 O THR B 68 3.804 5.565 3.092 1.00 0.33 O ATOM 2570 CB THR B 68 2.370 3.157 1.936 1.00 0.33 C ATOM 2571 OG1 THR B 68 2.712 3.434 0.586 1.00 0.42 O ATOM 2572 CG2 THR B 68 1.380 1.987 1.977 1.00 0.45 C ATOM 0 H THR B 68 2.132 6.013 1.208 1.00 0.26 H new ATOM 0 HA THR B 68 0.869 4.155 3.141 1.00 0.26 H new ATOM 0 HB THR B 68 3.259 2.879 2.501 1.00 0.33 H new ATOM 0 HG1 THR B 68 2.281 2.779 -0.002 1.00 0.42 H new ATOM 0 HG21 THR B 68 1.836 1.109 1.520 1.00 0.45 H new ATOM 0 HG22 THR B 68 1.122 1.765 3.012 1.00 0.45 H new ATOM 0 HG23 THR B 68 0.477 2.255 1.428 1.00 0.45 H new ATOM 2580 N GLY B 69 2.521 4.981 4.780 1.00 0.24 N ATOM 2581 CA GLY B 69 3.466 5.560 5.778 1.00 0.28 C ATOM 2582 C GLY B 69 3.395 4.772 7.086 1.00 0.26 C ATOM 2583 O GLY B 69 2.540 3.933 7.263 1.00 0.29 O ATOM 0 H GLY B 69 1.684 4.553 5.175 1.00 0.24 H new ATOM 0 HA2 GLY B 69 4.482 5.536 5.385 1.00 0.28 H new ATOM 0 HA3 GLY B 69 3.219 6.606 5.960 1.00 0.28 H new ATOM 2587 N SER B 70 4.314 5.028 7.984 1.00 0.24 N ATOM 2588 CA SER B 70 4.336 4.315 9.297 1.00 0.25 C ATOM 2589 C SER B 70 3.819 5.239 10.403 1.00 0.29 C ATOM 2590 O SER B 70 3.965 6.443 10.335 1.00 0.31 O ATOM 2591 CB SER B 70 5.764 3.875 9.619 1.00 0.27 C ATOM 2592 OG SER B 70 6.494 4.983 10.127 1.00 0.39 O ATOM 0 H SER B 70 5.061 5.712 7.860 1.00 0.24 H new ATOM 0 HA SER B 70 3.692 3.438 9.237 1.00 0.25 H new ATOM 0 HB2 SER B 70 5.751 3.067 10.350 1.00 0.27 H new ATOM 0 HB3 SER B 70 6.248 3.486 8.723 1.00 0.27 H new ATOM 0 HG SER B 70 7.410 4.704 10.335 1.00 0.39 H new ATOM 2598 N GLU B 71 3.234 4.686 11.436 1.00 0.32 N ATOM 2599 CA GLU B 71 2.728 5.547 12.545 1.00 0.39 C ATOM 2600 C GLU B 71 2.769 4.784 13.866 1.00 0.40 C ATOM 2601 O GLU B 71 3.052 3.603 13.908 1.00 0.37 O ATOM 2602 CB GLU B 71 1.291 5.990 12.256 1.00 0.40 C ATOM 2603 CG GLU B 71 0.328 4.802 12.324 1.00 0.49 C ATOM 2604 CD GLU B 71 -0.500 4.894 13.606 1.00 0.68 C ATOM 2605 OE1 GLU B 71 -1.051 5.953 13.858 1.00 1.26 O ATOM 2606 OE2 GLU B 71 -0.573 3.906 14.313 1.00 1.49 O ATOM 0 H GLU B 71 3.086 3.684 11.558 1.00 0.32 H new ATOM 0 HA GLU B 71 3.367 6.427 12.619 1.00 0.39 H new ATOM 0 HB2 GLU B 71 0.989 6.750 12.977 1.00 0.40 H new ATOM 0 HB3 GLU B 71 1.239 6.449 11.269 1.00 0.40 H new ATOM 0 HG2 GLU B 71 -0.328 4.801 11.453 1.00 0.49 H new ATOM 0 HG3 GLU B 71 0.886 3.866 12.304 1.00 0.49 H new ATOM 2613 N VAL B 72 2.508 5.460 14.949 1.00 0.45 N ATOM 2614 CA VAL B 72 2.555 4.786 16.271 1.00 0.49 C ATOM 2615 C VAL B 72 1.205 4.152 16.602 1.00 0.52 C ATOM 2616 O VAL B 72 0.164 4.762 16.456 1.00 0.71 O ATOM 2617 CB VAL B 72 2.917 5.802 17.355 1.00 0.59 C ATOM 2618 CG1 VAL B 72 2.952 5.105 18.716 1.00 0.56 C ATOM 2619 CG2 VAL B 72 4.294 6.398 17.055 1.00 0.87 C ATOM 0 H VAL B 72 2.264 6.450 14.974 1.00 0.45 H new ATOM 0 HA VAL B 72 3.311 4.002 16.232 1.00 0.49 H new ATOM 0 HB VAL B 72 2.171 6.596 17.371 1.00 0.59 H new ATOM 0 HG11 VAL B 72 3.210 5.829 19.489 1.00 0.56 H new ATOM 0 HG12 VAL B 72 1.973 4.678 18.931 1.00 0.56 H new ATOM 0 HG13 VAL B 72 3.698 4.311 18.699 1.00 0.56 H new ATOM 0 HG21 VAL B 72 4.553 7.122 17.827 1.00 0.87 H new ATOM 0 HG22 VAL B 72 5.039 5.603 17.039 1.00 0.87 H new ATOM 0 HG23 VAL B 72 4.272 6.894 16.085 1.00 0.87 H new ATOM 2629 N ARG B 73 1.222 2.930 17.062 1.00 0.47 N ATOM 2630 CA ARG B 73 -0.049 2.245 17.424 1.00 0.50 C ATOM 2631 C ARG B 73 0.199 1.314 18.613 1.00 0.54 C ATOM 2632 O ARG B 73 0.743 0.238 18.467 1.00 0.55 O ATOM 2633 CB ARG B 73 -0.554 1.432 16.232 1.00 0.49 C ATOM 2634 CG ARG B 73 -2.081 1.517 16.168 1.00 0.62 C ATOM 2635 CD ARG B 73 -2.591 0.676 14.999 1.00 0.72 C ATOM 2636 NE ARG B 73 -4.076 0.782 14.921 1.00 0.90 N ATOM 2637 CZ ARG B 73 -4.822 0.200 15.820 1.00 1.40 C ATOM 2638 NH1 ARG B 73 -4.269 -0.481 16.787 1.00 2.18 N ATOM 2639 NH2 ARG B 73 -6.121 0.299 15.753 1.00 1.68 N ATOM 0 H ARG B 73 2.066 2.375 17.203 1.00 0.47 H new ATOM 0 HA ARG B 73 -0.799 2.989 17.693 1.00 0.50 H new ATOM 0 HB2 ARG B 73 -0.119 1.812 15.308 1.00 0.49 H new ATOM 0 HB3 ARG B 73 -0.240 0.392 16.328 1.00 0.49 H new ATOM 0 HG2 ARG B 73 -2.515 1.161 17.102 1.00 0.62 H new ATOM 0 HG3 ARG B 73 -2.393 2.554 16.047 1.00 0.62 H new ATOM 0 HD2 ARG B 73 -2.142 1.019 14.067 1.00 0.72 H new ATOM 0 HD3 ARG B 73 -2.296 -0.365 15.130 1.00 0.72 H new ATOM 0 HE ARG B 73 -4.510 1.310 14.164 1.00 0.90 H new ATOM 0 HH11 ARG B 73 -3.253 -0.558 16.840 1.00 2.18 H new ATOM 0 HH12 ARG B 73 -4.853 -0.936 17.489 1.00 2.18 H new ATOM 0 HH21 ARG B 73 -6.554 0.831 14.998 1.00 1.68 H new ATOM 0 HH22 ARG B 73 -6.704 -0.156 16.456 1.00 1.68 H new ATOM 2653 N ASP B 74 -0.184 1.750 19.788 1.00 0.59 N ATOM 2654 CA ASP B 74 0.015 0.938 21.027 1.00 0.65 C ATOM 2655 C ASP B 74 1.445 1.125 21.536 1.00 0.65 C ATOM 2656 O ASP B 74 2.099 0.185 21.941 1.00 0.67 O ATOM 2657 CB ASP B 74 -0.248 -0.544 20.747 1.00 0.66 C ATOM 2658 CG ASP B 74 -0.793 -1.214 22.009 1.00 0.76 C ATOM 2659 OD1 ASP B 74 0.009 -1.642 22.823 1.00 1.35 O ATOM 2660 OD2 ASP B 74 -2.004 -1.288 22.140 1.00 1.25 O ATOM 0 H ASP B 74 -0.635 2.652 19.942 1.00 0.59 H new ATOM 0 HA ASP B 74 -0.690 1.276 21.787 1.00 0.65 H new ATOM 0 HB2 ASP B 74 -0.962 -0.649 19.930 1.00 0.66 H new ATOM 0 HB3 ASP B 74 0.673 -1.034 20.431 1.00 0.66 H new ATOM 2665 N ARG B 75 1.936 2.339 21.506 1.00 0.64 N ATOM 2666 CA ARG B 75 3.328 2.620 21.978 1.00 0.66 C ATOM 2667 C ARG B 75 4.320 1.819 21.128 1.00 0.60 C ATOM 2668 O ARG B 75 5.377 1.421 21.573 1.00 0.65 O ATOM 2669 CB ARG B 75 3.472 2.275 23.472 1.00 0.75 C ATOM 2670 CG ARG B 75 3.261 3.543 24.302 1.00 0.85 C ATOM 2671 CD ARG B 75 1.919 4.177 23.936 1.00 0.86 C ATOM 2672 NE ARG B 75 1.320 4.803 25.148 1.00 1.19 N ATOM 2673 CZ ARG B 75 0.169 5.413 25.068 1.00 1.81 C ATOM 2674 NH1 ARG B 75 -0.460 5.473 23.927 1.00 2.57 N ATOM 2675 NH2 ARG B 75 -0.352 5.963 26.131 1.00 2.18 N ATOM 0 H ARG B 75 1.426 3.157 21.171 1.00 0.64 H new ATOM 0 HA ARG B 75 3.543 3.682 21.864 1.00 0.66 H new ATOM 0 HB2 ARG B 75 2.743 1.515 23.754 1.00 0.75 H new ATOM 0 HB3 ARG B 75 4.460 1.858 23.668 1.00 0.75 H new ATOM 0 HG2 ARG B 75 3.283 3.302 25.365 1.00 0.85 H new ATOM 0 HG3 ARG B 75 4.071 4.249 24.118 1.00 0.85 H new ATOM 0 HD2 ARG B 75 2.059 4.927 23.157 1.00 0.86 H new ATOM 0 HD3 ARG B 75 1.245 3.421 23.533 1.00 0.86 H new ATOM 0 HE ARG B 75 1.810 4.755 26.041 1.00 1.19 H new ATOM 0 HH11 ARG B 75 -0.052 5.043 23.097 1.00 2.57 H new ATOM 0 HH12 ARG B 75 -1.360 5.950 23.865 1.00 2.57 H new ATOM 0 HH21 ARG B 75 0.140 5.916 27.023 1.00 2.18 H new ATOM 0 HH22 ARG B 75 -1.251 6.440 26.070 1.00 2.18 H new ATOM 2689 N ARG B 76 3.989 1.614 19.885 1.00 0.50 N ATOM 2690 CA ARG B 76 4.903 0.871 18.975 1.00 0.44 C ATOM 2691 C ARG B 76 4.667 1.353 17.553 1.00 0.40 C ATOM 2692 O ARG B 76 3.602 1.841 17.224 1.00 0.39 O ATOM 2693 CB ARG B 76 4.605 -0.623 19.013 1.00 0.45 C ATOM 2694 CG ARG B 76 5.909 -1.434 18.967 1.00 0.62 C ATOM 2695 CD ARG B 76 6.523 -1.520 20.366 1.00 1.29 C ATOM 2696 NE ARG B 76 6.171 -2.831 20.982 1.00 1.55 N ATOM 2697 CZ ARG B 76 6.370 -3.026 22.256 1.00 2.38 C ATOM 2698 NH1 ARG B 76 6.878 -2.074 22.990 1.00 3.14 N ATOM 2699 NH2 ARG B 76 6.061 -4.173 22.797 1.00 2.85 N ATOM 0 H ARG B 76 3.119 1.931 19.457 1.00 0.50 H new ATOM 0 HA ARG B 76 5.931 1.046 19.294 1.00 0.44 H new ATOM 0 HB2 ARG B 76 4.051 -0.866 19.919 1.00 0.45 H new ATOM 0 HB3 ARG B 76 3.971 -0.895 18.169 1.00 0.45 H new ATOM 0 HG2 ARG B 76 5.710 -2.436 18.586 1.00 0.62 H new ATOM 0 HG3 ARG B 76 6.614 -0.966 18.280 1.00 0.62 H new ATOM 0 HD2 ARG B 76 7.606 -1.413 20.307 1.00 1.29 H new ATOM 0 HD3 ARG B 76 6.155 -0.703 20.987 1.00 1.29 H new ATOM 0 HE ARG B 76 5.775 -3.575 20.408 1.00 1.55 H new ATOM 0 HH11 ARG B 76 7.119 -1.178 22.567 1.00 3.14 H new ATOM 0 HH12 ARG B 76 7.034 -2.226 23.986 1.00 3.14 H new ATOM 0 HH21 ARG B 76 5.664 -4.917 22.223 1.00 2.85 H new ATOM 0 HH22 ARG B 76 6.217 -4.325 23.793 1.00 2.85 H new ATOM 2713 N ARG B 77 5.647 1.225 16.710 1.00 0.38 N ATOM 2714 CA ARG B 77 5.468 1.686 15.307 1.00 0.34 C ATOM 2715 C ARG B 77 4.864 0.585 14.455 1.00 0.30 C ATOM 2716 O ARG B 77 5.166 -0.582 14.605 1.00 0.32 O ATOM 2717 CB ARG B 77 6.795 2.143 14.699 1.00 0.36 C ATOM 2718 CG ARG B 77 6.580 3.485 13.984 1.00 0.47 C ATOM 2719 CD ARG B 77 7.780 3.795 13.090 1.00 0.48 C ATOM 2720 NE ARG B 77 9.007 3.933 13.926 1.00 1.12 N ATOM 2721 CZ ARG B 77 9.285 5.072 14.502 1.00 1.45 C ATOM 2722 NH1 ARG B 77 8.476 6.088 14.375 1.00 1.69 N ATOM 2723 NH2 ARG B 77 10.373 5.192 15.212 1.00 2.39 N ATOM 0 H ARG B 77 6.559 0.824 16.927 1.00 0.38 H new ATOM 0 HA ARG B 77 4.787 2.537 15.325 1.00 0.34 H new ATOM 0 HB2 ARG B 77 7.550 2.248 15.478 1.00 0.36 H new ATOM 0 HB3 ARG B 77 7.164 1.396 13.996 1.00 0.36 H new ATOM 0 HG2 ARG B 77 5.670 3.447 13.386 1.00 0.47 H new ATOM 0 HG3 ARG B 77 6.446 4.280 14.717 1.00 0.47 H new ATOM 0 HD2 ARG B 77 7.915 2.999 12.357 1.00 0.48 H new ATOM 0 HD3 ARG B 77 7.603 4.715 12.533 1.00 0.48 H new ATOM 0 HE ARG B 77 9.631 3.136 14.048 1.00 1.12 H new ATOM 0 HH11 ARG B 77 7.623 5.995 13.824 1.00 1.69 H new ATOM 0 HH12 ARG B 77 8.697 6.975 14.827 1.00 1.69 H new ATOM 0 HH21 ARG B 77 11.004 4.398 15.316 1.00 2.39 H new ATOM 0 HH22 ARG B 77 10.592 6.080 15.663 1.00 2.39 H new ATOM 2737 N ILE B 78 4.000 0.966 13.562 1.00 0.26 N ATOM 2738 CA ILE B 78 3.339 -0.022 12.681 1.00 0.23 C ATOM 2739 C ILE B 78 3.188 0.595 11.293 1.00 0.21 C ATOM 2740 O ILE B 78 3.205 1.799 11.129 1.00 0.22 O ATOM 2741 CB ILE B 78 1.959 -0.358 13.277 1.00 0.24 C ATOM 2742 CG1 ILE B 78 1.533 -1.791 12.923 1.00 0.26 C ATOM 2743 CG2 ILE B 78 0.899 0.605 12.742 1.00 0.32 C ATOM 2744 CD1 ILE B 78 0.285 -2.148 13.732 1.00 0.58 C ATOM 0 H ILE B 78 3.722 1.935 13.405 1.00 0.26 H new ATOM 0 HA ILE B 78 3.926 -0.937 12.603 1.00 0.23 H new ATOM 0 HB ILE B 78 2.043 -0.263 14.360 1.00 0.24 H new ATOM 0 HG12 ILE B 78 1.326 -1.871 11.856 1.00 0.26 H new ATOM 0 HG13 ILE B 78 2.339 -2.490 13.145 1.00 0.26 H new ATOM 0 HG21 ILE B 78 -0.071 0.355 13.172 1.00 0.32 H new ATOM 0 HG22 ILE B 78 1.164 1.626 13.015 1.00 0.32 H new ATOM 0 HG23 ILE B 78 0.846 0.522 11.656 1.00 0.32 H new ATOM 0 HD11 ILE B 78 -0.028 -3.164 13.489 1.00 0.58 H new ATOM 0 HD12 ILE B 78 0.510 -2.082 14.796 1.00 0.58 H new ATOM 0 HD13 ILE B 78 -0.518 -1.453 13.487 1.00 0.58 H new ATOM 2756 N SER B 79 3.061 -0.221 10.297 1.00 0.20 N ATOM 2757 CA SER B 79 2.930 0.301 8.915 1.00 0.19 C ATOM 2758 C SER B 79 1.459 0.580 8.633 1.00 0.20 C ATOM 2759 O SER B 79 0.595 -0.085 9.163 1.00 0.22 O ATOM 2760 CB SER B 79 3.453 -0.750 7.938 1.00 0.22 C ATOM 2761 OG SER B 79 3.532 -2.002 8.602 1.00 0.61 O ATOM 0 H SER B 79 3.042 -1.238 10.379 1.00 0.20 H new ATOM 0 HA SER B 79 3.504 1.221 8.800 1.00 0.19 H new ATOM 0 HB2 SER B 79 2.792 -0.823 7.075 1.00 0.22 H new ATOM 0 HB3 SER B 79 4.435 -0.460 7.564 1.00 0.22 H new ATOM 0 HG SER B 79 4.456 -2.329 8.575 1.00 0.61 H new ATOM 2767 N TYR B 80 1.161 1.549 7.801 1.00 0.23 N ATOM 2768 CA TYR B 80 -0.271 1.844 7.492 1.00 0.29 C ATOM 2769 C TYR B 80 -0.410 2.269 6.038 1.00 0.29 C ATOM 2770 O TYR B 80 0.499 2.818 5.446 1.00 0.27 O ATOM 2771 CB TYR B 80 -0.824 2.929 8.442 1.00 0.41 C ATOM 2772 CG TYR B 80 -0.298 4.302 8.074 1.00 0.94 C ATOM 2773 CD1 TYR B 80 -0.822 4.991 6.972 1.00 1.63 C ATOM 2774 CD2 TYR B 80 0.717 4.891 8.841 1.00 1.88 C ATOM 2775 CE1 TYR B 80 -0.329 6.259 6.639 1.00 2.58 C ATOM 2776 CE2 TYR B 80 1.207 6.160 8.498 1.00 2.80 C ATOM 2777 CZ TYR B 80 0.684 6.839 7.400 1.00 3.04 C ATOM 2778 OH TYR B 80 1.169 8.088 7.067 1.00 4.08 O ATOM 0 H TYR B 80 1.842 2.143 7.327 1.00 0.23 H new ATOM 0 HA TYR B 80 -0.858 0.939 7.647 1.00 0.29 H new ATOM 0 HB2 TYR B 80 -1.913 2.931 8.400 1.00 0.41 H new ATOM 0 HB3 TYR B 80 -0.545 2.693 9.469 1.00 0.41 H new ATOM 0 HD1 TYR B 80 -1.606 4.544 6.379 1.00 1.63 H new ATOM 0 HD2 TYR B 80 1.121 4.368 9.695 1.00 1.88 H new ATOM 0 HE1 TYR B 80 -0.735 6.789 5.790 1.00 2.58 H new ATOM 0 HE2 TYR B 80 1.992 6.612 9.087 1.00 2.80 H new ATOM 0 HH TYR B 80 1.871 8.346 7.700 1.00 4.08 H new ATOM 2788 N ILE B 81 -1.553 1.975 5.461 1.00 0.31 N ATOM 2789 CA ILE B 81 -1.801 2.303 4.026 1.00 0.32 C ATOM 2790 C ILE B 81 -3.014 3.196 3.855 1.00 0.31 C ATOM 2791 O ILE B 81 -4.045 2.980 4.456 1.00 0.31 O ATOM 2792 CB ILE B 81 -2.103 1.027 3.242 1.00 0.35 C ATOM 2793 CG1 ILE B 81 -2.404 1.392 1.786 1.00 0.70 C ATOM 2794 CG2 ILE B 81 -3.352 0.362 3.828 1.00 0.90 C ATOM 2795 CD1 ILE B 81 -1.881 0.298 0.863 1.00 0.69 C ATOM 0 H ILE B 81 -2.332 1.516 5.933 1.00 0.31 H new ATOM 0 HA ILE B 81 -0.904 2.805 3.664 1.00 0.32 H new ATOM 0 HB ILE B 81 -1.247 0.355 3.300 1.00 0.35 H new ATOM 0 HG12 ILE B 81 -3.478 1.516 1.647 1.00 0.70 H new ATOM 0 HG13 ILE B 81 -1.938 2.345 1.536 1.00 0.70 H new ATOM 0 HG21 ILE B 81 -3.573 -0.550 3.273 1.00 0.90 H new ATOM 0 HG22 ILE B 81 -3.176 0.116 4.875 1.00 0.90 H new ATOM 0 HG23 ILE B 81 -4.197 1.046 3.754 1.00 0.90 H new ATOM 0 HD11 ILE B 81 -2.097 0.561 -0.172 1.00 0.69 H new ATOM 0 HD12 ILE B 81 -0.804 0.196 0.994 1.00 0.69 H new ATOM 0 HD13 ILE B 81 -2.368 -0.647 1.106 1.00 0.69 H new ATOM 2807 N LEU B 82 -2.902 4.157 2.981 1.00 0.30 N ATOM 2808 CA LEU B 82 -4.042 5.052 2.665 1.00 0.29 C ATOM 2809 C LEU B 82 -4.486 4.666 1.257 1.00 0.27 C ATOM 2810 O LEU B 82 -3.790 4.954 0.306 1.00 0.30 O ATOM 2811 CB LEU B 82 -3.563 6.504 2.658 1.00 0.31 C ATOM 2812 CG LEU B 82 -2.692 6.762 3.881 1.00 0.33 C ATOM 2813 CD1 LEU B 82 -2.261 8.231 3.891 1.00 0.34 C ATOM 2814 CD2 LEU B 82 -3.503 6.457 5.145 1.00 0.37 C ATOM 0 H LEU B 82 -2.047 4.361 2.463 1.00 0.30 H new ATOM 0 HA LEU B 82 -4.848 4.957 3.393 1.00 0.29 H new ATOM 0 HB2 LEU B 82 -2.998 6.707 1.748 1.00 0.31 H new ATOM 0 HB3 LEU B 82 -4.418 7.180 2.659 1.00 0.31 H new ATOM 0 HG LEU B 82 -1.808 6.125 3.850 1.00 0.33 H new ATOM 0 HD11 LEU B 82 -1.637 8.421 4.764 1.00 0.34 H new ATOM 0 HD12 LEU B 82 -1.695 8.450 2.986 1.00 0.34 H new ATOM 0 HD13 LEU B 82 -3.144 8.869 3.930 1.00 0.34 H new ATOM 0 HD21 LEU B 82 -2.887 6.639 6.025 1.00 0.37 H new ATOM 0 HD22 LEU B 82 -4.382 7.101 5.178 1.00 0.37 H new ATOM 0 HD23 LEU B 82 -3.818 5.414 5.132 1.00 0.37 H new ATOM 2826 N LEU B 83 -5.610 4.001 1.118 1.00 0.23 N ATOM 2827 CA LEU B 83 -6.076 3.569 -0.238 1.00 0.23 C ATOM 2828 C LEU B 83 -7.268 4.409 -0.688 1.00 0.22 C ATOM 2829 O LEU B 83 -8.305 4.404 -0.053 1.00 0.21 O ATOM 2830 CB LEU B 83 -6.494 2.097 -0.163 1.00 0.25 C ATOM 2831 CG LEU B 83 -6.349 1.410 -1.537 1.00 0.48 C ATOM 2832 CD1 LEU B 83 -5.060 0.582 -1.580 1.00 0.46 C ATOM 2833 CD2 LEU B 83 -7.530 0.476 -1.775 1.00 0.98 C ATOM 0 H LEU B 83 -6.225 3.739 1.888 1.00 0.23 H new ATOM 0 HA LEU B 83 -5.267 3.702 -0.956 1.00 0.23 H new ATOM 0 HB2 LEU B 83 -5.880 1.578 0.573 1.00 0.25 H new ATOM 0 HB3 LEU B 83 -7.527 2.026 0.176 1.00 0.25 H new ATOM 0 HG LEU B 83 -6.319 2.181 -2.307 1.00 0.48 H new ATOM 0 HD11 LEU B 83 -4.968 0.102 -2.554 1.00 0.46 H new ATOM 0 HD12 LEU B 83 -4.203 1.235 -1.415 1.00 0.46 H new ATOM 0 HD13 LEU B 83 -5.091 -0.180 -0.801 1.00 0.46 H new ATOM 0 HD21 LEU B 83 -7.422 -0.006 -2.747 1.00 0.98 H new ATOM 0 HD22 LEU B 83 -7.556 -0.284 -0.994 1.00 0.98 H new ATOM 0 HD23 LEU B 83 -8.457 1.049 -1.755 1.00 0.98 H new ATOM 2845 N ARG B 84 -7.137 5.115 -1.785 1.00 0.23 N ATOM 2846 CA ARG B 84 -8.264 5.944 -2.296 1.00 0.24 C ATOM 2847 C ARG B 84 -8.917 5.221 -3.470 1.00 0.30 C ATOM 2848 O ARG B 84 -8.354 4.305 -4.029 1.00 0.71 O ATOM 2849 CB ARG B 84 -7.731 7.305 -2.750 1.00 0.29 C ATOM 2850 CG ARG B 84 -8.864 8.334 -2.720 1.00 0.30 C ATOM 2851 CD ARG B 84 -8.326 9.705 -3.130 1.00 0.34 C ATOM 2852 NE ARG B 84 -9.330 10.751 -2.785 1.00 0.41 N ATOM 2853 CZ ARG B 84 -9.020 12.013 -2.887 1.00 0.50 C ATOM 2854 NH1 ARG B 84 -7.828 12.362 -3.288 1.00 0.55 N ATOM 2855 NH2 ARG B 84 -9.901 12.928 -2.586 1.00 0.60 N ATOM 0 H ARG B 84 -6.289 5.150 -2.350 1.00 0.23 H new ATOM 0 HA ARG B 84 -9.001 6.098 -1.508 1.00 0.24 H new ATOM 0 HB2 ARG B 84 -6.918 7.625 -2.098 1.00 0.29 H new ATOM 0 HB3 ARG B 84 -7.321 7.229 -3.757 1.00 0.29 H new ATOM 0 HG2 ARG B 84 -9.663 8.029 -3.396 1.00 0.30 H new ATOM 0 HG3 ARG B 84 -9.295 8.386 -1.720 1.00 0.30 H new ATOM 0 HD2 ARG B 84 -7.384 9.906 -2.620 1.00 0.34 H new ATOM 0 HD3 ARG B 84 -8.119 9.722 -4.200 1.00 0.34 H new ATOM 0 HE ARG B 84 -10.261 10.479 -2.469 1.00 0.41 H new ATOM 0 HH11 ARG B 84 -7.139 11.647 -3.522 1.00 0.55 H new ATOM 0 HH12 ARG B 84 -7.586 13.350 -3.368 1.00 0.55 H new ATOM 0 HH21 ARG B 84 -10.832 12.655 -2.271 1.00 0.60 H new ATOM 0 HH22 ARG B 84 -9.658 13.915 -2.666 1.00 0.60 H new ATOM 2869 N LEU B 85 -10.092 5.634 -3.853 1.00 0.31 N ATOM 2870 CA LEU B 85 -10.770 4.966 -5.005 1.00 0.28 C ATOM 2871 C LEU B 85 -11.847 5.882 -5.568 1.00 0.27 C ATOM 2872 O LEU B 85 -12.391 6.696 -4.861 1.00 0.29 O ATOM 2873 CB LEU B 85 -11.415 3.660 -4.536 1.00 0.29 C ATOM 2874 CG LEU B 85 -11.349 2.613 -5.650 1.00 0.56 C ATOM 2875 CD1 LEU B 85 -9.998 1.899 -5.616 1.00 1.44 C ATOM 2876 CD2 LEU B 85 -12.462 1.583 -5.446 1.00 0.93 C ATOM 0 H LEU B 85 -10.612 6.399 -3.424 1.00 0.31 H new ATOM 0 HA LEU B 85 -10.032 4.752 -5.778 1.00 0.28 H new ATOM 0 HB2 LEU B 85 -10.903 3.290 -3.648 1.00 0.29 H new ATOM 0 HB3 LEU B 85 -12.453 3.838 -4.254 1.00 0.29 H new ATOM 0 HG LEU B 85 -11.472 3.110 -6.612 1.00 0.56 H new ATOM 0 HD11 LEU B 85 -9.959 1.155 -6.412 1.00 1.44 H new ATOM 0 HD12 LEU B 85 -9.199 2.626 -5.759 1.00 1.44 H new ATOM 0 HD13 LEU B 85 -9.871 1.406 -4.652 1.00 1.44 H new ATOM 0 HD21 LEU B 85 -12.417 0.836 -6.239 1.00 0.93 H new ATOM 0 HD22 LEU B 85 -12.333 1.095 -4.480 1.00 0.93 H new ATOM 0 HD23 LEU B 85 -13.430 2.083 -5.474 1.00 0.93 H new ATOM 2888 N LYS B 86 -12.146 5.752 -6.838 1.00 0.31 N ATOM 2889 CA LYS B 86 -13.190 6.615 -7.468 1.00 0.33 C ATOM 2890 C LYS B 86 -14.079 5.760 -8.375 1.00 0.30 C ATOM 2891 O LYS B 86 -13.604 4.937 -9.127 1.00 0.34 O ATOM 2892 CB LYS B 86 -12.501 7.701 -8.297 1.00 0.39 C ATOM 2893 CG LYS B 86 -13.534 8.512 -9.089 1.00 0.41 C ATOM 2894 CD LYS B 86 -13.571 8.073 -10.560 1.00 0.41 C ATOM 2895 CE LYS B 86 -14.470 9.024 -11.352 1.00 0.51 C ATOM 2896 NZ LYS B 86 -13.653 9.750 -12.365 1.00 1.31 N ATOM 0 H LYS B 86 -11.708 5.080 -7.468 1.00 0.31 H new ATOM 0 HA LYS B 86 -13.806 7.077 -6.696 1.00 0.33 H new ATOM 0 HB2 LYS B 86 -11.936 8.363 -7.641 1.00 0.39 H new ATOM 0 HB3 LYS B 86 -11.786 7.245 -8.982 1.00 0.39 H new ATOM 0 HG2 LYS B 86 -14.520 8.384 -8.643 1.00 0.41 H new ATOM 0 HG3 LYS B 86 -13.292 9.573 -9.029 1.00 0.41 H new ATOM 0 HD2 LYS B 86 -12.564 8.075 -10.977 1.00 0.41 H new ATOM 0 HD3 LYS B 86 -13.946 7.052 -10.637 1.00 0.41 H new ATOM 0 HE2 LYS B 86 -15.266 8.465 -11.844 1.00 0.51 H new ATOM 0 HE3 LYS B 86 -14.949 9.734 -10.678 1.00 0.51 H new ATOM 0 HZ1 LYS B 86 -14.263 10.397 -12.904 1.00 1.31 H new ATOM 0 HZ2 LYS B 86 -12.909 10.295 -11.885 1.00 1.31 H new ATOM 0 HZ3 LYS B 86 -13.216 9.065 -13.014 1.00 1.31 H new ATOM 2910 N ARG B 87 -15.368 5.959 -8.308 1.00 0.28 N ATOM 2911 CA ARG B 87 -16.296 5.167 -9.175 1.00 0.27 C ATOM 2912 C ARG B 87 -16.609 5.963 -10.438 1.00 0.28 C ATOM 2913 O ARG B 87 -16.855 7.152 -10.378 1.00 0.32 O ATOM 2914 CB ARG B 87 -17.600 4.875 -8.429 1.00 0.29 C ATOM 2915 CG ARG B 87 -17.298 4.144 -7.116 1.00 0.61 C ATOM 2916 CD ARG B 87 -16.637 2.794 -7.405 1.00 0.42 C ATOM 2917 NE ARG B 87 -16.880 1.862 -6.262 1.00 0.48 N ATOM 2918 CZ ARG B 87 -17.848 0.974 -6.297 1.00 0.81 C ATOM 2919 NH1 ARG B 87 -18.672 0.907 -7.312 1.00 1.64 N ATOM 2920 NH2 ARG B 87 -18.002 0.155 -5.293 1.00 0.87 N ATOM 0 H ARG B 87 -15.821 6.634 -7.692 1.00 0.28 H new ATOM 0 HA ARG B 87 -15.817 4.224 -9.437 1.00 0.27 H new ATOM 0 HB2 ARG B 87 -18.128 5.806 -8.224 1.00 0.29 H new ATOM 0 HB3 ARG B 87 -18.257 4.267 -9.051 1.00 0.29 H new ATOM 0 HG2 ARG B 87 -16.642 4.753 -6.494 1.00 0.61 H new ATOM 0 HG3 ARG B 87 -18.220 3.993 -6.554 1.00 0.61 H new ATOM 0 HD2 ARG B 87 -17.040 2.370 -8.325 1.00 0.42 H new ATOM 0 HD3 ARG B 87 -15.566 2.927 -7.557 1.00 0.42 H new ATOM 0 HE ARG B 87 -16.282 1.916 -5.438 1.00 0.48 H new ATOM 0 HH11 ARG B 87 -18.569 1.552 -8.096 1.00 1.64 H new ATOM 0 HH12 ARG B 87 -19.417 0.210 -7.319 1.00 1.64 H new ATOM 0 HH21 ARG B 87 -17.374 0.208 -4.491 1.00 0.87 H new ATOM 0 HH22 ARG B 87 -18.750 -0.538 -5.310 1.00 0.87 H new ATOM 2934 N VAL B 88 -16.612 5.314 -11.579 1.00 0.28 N ATOM 2935 CA VAL B 88 -16.920 6.017 -12.864 1.00 0.32 C ATOM 2936 C VAL B 88 -18.295 5.554 -13.344 1.00 0.34 C ATOM 2937 O VAL B 88 -18.842 6.066 -14.301 1.00 0.39 O ATOM 2938 CB VAL B 88 -15.867 5.639 -13.919 1.00 0.34 C ATOM 2939 CG1 VAL B 88 -16.093 6.442 -15.204 1.00 0.49 C ATOM 2940 CG2 VAL B 88 -14.459 5.934 -13.394 1.00 0.68 C ATOM 0 H VAL B 88 -16.412 4.318 -11.674 1.00 0.28 H new ATOM 0 HA VAL B 88 -16.910 7.097 -12.714 1.00 0.32 H new ATOM 0 HB VAL B 88 -15.963 4.574 -14.129 1.00 0.34 H new ATOM 0 HG11 VAL B 88 -15.341 6.165 -15.943 1.00 0.49 H new ATOM 0 HG12 VAL B 88 -17.086 6.226 -15.598 1.00 0.49 H new ATOM 0 HG13 VAL B 88 -16.013 7.507 -14.986 1.00 0.49 H new ATOM 0 HG21 VAL B 88 -13.724 5.662 -14.151 1.00 0.68 H new ATOM 0 HG22 VAL B 88 -14.370 6.997 -13.168 1.00 0.68 H new ATOM 0 HG23 VAL B 88 -14.279 5.354 -12.489 1.00 0.68 H new ATOM 2950 N TYR B 89 -18.859 4.587 -12.678 1.00 0.33 N ATOM 2951 CA TYR B 89 -20.199 4.086 -13.085 1.00 0.39 C ATOM 2952 C TYR B 89 -20.853 3.361 -11.907 1.00 0.50 C ATOM 2953 O TYR B 89 -20.452 3.617 -10.784 1.00 1.12 O ATOM 2954 CB TYR B 89 -20.047 3.119 -14.261 1.00 0.41 C ATOM 2955 CG TYR B 89 -21.179 3.329 -15.238 1.00 0.54 C ATOM 2956 CD1 TYR B 89 -22.367 2.603 -15.098 1.00 1.13 C ATOM 2957 CD2 TYR B 89 -21.039 4.249 -16.284 1.00 1.47 C ATOM 2958 CE1 TYR B 89 -23.417 2.797 -16.003 1.00 1.27 C ATOM 2959 CE2 TYR B 89 -22.089 4.443 -17.190 1.00 1.77 C ATOM 2960 CZ TYR B 89 -23.277 3.717 -17.050 1.00 1.26 C ATOM 2961 OH TYR B 89 -24.312 3.908 -17.943 1.00 1.66 O ATOM 2962 OXT TYR B 89 -21.742 2.562 -12.149 1.00 1.01 O ATOM 0 H TYR B 89 -18.449 4.122 -11.868 1.00 0.33 H new ATOM 0 HA TYR B 89 -20.825 4.926 -13.385 1.00 0.39 H new ATOM 0 HB2 TYR B 89 -19.090 3.281 -14.757 1.00 0.41 H new ATOM 0 HB3 TYR B 89 -20.049 2.090 -13.902 1.00 0.41 H new ATOM 0 HD1 TYR B 89 -22.474 1.893 -14.291 1.00 1.13 H new ATOM 0 HD2 TYR B 89 -20.122 4.809 -16.392 1.00 1.47 H new ATOM 0 HE1 TYR B 89 -24.334 2.238 -15.894 1.00 1.27 H new ATOM 0 HE2 TYR B 89 -21.982 5.153 -17.997 1.00 1.77 H new ATOM 0 HH TYR B 89 -24.052 4.581 -18.606 1.00 1.66 H new