USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1011 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 Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.187 X(o=-0.19,f=-0.18) USER MOD Single : A 15 MET CE :methyl -156:sc= -0.0284 (180deg=-0.366) USER MOD Single : A 25 LYS NZ :NH3+ 140:sc= -0.917 (180deg=-1.81!) USER MOD Single : A 26 ASN : amide:sc= -1.06 K(o=-1.1,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.884 K(o=-0.88,f=-0.081) USER MOD Single : A 36 TYR OH : rot 168:sc= -1.62 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -2.36 K(o=-2.4,f=-4.2!) USER MOD Single : A 46 THR OG1 : rot -72:sc= -0.389 USER MOD Single : A 49 LYS NZ :NH3+ -123:sc= -0.441 (180deg=-2.09!) USER MOD Single : A 53 SER OG : rot 100:sc= 0.197 USER MOD Single : A 60 SER OG : rot -49:sc= 0.177 USER MOD Single : A 63 SER OG : rot 61:sc= 0.613 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.0504 USER MOD Single : A 72 THR OG1 : rot 97:sc= 1.2 USER MOD Single : A 73 GLN : amide:sc= -2.21 K(o=-2.2,f=-7.2!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -1.26 K(o=-1.3,f=-0.01) USER MOD Single : A 86 LYS NZ :NH3+ -105:sc= -0.609 (180deg=-2.62!) USER MOD Single : A 87 MET CE :methyl -160:sc= -2.56 (180deg=-2.85) USER MOD Single : A 91 GLN : amide:sc= -1.45 K(o=-1.5,f=-6.9!) USER MOD Single : A 92 GLN : amide:sc= -4.65! C(o=-4.7!,f=-4.7!) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.0814 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ -117:sc= -0.21 (180deg=-1.53!) USER MOD Single : A 105 GLN : amide:sc= -0.413 X(o=-0.41,f=-0.4) USER MOD Single : A 106 MET CE :methyl 157:sc= -1.64 (180deg=-3.52!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.0159 USER MOD Single : A 110 SER OG : rot -93:sc= -1.48! USER MOD Single : A 111 HIS : no HD1:sc= -1.55 K(o=-1.6,f=-2.3) USER MOD Single : A 112 THR OG1 : rot -160:sc= -0.659 USER MOD Single : A 118 LYS NZ :NH3+ 155:sc= -0.11 (180deg=-0.9) USER MOD Single : A 119 ASN : amide:sc= -0.052 X(o=-0.052,f=-0.1) USER MOD Single : A 126 GLN : amide:sc= -0.0273 X(o=-0.027,f=0) USER MOD Single : A 128 LYS NZ :NH3+ -132:sc= -0.0679 (180deg=-1.95!) USER MOD ----------------------------------------------------------------- ATOM 106 N ASP A 8 17.856 -9.065 -9.092 1.00 61.44 N ATOM 107 CA ASP A 8 18.407 -10.410 -9.218 1.00 43.44 C ATOM 108 C ASP A 8 17.514 -11.283 -10.094 1.00 65.21 C ATOM 109 O ASP A 8 16.326 -11.449 -9.817 1.00 32.01 O ATOM 110 CB ASP A 8 18.571 -11.048 -7.838 1.00 61.23 C ATOM 111 CG ASP A 8 19.288 -12.383 -7.899 1.00 51.32 C ATOM 112 OD1 ASP A 8 20.208 -12.525 -8.732 1.00 2.22 O ATOM 113 OD2 ASP A 8 18.929 -13.285 -7.114 1.00 4.42 O ATOM 0 HA ASP A 8 19.386 -10.333 -9.692 1.00 43.44 H new ATOM 0 HB2 ASP A 8 19.127 -10.369 -7.191 1.00 61.23 H new ATOM 0 HB3 ASP A 8 17.589 -11.187 -7.386 1.00 61.23 H new ATOM 118 N LEU A 9 18.094 -11.839 -11.152 1.00 41.34 N ATOM 119 CA LEU A 9 17.351 -12.695 -12.070 1.00 70.03 C ATOM 120 C LEU A 9 17.658 -14.167 -11.811 1.00 54.42 C ATOM 121 O LEU A 9 17.397 -15.024 -12.656 1.00 4.14 O ATOM 122 CB LEU A 9 17.690 -12.339 -13.519 1.00 1.02 C ATOM 123 CG LEU A 9 19.109 -12.677 -13.978 1.00 52.15 C ATOM 124 CD1 LEU A 9 19.129 -12.983 -15.468 1.00 35.20 C ATOM 125 CD2 LEU A 9 20.061 -11.535 -13.654 1.00 53.23 C ATOM 0 H LEU A 9 19.076 -11.712 -11.395 1.00 41.34 H new ATOM 0 HA LEU A 9 16.287 -12.529 -11.901 1.00 70.03 H new ATOM 0 HB2 LEU A 9 16.986 -12.853 -14.173 1.00 1.02 H new ATOM 0 HB3 LEU A 9 17.530 -11.270 -13.656 1.00 1.02 H new ATOM 0 HG LEU A 9 19.442 -13.565 -13.441 1.00 52.15 H new ATOM 0 HD11 LEU A 9 20.147 -13.221 -15.777 1.00 35.20 H new ATOM 0 HD12 LEU A 9 18.479 -13.833 -15.674 1.00 35.20 H new ATOM 0 HD13 LEU A 9 18.776 -12.114 -16.023 1.00 35.20 H new ATOM 0 HD21 LEU A 9 21.066 -11.793 -13.988 1.00 53.23 H new ATOM 0 HD22 LEU A 9 19.731 -10.630 -14.164 1.00 53.23 H new ATOM 0 HD23 LEU A 9 20.069 -11.362 -12.578 1.00 53.23 H new ATOM 137 N VAL A 10 18.210 -14.453 -10.637 1.00 5.33 N ATOM 138 CA VAL A 10 18.550 -15.821 -10.264 1.00 75.04 C ATOM 139 C VAL A 10 17.413 -16.477 -9.488 1.00 4.34 C ATOM 140 O VAL A 10 17.184 -17.681 -9.600 1.00 65.33 O ATOM 141 CB VAL A 10 19.833 -15.870 -9.414 1.00 40.24 C ATOM 142 CG1 VAL A 10 20.143 -17.299 -8.996 1.00 73.12 C ATOM 143 CG2 VAL A 10 21.001 -15.264 -10.178 1.00 72.24 C ATOM 0 H VAL A 10 18.432 -13.755 -9.927 1.00 5.33 H new ATOM 0 HA VAL A 10 18.718 -16.369 -11.191 1.00 75.04 H new ATOM 0 HB VAL A 10 19.673 -15.280 -8.512 1.00 40.24 H new ATOM 0 HG11 VAL A 10 21.053 -17.313 -8.396 1.00 73.12 H new ATOM 0 HG12 VAL A 10 19.315 -17.694 -8.408 1.00 73.12 H new ATOM 0 HG13 VAL A 10 20.284 -17.915 -9.884 1.00 73.12 H new ATOM 0 HG21 VAL A 10 21.900 -15.307 -9.563 1.00 72.24 H new ATOM 0 HG22 VAL A 10 21.164 -15.825 -11.098 1.00 72.24 H new ATOM 0 HG23 VAL A 10 20.777 -14.225 -10.421 1.00 72.24 H new ATOM 153 N TYR A 11 16.704 -15.677 -8.700 1.00 1.54 N ATOM 154 CA TYR A 11 15.592 -16.179 -7.902 1.00 30.22 C ATOM 155 C TYR A 11 14.289 -16.133 -8.694 1.00 32.13 C ATOM 156 O TYR A 11 13.229 -16.508 -8.190 1.00 52.34 O ATOM 157 CB TYR A 11 15.449 -15.363 -6.616 1.00 25.10 C ATOM 158 CG TYR A 11 14.801 -14.013 -6.824 1.00 75.42 C ATOM 159 CD1 TYR A 11 13.419 -13.871 -6.779 1.00 41.30 C ATOM 160 CD2 TYR A 11 15.568 -12.881 -7.067 1.00 63.21 C ATOM 161 CE1 TYR A 11 12.822 -12.640 -6.969 1.00 55.34 C ATOM 162 CE2 TYR A 11 14.980 -11.646 -7.257 1.00 75.11 C ATOM 163 CZ TYR A 11 13.606 -11.530 -7.208 1.00 30.54 C ATOM 164 OH TYR A 11 13.016 -10.302 -7.398 1.00 34.12 O ATOM 0 H TYR A 11 16.880 -14.678 -8.597 1.00 1.54 H new ATOM 0 HA TYR A 11 15.803 -17.217 -7.644 1.00 30.22 H new ATOM 0 HB2 TYR A 11 14.859 -15.933 -5.898 1.00 25.10 H new ATOM 0 HB3 TYR A 11 16.436 -15.219 -6.175 1.00 25.10 H new ATOM 0 HD1 TYR A 11 12.802 -14.737 -6.592 1.00 41.30 H new ATOM 0 HD2 TYR A 11 16.644 -12.968 -7.108 1.00 63.21 H new ATOM 0 HE1 TYR A 11 11.747 -12.547 -6.931 1.00 55.34 H new ATOM 0 HE2 TYR A 11 15.592 -10.776 -7.443 1.00 75.11 H new ATOM 0 HH TYR A 11 13.709 -9.627 -7.553 1.00 34.12 H new ATOM 174 N LEU A 12 14.376 -15.672 -9.936 1.00 54.24 N ATOM 175 CA LEU A 12 13.204 -15.577 -10.801 1.00 2.42 C ATOM 176 C LEU A 12 12.939 -16.903 -11.506 1.00 51.43 C ATOM 177 O LEU A 12 11.857 -17.476 -11.385 1.00 24.13 O ATOM 178 CB LEU A 12 13.398 -14.466 -11.834 1.00 55.43 C ATOM 179 CG LEU A 12 12.702 -13.138 -11.531 1.00 30.12 C ATOM 180 CD1 LEU A 12 11.191 -13.302 -11.587 1.00 41.14 C ATOM 181 CD2 LEU A 12 13.132 -12.609 -10.170 1.00 64.24 C ATOM 0 H LEU A 12 15.245 -15.358 -10.368 1.00 54.24 H new ATOM 0 HA LEU A 12 12.341 -15.339 -10.179 1.00 2.42 H new ATOM 0 HB2 LEU A 12 14.466 -14.278 -11.939 1.00 55.43 H new ATOM 0 HB3 LEU A 12 13.042 -14.828 -12.799 1.00 55.43 H new ATOM 0 HG LEU A 12 12.997 -12.414 -12.290 1.00 30.12 H new ATOM 0 HD11 LEU A 12 10.713 -12.347 -11.369 1.00 41.14 H new ATOM 0 HD12 LEU A 12 10.898 -13.635 -12.582 1.00 41.14 H new ATOM 0 HD13 LEU A 12 10.878 -14.041 -10.850 1.00 41.14 H new ATOM 0 HD21 LEU A 12 12.627 -11.664 -9.971 1.00 64.24 H new ATOM 0 HD22 LEU A 12 12.867 -13.332 -9.398 1.00 64.24 H new ATOM 0 HD23 LEU A 12 14.211 -12.452 -10.165 1.00 64.24 H new ATOM 193 N ASN A 13 13.935 -17.385 -12.243 1.00 12.14 N ATOM 194 CA ASN A 13 13.810 -18.645 -12.967 1.00 14.35 C ATOM 195 C ASN A 13 13.626 -19.811 -12.001 1.00 35.25 C ATOM 196 O ASN A 13 12.721 -20.630 -12.164 1.00 51.00 O ATOM 197 CB ASN A 13 15.044 -18.880 -13.839 1.00 61.41 C ATOM 198 CG ASN A 13 15.493 -17.623 -14.558 1.00 13.31 C ATOM 199 OD1 ASN A 13 16.672 -17.271 -14.540 1.00 65.50 O ATOM 200 ND2 ASN A 13 14.550 -16.938 -15.195 1.00 43.33 N ATOM 0 H ASN A 13 14.837 -16.922 -12.354 1.00 12.14 H new ATOM 0 HA ASN A 13 12.929 -18.583 -13.606 1.00 14.35 H new ATOM 0 HB2 ASN A 13 15.859 -19.250 -13.217 1.00 61.41 H new ATOM 0 HB3 ASN A 13 14.825 -19.656 -14.572 1.00 61.41 H new ATOM 0 HD21 ASN A 13 14.791 -16.083 -15.696 1.00 43.33 H new ATOM 0 HD22 ASN A 13 13.585 -17.267 -15.183 1.00 43.33 H new ATOM 207 N VAL A 14 14.490 -19.880 -10.993 1.00 32.01 N ATOM 208 CA VAL A 14 14.422 -20.945 -9.999 1.00 41.30 C ATOM 209 C VAL A 14 13.022 -21.053 -9.405 1.00 25.35 C ATOM 210 O VAL A 14 12.599 -22.128 -8.981 1.00 71.41 O ATOM 211 CB VAL A 14 15.435 -20.716 -8.861 1.00 52.34 C ATOM 212 CG1 VAL A 14 14.959 -19.605 -7.938 1.00 14.21 C ATOM 213 CG2 VAL A 14 15.664 -22.004 -8.085 1.00 51.23 C ATOM 0 H VAL A 14 15.245 -19.211 -10.843 1.00 32.01 H new ATOM 0 HA VAL A 14 14.668 -21.874 -10.513 1.00 41.30 H new ATOM 0 HB VAL A 14 16.385 -20.409 -9.299 1.00 52.34 H new ATOM 0 HG11 VAL A 14 15.687 -19.458 -7.140 1.00 14.21 H new ATOM 0 HG12 VAL A 14 14.851 -18.681 -8.506 1.00 14.21 H new ATOM 0 HG13 VAL A 14 13.997 -19.879 -7.505 1.00 14.21 H new ATOM 0 HG21 VAL A 14 16.382 -21.824 -7.285 1.00 51.23 H new ATOM 0 HG22 VAL A 14 14.721 -22.343 -7.656 1.00 51.23 H new ATOM 0 HG23 VAL A 14 16.053 -22.769 -8.757 1.00 51.23 H new ATOM 223 N MET A 15 12.309 -19.933 -9.377 1.00 13.42 N ATOM 224 CA MET A 15 10.955 -19.902 -8.835 1.00 70.54 C ATOM 225 C MET A 15 10.026 -20.802 -9.644 1.00 72.03 C ATOM 226 O MET A 15 9.155 -21.470 -9.088 1.00 0.34 O ATOM 227 CB MET A 15 10.418 -18.470 -8.828 1.00 33.05 C ATOM 228 CG MET A 15 9.140 -18.305 -8.021 1.00 10.32 C ATOM 229 SD MET A 15 7.835 -17.476 -8.949 1.00 1.43 S ATOM 230 CE MET A 15 8.642 -15.930 -9.361 1.00 31.53 C ATOM 0 H MET A 15 12.645 -19.034 -9.723 1.00 13.42 H new ATOM 0 HA MET A 15 10.991 -20.273 -7.811 1.00 70.54 H new ATOM 0 HB2 MET A 15 11.182 -17.806 -8.423 1.00 33.05 H new ATOM 0 HB3 MET A 15 10.233 -18.155 -9.855 1.00 33.05 H new ATOM 0 HG2 MET A 15 8.787 -19.286 -7.702 1.00 10.32 H new ATOM 0 HG3 MET A 15 9.356 -17.735 -7.118 1.00 10.32 H new ATOM 0 HE1 MET A 15 7.889 -15.163 -9.541 1.00 31.53 H new ATOM 0 HE2 MET A 15 9.283 -15.622 -8.535 1.00 31.53 H new ATOM 0 HE3 MET A 15 9.246 -16.063 -10.258 1.00 31.53 H new ATOM 240 N GLU A 16 10.218 -20.814 -10.960 1.00 13.53 N ATOM 241 CA GLU A 16 9.395 -21.631 -11.844 1.00 0.31 C ATOM 242 C GLU A 16 9.657 -23.116 -11.612 1.00 70.10 C ATOM 243 O GLU A 16 8.765 -23.949 -11.778 1.00 14.13 O ATOM 244 CB GLU A 16 9.670 -21.275 -13.306 1.00 65.34 C ATOM 245 CG GLU A 16 9.147 -19.907 -13.709 1.00 41.12 C ATOM 246 CD GLU A 16 9.293 -19.640 -15.195 1.00 23.42 C ATOM 247 OE1 GLU A 16 9.099 -20.584 -15.989 1.00 53.23 O ATOM 248 OE2 GLU A 16 9.602 -18.487 -15.562 1.00 63.55 O ATOM 0 H GLU A 16 10.936 -20.268 -11.437 1.00 13.53 H new ATOM 0 HA GLU A 16 8.349 -21.425 -11.618 1.00 0.31 H new ATOM 0 HB2 GLU A 16 10.745 -21.310 -13.484 1.00 65.34 H new ATOM 0 HB3 GLU A 16 9.216 -22.031 -13.947 1.00 65.34 H new ATOM 0 HG2 GLU A 16 8.096 -19.828 -13.431 1.00 41.12 H new ATOM 0 HG3 GLU A 16 9.683 -19.139 -13.151 1.00 41.12 H new ATOM 255 N LEU A 17 10.887 -23.441 -11.228 1.00 54.15 N ATOM 256 CA LEU A 17 11.268 -24.826 -10.974 1.00 11.21 C ATOM 257 C LEU A 17 10.621 -25.342 -9.692 1.00 42.15 C ATOM 258 O LEU A 17 10.011 -26.411 -9.680 1.00 12.04 O ATOM 259 CB LEU A 17 12.790 -24.947 -10.875 1.00 54.42 C ATOM 260 CG LEU A 17 13.351 -26.369 -10.864 1.00 73.00 C ATOM 261 CD1 LEU A 17 14.793 -26.378 -11.345 1.00 4.52 C ATOM 262 CD2 LEU A 17 13.247 -26.972 -9.471 1.00 24.13 C ATOM 0 H LEU A 17 11.637 -22.764 -11.086 1.00 54.15 H new ATOM 0 HA LEU A 17 10.915 -25.433 -11.808 1.00 11.21 H new ATOM 0 HB2 LEU A 17 13.232 -24.410 -11.714 1.00 54.42 H new ATOM 0 HB3 LEU A 17 13.116 -24.442 -9.966 1.00 54.42 H new ATOM 0 HG LEU A 17 12.759 -26.978 -11.547 1.00 73.00 H new ATOM 0 HD11 LEU A 17 15.175 -27.399 -11.330 1.00 4.52 H new ATOM 0 HD12 LEU A 17 14.840 -25.988 -12.362 1.00 4.52 H new ATOM 0 HD13 LEU A 17 15.399 -25.754 -10.688 1.00 4.52 H new ATOM 0 HD21 LEU A 17 13.651 -27.984 -9.482 1.00 24.13 H new ATOM 0 HD22 LEU A 17 13.814 -26.362 -8.767 1.00 24.13 H new ATOM 0 HD23 LEU A 17 12.201 -27.002 -9.165 1.00 24.13 H new ATOM 274 N VAL A 18 10.758 -24.574 -8.616 1.00 75.00 N ATOM 275 CA VAL A 18 10.184 -24.952 -7.330 1.00 11.41 C ATOM 276 C VAL A 18 8.691 -25.233 -7.455 1.00 53.44 C ATOM 277 O VAL A 18 8.124 -25.994 -6.672 1.00 20.33 O ATOM 278 CB VAL A 18 10.401 -23.852 -6.274 1.00 1.22 C ATOM 279 CG1 VAL A 18 9.940 -24.327 -4.905 1.00 31.44 C ATOM 280 CG2 VAL A 18 11.862 -23.431 -6.237 1.00 4.43 C ATOM 0 H VAL A 18 11.261 -23.687 -8.609 1.00 75.00 H new ATOM 0 HA VAL A 18 10.696 -25.860 -7.010 1.00 11.41 H new ATOM 0 HB VAL A 18 9.803 -22.984 -6.551 1.00 1.22 H new ATOM 0 HG11 VAL A 18 10.101 -23.536 -4.172 1.00 31.44 H new ATOM 0 HG12 VAL A 18 8.879 -24.575 -4.944 1.00 31.44 H new ATOM 0 HG13 VAL A 18 10.509 -25.211 -4.616 1.00 31.44 H new ATOM 0 HG21 VAL A 18 11.998 -22.653 -5.486 1.00 4.43 H new ATOM 0 HG22 VAL A 18 12.482 -24.291 -5.985 1.00 4.43 H new ATOM 0 HG23 VAL A 18 12.155 -23.047 -7.214 1.00 4.43 H new ATOM 290 N ARG A 19 8.059 -24.613 -8.447 1.00 11.22 N ATOM 291 CA ARG A 19 6.631 -24.796 -8.675 1.00 14.50 C ATOM 292 C ARG A 19 6.371 -26.027 -9.538 1.00 41.22 C ATOM 293 O ARG A 19 5.533 -26.864 -9.206 1.00 72.22 O ATOM 294 CB ARG A 19 6.037 -23.555 -9.345 1.00 73.23 C ATOM 295 CG ARG A 19 4.587 -23.295 -8.970 1.00 71.51 C ATOM 296 CD ARG A 19 3.631 -23.965 -9.944 1.00 73.44 C ATOM 297 NE ARG A 19 2.355 -24.299 -9.317 1.00 72.21 N ATOM 298 CZ ARG A 19 1.511 -25.202 -9.803 1.00 71.53 C ATOM 299 NH1 ARG A 19 1.806 -25.859 -10.917 1.00 23.04 N ATOM 300 NH2 ARG A 19 0.369 -25.451 -9.175 1.00 52.11 N ATOM 0 H ARG A 19 8.514 -23.980 -9.105 1.00 11.22 H new ATOM 0 HA ARG A 19 6.150 -24.944 -7.708 1.00 14.50 H new ATOM 0 HB2 ARG A 19 6.635 -22.685 -9.074 1.00 73.23 H new ATOM 0 HB3 ARG A 19 6.109 -23.667 -10.427 1.00 73.23 H new ATOM 0 HG2 ARG A 19 4.399 -23.664 -7.962 1.00 71.51 H new ATOM 0 HG3 ARG A 19 4.401 -22.221 -8.956 1.00 71.51 H new ATOM 0 HD2 ARG A 19 3.456 -23.304 -10.793 1.00 73.44 H new ATOM 0 HD3 ARG A 19 4.090 -24.872 -10.337 1.00 73.44 H new ATOM 0 HE ARG A 19 2.098 -23.812 -8.459 1.00 72.21 H new ATOM 0 HH11 ARG A 19 2.683 -25.671 -11.403 1.00 23.04 H new ATOM 0 HH12 ARG A 19 1.156 -26.552 -11.288 1.00 23.04 H new ATOM 0 HH21 ARG A 19 0.138 -24.949 -8.318 1.00 52.11 H new ATOM 0 HH22 ARG A 19 -0.278 -26.145 -9.549 1.00 52.11 H new ATOM 314 N ALA A 20 7.096 -26.129 -10.647 1.00 51.24 N ATOM 315 CA ALA A 20 6.945 -27.258 -11.557 1.00 43.42 C ATOM 316 C ALA A 20 7.350 -28.564 -10.883 1.00 33.13 C ATOM 317 O ALA A 20 6.906 -29.642 -11.279 1.00 22.25 O ATOM 318 CB ALA A 20 7.770 -27.034 -12.816 1.00 74.34 C ATOM 0 H ALA A 20 7.794 -25.444 -10.937 1.00 51.24 H new ATOM 0 HA ALA A 20 5.893 -27.333 -11.833 1.00 43.42 H new ATOM 0 HB1 ALA A 20 7.648 -27.884 -13.487 1.00 74.34 H new ATOM 0 HB2 ALA A 20 7.432 -26.126 -13.316 1.00 74.34 H new ATOM 0 HB3 ALA A 20 8.822 -26.931 -12.548 1.00 74.34 H new ATOM 324 N VAL A 21 8.195 -28.461 -9.862 1.00 41.11 N ATOM 325 CA VAL A 21 8.659 -29.635 -9.132 1.00 42.41 C ATOM 326 C VAL A 21 7.757 -29.933 -7.940 1.00 75.03 C ATOM 327 O VAL A 21 7.759 -31.044 -7.408 1.00 72.05 O ATOM 328 CB VAL A 21 10.105 -29.450 -8.634 1.00 31.23 C ATOM 329 CG1 VAL A 21 10.166 -28.379 -7.555 1.00 75.14 C ATOM 330 CG2 VAL A 21 10.663 -30.769 -8.119 1.00 51.52 C ATOM 0 H VAL A 21 8.572 -27.577 -9.522 1.00 41.11 H new ATOM 0 HA VAL A 21 8.626 -30.474 -9.827 1.00 42.41 H new ATOM 0 HB VAL A 21 10.720 -29.123 -9.472 1.00 31.23 H new ATOM 0 HG11 VAL A 21 11.195 -28.263 -7.216 1.00 75.14 H new ATOM 0 HG12 VAL A 21 9.809 -27.433 -7.961 1.00 75.14 H new ATOM 0 HG13 VAL A 21 9.538 -28.673 -6.714 1.00 75.14 H new ATOM 0 HG21 VAL A 21 11.685 -30.621 -7.771 1.00 51.52 H new ATOM 0 HG22 VAL A 21 10.047 -31.127 -7.294 1.00 51.52 H new ATOM 0 HG23 VAL A 21 10.657 -31.505 -8.923 1.00 51.52 H new ATOM 340 N LEU A 22 6.985 -28.935 -7.525 1.00 52.43 N ATOM 341 CA LEU A 22 6.075 -29.090 -6.396 1.00 10.55 C ATOM 342 C LEU A 22 4.778 -29.764 -6.830 1.00 14.04 C ATOM 343 O LEU A 22 4.105 -30.411 -6.028 1.00 25.34 O ATOM 344 CB LEU A 22 5.770 -27.727 -5.770 1.00 65.21 C ATOM 345 CG LEU A 22 4.657 -27.704 -4.722 1.00 4.51 C ATOM 346 CD1 LEU A 22 5.031 -28.566 -3.527 1.00 24.24 C ATOM 347 CD2 LEU A 22 4.369 -26.276 -4.282 1.00 43.51 C ATOM 0 H LEU A 22 6.971 -28.010 -7.954 1.00 52.43 H new ATOM 0 HA LEU A 22 6.561 -29.723 -5.654 1.00 10.55 H new ATOM 0 HB2 LEU A 22 6.683 -27.348 -5.310 1.00 65.21 H new ATOM 0 HB3 LEU A 22 5.504 -27.034 -6.568 1.00 65.21 H new ATOM 0 HG LEU A 22 3.753 -28.115 -5.171 1.00 4.51 H new ATOM 0 HD11 LEU A 22 4.227 -28.537 -2.792 1.00 24.24 H new ATOM 0 HD12 LEU A 22 5.187 -29.594 -3.854 1.00 24.24 H new ATOM 0 HD13 LEU A 22 5.948 -28.186 -3.077 1.00 24.24 H new ATOM 0 HD21 LEU A 22 3.574 -26.278 -3.536 1.00 43.51 H new ATOM 0 HD22 LEU A 22 5.270 -25.839 -3.851 1.00 43.51 H new ATOM 0 HD23 LEU A 22 4.056 -25.686 -5.143 1.00 43.51 H new ATOM 359 N GLU A 23 4.434 -29.609 -8.104 1.00 54.13 N ATOM 360 CA GLU A 23 3.217 -30.205 -8.645 1.00 3.54 C ATOM 361 C GLU A 23 3.373 -31.715 -8.799 1.00 0.34 C ATOM 362 O GLU A 23 2.411 -32.469 -8.645 1.00 51.50 O ATOM 363 CB GLU A 23 2.872 -29.576 -9.996 1.00 52.01 C ATOM 364 CG GLU A 23 4.022 -29.597 -10.989 1.00 32.10 C ATOM 365 CD GLU A 23 3.609 -29.127 -12.370 1.00 73.23 C ATOM 366 OE1 GLU A 23 3.107 -29.959 -13.155 1.00 43.22 O ATOM 367 OE2 GLU A 23 3.787 -27.927 -12.666 1.00 11.12 O ATOM 0 H GLU A 23 4.980 -29.076 -8.781 1.00 54.13 H new ATOM 0 HA GLU A 23 2.405 -30.011 -7.944 1.00 3.54 H new ATOM 0 HB2 GLU A 23 2.022 -30.105 -10.427 1.00 52.01 H new ATOM 0 HB3 GLU A 23 2.559 -28.544 -9.837 1.00 52.01 H new ATOM 0 HG2 GLU A 23 4.828 -28.963 -10.619 1.00 32.10 H new ATOM 0 HG3 GLU A 23 4.419 -30.610 -11.058 1.00 32.10 H new ATOM 374 N LEU A 24 4.591 -32.150 -9.103 1.00 54.35 N ATOM 375 CA LEU A 24 4.874 -33.570 -9.279 1.00 51.03 C ATOM 376 C LEU A 24 5.042 -34.263 -7.931 1.00 2.43 C ATOM 377 O LEU A 24 5.242 -35.476 -7.864 1.00 44.40 O ATOM 378 CB LEU A 24 6.136 -33.758 -10.123 1.00 11.20 C ATOM 379 CG LEU A 24 7.465 -33.652 -9.375 1.00 3.40 C ATOM 380 CD1 LEU A 24 7.913 -35.020 -8.884 1.00 54.15 C ATOM 381 CD2 LEU A 24 8.530 -33.028 -10.266 1.00 21.04 C ATOM 0 H LEU A 24 5.398 -31.540 -9.233 1.00 54.35 H new ATOM 0 HA LEU A 24 4.028 -34.022 -9.796 1.00 51.03 H new ATOM 0 HB2 LEU A 24 6.087 -34.737 -10.600 1.00 11.20 H new ATOM 0 HB3 LEU A 24 6.130 -33.014 -10.920 1.00 11.20 H new ATOM 0 HG LEU A 24 7.321 -33.007 -8.508 1.00 3.40 H new ATOM 0 HD11 LEU A 24 8.861 -34.924 -8.354 1.00 54.15 H new ATOM 0 HD12 LEU A 24 7.160 -35.429 -8.210 1.00 54.15 H new ATOM 0 HD13 LEU A 24 8.040 -35.689 -9.735 1.00 54.15 H new ATOM 0 HD21 LEU A 24 9.469 -32.960 -9.717 1.00 21.04 H new ATOM 0 HD22 LEU A 24 8.671 -33.647 -11.152 1.00 21.04 H new ATOM 0 HD23 LEU A 24 8.213 -32.030 -10.567 1.00 21.04 H new ATOM 393 N LYS A 25 4.958 -33.484 -6.857 1.00 73.41 N ATOM 394 CA LYS A 25 5.097 -34.022 -5.509 1.00 31.00 C ATOM 395 C LYS A 25 3.744 -34.457 -4.954 1.00 63.45 C ATOM 396 O LYS A 25 3.674 -35.251 -4.017 1.00 12.53 O ATOM 397 CB LYS A 25 5.727 -32.978 -4.584 1.00 61.31 C ATOM 398 CG LYS A 25 7.245 -32.952 -4.641 1.00 33.42 C ATOM 399 CD LYS A 25 7.816 -31.832 -3.788 1.00 53.11 C ATOM 400 CE LYS A 25 7.485 -32.028 -2.316 1.00 41.44 C ATOM 401 NZ LYS A 25 6.195 -31.381 -1.947 1.00 25.12 N ATOM 0 H LYS A 25 4.794 -32.478 -6.894 1.00 73.41 H new ATOM 0 HA LYS A 25 5.747 -34.895 -5.559 1.00 31.00 H new ATOM 0 HB2 LYS A 25 5.345 -31.992 -4.849 1.00 61.31 H new ATOM 0 HB3 LYS A 25 5.414 -33.176 -3.559 1.00 61.31 H new ATOM 0 HG2 LYS A 25 7.639 -33.909 -4.298 1.00 33.42 H new ATOM 0 HG3 LYS A 25 7.569 -32.825 -5.674 1.00 33.42 H new ATOM 0 HD2 LYS A 25 8.898 -31.791 -3.916 1.00 53.11 H new ATOM 0 HD3 LYS A 25 7.418 -30.876 -4.127 1.00 53.11 H new ATOM 0 HE2 LYS A 25 7.433 -33.094 -2.094 1.00 41.44 H new ATOM 0 HE3 LYS A 25 8.287 -31.614 -1.705 1.00 41.44 H new ATOM 0 HZ1 LYS A 25 5.672 -31.997 -1.293 1.00 25.12 H new ATOM 0 HZ2 LYS A 25 6.384 -30.468 -1.486 1.00 25.12 H new ATOM 0 HZ3 LYS A 25 5.627 -31.225 -2.804 1.00 25.12 H new ATOM 415 N ASN A 26 2.673 -33.934 -5.542 1.00 31.23 N ATOM 416 CA ASN A 26 1.322 -34.270 -5.106 1.00 61.14 C ATOM 417 C ASN A 26 0.631 -35.171 -6.125 1.00 33.41 C ATOM 418 O ASN A 26 -0.275 -35.931 -5.782 1.00 4.21 O ATOM 419 CB ASN A 26 0.501 -32.997 -4.895 1.00 14.21 C ATOM 420 CG ASN A 26 0.694 -32.407 -3.511 1.00 60.12 C ATOM 421 OD1 ASN A 26 -0.270 -32.029 -2.845 1.00 61.11 O ATOM 422 ND2 ASN A 26 1.945 -32.326 -3.072 1.00 52.35 N ATOM 0 H ASN A 26 2.714 -33.277 -6.321 1.00 31.23 H new ATOM 0 HA ASN A 26 1.395 -34.808 -4.161 1.00 61.14 H new ATOM 0 HB2 ASN A 26 0.783 -32.258 -5.645 1.00 14.21 H new ATOM 0 HB3 ASN A 26 -0.555 -33.219 -5.048 1.00 14.21 H new ATOM 0 HD21 ASN A 26 2.137 -31.938 -2.148 1.00 52.35 H new ATOM 0 HD22 ASN A 26 2.713 -32.652 -3.658 1.00 52.35 H new ATOM 429 N GLU A 27 1.065 -35.081 -7.378 1.00 61.20 N ATOM 430 CA GLU A 27 0.487 -35.889 -8.446 1.00 44.30 C ATOM 431 C GLU A 27 1.068 -37.300 -8.436 1.00 42.21 C ATOM 432 O GLU A 27 0.627 -38.170 -9.188 1.00 64.20 O ATOM 433 CB GLU A 27 0.738 -35.232 -9.805 1.00 3.30 C ATOM 434 CG GLU A 27 -0.320 -34.212 -10.193 1.00 24.23 C ATOM 435 CD GLU A 27 -1.489 -34.836 -10.929 1.00 62.25 C ATOM 436 OE1 GLU A 27 -1.456 -36.063 -11.162 1.00 41.25 O ATOM 437 OE2 GLU A 27 -2.436 -34.099 -11.273 1.00 40.32 O ATOM 0 H GLU A 27 1.814 -34.457 -7.679 1.00 61.20 H new ATOM 0 HA GLU A 27 -0.587 -35.956 -8.275 1.00 44.30 H new ATOM 0 HB2 GLU A 27 1.712 -34.744 -9.789 1.00 3.30 H new ATOM 0 HB3 GLU A 27 0.782 -36.006 -10.571 1.00 3.30 H new ATOM 0 HG2 GLU A 27 -0.685 -33.713 -9.295 1.00 24.23 H new ATOM 0 HG3 GLU A 27 0.133 -33.445 -10.822 1.00 24.23 H new ATOM 444 N LEU A 28 2.060 -37.519 -7.580 1.00 10.10 N ATOM 445 CA LEU A 28 2.703 -38.824 -7.471 1.00 53.13 C ATOM 446 C LEU A 28 1.667 -39.926 -7.273 1.00 22.15 C ATOM 447 O LEU A 28 1.772 -41.003 -7.859 1.00 71.12 O ATOM 448 CB LEU A 28 3.699 -38.829 -6.310 1.00 53.23 C ATOM 449 CG LEU A 28 4.839 -39.842 -6.409 1.00 24.32 C ATOM 450 CD1 LEU A 28 4.297 -41.262 -6.363 1.00 22.41 C ATOM 451 CD2 LEU A 28 5.644 -39.618 -7.681 1.00 2.44 C ATOM 0 H LEU A 28 2.437 -36.810 -6.951 1.00 10.10 H new ATOM 0 HA LEU A 28 3.238 -39.017 -8.401 1.00 53.13 H new ATOM 0 HB2 LEU A 28 4.132 -37.832 -6.224 1.00 53.23 H new ATOM 0 HB3 LEU A 28 3.150 -39.019 -5.387 1.00 53.23 H new ATOM 0 HG LEU A 28 5.500 -39.699 -5.555 1.00 24.32 H new ATOM 0 HD11 LEU A 28 5.123 -41.969 -6.435 1.00 22.41 H new ATOM 0 HD12 LEU A 28 3.766 -41.418 -5.424 1.00 22.41 H new ATOM 0 HD13 LEU A 28 3.613 -41.418 -7.197 1.00 22.41 H new ATOM 0 HD21 LEU A 28 6.451 -40.349 -7.734 1.00 2.44 H new ATOM 0 HD22 LEU A 28 4.994 -39.732 -8.548 1.00 2.44 H new ATOM 0 HD23 LEU A 28 6.065 -38.612 -7.673 1.00 2.44 H new ATOM 463 N SER A 29 0.667 -39.648 -6.443 1.00 35.21 N ATOM 464 CA SER A 29 -0.388 -40.617 -6.165 1.00 42.45 C ATOM 465 C SER A 29 -1.616 -40.345 -7.029 1.00 62.12 C ATOM 466 O SER A 29 -2.748 -40.407 -6.552 1.00 55.11 O ATOM 467 CB SER A 29 -0.772 -40.574 -4.685 1.00 41.02 C ATOM 468 OG SER A 29 -1.253 -41.833 -4.247 1.00 1.33 O ATOM 0 H SER A 29 0.565 -38.760 -5.951 1.00 35.21 H new ATOM 0 HA SER A 29 -0.008 -41.610 -6.406 1.00 42.45 H new ATOM 0 HB2 SER A 29 0.094 -40.285 -4.090 1.00 41.02 H new ATOM 0 HB3 SER A 29 -1.537 -39.814 -4.526 1.00 41.02 H new ATOM 0 HG SER A 29 -1.490 -41.780 -3.298 1.00 1.33 H new ATOM 474 N GLN A 30 -1.381 -40.044 -8.302 1.00 71.54 N ATOM 475 CA GLN A 30 -2.468 -39.763 -9.233 1.00 43.30 C ATOM 476 C GLN A 30 -2.220 -40.436 -10.579 1.00 32.12 C ATOM 477 O GLN A 30 -2.876 -41.420 -10.922 1.00 72.45 O ATOM 478 CB GLN A 30 -2.624 -38.253 -9.426 1.00 21.33 C ATOM 479 CG GLN A 30 -3.792 -37.659 -8.656 1.00 33.33 C ATOM 480 CD GLN A 30 -3.484 -36.285 -8.095 1.00 43.14 C ATOM 481 OE1 GLN A 30 -3.929 -35.269 -8.631 1.00 24.30 O ATOM 482 NE2 GLN A 30 -2.718 -36.245 -7.011 1.00 71.52 N ATOM 0 H GLN A 30 -0.449 -39.988 -8.712 1.00 71.54 H new ATOM 0 HA GLN A 30 -3.388 -40.166 -8.810 1.00 43.30 H new ATOM 0 HB2 GLN A 30 -1.704 -37.758 -9.114 1.00 21.33 H new ATOM 0 HB3 GLN A 30 -2.755 -38.042 -10.487 1.00 21.33 H new ATOM 0 HG2 GLN A 30 -4.659 -37.593 -9.313 1.00 33.33 H new ATOM 0 HG3 GLN A 30 -4.062 -38.328 -7.839 1.00 33.33 H new ATOM 0 HE21 GLN A 30 -2.371 -37.111 -6.600 1.00 71.52 H new ATOM 0 HE22 GLN A 30 -2.477 -35.348 -6.590 1.00 71.52 H new ATOM 491 N LEU A 31 -1.271 -39.900 -11.337 1.00 45.22 N ATOM 492 CA LEU A 31 -0.936 -40.449 -12.647 1.00 11.32 C ATOM 493 C LEU A 31 0.268 -41.380 -12.555 1.00 61.52 C ATOM 494 O LEU A 31 1.060 -41.321 -11.614 1.00 74.40 O ATOM 495 CB LEU A 31 -0.647 -39.319 -13.637 1.00 0.24 C ATOM 496 CG LEU A 31 -1.867 -38.681 -14.302 1.00 40.00 C ATOM 497 CD1 LEU A 31 -1.454 -37.471 -15.125 1.00 52.33 C ATOM 498 CD2 LEU A 31 -2.593 -39.697 -15.172 1.00 24.45 C ATOM 0 H LEU A 31 -0.719 -39.086 -11.068 1.00 45.22 H new ATOM 0 HA LEU A 31 -1.791 -41.025 -13.002 1.00 11.32 H new ATOM 0 HB2 LEU A 31 -0.093 -38.539 -13.115 1.00 0.24 H new ATOM 0 HB3 LEU A 31 0.007 -39.706 -14.418 1.00 0.24 H new ATOM 0 HG LEU A 31 -2.550 -38.348 -13.521 1.00 40.00 H new ATOM 0 HD11 LEU A 31 -2.335 -37.030 -15.591 1.00 52.33 H new ATOM 0 HD12 LEU A 31 -0.979 -36.735 -14.476 1.00 52.33 H new ATOM 0 HD13 LEU A 31 -0.751 -37.780 -15.899 1.00 52.33 H new ATOM 0 HD21 LEU A 31 -3.458 -39.225 -15.637 1.00 24.45 H new ATOM 0 HD22 LEU A 31 -1.918 -40.061 -15.947 1.00 24.45 H new ATOM 0 HD23 LEU A 31 -2.923 -40.534 -14.556 1.00 24.45 H new ATOM 510 N PRO A 32 0.413 -42.261 -13.557 1.00 11.13 N ATOM 511 CA PRO A 32 1.520 -43.220 -13.614 1.00 31.24 C ATOM 512 C PRO A 32 2.860 -42.544 -13.884 1.00 13.04 C ATOM 513 O PRO A 32 2.928 -41.368 -14.242 1.00 32.03 O ATOM 514 CB PRO A 32 1.137 -44.134 -14.780 1.00 65.42 C ATOM 515 CG PRO A 32 0.257 -43.299 -15.643 1.00 54.34 C ATOM 516 CD PRO A 32 -0.493 -42.387 -14.711 1.00 64.30 C ATOM 0 HA PRO A 32 1.653 -43.746 -12.668 1.00 31.24 H new ATOM 0 HB2 PRO A 32 2.019 -44.472 -15.324 1.00 65.42 H new ATOM 0 HB3 PRO A 32 0.617 -45.026 -14.430 1.00 65.42 H new ATOM 0 HG2 PRO A 32 0.844 -42.726 -16.361 1.00 54.34 H new ATOM 0 HG3 PRO A 32 -0.430 -43.921 -16.217 1.00 54.34 H new ATOM 0 HD2 PRO A 32 -0.695 -41.420 -15.171 1.00 64.30 H new ATOM 0 HD3 PRO A 32 -1.455 -42.810 -14.422 1.00 64.30 H new ATOM 524 N PRO A 33 3.952 -43.302 -13.709 1.00 61.53 N ATOM 525 CA PRO A 33 5.310 -42.797 -13.930 1.00 3.01 C ATOM 526 C PRO A 33 5.602 -42.543 -15.405 1.00 71.50 C ATOM 527 O PRO A 33 6.549 -41.837 -15.747 1.00 4.44 O ATOM 528 CB PRO A 33 6.199 -43.923 -13.395 1.00 10.41 C ATOM 529 CG PRO A 33 5.365 -45.152 -13.512 1.00 3.40 C ATOM 530 CD PRO A 33 3.945 -44.712 -13.284 1.00 24.22 C ATOM 0 HA PRO A 33 5.472 -41.837 -13.439 1.00 3.01 H new ATOM 0 HB2 PRO A 33 7.118 -44.011 -13.975 1.00 10.41 H new ATOM 0 HB3 PRO A 33 6.491 -43.740 -12.361 1.00 10.41 H new ATOM 0 HG2 PRO A 33 5.479 -45.609 -14.495 1.00 3.40 H new ATOM 0 HG3 PRO A 33 5.665 -45.899 -12.777 1.00 3.40 H new ATOM 0 HD2 PRO A 33 3.242 -45.305 -13.869 1.00 24.22 H new ATOM 0 HD3 PRO A 33 3.655 -44.815 -12.238 1.00 24.22 H new ATOM 538 N GLU A 34 4.781 -43.125 -16.274 1.00 41.23 N ATOM 539 CA GLU A 34 4.953 -42.961 -17.713 1.00 52.01 C ATOM 540 C GLU A 34 4.786 -41.499 -18.118 1.00 20.20 C ATOM 541 O GLU A 34 5.414 -41.031 -19.067 1.00 12.03 O ATOM 542 CB GLU A 34 3.947 -43.830 -18.471 1.00 51.53 C ATOM 543 CG GLU A 34 3.950 -43.595 -19.973 1.00 22.24 C ATOM 544 CD GLU A 34 5.250 -44.022 -20.627 1.00 32.32 C ATOM 545 OE1 GLU A 34 5.881 -44.976 -20.126 1.00 63.12 O ATOM 546 OE2 GLU A 34 5.635 -43.402 -21.640 1.00 71.23 O ATOM 0 H GLU A 34 3.992 -43.713 -16.007 1.00 41.23 H new ATOM 0 HA GLU A 34 5.963 -43.278 -17.971 1.00 52.01 H new ATOM 0 HB2 GLU A 34 4.166 -44.880 -18.275 1.00 51.53 H new ATOM 0 HB3 GLU A 34 2.947 -43.636 -18.083 1.00 51.53 H new ATOM 0 HG2 GLU A 34 3.123 -44.143 -20.425 1.00 22.24 H new ATOM 0 HG3 GLU A 34 3.778 -42.537 -20.172 1.00 22.24 H new ATOM 553 N GLY A 35 3.934 -40.783 -17.391 1.00 33.13 N ATOM 554 CA GLY A 35 3.698 -39.383 -17.689 1.00 44.52 C ATOM 555 C GLY A 35 4.655 -38.464 -16.954 1.00 72.53 C ATOM 556 O GLY A 35 4.862 -37.320 -17.359 1.00 23.30 O ATOM 0 H GLY A 35 3.403 -41.148 -16.600 1.00 33.13 H new ATOM 0 HA2 GLY A 35 3.797 -39.222 -18.762 1.00 44.52 H new ATOM 0 HA3 GLY A 35 2.673 -39.125 -17.421 1.00 44.52 H new ATOM 560 N TYR A 36 5.238 -38.965 -15.871 1.00 33.12 N ATOM 561 CA TYR A 36 6.174 -38.181 -15.075 1.00 43.51 C ATOM 562 C TYR A 36 7.521 -38.060 -15.781 1.00 43.13 C ATOM 563 O TYR A 36 8.253 -37.090 -15.586 1.00 43.50 O ATOM 564 CB TYR A 36 6.363 -38.817 -13.697 1.00 65.12 C ATOM 565 CG TYR A 36 5.585 -38.127 -12.600 1.00 21.54 C ATOM 566 CD1 TYR A 36 4.285 -37.687 -12.814 1.00 20.00 C ATOM 567 CD2 TYR A 36 6.150 -37.917 -11.347 1.00 71.35 C ATOM 568 CE1 TYR A 36 3.571 -37.056 -11.814 1.00 53.22 C ATOM 569 CE2 TYR A 36 5.442 -37.288 -10.341 1.00 64.33 C ATOM 570 CZ TYR A 36 4.154 -36.859 -10.580 1.00 15.04 C ATOM 571 OH TYR A 36 3.445 -36.232 -9.581 1.00 13.13 O ATOM 0 H TYR A 36 5.079 -39.911 -15.524 1.00 33.12 H new ATOM 0 HA TYR A 36 5.757 -37.181 -14.952 1.00 43.51 H new ATOM 0 HB2 TYR A 36 6.059 -39.863 -13.744 1.00 65.12 H new ATOM 0 HB3 TYR A 36 7.423 -38.804 -13.443 1.00 65.12 H new ATOM 0 HD1 TYR A 36 3.825 -37.841 -13.779 1.00 20.00 H new ATOM 0 HD2 TYR A 36 7.159 -38.251 -11.157 1.00 71.35 H new ATOM 0 HE1 TYR A 36 2.562 -36.719 -11.998 1.00 53.22 H new ATOM 0 HE2 TYR A 36 5.895 -37.133 -9.373 1.00 64.33 H new ATOM 0 HH TYR A 36 3.915 -36.341 -8.728 1.00 13.13 H new ATOM 581 N VAL A 37 7.842 -39.053 -16.604 1.00 73.42 N ATOM 582 CA VAL A 37 9.099 -39.060 -17.342 1.00 43.40 C ATOM 583 C VAL A 37 9.277 -37.770 -18.136 1.00 71.41 C ATOM 584 O VAL A 37 10.400 -37.330 -18.382 1.00 13.51 O ATOM 585 CB VAL A 37 9.179 -40.258 -18.306 1.00 34.41 C ATOM 586 CG1 VAL A 37 8.160 -40.112 -19.426 1.00 13.23 C ATOM 587 CG2 VAL A 37 10.585 -40.397 -18.869 1.00 1.15 C ATOM 0 H VAL A 37 7.248 -39.864 -16.776 1.00 73.42 H new ATOM 0 HA VAL A 37 9.898 -39.144 -16.605 1.00 43.40 H new ATOM 0 HB VAL A 37 8.944 -41.165 -17.749 1.00 34.41 H new ATOM 0 HG11 VAL A 37 8.232 -40.968 -20.097 1.00 13.23 H new ATOM 0 HG12 VAL A 37 7.157 -40.067 -19.002 1.00 13.23 H new ATOM 0 HG13 VAL A 37 8.360 -39.197 -19.983 1.00 13.23 H new ATOM 0 HG21 VAL A 37 10.622 -41.249 -19.548 1.00 1.15 H new ATOM 0 HG22 VAL A 37 10.852 -39.489 -19.410 1.00 1.15 H new ATOM 0 HG23 VAL A 37 11.290 -40.553 -18.053 1.00 1.15 H new ATOM 597 N VAL A 38 8.161 -37.169 -18.535 1.00 74.01 N ATOM 598 CA VAL A 38 8.192 -35.928 -19.301 1.00 21.54 C ATOM 599 C VAL A 38 8.228 -34.715 -18.379 1.00 11.32 C ATOM 600 O VAL A 38 8.691 -33.641 -18.765 1.00 71.53 O ATOM 601 CB VAL A 38 6.973 -35.814 -20.235 1.00 32.23 C ATOM 602 CG1 VAL A 38 7.073 -34.563 -21.093 1.00 43.24 C ATOM 603 CG2 VAL A 38 6.848 -37.058 -21.102 1.00 44.43 C ATOM 0 H VAL A 38 7.224 -37.521 -18.341 1.00 74.01 H new ATOM 0 HA VAL A 38 9.100 -35.950 -19.903 1.00 21.54 H new ATOM 0 HB VAL A 38 6.074 -35.734 -19.623 1.00 32.23 H new ATOM 0 HG11 VAL A 38 6.203 -34.499 -21.746 1.00 43.24 H new ATOM 0 HG12 VAL A 38 7.109 -33.683 -20.451 1.00 43.24 H new ATOM 0 HG13 VAL A 38 7.979 -34.608 -21.698 1.00 43.24 H new ATOM 0 HG21 VAL A 38 5.981 -36.960 -21.756 1.00 44.43 H new ATOM 0 HG22 VAL A 38 7.748 -37.172 -21.707 1.00 44.43 H new ATOM 0 HG23 VAL A 38 6.725 -37.934 -20.465 1.00 44.43 H new ATOM 613 N VAL A 39 7.736 -34.892 -17.157 1.00 2.05 N ATOM 614 CA VAL A 39 7.713 -33.812 -16.178 1.00 2.33 C ATOM 615 C VAL A 39 9.113 -33.520 -15.648 1.00 34.22 C ATOM 616 O VAL A 39 9.502 -32.362 -15.496 1.00 20.34 O ATOM 617 CB VAL A 39 6.787 -34.147 -14.993 1.00 63.04 C ATOM 618 CG1 VAL A 39 6.619 -32.937 -14.088 1.00 1.35 C ATOM 619 CG2 VAL A 39 5.438 -34.639 -15.495 1.00 62.32 C ATOM 0 H VAL A 39 7.348 -35.774 -16.821 1.00 2.05 H new ATOM 0 HA VAL A 39 7.330 -32.929 -16.690 1.00 2.33 H new ATOM 0 HB VAL A 39 7.246 -34.945 -14.410 1.00 63.04 H new ATOM 0 HG11 VAL A 39 5.962 -33.193 -13.257 1.00 1.35 H new ATOM 0 HG12 VAL A 39 7.592 -32.634 -13.701 1.00 1.35 H new ATOM 0 HG13 VAL A 39 6.183 -32.116 -14.656 1.00 1.35 H new ATOM 0 HG21 VAL A 39 4.796 -34.871 -14.645 1.00 62.32 H new ATOM 0 HG22 VAL A 39 4.971 -33.863 -16.102 1.00 62.32 H new ATOM 0 HG23 VAL A 39 5.579 -35.536 -16.099 1.00 62.32 H new ATOM 629 N VAL A 40 9.866 -34.579 -15.368 1.00 61.14 N ATOM 630 CA VAL A 40 11.224 -34.438 -14.857 1.00 0.42 C ATOM 631 C VAL A 40 12.071 -33.567 -15.778 1.00 54.33 C ATOM 632 O VAL A 40 13.038 -32.941 -15.344 1.00 62.32 O ATOM 633 CB VAL A 40 11.908 -35.808 -14.693 1.00 33.13 C ATOM 634 CG1 VAL A 40 13.278 -35.648 -14.051 1.00 73.24 C ATOM 635 CG2 VAL A 40 11.033 -36.745 -13.874 1.00 14.23 C ATOM 0 H VAL A 40 9.558 -35.544 -15.487 1.00 61.14 H new ATOM 0 HA VAL A 40 11.146 -33.960 -13.880 1.00 0.42 H new ATOM 0 HB VAL A 40 12.046 -36.247 -15.681 1.00 33.13 H new ATOM 0 HG11 VAL A 40 13.746 -36.627 -13.943 1.00 73.24 H new ATOM 0 HG12 VAL A 40 13.903 -35.014 -14.680 1.00 73.24 H new ATOM 0 HG13 VAL A 40 13.168 -35.188 -13.069 1.00 73.24 H new ATOM 0 HG21 VAL A 40 11.532 -37.708 -13.768 1.00 14.23 H new ATOM 0 HG22 VAL A 40 10.862 -36.314 -12.887 1.00 14.23 H new ATOM 0 HG23 VAL A 40 10.077 -36.885 -14.379 1.00 14.23 H new ATOM 645 N LYS A 41 11.700 -33.530 -17.054 1.00 12.13 N ATOM 646 CA LYS A 41 12.423 -32.734 -18.039 1.00 30.35 C ATOM 647 C LYS A 41 12.254 -31.243 -17.764 1.00 73.40 C ATOM 648 O LYS A 41 13.234 -30.514 -17.619 1.00 31.40 O ATOM 649 CB LYS A 41 11.932 -33.063 -19.450 1.00 54.21 C ATOM 650 CG LYS A 41 13.000 -33.674 -20.339 1.00 64.52 C ATOM 651 CD LYS A 41 12.900 -35.190 -20.370 1.00 30.32 C ATOM 652 CE LYS A 41 13.517 -35.815 -19.128 1.00 1.12 C ATOM 653 NZ LYS A 41 14.921 -36.252 -19.366 1.00 13.23 N ATOM 0 H LYS A 41 10.902 -34.042 -17.430 1.00 12.13 H new ATOM 0 HA LYS A 41 13.482 -32.981 -17.963 1.00 30.35 H new ATOM 0 HB2 LYS A 41 11.091 -33.752 -19.381 1.00 54.21 H new ATOM 0 HB3 LYS A 41 11.560 -32.152 -19.918 1.00 54.21 H new ATOM 0 HG2 LYS A 41 12.901 -33.281 -21.351 1.00 64.52 H new ATOM 0 HG3 LYS A 41 13.986 -33.381 -19.979 1.00 64.52 H new ATOM 0 HD2 LYS A 41 11.853 -35.485 -20.445 1.00 30.32 H new ATOM 0 HD3 LYS A 41 13.403 -35.571 -21.259 1.00 30.32 H new ATOM 0 HE2 LYS A 41 13.494 -35.095 -18.310 1.00 1.12 H new ATOM 0 HE3 LYS A 41 12.918 -36.671 -18.816 1.00 1.12 H new ATOM 0 HZ1 LYS A 41 15.306 -36.672 -18.496 1.00 13.23 H new ATOM 0 HZ2 LYS A 41 14.940 -36.958 -20.130 1.00 13.23 H new ATOM 0 HZ3 LYS A 41 15.499 -35.431 -19.639 1.00 13.23 H new ATOM 667 N ASN A 42 11.004 -30.798 -17.693 1.00 14.33 N ATOM 668 CA ASN A 42 10.706 -29.393 -17.434 1.00 64.53 C ATOM 669 C ASN A 42 11.056 -29.019 -15.997 1.00 53.02 C ATOM 670 O ASN A 42 11.080 -27.841 -15.639 1.00 61.34 O ATOM 671 CB ASN A 42 9.228 -29.106 -17.703 1.00 51.32 C ATOM 672 CG ASN A 42 8.355 -29.391 -16.497 1.00 14.34 C ATOM 673 OD1 ASN A 42 8.328 -28.618 -15.539 1.00 42.50 O ATOM 674 ND2 ASN A 42 7.635 -30.506 -16.538 1.00 14.32 N ATOM 0 H ASN A 42 10.181 -31.389 -17.811 1.00 14.33 H new ATOM 0 HA ASN A 42 11.314 -28.788 -18.106 1.00 64.53 H new ATOM 0 HB2 ASN A 42 9.111 -28.062 -17.995 1.00 51.32 H new ATOM 0 HB3 ASN A 42 8.890 -29.712 -18.544 1.00 51.32 H new ATOM 0 HD21 ASN A 42 7.029 -30.751 -15.755 1.00 14.32 H new ATOM 0 HD22 ASN A 42 7.688 -31.118 -17.352 1.00 14.32 H new ATOM 681 N VAL A 43 11.326 -30.030 -15.177 1.00 43.41 N ATOM 682 CA VAL A 43 11.676 -29.807 -13.779 1.00 61.23 C ATOM 683 C VAL A 43 13.188 -29.794 -13.587 1.00 24.44 C ATOM 684 O VAL A 43 13.698 -29.207 -12.634 1.00 4.51 O ATOM 685 CB VAL A 43 11.063 -30.887 -12.868 1.00 73.25 C ATOM 686 CG1 VAL A 43 11.487 -30.672 -11.424 1.00 3.12 C ATOM 687 CG2 VAL A 43 9.547 -30.890 -12.992 1.00 55.25 C ATOM 0 H VAL A 43 11.309 -31.011 -15.456 1.00 43.41 H new ATOM 0 HA VAL A 43 11.269 -28.835 -13.502 1.00 61.23 H new ATOM 0 HB VAL A 43 11.433 -31.861 -13.189 1.00 73.25 H new ATOM 0 HG11 VAL A 43 11.044 -31.445 -10.796 1.00 3.12 H new ATOM 0 HG12 VAL A 43 12.573 -30.725 -11.352 1.00 3.12 H new ATOM 0 HG13 VAL A 43 11.148 -29.692 -11.087 1.00 3.12 H new ATOM 0 HG21 VAL A 43 9.130 -31.659 -12.342 1.00 55.25 H new ATOM 0 HG22 VAL A 43 9.156 -29.916 -12.699 1.00 55.25 H new ATOM 0 HG23 VAL A 43 9.267 -31.097 -14.025 1.00 55.25 H new ATOM 697 N GLY A 44 13.901 -30.448 -14.499 1.00 45.53 N ATOM 698 CA GLY A 44 15.349 -30.499 -14.412 1.00 42.23 C ATOM 699 C GLY A 44 16.024 -29.611 -15.439 1.00 75.24 C ATOM 700 O GLY A 44 17.234 -29.390 -15.381 1.00 70.32 O ATOM 0 H GLY A 44 13.502 -30.943 -15.296 1.00 45.53 H new ATOM 0 HA2 GLY A 44 15.661 -30.195 -13.413 1.00 42.23 H new ATOM 0 HA3 GLY A 44 15.682 -31.528 -14.551 1.00 42.23 H new ATOM 704 N LEU A 45 15.241 -29.102 -16.384 1.00 15.00 N ATOM 705 CA LEU A 45 15.769 -28.234 -17.431 1.00 25.24 C ATOM 706 C LEU A 45 15.688 -26.769 -17.016 1.00 3.34 C ATOM 707 O LEU A 45 16.154 -25.882 -17.732 1.00 41.11 O ATOM 708 CB LEU A 45 15.001 -28.450 -18.736 1.00 3.23 C ATOM 709 CG LEU A 45 15.375 -29.697 -19.537 1.00 25.54 C ATOM 710 CD1 LEU A 45 14.196 -30.168 -20.373 1.00 60.42 C ATOM 711 CD2 LEU A 45 16.583 -29.421 -20.421 1.00 33.51 C ATOM 0 H LEU A 45 14.238 -29.275 -16.447 1.00 15.00 H new ATOM 0 HA LEU A 45 16.817 -28.491 -17.587 1.00 25.24 H new ATOM 0 HB2 LEU A 45 13.937 -28.497 -18.504 1.00 3.23 H new ATOM 0 HB3 LEU A 45 15.150 -27.577 -19.371 1.00 3.23 H new ATOM 0 HG LEU A 45 15.637 -30.490 -18.837 1.00 25.54 H new ATOM 0 HD11 LEU A 45 14.481 -31.057 -20.936 1.00 60.42 H new ATOM 0 HD12 LEU A 45 13.358 -30.407 -19.718 1.00 60.42 H new ATOM 0 HD13 LEU A 45 13.902 -29.379 -21.065 1.00 60.42 H new ATOM 0 HD21 LEU A 45 16.835 -30.320 -20.984 1.00 33.51 H new ATOM 0 HD22 LEU A 45 16.350 -28.612 -21.114 1.00 33.51 H new ATOM 0 HD23 LEU A 45 17.431 -29.133 -19.799 1.00 33.51 H new ATOM 723 N THR A 46 15.095 -26.520 -15.852 1.00 22.41 N ATOM 724 CA THR A 46 14.954 -25.163 -15.340 1.00 71.04 C ATOM 725 C THR A 46 16.171 -24.756 -14.517 1.00 34.41 C ATOM 726 O THR A 46 16.476 -23.570 -14.385 1.00 72.33 O ATOM 727 CB THR A 46 13.689 -25.018 -14.473 1.00 24.42 C ATOM 728 OG1 THR A 46 12.770 -26.076 -14.767 1.00 30.12 O ATOM 729 CG2 THR A 46 13.018 -23.675 -14.714 1.00 43.32 C ATOM 0 H THR A 46 14.705 -27.242 -15.246 1.00 22.41 H new ATOM 0 HA THR A 46 14.869 -24.506 -16.206 1.00 71.04 H new ATOM 0 HB THR A 46 13.985 -25.075 -13.426 1.00 24.42 H new ATOM 0 HG1 THR A 46 12.370 -25.926 -15.649 1.00 30.12 H new ATOM 0 HG21 THR A 46 12.127 -23.596 -14.091 1.00 43.32 H new ATOM 0 HG22 THR A 46 13.710 -22.872 -14.461 1.00 43.32 H new ATOM 0 HG23 THR A 46 12.735 -23.593 -15.763 1.00 43.32 H new ATOM 737 N LEU A 47 16.863 -25.746 -13.964 1.00 71.45 N ATOM 738 CA LEU A 47 18.048 -25.492 -13.153 1.00 44.54 C ATOM 739 C LEU A 47 19.297 -25.410 -14.025 1.00 44.22 C ATOM 740 O LEU A 47 20.145 -24.539 -13.832 1.00 4.41 O ATOM 741 CB LEU A 47 18.217 -26.590 -12.102 1.00 42.03 C ATOM 742 CG LEU A 47 18.286 -28.022 -12.633 1.00 70.24 C ATOM 743 CD1 LEU A 47 19.732 -28.454 -12.817 1.00 64.44 C ATOM 744 CD2 LEU A 47 17.558 -28.974 -11.695 1.00 62.35 C ATOM 0 H LEU A 47 16.624 -26.733 -14.063 1.00 71.45 H new ATOM 0 HA LEU A 47 17.915 -24.534 -12.650 1.00 44.54 H new ATOM 0 HB2 LEU A 47 19.128 -26.389 -11.538 1.00 42.03 H new ATOM 0 HB3 LEU A 47 17.386 -26.524 -11.400 1.00 42.03 H new ATOM 0 HG LEU A 47 17.793 -28.053 -13.605 1.00 70.24 H new ATOM 0 HD11 LEU A 47 19.761 -29.476 -13.196 1.00 64.44 H new ATOM 0 HD12 LEU A 47 20.223 -27.789 -13.528 1.00 64.44 H new ATOM 0 HD13 LEU A 47 20.250 -28.407 -11.859 1.00 64.44 H new ATOM 0 HD21 LEU A 47 17.617 -29.989 -12.089 1.00 62.35 H new ATOM 0 HD22 LEU A 47 18.022 -28.939 -10.709 1.00 62.35 H new ATOM 0 HD23 LEU A 47 16.512 -28.677 -11.614 1.00 62.35 H new ATOM 756 N ARG A 48 19.403 -26.322 -14.986 1.00 55.33 N ATOM 757 CA ARG A 48 20.547 -26.352 -15.889 1.00 22.13 C ATOM 758 C ARG A 48 20.595 -25.093 -16.749 1.00 75.15 C ATOM 759 O ARG A 48 21.619 -24.781 -17.357 1.00 0.01 O ATOM 760 CB ARG A 48 20.486 -27.592 -16.783 1.00 1.03 C ATOM 761 CG ARG A 48 19.458 -27.489 -17.898 1.00 4.22 C ATOM 762 CD ARG A 48 19.478 -28.720 -18.789 1.00 64.45 C ATOM 763 NE ARG A 48 20.836 -29.096 -19.173 1.00 65.33 N ATOM 764 CZ ARG A 48 21.171 -30.310 -19.598 1.00 51.55 C ATOM 765 NH1 ARG A 48 20.251 -31.259 -19.694 1.00 75.12 N ATOM 766 NH2 ARG A 48 22.428 -30.575 -19.930 1.00 2.35 N ATOM 0 H ARG A 48 18.710 -27.050 -15.159 1.00 55.33 H new ATOM 0 HA ARG A 48 21.453 -26.392 -15.285 1.00 22.13 H new ATOM 0 HB2 ARG A 48 21.469 -27.762 -17.221 1.00 1.03 H new ATOM 0 HB3 ARG A 48 20.256 -28.462 -16.168 1.00 1.03 H new ATOM 0 HG2 ARG A 48 18.464 -27.366 -17.468 1.00 4.22 H new ATOM 0 HG3 ARG A 48 19.658 -26.601 -18.498 1.00 4.22 H new ATOM 0 HD2 ARG A 48 19.005 -29.552 -18.268 1.00 64.45 H new ATOM 0 HD3 ARG A 48 18.888 -28.528 -19.685 1.00 64.45 H new ATOM 0 HE ARG A 48 21.568 -28.388 -19.112 1.00 65.33 H new ATOM 0 HH11 ARG A 48 19.283 -31.059 -19.441 1.00 75.12 H new ATOM 0 HH12 ARG A 48 20.511 -32.190 -20.020 1.00 75.12 H new ATOM 0 HH21 ARG A 48 23.139 -29.847 -19.859 1.00 2.35 H new ATOM 0 HH22 ARG A 48 22.684 -31.507 -20.256 1.00 2.35 H new ATOM 780 N LYS A 49 19.479 -24.373 -16.798 1.00 33.34 N ATOM 781 CA LYS A 49 19.391 -23.148 -17.583 1.00 4.22 C ATOM 782 C LYS A 49 19.617 -21.921 -16.704 1.00 60.51 C ATOM 783 O LYS A 49 20.171 -20.917 -17.153 1.00 24.23 O ATOM 784 CB LYS A 49 18.026 -23.053 -18.268 1.00 65.03 C ATOM 785 CG LYS A 49 16.881 -22.785 -17.308 1.00 33.32 C ATOM 786 CD LYS A 49 15.574 -22.556 -18.049 1.00 1.23 C ATOM 787 CE LYS A 49 15.538 -21.184 -18.704 1.00 4.41 C ATOM 788 NZ LYS A 49 16.064 -21.220 -20.097 1.00 32.22 N ATOM 0 H LYS A 49 18.622 -24.618 -16.302 1.00 33.34 H new ATOM 0 HA LYS A 49 20.171 -23.177 -18.344 1.00 4.22 H new ATOM 0 HB2 LYS A 49 18.058 -22.258 -19.013 1.00 65.03 H new ATOM 0 HB3 LYS A 49 17.831 -23.983 -18.802 1.00 65.03 H new ATOM 0 HG2 LYS A 49 16.771 -23.629 -16.627 1.00 33.32 H new ATOM 0 HG3 LYS A 49 17.113 -21.911 -16.699 1.00 33.32 H new ATOM 0 HD2 LYS A 49 15.446 -23.327 -18.809 1.00 1.23 H new ATOM 0 HD3 LYS A 49 14.739 -22.651 -17.355 1.00 1.23 H new ATOM 0 HE2 LYS A 49 14.513 -20.812 -18.712 1.00 4.41 H new ATOM 0 HE3 LYS A 49 16.126 -20.483 -18.112 1.00 4.41 H new ATOM 0 HZ1 LYS A 49 16.854 -20.550 -20.187 1.00 32.22 H new ATOM 0 HZ2 LYS A 49 16.398 -22.180 -20.317 1.00 32.22 H new ATOM 0 HZ3 LYS A 49 15.308 -20.955 -20.760 1.00 32.22 H new ATOM 802 N LEU A 50 19.186 -22.010 -15.451 1.00 34.02 N ATOM 803 CA LEU A 50 19.342 -20.908 -14.508 1.00 41.32 C ATOM 804 C LEU A 50 20.752 -20.885 -13.926 1.00 33.22 C ATOM 805 O LEU A 50 21.248 -19.835 -13.516 1.00 72.23 O ATOM 806 CB LEU A 50 18.314 -21.025 -13.381 1.00 42.43 C ATOM 807 CG LEU A 50 18.818 -21.639 -12.075 1.00 13.34 C ATOM 808 CD1 LEU A 50 19.441 -20.571 -11.189 1.00 23.53 C ATOM 809 CD2 LEU A 50 17.684 -22.344 -11.345 1.00 72.22 C ATOM 0 H LEU A 50 18.726 -22.834 -15.064 1.00 34.02 H new ATOM 0 HA LEU A 50 19.176 -19.975 -15.047 1.00 41.32 H new ATOM 0 HB2 LEU A 50 17.926 -20.030 -13.165 1.00 42.43 H new ATOM 0 HB3 LEU A 50 17.476 -21.623 -13.741 1.00 42.43 H new ATOM 0 HG LEU A 50 19.584 -22.377 -12.314 1.00 13.34 H new ATOM 0 HD11 LEU A 50 19.794 -21.026 -10.264 1.00 23.53 H new ATOM 0 HD12 LEU A 50 20.280 -20.110 -11.710 1.00 23.53 H new ATOM 0 HD13 LEU A 50 18.696 -19.810 -10.957 1.00 23.53 H new ATOM 0 HD21 LEU A 50 18.061 -22.775 -10.418 1.00 72.22 H new ATOM 0 HD22 LEU A 50 16.896 -21.626 -11.118 1.00 72.22 H new ATOM 0 HD23 LEU A 50 17.282 -23.136 -11.976 1.00 72.22 H new ATOM 821 N ILE A 51 21.392 -22.049 -13.894 1.00 72.11 N ATOM 822 CA ILE A 51 22.745 -22.162 -13.365 1.00 44.32 C ATOM 823 C ILE A 51 23.716 -21.285 -14.148 1.00 43.44 C ATOM 824 O ILE A 51 24.704 -20.794 -13.603 1.00 41.13 O ATOM 825 CB ILE A 51 23.244 -23.618 -13.401 1.00 22.45 C ATOM 826 CG1 ILE A 51 22.585 -24.433 -12.286 1.00 30.32 C ATOM 827 CG2 ILE A 51 24.759 -23.663 -13.271 1.00 44.43 C ATOM 828 CD1 ILE A 51 22.480 -25.910 -12.598 1.00 1.32 C ATOM 0 H ILE A 51 20.995 -22.927 -14.228 1.00 72.11 H new ATOM 0 HA ILE A 51 22.708 -21.825 -12.329 1.00 44.32 H new ATOM 0 HB ILE A 51 22.968 -24.057 -14.360 1.00 22.45 H new ATOM 0 HG12 ILE A 51 23.156 -24.304 -11.367 1.00 30.32 H new ATOM 0 HG13 ILE A 51 21.587 -24.037 -12.099 1.00 30.32 H new ATOM 0 HG21 ILE A 51 25.096 -24.699 -13.298 1.00 44.43 H new ATOM 0 HG22 ILE A 51 25.211 -23.113 -14.096 1.00 44.43 H new ATOM 0 HG23 ILE A 51 25.057 -23.209 -12.326 1.00 44.43 H new ATOM 0 HD11 ILE A 51 22.003 -26.425 -11.764 1.00 1.32 H new ATOM 0 HD12 ILE A 51 21.884 -26.050 -13.500 1.00 1.32 H new ATOM 0 HD13 ILE A 51 23.477 -26.320 -12.755 1.00 1.32 H new ATOM 840 N GLY A 52 23.427 -21.090 -15.432 1.00 31.15 N ATOM 841 CA GLY A 52 24.283 -20.270 -16.269 1.00 72.41 C ATOM 842 C GLY A 52 24.085 -18.788 -16.024 1.00 43.43 C ATOM 843 O GLY A 52 24.764 -17.956 -16.627 1.00 23.21 O ATOM 0 H GLY A 52 22.615 -21.485 -15.907 1.00 31.15 H new ATOM 0 HA2 GLY A 52 25.325 -20.530 -16.083 1.00 72.41 H new ATOM 0 HA3 GLY A 52 24.082 -20.492 -17.317 1.00 72.41 H new ATOM 847 N SER A 53 23.152 -18.455 -15.139 1.00 13.33 N ATOM 848 CA SER A 53 22.863 -17.061 -14.820 1.00 33.52 C ATOM 849 C SER A 53 23.704 -16.589 -13.638 1.00 0.10 C ATOM 850 O SER A 53 24.067 -15.416 -13.549 1.00 65.03 O ATOM 851 CB SER A 53 21.376 -16.886 -14.504 1.00 70.24 C ATOM 852 OG SER A 53 20.600 -17.892 -15.132 1.00 55.11 O ATOM 0 H SER A 53 22.583 -19.131 -14.630 1.00 13.33 H new ATOM 0 HA SER A 53 23.117 -16.455 -15.690 1.00 33.52 H new ATOM 0 HB2 SER A 53 21.223 -16.924 -13.425 1.00 70.24 H new ATOM 0 HB3 SER A 53 21.043 -15.903 -14.838 1.00 70.24 H new ATOM 0 HG SER A 53 20.384 -18.592 -14.481 1.00 55.11 H new ATOM 858 N VAL A 54 24.010 -17.511 -12.731 1.00 62.42 N ATOM 859 CA VAL A 54 24.809 -17.191 -11.555 1.00 24.15 C ATOM 860 C VAL A 54 26.299 -17.321 -11.850 1.00 64.22 C ATOM 861 O VAL A 54 27.129 -16.683 -11.203 1.00 3.15 O ATOM 862 CB VAL A 54 24.451 -18.104 -10.367 1.00 62.41 C ATOM 863 CG1 VAL A 54 25.071 -17.577 -9.082 1.00 31.21 C ATOM 864 CG2 VAL A 54 22.942 -18.230 -10.229 1.00 15.25 C ATOM 0 H VAL A 54 23.716 -18.486 -12.788 1.00 62.42 H new ATOM 0 HA VAL A 54 24.583 -16.158 -11.291 1.00 24.15 H new ATOM 0 HB VAL A 54 24.859 -19.096 -10.558 1.00 62.41 H new ATOM 0 HG11 VAL A 54 24.807 -18.235 -8.254 1.00 31.21 H new ATOM 0 HG12 VAL A 54 26.155 -17.544 -9.188 1.00 31.21 H new ATOM 0 HG13 VAL A 54 24.696 -16.573 -8.882 1.00 31.21 H new ATOM 0 HG21 VAL A 54 22.707 -18.878 -9.385 1.00 15.25 H new ATOM 0 HG22 VAL A 54 22.508 -17.244 -10.061 1.00 15.25 H new ATOM 0 HG23 VAL A 54 22.528 -18.658 -11.142 1.00 15.25 H new ATOM 874 N ASP A 55 26.631 -18.151 -12.833 1.00 25.34 N ATOM 875 CA ASP A 55 28.022 -18.365 -13.216 1.00 42.52 C ATOM 876 C ASP A 55 28.690 -17.046 -13.594 1.00 71.14 C ATOM 877 O ASP A 55 29.903 -16.890 -13.453 1.00 12.04 O ATOM 878 CB ASP A 55 28.106 -19.347 -14.385 1.00 42.14 C ATOM 879 CG ASP A 55 29.537 -19.661 -14.776 1.00 20.32 C ATOM 880 OD1 ASP A 55 30.126 -18.880 -15.552 1.00 2.54 O ATOM 881 OD2 ASP A 55 30.068 -20.689 -14.305 1.00 11.41 O ATOM 0 H ASP A 55 25.956 -18.687 -13.379 1.00 25.34 H new ATOM 0 HA ASP A 55 28.549 -18.786 -12.360 1.00 42.52 H new ATOM 0 HB2 ASP A 55 27.595 -20.271 -14.117 1.00 42.14 H new ATOM 0 HB3 ASP A 55 27.581 -18.930 -15.244 1.00 42.14 H new ATOM 886 N ASP A 56 27.890 -16.101 -14.077 1.00 24.21 N ATOM 887 CA ASP A 56 28.404 -14.796 -14.476 1.00 14.21 C ATOM 888 C ASP A 56 28.667 -13.919 -13.255 1.00 62.44 C ATOM 889 O ASP A 56 29.521 -13.032 -13.288 1.00 12.12 O ATOM 890 CB ASP A 56 27.416 -14.101 -15.415 1.00 10.15 C ATOM 891 CG ASP A 56 27.688 -12.615 -15.544 1.00 60.22 C ATOM 892 OD1 ASP A 56 28.861 -12.243 -15.759 1.00 53.24 O ATOM 893 OD2 ASP A 56 26.728 -11.825 -15.431 1.00 41.34 O ATOM 0 H ASP A 56 26.884 -16.214 -14.201 1.00 24.21 H new ATOM 0 HA ASP A 56 29.347 -14.949 -15.001 1.00 14.21 H new ATOM 0 HB2 ASP A 56 27.469 -14.564 -16.400 1.00 10.15 H new ATOM 0 HB3 ASP A 56 26.401 -14.251 -15.046 1.00 10.15 H new ATOM 898 N LEU A 57 27.929 -14.173 -12.181 1.00 33.12 N ATOM 899 CA LEU A 57 28.082 -13.407 -10.949 1.00 55.40 C ATOM 900 C LEU A 57 29.152 -14.022 -10.054 1.00 30.43 C ATOM 901 O LEU A 57 29.599 -13.404 -9.087 1.00 33.15 O ATOM 902 CB LEU A 57 26.750 -13.339 -10.199 1.00 2.22 C ATOM 903 CG LEU A 57 25.785 -12.239 -10.642 1.00 41.33 C ATOM 904 CD1 LEU A 57 26.406 -10.867 -10.431 1.00 2.32 C ATOM 905 CD2 LEU A 57 25.393 -12.429 -12.100 1.00 75.51 C ATOM 0 H LEU A 57 27.218 -14.903 -12.138 1.00 33.12 H new ATOM 0 HA LEU A 57 28.394 -12.397 -11.215 1.00 55.40 H new ATOM 0 HB2 LEU A 57 26.247 -14.300 -10.305 1.00 2.22 H new ATOM 0 HB3 LEU A 57 26.960 -13.205 -9.138 1.00 2.22 H new ATOM 0 HG LEU A 57 24.884 -12.306 -10.032 1.00 41.33 H new ATOM 0 HD11 LEU A 57 25.705 -10.097 -10.752 1.00 2.32 H new ATOM 0 HD12 LEU A 57 26.636 -10.730 -9.374 1.00 2.32 H new ATOM 0 HD13 LEU A 57 27.323 -10.789 -11.015 1.00 2.32 H new ATOM 0 HD21 LEU A 57 24.706 -11.637 -12.398 1.00 75.51 H new ATOM 0 HD22 LEU A 57 26.285 -12.389 -12.725 1.00 75.51 H new ATOM 0 HD23 LEU A 57 24.907 -13.397 -12.223 1.00 75.51 H new ATOM 917 N LEU A 58 29.561 -15.243 -10.383 1.00 40.51 N ATOM 918 CA LEU A 58 30.582 -15.942 -9.610 1.00 74.03 C ATOM 919 C LEU A 58 31.816 -15.067 -9.420 1.00 42.45 C ATOM 920 O LEU A 58 32.226 -14.763 -8.300 1.00 30.12 O ATOM 921 CB LEU A 58 30.970 -17.248 -10.306 1.00 3.23 C ATOM 922 CG LEU A 58 30.637 -18.535 -9.551 1.00 73.21 C ATOM 923 CD1 LEU A 58 31.161 -19.747 -10.305 1.00 65.21 C ATOM 924 CD2 LEU A 58 31.210 -18.492 -8.142 1.00 44.34 C ATOM 0 H LEU A 58 29.201 -15.769 -11.179 1.00 40.51 H new ATOM 0 HA LEU A 58 30.167 -16.170 -8.628 1.00 74.03 H new ATOM 0 HB2 LEU A 58 30.474 -17.281 -11.276 1.00 3.23 H new ATOM 0 HB3 LEU A 58 32.043 -17.230 -10.497 1.00 3.23 H new ATOM 0 HG LEU A 58 29.553 -18.619 -9.477 1.00 73.21 H new ATOM 0 HD11 LEU A 58 30.915 -20.654 -9.752 1.00 65.21 H new ATOM 0 HD12 LEU A 58 30.702 -19.788 -11.293 1.00 65.21 H new ATOM 0 HD13 LEU A 58 32.243 -19.670 -10.411 1.00 65.21 H new ATOM 0 HD21 LEU A 58 30.963 -19.417 -7.620 1.00 44.34 H new ATOM 0 HD22 LEU A 58 32.293 -18.383 -8.193 1.00 44.34 H new ATOM 0 HD23 LEU A 58 30.785 -17.646 -7.602 1.00 44.34 H new ATOM 936 N PRO A 59 32.423 -14.648 -10.541 1.00 63.40 N ATOM 937 CA PRO A 59 33.618 -13.799 -10.524 1.00 62.43 C ATOM 938 C PRO A 59 33.317 -12.384 -10.042 1.00 62.34 C ATOM 939 O PRO A 59 34.226 -11.574 -9.859 1.00 31.52 O ATOM 940 CB PRO A 59 34.062 -13.782 -11.989 1.00 72.42 C ATOM 941 CG PRO A 59 32.819 -14.053 -12.765 1.00 12.34 C ATOM 942 CD PRO A 59 31.990 -14.972 -11.911 1.00 13.34 C ATOM 0 HA PRO A 59 34.377 -14.177 -9.839 1.00 62.43 H new ATOM 0 HB2 PRO A 59 34.496 -12.819 -12.260 1.00 72.42 H new ATOM 0 HB3 PRO A 59 34.822 -14.540 -12.181 1.00 72.42 H new ATOM 0 HG2 PRO A 59 32.282 -13.128 -12.978 1.00 12.34 H new ATOM 0 HG3 PRO A 59 33.051 -14.515 -13.725 1.00 12.34 H new ATOM 0 HD2 PRO A 59 30.923 -14.794 -12.048 1.00 13.34 H new ATOM 0 HD3 PRO A 59 32.172 -16.019 -12.153 1.00 13.34 H new ATOM 950 N SER A 60 32.036 -12.093 -9.839 1.00 23.31 N ATOM 951 CA SER A 60 31.616 -10.774 -9.381 1.00 75.23 C ATOM 952 C SER A 60 31.226 -10.810 -7.907 1.00 13.33 C ATOM 953 O SER A 60 30.498 -9.941 -7.424 1.00 31.14 O ATOM 954 CB SER A 60 30.439 -10.272 -10.220 1.00 14.33 C ATOM 955 OG SER A 60 30.281 -8.870 -10.088 1.00 54.42 O ATOM 0 H SER A 60 31.272 -12.752 -9.984 1.00 23.31 H new ATOM 0 HA SER A 60 32.456 -10.090 -9.500 1.00 75.23 H new ATOM 0 HB2 SER A 60 30.600 -10.526 -11.268 1.00 14.33 H new ATOM 0 HB3 SER A 60 29.524 -10.775 -9.907 1.00 14.33 H new ATOM 0 HG SER A 60 30.285 -8.628 -9.138 1.00 54.42 H new ATOM 961 N LEU A 61 31.715 -11.820 -7.196 1.00 52.02 N ATOM 962 CA LEU A 61 31.419 -11.970 -5.776 1.00 33.53 C ATOM 963 C LEU A 61 32.698 -12.176 -4.972 1.00 23.35 C ATOM 964 O LEU A 61 33.741 -12.556 -5.504 1.00 62.23 O ATOM 965 CB LEU A 61 30.469 -13.149 -5.555 1.00 12.13 C ATOM 966 CG LEU A 61 31.129 -14.503 -5.292 1.00 52.00 C ATOM 967 CD1 LEU A 61 31.017 -14.875 -3.822 1.00 2.14 C ATOM 968 CD2 LEU A 61 30.502 -15.580 -6.166 1.00 25.14 C ATOM 0 H LEU A 61 32.318 -12.547 -7.580 1.00 52.02 H new ATOM 0 HA LEU A 61 30.939 -11.054 -5.431 1.00 33.53 H new ATOM 0 HB2 LEU A 61 29.820 -12.914 -4.711 1.00 12.13 H new ATOM 0 HB3 LEU A 61 29.829 -13.244 -6.432 1.00 12.13 H new ATOM 0 HG LEU A 61 32.186 -14.426 -5.546 1.00 52.00 H new ATOM 0 HD11 LEU A 61 31.492 -15.841 -3.654 1.00 2.14 H new ATOM 0 HD12 LEU A 61 31.513 -14.117 -3.216 1.00 2.14 H new ATOM 0 HD13 LEU A 61 29.966 -14.934 -3.541 1.00 2.14 H new ATOM 0 HD21 LEU A 61 30.984 -16.537 -5.966 1.00 25.14 H new ATOM 0 HD22 LEU A 61 29.438 -15.656 -5.943 1.00 25.14 H new ATOM 0 HD23 LEU A 61 30.635 -15.319 -7.216 1.00 25.14 H new ATOM 980 N PRO A 62 32.619 -11.922 -3.657 1.00 33.21 N ATOM 981 CA PRO A 62 33.761 -12.075 -2.750 1.00 75.45 C ATOM 982 C PRO A 62 34.145 -13.536 -2.544 1.00 70.53 C ATOM 983 O PRO A 62 33.713 -14.413 -3.292 1.00 61.44 O ATOM 984 CB PRO A 62 33.258 -11.465 -1.440 1.00 55.31 C ATOM 985 CG PRO A 62 31.775 -11.602 -1.502 1.00 64.14 C ATOM 986 CD PRO A 62 31.408 -11.466 -2.954 1.00 73.21 C ATOM 0 HA PRO A 62 34.659 -11.597 -3.141 1.00 75.45 H new ATOM 0 HB2 PRO A 62 33.668 -11.989 -0.576 1.00 55.31 H new ATOM 0 HB3 PRO A 62 33.556 -10.420 -1.350 1.00 55.31 H new ATOM 0 HG2 PRO A 62 31.455 -12.566 -1.107 1.00 64.14 H new ATOM 0 HG3 PRO A 62 31.287 -10.834 -0.902 1.00 64.14 H new ATOM 0 HD2 PRO A 62 30.542 -12.077 -3.208 1.00 73.21 H new ATOM 0 HD3 PRO A 62 31.158 -10.436 -3.210 1.00 73.21 H new ATOM 994 N SER A 63 34.959 -13.791 -1.525 1.00 20.32 N ATOM 995 CA SER A 63 35.404 -15.146 -1.222 1.00 63.54 C ATOM 996 C SER A 63 34.729 -15.671 0.041 1.00 5.35 C ATOM 997 O SER A 63 35.396 -16.122 0.973 1.00 40.50 O ATOM 998 CB SER A 63 36.925 -15.181 -1.054 1.00 55.13 C ATOM 999 OG SER A 63 37.323 -14.494 0.120 1.00 64.45 O ATOM 0 H SER A 63 35.324 -13.077 -0.895 1.00 20.32 H new ATOM 0 HA SER A 63 35.123 -15.789 -2.056 1.00 63.54 H new ATOM 0 HB2 SER A 63 37.265 -16.215 -1.007 1.00 55.13 H new ATOM 0 HB3 SER A 63 37.401 -14.728 -1.924 1.00 55.13 H new ATOM 0 HG SER A 63 36.920 -14.924 0.903 1.00 64.45 H new ATOM 1005 N SER A 64 33.402 -15.608 0.066 1.00 50.25 N ATOM 1006 CA SER A 64 32.635 -16.072 1.216 1.00 64.12 C ATOM 1007 C SER A 64 31.317 -16.699 0.773 1.00 53.42 C ATOM 1008 O SER A 64 30.909 -17.741 1.285 1.00 12.23 O ATOM 1009 CB SER A 64 32.365 -14.913 2.177 1.00 50.22 C ATOM 1010 OG SER A 64 32.107 -15.386 3.487 1.00 33.32 O ATOM 0 H SER A 64 32.835 -15.240 -0.698 1.00 50.25 H new ATOM 0 HA SER A 64 33.223 -16.832 1.731 1.00 64.12 H new ATOM 0 HB2 SER A 64 33.223 -14.242 2.192 1.00 50.22 H new ATOM 0 HB3 SER A 64 31.513 -14.333 1.822 1.00 50.22 H new ATOM 0 HG SER A 64 31.939 -14.626 4.082 1.00 33.32 H new ATOM 1016 N SER A 65 30.655 -16.055 -0.183 1.00 54.31 N ATOM 1017 CA SER A 65 29.380 -16.545 -0.694 1.00 31.44 C ATOM 1018 C SER A 65 29.596 -17.533 -1.836 1.00 22.52 C ATOM 1019 O SER A 65 28.706 -18.315 -2.172 1.00 24.22 O ATOM 1020 CB SER A 65 28.514 -15.378 -1.171 1.00 42.12 C ATOM 1021 OG SER A 65 27.664 -14.916 -0.136 1.00 31.53 O ATOM 0 H SER A 65 30.981 -15.192 -0.619 1.00 54.31 H new ATOM 0 HA SER A 65 28.866 -17.061 0.117 1.00 31.44 H new ATOM 0 HB2 SER A 65 29.153 -14.563 -1.512 1.00 42.12 H new ATOM 0 HB3 SER A 65 27.914 -15.692 -2.025 1.00 42.12 H new ATOM 0 HG SER A 65 27.123 -14.169 -0.466 1.00 31.53 H new ATOM 1027 N ARG A 66 30.785 -17.492 -2.429 1.00 11.33 N ATOM 1028 CA ARG A 66 31.119 -18.382 -3.534 1.00 50.31 C ATOM 1029 C ARG A 66 30.864 -19.838 -3.156 1.00 2.22 C ATOM 1030 O ARG A 66 30.402 -20.632 -3.976 1.00 24.55 O ATOM 1031 CB ARG A 66 32.582 -18.198 -3.941 1.00 3.35 C ATOM 1032 CG ARG A 66 33.067 -19.224 -4.951 1.00 24.30 C ATOM 1033 CD ARG A 66 34.072 -20.184 -4.332 1.00 40.51 C ATOM 1034 NE ARG A 66 35.409 -19.602 -4.256 1.00 44.42 N ATOM 1035 CZ ARG A 66 36.424 -20.172 -3.615 1.00 54.23 C ATOM 1036 NH1 ARG A 66 36.254 -21.333 -2.998 1.00 54.04 N ATOM 1037 NH2 ARG A 66 37.611 -19.580 -3.591 1.00 22.40 N ATOM 0 H ARG A 66 31.533 -16.852 -2.162 1.00 11.33 H new ATOM 0 HA ARG A 66 30.479 -18.127 -4.379 1.00 50.31 H new ATOM 0 HB2 ARG A 66 32.711 -17.200 -4.359 1.00 3.35 H new ATOM 0 HB3 ARG A 66 33.208 -18.254 -3.050 1.00 3.35 H new ATOM 0 HG2 ARG A 66 32.217 -19.785 -5.338 1.00 24.30 H new ATOM 0 HG3 ARG A 66 33.524 -18.714 -5.799 1.00 24.30 H new ATOM 0 HD2 ARG A 66 33.740 -20.461 -3.332 1.00 40.51 H new ATOM 0 HD3 ARG A 66 34.108 -21.100 -4.921 1.00 40.51 H new ATOM 0 HE ARG A 66 35.573 -18.709 -4.720 1.00 44.42 H new ATOM 0 HH11 ARG A 66 35.343 -21.791 -3.015 1.00 54.04 H new ATOM 0 HH12 ARG A 66 37.035 -21.769 -2.507 1.00 54.04 H new ATOM 0 HH21 ARG A 66 37.745 -18.687 -4.065 1.00 22.40 H new ATOM 0 HH22 ARG A 66 38.390 -20.018 -3.099 1.00 22.40 H new ATOM 1051 N THR A 67 31.169 -20.182 -1.908 1.00 52.13 N ATOM 1052 CA THR A 67 30.975 -21.542 -1.421 1.00 52.25 C ATOM 1053 C THR A 67 29.521 -21.977 -1.569 1.00 42.45 C ATOM 1054 O THR A 67 29.219 -23.169 -1.578 1.00 20.41 O ATOM 1055 CB THR A 67 31.391 -21.674 0.056 1.00 75.42 C ATOM 1056 OG1 THR A 67 32.473 -20.782 0.342 1.00 1.10 O ATOM 1057 CG2 THR A 67 31.806 -23.103 0.375 1.00 41.41 C ATOM 0 H THR A 67 31.551 -19.537 -1.216 1.00 52.13 H new ATOM 0 HA THR A 67 31.608 -22.189 -2.028 1.00 52.25 H new ATOM 0 HB THR A 67 30.534 -21.414 0.677 1.00 75.42 H new ATOM 0 HG1 THR A 67 32.730 -20.871 1.283 1.00 1.10 H new ATOM 0 HG21 THR A 67 32.096 -23.172 1.424 1.00 41.41 H new ATOM 0 HG22 THR A 67 30.970 -23.776 0.184 1.00 41.41 H new ATOM 0 HG23 THR A 67 32.650 -23.386 -0.254 1.00 41.41 H new ATOM 1065 N GLU A 68 28.625 -21.001 -1.687 1.00 25.34 N ATOM 1066 CA GLU A 68 27.203 -21.285 -1.834 1.00 71.32 C ATOM 1067 C GLU A 68 26.845 -21.524 -3.298 1.00 71.23 C ATOM 1068 O GLU A 68 26.174 -22.501 -3.633 1.00 22.34 O ATOM 1069 CB GLU A 68 26.369 -20.130 -1.276 1.00 31.42 C ATOM 1070 CG GLU A 68 25.445 -20.540 -0.141 1.00 2.21 C ATOM 1071 CD GLU A 68 24.642 -21.785 -0.463 1.00 31.01 C ATOM 1072 OE1 GLU A 68 23.729 -21.700 -1.310 1.00 71.14 O ATOM 1073 OE2 GLU A 68 24.927 -22.845 0.133 1.00 2.22 O ATOM 0 H GLU A 68 28.859 -20.008 -1.684 1.00 25.34 H new ATOM 0 HA GLU A 68 26.979 -22.191 -1.270 1.00 71.32 H new ATOM 0 HB2 GLU A 68 27.039 -19.346 -0.923 1.00 31.42 H new ATOM 0 HB3 GLU A 68 25.773 -19.701 -2.081 1.00 31.42 H new ATOM 0 HG2 GLU A 68 26.036 -20.716 0.758 1.00 2.21 H new ATOM 0 HG3 GLU A 68 24.763 -19.720 0.081 1.00 2.21 H new ATOM 1080 N ILE A 69 27.296 -20.625 -4.166 1.00 4.21 N ATOM 1081 CA ILE A 69 27.024 -20.738 -5.593 1.00 45.45 C ATOM 1082 C ILE A 69 27.783 -21.910 -6.207 1.00 12.14 C ATOM 1083 O ILE A 69 27.184 -22.804 -6.804 1.00 24.15 O ATOM 1084 CB ILE A 69 27.405 -19.447 -6.343 1.00 14.24 C ATOM 1085 CG1 ILE A 69 26.588 -18.266 -5.815 1.00 13.51 C ATOM 1086 CG2 ILE A 69 27.190 -19.620 -7.839 1.00 12.02 C ATOM 1087 CD1 ILE A 69 27.369 -16.972 -5.749 1.00 21.14 C ATOM 0 H ILE A 69 27.852 -19.810 -3.906 1.00 4.21 H new ATOM 0 HA ILE A 69 25.952 -20.907 -5.697 1.00 45.45 H new ATOM 0 HB ILE A 69 28.461 -19.241 -6.169 1.00 14.24 H new ATOM 0 HG12 ILE A 69 25.717 -18.123 -6.454 1.00 13.51 H new ATOM 0 HG13 ILE A 69 26.217 -18.508 -4.819 1.00 13.51 H new ATOM 0 HG21 ILE A 69 27.464 -18.700 -8.355 1.00 12.02 H new ATOM 0 HG22 ILE A 69 27.811 -20.438 -8.204 1.00 12.02 H new ATOM 0 HG23 ILE A 69 26.141 -19.846 -8.032 1.00 12.02 H new ATOM 0 HD11 ILE A 69 26.727 -16.179 -5.366 1.00 21.14 H new ATOM 0 HD12 ILE A 69 28.226 -17.097 -5.087 1.00 21.14 H new ATOM 0 HD13 ILE A 69 27.718 -16.706 -6.747 1.00 21.14 H new ATOM 1099 N GLU A 70 29.103 -21.899 -6.053 1.00 2.01 N ATOM 1100 CA GLU A 70 29.943 -22.963 -6.591 1.00 1.40 C ATOM 1101 C GLU A 70 29.622 -24.298 -5.927 1.00 35.41 C ATOM 1102 O GLU A 70 30.004 -25.358 -6.422 1.00 14.14 O ATOM 1103 CB GLU A 70 31.422 -22.625 -6.392 1.00 41.23 C ATOM 1104 CG GLU A 70 32.204 -22.526 -7.692 1.00 32.15 C ATOM 1105 CD GLU A 70 33.689 -22.765 -7.499 1.00 33.53 C ATOM 1106 OE1 GLU A 70 34.052 -23.535 -6.585 1.00 64.44 O ATOM 1107 OE2 GLU A 70 34.487 -22.182 -8.262 1.00 30.41 O ATOM 0 H GLU A 70 29.614 -21.166 -5.561 1.00 2.01 H new ATOM 0 HA GLU A 70 29.737 -23.049 -7.658 1.00 1.40 H new ATOM 0 HB2 GLU A 70 31.501 -21.678 -5.857 1.00 41.23 H new ATOM 0 HB3 GLU A 70 31.878 -23.387 -5.760 1.00 41.23 H new ATOM 0 HG2 GLU A 70 31.812 -23.253 -8.404 1.00 32.15 H new ATOM 0 HG3 GLU A 70 32.052 -21.539 -8.129 1.00 32.15 H new ATOM 1114 N GLY A 71 28.916 -24.239 -4.801 1.00 40.54 N ATOM 1115 CA GLY A 71 28.555 -25.449 -4.087 1.00 23.02 C ATOM 1116 C GLY A 71 27.134 -25.891 -4.375 1.00 63.04 C ATOM 1117 O GLY A 71 26.786 -27.056 -4.179 1.00 13.30 O ATOM 0 H GLY A 71 28.588 -23.374 -4.371 1.00 40.54 H new ATOM 0 HA2 GLY A 71 29.243 -26.248 -4.362 1.00 23.02 H new ATOM 0 HA3 GLY A 71 28.670 -25.283 -3.016 1.00 23.02 H new ATOM 1121 N THR A 72 26.309 -24.959 -4.842 1.00 43.31 N ATOM 1122 CA THR A 72 24.918 -25.257 -5.155 1.00 74.24 C ATOM 1123 C THR A 72 24.742 -25.564 -6.638 1.00 74.22 C ATOM 1124 O THR A 72 24.026 -26.495 -7.007 1.00 51.22 O ATOM 1125 CB THR A 72 23.992 -24.087 -4.772 1.00 20.45 C ATOM 1126 OG1 THR A 72 24.014 -23.891 -3.353 1.00 54.43 O ATOM 1127 CG2 THR A 72 22.566 -24.353 -5.230 1.00 40.32 C ATOM 0 H THR A 72 26.581 -23.991 -5.012 1.00 43.31 H new ATOM 0 HA THR A 72 24.644 -26.134 -4.569 1.00 74.24 H new ATOM 0 HB THR A 72 24.354 -23.187 -5.269 1.00 20.45 H new ATOM 0 HG1 THR A 72 24.648 -23.177 -3.131 1.00 54.43 H new ATOM 0 HG21 THR A 72 21.931 -23.513 -4.948 1.00 40.32 H new ATOM 0 HG22 THR A 72 22.548 -24.474 -6.313 1.00 40.32 H new ATOM 0 HG23 THR A 72 22.196 -25.263 -4.757 1.00 40.32 H new ATOM 1135 N GLN A 73 25.399 -24.776 -7.483 1.00 21.40 N ATOM 1136 CA GLN A 73 25.314 -24.965 -8.926 1.00 61.43 C ATOM 1137 C GLN A 73 25.881 -26.322 -9.332 1.00 1.10 C ATOM 1138 O GLN A 73 25.637 -26.803 -10.439 1.00 22.03 O ATOM 1139 CB GLN A 73 26.064 -23.848 -9.653 1.00 41.22 C ATOM 1140 CG GLN A 73 25.629 -22.452 -9.236 1.00 61.14 C ATOM 1141 CD GLN A 73 24.406 -21.972 -9.993 1.00 5.40 C ATOM 1142 OE1 GLN A 73 24.521 -21.304 -11.021 1.00 2.50 O ATOM 1143 NE2 GLN A 73 23.226 -22.310 -9.487 1.00 42.13 N ATOM 0 H GLN A 73 25.996 -24.001 -7.193 1.00 21.40 H new ATOM 0 HA GLN A 73 24.262 -24.931 -9.210 1.00 61.43 H new ATOM 0 HB2 GLN A 73 27.132 -23.958 -9.466 1.00 41.22 H new ATOM 0 HB3 GLN A 73 25.915 -23.961 -10.727 1.00 41.22 H new ATOM 0 HG2 GLN A 73 25.416 -22.446 -8.167 1.00 61.14 H new ATOM 0 HG3 GLN A 73 26.451 -21.755 -9.401 1.00 61.14 H new ATOM 0 HE21 GLN A 73 23.178 -22.865 -8.633 1.00 42.13 H new ATOM 0 HE22 GLN A 73 22.368 -22.015 -9.953 1.00 42.13 H new ATOM 1152 N LYS A 74 26.640 -26.934 -8.429 1.00 73.43 N ATOM 1153 CA LYS A 74 27.242 -28.236 -8.692 1.00 35.34 C ATOM 1154 C LYS A 74 26.326 -29.363 -8.223 1.00 25.11 C ATOM 1155 O LYS A 74 26.226 -30.406 -8.871 1.00 41.55 O ATOM 1156 CB LYS A 74 28.599 -28.344 -7.993 1.00 40.52 C ATOM 1157 CG LYS A 74 28.505 -28.349 -6.477 1.00 55.53 C ATOM 1158 CD LYS A 74 28.442 -29.764 -5.927 1.00 43.51 C ATOM 1159 CE LYS A 74 29.830 -30.302 -5.616 1.00 4.15 C ATOM 1160 NZ LYS A 74 30.262 -29.955 -4.233 1.00 44.03 N ATOM 0 H LYS A 74 26.853 -26.549 -7.509 1.00 73.43 H new ATOM 0 HA LYS A 74 27.386 -28.331 -9.768 1.00 35.34 H new ATOM 0 HB2 LYS A 74 29.095 -29.258 -8.321 1.00 40.52 H new ATOM 0 HB3 LYS A 74 29.227 -27.510 -8.307 1.00 40.52 H new ATOM 0 HG2 LYS A 74 29.368 -27.832 -6.056 1.00 55.53 H new ATOM 0 HG3 LYS A 74 27.619 -27.796 -6.165 1.00 55.53 H new ATOM 0 HD2 LYS A 74 27.834 -29.777 -5.022 1.00 43.51 H new ATOM 0 HD3 LYS A 74 27.952 -30.415 -6.650 1.00 43.51 H new ATOM 0 HE2 LYS A 74 29.835 -31.385 -5.737 1.00 4.15 H new ATOM 0 HE3 LYS A 74 30.545 -29.898 -6.332 1.00 4.15 H new ATOM 0 HZ1 LYS A 74 31.213 -30.339 -4.060 1.00 44.03 H new ATOM 0 HZ2 LYS A 74 30.282 -28.921 -4.125 1.00 44.03 H new ATOM 0 HZ3 LYS A 74 29.594 -30.362 -3.548 1.00 44.03 H new ATOM 1174 N LEU A 75 25.660 -29.147 -7.094 1.00 70.03 N ATOM 1175 CA LEU A 75 24.751 -30.144 -6.540 1.00 22.25 C ATOM 1176 C LEU A 75 23.380 -30.059 -7.201 1.00 74.25 C ATOM 1177 O LEU A 75 22.575 -30.987 -7.109 1.00 31.14 O ATOM 1178 CB LEU A 75 24.613 -29.953 -5.028 1.00 44.41 C ATOM 1179 CG LEU A 75 23.559 -28.944 -4.573 1.00 13.51 C ATOM 1180 CD1 LEU A 75 22.211 -29.625 -4.393 1.00 52.53 C ATOM 1181 CD2 LEU A 75 23.992 -28.265 -3.281 1.00 71.24 C ATOM 0 H LEU A 75 25.732 -28.291 -6.545 1.00 70.03 H new ATOM 0 HA LEU A 75 25.169 -31.131 -6.739 1.00 22.25 H new ATOM 0 HB2 LEU A 75 24.380 -30.919 -4.580 1.00 44.41 H new ATOM 0 HB3 LEU A 75 25.580 -29.642 -4.631 1.00 44.41 H new ATOM 0 HG LEU A 75 23.458 -28.181 -5.345 1.00 13.51 H new ATOM 0 HD11 LEU A 75 21.473 -28.891 -4.069 1.00 52.53 H new ATOM 0 HD12 LEU A 75 21.895 -30.063 -5.340 1.00 52.53 H new ATOM 0 HD13 LEU A 75 22.297 -30.409 -3.641 1.00 52.53 H new ATOM 0 HD21 LEU A 75 23.229 -27.550 -2.972 1.00 71.24 H new ATOM 0 HD22 LEU A 75 24.122 -29.016 -2.501 1.00 71.24 H new ATOM 0 HD23 LEU A 75 24.935 -27.742 -3.443 1.00 71.24 H new ATOM 1193 N LEU A 76 23.120 -28.942 -7.871 1.00 42.23 N ATOM 1194 CA LEU A 76 21.846 -28.736 -8.552 1.00 3.12 C ATOM 1195 C LEU A 76 21.611 -29.814 -9.605 1.00 32.24 C ATOM 1196 O LEU A 76 20.473 -30.086 -9.985 1.00 50.12 O ATOM 1197 CB LEU A 76 21.812 -27.353 -9.205 1.00 62.10 C ATOM 1198 CG LEU A 76 20.546 -26.530 -8.968 1.00 12.35 C ATOM 1199 CD1 LEU A 76 20.307 -26.335 -7.478 1.00 61.13 C ATOM 1200 CD2 LEU A 76 20.643 -25.185 -9.674 1.00 65.40 C ATOM 0 H LEU A 76 23.775 -28.164 -7.958 1.00 42.23 H new ATOM 0 HA LEU A 76 21.051 -28.800 -7.809 1.00 3.12 H new ATOM 0 HB2 LEU A 76 22.666 -26.781 -8.843 1.00 62.10 H new ATOM 0 HB3 LEU A 76 21.945 -27.477 -10.280 1.00 62.10 H new ATOM 0 HG LEU A 76 19.699 -27.076 -9.383 1.00 12.35 H new ATOM 0 HD11 LEU A 76 19.402 -25.747 -7.329 1.00 61.13 H new ATOM 0 HD12 LEU A 76 20.192 -27.307 -6.998 1.00 61.13 H new ATOM 0 HD13 LEU A 76 21.156 -25.812 -7.039 1.00 61.13 H new ATOM 0 HD21 LEU A 76 19.733 -24.613 -9.494 1.00 65.40 H new ATOM 0 HD22 LEU A 76 21.500 -24.633 -9.289 1.00 65.40 H new ATOM 0 HD23 LEU A 76 20.765 -25.344 -10.745 1.00 65.40 H new ATOM 1212 N ASN A 77 22.695 -30.427 -10.070 1.00 12.34 N ATOM 1213 CA ASN A 77 22.606 -31.477 -11.077 1.00 61.14 C ATOM 1214 C ASN A 77 22.593 -32.857 -10.426 1.00 3.42 C ATOM 1215 O ASN A 77 22.605 -33.880 -11.111 1.00 13.51 O ATOM 1216 CB ASN A 77 23.778 -31.374 -12.056 1.00 54.12 C ATOM 1217 CG ASN A 77 23.468 -30.472 -13.235 1.00 41.22 C ATOM 1218 OD1 ASN A 77 22.914 -30.915 -14.241 1.00 52.33 O ATOM 1219 ND2 ASN A 77 23.826 -29.199 -13.116 1.00 5.31 N ATOM 0 H ASN A 77 23.645 -30.214 -9.765 1.00 12.34 H new ATOM 0 HA ASN A 77 21.672 -31.344 -11.623 1.00 61.14 H new ATOM 0 HB2 ASN A 77 24.654 -30.993 -11.531 1.00 54.12 H new ATOM 0 HB3 ASN A 77 24.032 -32.369 -12.420 1.00 54.12 H new ATOM 0 HD21 ASN A 77 23.644 -28.545 -13.877 1.00 5.31 H new ATOM 0 HD22 ASN A 77 24.283 -28.875 -12.264 1.00 5.31 H new ATOM 1226 N LYS A 78 22.569 -32.877 -9.098 1.00 30.15 N ATOM 1227 CA LYS A 78 22.553 -34.130 -8.351 1.00 54.34 C ATOM 1228 C LYS A 78 21.180 -34.377 -7.734 1.00 30.22 C ATOM 1229 O LYS A 78 20.817 -35.517 -7.442 1.00 14.34 O ATOM 1230 CB LYS A 78 23.620 -34.108 -7.255 1.00 64.33 C ATOM 1231 CG LYS A 78 25.032 -33.926 -7.785 1.00 62.40 C ATOM 1232 CD LYS A 78 26.071 -34.338 -6.756 1.00 4.55 C ATOM 1233 CE LYS A 78 27.349 -34.829 -7.419 1.00 10.23 C ATOM 1234 NZ LYS A 78 28.217 -35.575 -6.466 1.00 72.21 N ATOM 0 H LYS A 78 22.560 -32.039 -8.516 1.00 30.15 H new ATOM 0 HA LYS A 78 22.772 -34.941 -9.045 1.00 54.34 H new ATOM 0 HB2 LYS A 78 23.396 -33.301 -6.557 1.00 64.33 H new ATOM 0 HB3 LYS A 78 23.570 -35.040 -6.692 1.00 64.33 H new ATOM 0 HG2 LYS A 78 25.161 -34.518 -8.691 1.00 62.40 H new ATOM 0 HG3 LYS A 78 25.186 -32.883 -8.062 1.00 62.40 H new ATOM 0 HD2 LYS A 78 26.298 -33.492 -6.108 1.00 4.55 H new ATOM 0 HD3 LYS A 78 25.664 -35.125 -6.121 1.00 4.55 H new ATOM 0 HE2 LYS A 78 27.097 -35.473 -8.261 1.00 10.23 H new ATOM 0 HE3 LYS A 78 27.899 -33.979 -7.822 1.00 10.23 H new ATOM 0 HZ1 LYS A 78 29.078 -35.893 -6.956 1.00 72.21 H new ATOM 0 HZ2 LYS A 78 28.479 -34.953 -5.675 1.00 72.21 H new ATOM 0 HZ3 LYS A 78 27.702 -36.401 -6.101 1.00 72.21 H new ATOM 1248 N ASP A 79 20.422 -33.304 -7.539 1.00 53.02 N ATOM 1249 CA ASP A 79 19.088 -33.405 -6.959 1.00 33.32 C ATOM 1250 C ASP A 79 18.141 -34.146 -7.898 1.00 63.41 C ATOM 1251 O ASP A 79 17.105 -34.659 -7.474 1.00 73.44 O ATOM 1252 CB ASP A 79 18.535 -32.013 -6.652 1.00 13.31 C ATOM 1253 CG ASP A 79 19.505 -31.168 -5.850 1.00 22.33 C ATOM 1254 OD1 ASP A 79 20.249 -31.740 -5.026 1.00 24.53 O ATOM 1255 OD2 ASP A 79 19.521 -29.935 -6.046 1.00 61.43 O ATOM 0 H ASP A 79 20.709 -32.354 -7.774 1.00 53.02 H new ATOM 0 HA ASP A 79 19.165 -33.970 -6.030 1.00 33.32 H new ATOM 0 HB2 ASP A 79 18.301 -31.504 -7.587 1.00 13.31 H new ATOM 0 HB3 ASP A 79 17.600 -32.110 -6.100 1.00 13.31 H new ATOM 1260 N LEU A 80 18.504 -34.198 -9.175 1.00 52.10 N ATOM 1261 CA LEU A 80 17.686 -34.875 -10.176 1.00 25.54 C ATOM 1262 C LEU A 80 18.350 -36.169 -10.636 1.00 24.34 C ATOM 1263 O LEU A 80 17.711 -37.022 -11.250 1.00 32.40 O ATOM 1264 CB LEU A 80 17.448 -33.957 -11.375 1.00 40.32 C ATOM 1265 CG LEU A 80 18.592 -33.007 -11.731 1.00 43.11 C ATOM 1266 CD1 LEU A 80 19.863 -33.789 -12.027 1.00 55.13 C ATOM 1267 CD2 LEU A 80 18.212 -32.135 -12.919 1.00 14.34 C ATOM 0 H LEU A 80 19.359 -33.780 -9.542 1.00 52.10 H new ATOM 0 HA LEU A 80 16.727 -35.122 -9.720 1.00 25.54 H new ATOM 0 HB2 LEU A 80 17.234 -34.577 -12.245 1.00 40.32 H new ATOM 0 HB3 LEU A 80 16.556 -33.362 -11.180 1.00 40.32 H new ATOM 0 HG LEU A 80 18.779 -32.359 -10.875 1.00 43.11 H new ATOM 0 HD11 LEU A 80 20.666 -33.096 -12.278 1.00 55.13 H new ATOM 0 HD12 LEU A 80 20.146 -34.369 -11.149 1.00 55.13 H new ATOM 0 HD13 LEU A 80 19.689 -34.462 -12.866 1.00 55.13 H new ATOM 0 HD21 LEU A 80 19.038 -31.465 -13.158 1.00 14.34 H new ATOM 0 HD22 LEU A 80 17.997 -32.767 -13.780 1.00 14.34 H new ATOM 0 HD23 LEU A 80 17.329 -31.547 -12.671 1.00 14.34 H new ATOM 1279 N ALA A 81 19.637 -36.309 -10.332 1.00 53.30 N ATOM 1280 CA ALA A 81 20.386 -37.500 -10.710 1.00 62.25 C ATOM 1281 C ALA A 81 19.791 -38.750 -10.070 1.00 51.33 C ATOM 1282 O ALA A 81 19.814 -39.830 -10.658 1.00 64.24 O ATOM 1283 CB ALA A 81 21.849 -37.350 -10.319 1.00 71.21 C ATOM 0 H ALA A 81 20.182 -35.612 -9.825 1.00 53.30 H new ATOM 0 HA ALA A 81 20.320 -37.612 -11.792 1.00 62.25 H new ATOM 0 HB1 ALA A 81 22.397 -38.247 -10.607 1.00 71.21 H new ATOM 0 HB2 ALA A 81 22.275 -36.486 -10.828 1.00 71.21 H new ATOM 0 HB3 ALA A 81 21.925 -37.210 -9.241 1.00 71.21 H new ATOM 1289 N GLU A 82 19.259 -38.594 -8.862 1.00 54.31 N ATOM 1290 CA GLU A 82 18.659 -39.711 -8.142 1.00 73.14 C ATOM 1291 C GLU A 82 17.176 -39.841 -8.477 1.00 54.44 C ATOM 1292 O GLU A 82 16.599 -40.926 -8.387 1.00 4.41 O ATOM 1293 CB GLU A 82 18.838 -39.530 -6.634 1.00 0.04 C ATOM 1294 CG GLU A 82 20.273 -39.250 -6.221 1.00 1.44 C ATOM 1295 CD GLU A 82 21.171 -40.462 -6.373 1.00 4.35 C ATOM 1296 OE1 GLU A 82 20.727 -41.577 -6.029 1.00 41.00 O ATOM 1297 OE2 GLU A 82 22.319 -40.294 -6.836 1.00 22.44 O ATOM 0 H GLU A 82 19.231 -37.706 -8.362 1.00 54.31 H new ATOM 0 HA GLU A 82 19.166 -40.624 -8.454 1.00 73.14 H new ATOM 0 HB2 GLU A 82 18.205 -38.709 -6.297 1.00 0.04 H new ATOM 0 HB3 GLU A 82 18.491 -40.429 -6.125 1.00 0.04 H new ATOM 0 HG2 GLU A 82 20.668 -38.432 -6.824 1.00 1.44 H new ATOM 0 HG3 GLU A 82 20.290 -38.918 -5.183 1.00 1.44 H new ATOM 1304 N LEU A 83 16.563 -38.727 -8.864 1.00 62.01 N ATOM 1305 CA LEU A 83 15.147 -38.714 -9.213 1.00 34.44 C ATOM 1306 C LEU A 83 14.908 -39.414 -10.547 1.00 11.21 C ATOM 1307 O LEU A 83 14.041 -40.281 -10.658 1.00 13.02 O ATOM 1308 CB LEU A 83 14.630 -37.276 -9.278 1.00 62.01 C ATOM 1309 CG LEU A 83 13.317 -37.068 -10.033 1.00 33.21 C ATOM 1310 CD1 LEU A 83 12.249 -38.022 -9.520 1.00 25.52 C ATOM 1311 CD2 LEU A 83 12.851 -35.625 -9.905 1.00 34.31 C ATOM 0 H LEU A 83 17.025 -37.821 -8.944 1.00 62.01 H new ATOM 0 HA LEU A 83 14.603 -39.254 -8.438 1.00 34.44 H new ATOM 0 HB2 LEU A 83 14.502 -36.911 -8.259 1.00 62.01 H new ATOM 0 HB3 LEU A 83 15.396 -36.657 -9.744 1.00 62.01 H new ATOM 0 HG LEU A 83 13.489 -37.281 -11.088 1.00 33.21 H new ATOM 0 HD11 LEU A 83 11.322 -37.859 -10.069 1.00 25.52 H new ATOM 0 HD12 LEU A 83 12.580 -39.050 -9.664 1.00 25.52 H new ATOM 0 HD13 LEU A 83 12.079 -37.841 -8.459 1.00 25.52 H new ATOM 0 HD21 LEU A 83 11.915 -35.495 -10.449 1.00 34.31 H new ATOM 0 HD22 LEU A 83 12.696 -35.385 -8.853 1.00 34.31 H new ATOM 0 HD23 LEU A 83 13.608 -34.960 -10.321 1.00 34.31 H new ATOM 1323 N ILE A 84 15.684 -39.033 -11.556 1.00 13.50 N ATOM 1324 CA ILE A 84 15.559 -39.626 -12.882 1.00 15.44 C ATOM 1325 C ILE A 84 15.950 -41.099 -12.864 1.00 23.23 C ATOM 1326 O ILE A 84 15.235 -41.948 -13.394 1.00 21.45 O ATOM 1327 CB ILE A 84 16.431 -38.887 -13.914 1.00 13.44 C ATOM 1328 CG1 ILE A 84 16.016 -37.417 -14.005 1.00 3.55 C ATOM 1329 CG2 ILE A 84 16.324 -39.558 -15.275 1.00 10.22 C ATOM 1330 CD1 ILE A 84 17.156 -36.488 -14.362 1.00 21.52 C ATOM 0 H ILE A 84 16.406 -38.316 -11.481 1.00 13.50 H new ATOM 0 HA ILE A 84 14.512 -39.534 -13.171 1.00 15.44 H new ATOM 0 HB ILE A 84 17.470 -38.932 -13.589 1.00 13.44 H new ATOM 0 HG12 ILE A 84 15.228 -37.316 -14.751 1.00 3.55 H new ATOM 0 HG13 ILE A 84 15.592 -37.108 -13.050 1.00 3.55 H new ATOM 0 HG21 ILE A 84 16.946 -39.024 -15.994 1.00 10.22 H new ATOM 0 HG22 ILE A 84 16.663 -40.591 -15.199 1.00 10.22 H new ATOM 0 HG23 ILE A 84 15.287 -39.540 -15.609 1.00 10.22 H new ATOM 0 HD11 ILE A 84 16.789 -35.463 -14.409 1.00 21.52 H new ATOM 0 HD12 ILE A 84 17.935 -36.560 -13.603 1.00 21.52 H new ATOM 0 HD13 ILE A 84 17.566 -36.771 -15.331 1.00 21.52 H new ATOM 1342 N ASN A 85 17.091 -41.395 -12.249 1.00 32.33 N ATOM 1343 CA ASN A 85 17.578 -42.767 -12.160 1.00 73.12 C ATOM 1344 C ASN A 85 16.541 -43.671 -11.499 1.00 42.33 C ATOM 1345 O ASN A 85 16.519 -44.880 -11.728 1.00 61.22 O ATOM 1346 CB ASN A 85 18.889 -42.815 -11.373 1.00 33.21 C ATOM 1347 CG ASN A 85 20.089 -42.455 -12.227 1.00 24.44 C ATOM 1348 OD1 ASN A 85 21.122 -43.124 -12.179 1.00 31.22 O ATOM 1349 ND2 ASN A 85 19.959 -41.394 -13.013 1.00 52.34 N ATOM 0 H ASN A 85 17.695 -40.703 -11.805 1.00 32.33 H new ATOM 0 HA ASN A 85 17.757 -43.129 -13.172 1.00 73.12 H new ATOM 0 HB2 ASN A 85 18.828 -42.128 -10.529 1.00 33.21 H new ATOM 0 HB3 ASN A 85 19.026 -43.815 -10.961 1.00 33.21 H new ATOM 0 HD21 ASN A 85 20.734 -41.103 -13.610 1.00 52.34 H new ATOM 0 HD22 ASN A 85 19.084 -40.869 -13.021 1.00 52.34 H new ATOM 1356 N LYS A 86 15.683 -43.075 -10.678 1.00 73.15 N ATOM 1357 CA LYS A 86 14.641 -43.824 -9.985 1.00 5.11 C ATOM 1358 C LYS A 86 13.413 -43.996 -10.872 1.00 34.21 C ATOM 1359 O LYS A 86 12.615 -44.911 -10.672 1.00 33.53 O ATOM 1360 CB LYS A 86 14.251 -43.112 -8.687 1.00 63.53 C ATOM 1361 CG LYS A 86 13.585 -44.023 -7.671 1.00 21.52 C ATOM 1362 CD LYS A 86 14.059 -43.724 -6.259 1.00 1.15 C ATOM 1363 CE LYS A 86 14.719 -44.938 -5.623 1.00 34.13 C ATOM 1364 NZ LYS A 86 13.727 -45.999 -5.292 1.00 53.42 N ATOM 0 H LYS A 86 15.689 -42.075 -10.476 1.00 73.15 H new ATOM 0 HA LYS A 86 15.035 -44.812 -9.746 1.00 5.11 H new ATOM 0 HB2 LYS A 86 15.144 -42.674 -8.240 1.00 63.53 H new ATOM 0 HB3 LYS A 86 13.576 -42.289 -8.922 1.00 63.53 H new ATOM 0 HG2 LYS A 86 12.503 -43.901 -7.726 1.00 21.52 H new ATOM 0 HG3 LYS A 86 13.802 -45.063 -7.916 1.00 21.52 H new ATOM 0 HD2 LYS A 86 14.765 -42.894 -6.279 1.00 1.15 H new ATOM 0 HD3 LYS A 86 13.213 -43.408 -5.649 1.00 1.15 H new ATOM 0 HE2 LYS A 86 15.469 -45.342 -6.303 1.00 34.13 H new ATOM 0 HE3 LYS A 86 15.242 -44.634 -4.716 1.00 34.13 H new ATOM 0 HZ1 LYS A 86 13.559 -46.009 -4.266 1.00 53.42 H new ATOM 0 HZ2 LYS A 86 12.833 -45.805 -5.787 1.00 53.42 H new ATOM 0 HZ3 LYS A 86 14.095 -46.924 -5.592 1.00 53.42 H new ATOM 1378 N MET A 87 13.268 -43.111 -11.853 1.00 32.41 N ATOM 1379 CA MET A 87 12.137 -43.168 -12.772 1.00 70.30 C ATOM 1380 C MET A 87 12.264 -44.359 -13.717 1.00 42.44 C ATOM 1381 O MET A 87 11.361 -45.190 -13.809 1.00 54.40 O ATOM 1382 CB MET A 87 12.041 -41.871 -13.577 1.00 13.21 C ATOM 1383 CG MET A 87 11.119 -41.970 -14.781 1.00 54.23 C ATOM 1384 SD MET A 87 9.466 -42.545 -14.345 1.00 41.45 S ATOM 1385 CE MET A 87 8.687 -41.004 -13.868 1.00 31.35 C ATOM 0 H MET A 87 13.919 -42.346 -12.032 1.00 32.41 H new ATOM 0 HA MET A 87 11.228 -43.290 -12.183 1.00 70.30 H new ATOM 0 HB2 MET A 87 11.688 -41.073 -12.924 1.00 13.21 H new ATOM 0 HB3 MET A 87 13.038 -41.588 -13.915 1.00 13.21 H new ATOM 0 HG2 MET A 87 11.045 -40.993 -15.259 1.00 54.23 H new ATOM 0 HG3 MET A 87 11.555 -42.650 -15.513 1.00 54.23 H new ATOM 0 HE1 MET A 87 7.813 -41.214 -13.251 1.00 31.35 H new ATOM 0 HE2 MET A 87 9.395 -40.399 -13.301 1.00 31.35 H new ATOM 0 HE3 MET A 87 8.379 -40.461 -14.761 1.00 31.35 H new ATOM 1395 N ARG A 88 13.391 -44.434 -14.419 1.00 12.15 N ATOM 1396 CA ARG A 88 13.635 -45.522 -15.358 1.00 14.21 C ATOM 1397 C ARG A 88 13.735 -46.858 -14.628 1.00 71.11 C ATOM 1398 O ARG A 88 13.665 -47.922 -15.245 1.00 55.35 O ATOM 1399 CB ARG A 88 14.918 -45.263 -16.149 1.00 3.01 C ATOM 1400 CG ARG A 88 16.140 -45.043 -15.272 1.00 22.41 C ATOM 1401 CD ARG A 88 17.391 -44.814 -16.106 1.00 53.12 C ATOM 1402 NE ARG A 88 17.694 -45.957 -16.964 1.00 10.44 N ATOM 1403 CZ ARG A 88 18.619 -45.935 -17.916 1.00 62.35 C ATOM 1404 NH1 ARG A 88 19.328 -44.836 -18.132 1.00 41.24 N ATOM 1405 NH2 ARG A 88 18.837 -47.016 -18.655 1.00 43.45 N ATOM 0 H ARG A 88 14.149 -43.754 -14.355 1.00 12.15 H new ATOM 0 HA ARG A 88 12.793 -45.568 -16.049 1.00 14.21 H new ATOM 0 HB2 ARG A 88 15.104 -46.109 -16.811 1.00 3.01 H new ATOM 0 HB3 ARG A 88 14.774 -44.388 -16.783 1.00 3.01 H new ATOM 0 HG2 ARG A 88 15.973 -44.184 -14.622 1.00 22.41 H new ATOM 0 HG3 ARG A 88 16.286 -45.908 -14.626 1.00 22.41 H new ATOM 0 HD2 ARG A 88 17.259 -43.924 -16.721 1.00 53.12 H new ATOM 0 HD3 ARG A 88 18.237 -44.622 -15.446 1.00 53.12 H new ATOM 0 HE ARG A 88 17.166 -46.819 -16.824 1.00 10.44 H new ATOM 0 HH11 ARG A 88 19.164 -44.004 -17.566 1.00 41.24 H new ATOM 0 HH12 ARG A 88 20.038 -44.823 -18.864 1.00 41.24 H new ATOM 0 HH21 ARG A 88 18.294 -47.864 -18.491 1.00 43.45 H new ATOM 0 HH22 ARG A 88 19.548 -46.999 -19.386 1.00 43.45 H new ATOM 1419 N LEU A 89 13.900 -46.796 -13.312 1.00 21.25 N ATOM 1420 CA LEU A 89 14.011 -48.001 -12.497 1.00 34.23 C ATOM 1421 C LEU A 89 12.672 -48.348 -11.852 1.00 42.53 C ATOM 1422 O LEU A 89 12.407 -49.506 -11.533 1.00 61.02 O ATOM 1423 CB LEU A 89 15.077 -47.814 -11.416 1.00 13.31 C ATOM 1424 CG LEU A 89 15.075 -48.844 -10.286 1.00 2.11 C ATOM 1425 CD1 LEU A 89 15.482 -50.212 -10.810 1.00 62.14 C ATOM 1426 CD2 LEU A 89 16.002 -48.404 -9.162 1.00 63.11 C ATOM 0 H LEU A 89 13.960 -45.924 -12.786 1.00 21.25 H new ATOM 0 HA LEU A 89 14.304 -48.824 -13.149 1.00 34.23 H new ATOM 0 HB2 LEU A 89 16.057 -47.830 -11.893 1.00 13.31 H new ATOM 0 HB3 LEU A 89 14.952 -46.824 -10.978 1.00 13.31 H new ATOM 0 HG LEU A 89 14.063 -48.917 -9.888 1.00 2.11 H new ATOM 0 HD11 LEU A 89 15.475 -50.932 -9.992 1.00 62.14 H new ATOM 0 HD12 LEU A 89 14.779 -50.531 -11.580 1.00 62.14 H new ATOM 0 HD13 LEU A 89 16.484 -50.155 -11.235 1.00 62.14 H new ATOM 0 HD21 LEU A 89 15.988 -49.149 -8.366 1.00 63.11 H new ATOM 0 HD22 LEU A 89 17.017 -48.302 -9.546 1.00 63.11 H new ATOM 0 HD23 LEU A 89 15.666 -47.445 -8.767 1.00 63.11 H new ATOM 1438 N ALA A 90 11.832 -47.335 -11.666 1.00 75.20 N ATOM 1439 CA ALA A 90 10.519 -47.533 -11.064 1.00 71.20 C ATOM 1440 C ALA A 90 9.484 -47.915 -12.117 1.00 20.21 C ATOM 1441 O ALA A 90 8.775 -48.910 -11.970 1.00 63.53 O ATOM 1442 CB ALA A 90 10.083 -46.277 -10.324 1.00 31.52 C ATOM 0 H ALA A 90 12.037 -46.370 -11.923 1.00 75.20 H new ATOM 0 HA ALA A 90 10.594 -48.354 -10.351 1.00 71.20 H new ATOM 0 HB1 ALA A 90 9.101 -46.439 -9.879 1.00 31.52 H new ATOM 0 HB2 ALA A 90 10.804 -46.049 -9.539 1.00 31.52 H new ATOM 0 HB3 ALA A 90 10.032 -45.442 -11.023 1.00 31.52 H new ATOM 1448 N GLN A 91 9.403 -47.117 -13.177 1.00 33.42 N ATOM 1449 CA GLN A 91 8.453 -47.372 -14.253 1.00 73.31 C ATOM 1450 C GLN A 91 8.778 -48.680 -14.968 1.00 40.41 C ATOM 1451 O GLN A 91 7.931 -49.248 -15.656 1.00 71.32 O ATOM 1452 CB GLN A 91 8.460 -46.215 -15.253 1.00 40.22 C ATOM 1453 CG GLN A 91 9.665 -46.219 -16.180 1.00 72.42 C ATOM 1454 CD GLN A 91 9.895 -44.876 -16.845 1.00 32.51 C ATOM 1455 OE1 GLN A 91 11.024 -44.391 -16.915 1.00 2.20 O ATOM 1456 NE2 GLN A 91 8.822 -44.268 -17.338 1.00 23.12 N ATOM 0 H GLN A 91 9.983 -46.289 -13.313 1.00 33.42 H new ATOM 0 HA GLN A 91 7.459 -47.457 -13.813 1.00 73.31 H new ATOM 0 HB2 GLN A 91 7.551 -46.258 -15.853 1.00 40.22 H new ATOM 0 HB3 GLN A 91 8.436 -45.273 -14.706 1.00 40.22 H new ATOM 0 HG2 GLN A 91 10.554 -46.496 -15.613 1.00 72.42 H new ATOM 0 HG3 GLN A 91 9.526 -46.981 -16.947 1.00 72.42 H new ATOM 0 HE21 GLN A 91 7.905 -44.707 -17.258 1.00 23.12 H new ATOM 0 HE22 GLN A 91 8.915 -43.362 -17.797 1.00 23.12 H new ATOM 1465 N GLN A 92 10.010 -49.149 -14.800 1.00 71.52 N ATOM 1466 CA GLN A 92 10.447 -50.389 -15.431 1.00 34.50 C ATOM 1467 C GLN A 92 9.484 -51.529 -15.116 1.00 35.25 C ATOM 1468 O GLN A 92 8.783 -51.500 -14.105 1.00 74.40 O ATOM 1469 CB GLN A 92 11.857 -50.754 -14.965 1.00 62.21 C ATOM 1470 CG GLN A 92 12.459 -51.933 -15.712 1.00 72.52 C ATOM 1471 CD GLN A 92 12.156 -53.262 -15.047 1.00 50.41 C ATOM 1472 OE1 GLN A 92 11.682 -54.198 -15.691 1.00 64.14 O ATOM 1473 NE2 GLN A 92 12.428 -53.350 -13.750 1.00 65.45 N ATOM 0 H GLN A 92 10.723 -48.690 -14.233 1.00 71.52 H new ATOM 0 HA GLN A 92 10.457 -50.234 -16.510 1.00 34.50 H new ATOM 0 HB2 GLN A 92 12.507 -49.887 -15.087 1.00 62.21 H new ATOM 0 HB3 GLN A 92 11.830 -50.985 -13.900 1.00 62.21 H new ATOM 0 HG2 GLN A 92 12.076 -51.946 -16.732 1.00 72.52 H new ATOM 0 HG3 GLN A 92 13.539 -51.803 -15.779 1.00 72.52 H new ATOM 0 HE21 GLN A 92 12.820 -52.549 -13.256 1.00 65.45 H new ATOM 0 HE22 GLN A 92 12.244 -54.219 -13.248 1.00 65.45 H new ATOM 1482 N ASN A 93 9.455 -52.532 -15.988 1.00 13.52 N ATOM 1483 CA ASN A 93 8.576 -53.681 -15.802 1.00 65.05 C ATOM 1484 C ASN A 93 9.099 -54.592 -14.695 1.00 54.52 C ATOM 1485 O ASN A 93 9.657 -55.655 -14.964 1.00 1.34 O ATOM 1486 CB ASN A 93 8.450 -54.468 -17.108 1.00 70.43 C ATOM 1487 CG ASN A 93 7.772 -53.667 -18.203 1.00 62.21 C ATOM 1488 OD1 ASN A 93 8.430 -53.143 -19.102 1.00 2.54 O ATOM 1489 ND2 ASN A 93 6.450 -53.569 -18.132 1.00 72.31 N ATOM 0 H ASN A 93 10.030 -52.572 -16.830 1.00 13.52 H new ATOM 0 HA ASN A 93 7.593 -53.312 -15.511 1.00 65.05 H new ATOM 0 HB2 ASN A 93 9.442 -54.770 -17.444 1.00 70.43 H new ATOM 0 HB3 ASN A 93 7.883 -55.381 -16.926 1.00 70.43 H new ATOM 0 HD21 ASN A 93 5.939 -53.043 -18.841 1.00 72.31 H new ATOM 0 HD22 ASN A 93 5.945 -54.020 -17.369 1.00 72.31 H new ATOM 1496 N ALA A 94 8.912 -54.166 -13.450 1.00 20.41 N ATOM 1497 CA ALA A 94 9.361 -54.944 -12.302 1.00 24.11 C ATOM 1498 C ALA A 94 8.179 -55.541 -11.547 1.00 30.44 C ATOM 1499 O ALA A 94 7.231 -54.837 -11.200 1.00 11.22 O ATOM 1500 CB ALA A 94 10.200 -54.078 -11.374 1.00 20.15 C ATOM 0 H ALA A 94 8.453 -53.287 -13.211 1.00 20.41 H new ATOM 0 HA ALA A 94 9.976 -55.766 -12.669 1.00 24.11 H new ATOM 0 HB1 ALA A 94 10.529 -54.671 -10.521 1.00 20.15 H new ATOM 0 HB2 ALA A 94 11.071 -53.704 -11.913 1.00 20.15 H new ATOM 0 HB3 ALA A 94 9.603 -53.237 -11.022 1.00 20.15 H new ATOM 1506 N VAL A 95 8.241 -56.845 -11.295 1.00 71.22 N ATOM 1507 CA VAL A 95 7.175 -57.537 -10.581 1.00 22.55 C ATOM 1508 C VAL A 95 7.593 -57.863 -9.151 1.00 43.10 C ATOM 1509 O VAL A 95 7.897 -59.012 -8.827 1.00 12.54 O ATOM 1510 CB VAL A 95 6.774 -58.841 -11.296 1.00 25.31 C ATOM 1511 CG1 VAL A 95 5.548 -59.456 -10.639 1.00 53.31 C ATOM 1512 CG2 VAL A 95 6.525 -58.582 -12.774 1.00 33.40 C ATOM 0 H VAL A 95 9.018 -57.443 -11.575 1.00 71.22 H new ATOM 0 HA VAL A 95 6.318 -56.863 -10.562 1.00 22.55 H new ATOM 0 HB VAL A 95 7.596 -59.551 -11.208 1.00 25.31 H new ATOM 0 HG11 VAL A 95 5.280 -60.376 -11.158 1.00 53.31 H new ATOM 0 HG12 VAL A 95 5.768 -59.679 -9.595 1.00 53.31 H new ATOM 0 HG13 VAL A 95 4.716 -58.754 -10.692 1.00 53.31 H new ATOM 0 HG21 VAL A 95 6.243 -59.514 -13.264 1.00 33.40 H new ATOM 0 HG22 VAL A 95 5.720 -57.855 -12.886 1.00 33.40 H new ATOM 0 HG23 VAL A 95 7.433 -58.191 -13.233 1.00 33.40 H new ATOM 1522 N THR A 96 7.607 -56.844 -8.298 1.00 11.44 N ATOM 1523 CA THR A 96 7.988 -57.020 -6.902 1.00 64.21 C ATOM 1524 C THR A 96 7.404 -55.916 -6.028 1.00 61.14 C ATOM 1525 O THR A 96 7.091 -54.829 -6.513 1.00 12.44 O ATOM 1526 CB THR A 96 9.520 -57.035 -6.736 1.00 13.52 C ATOM 1527 OG1 THR A 96 9.861 -57.135 -5.349 1.00 11.13 O ATOM 1528 CG2 THR A 96 10.140 -55.777 -7.326 1.00 71.21 C ATOM 0 H THR A 96 7.359 -55.887 -8.550 1.00 11.44 H new ATOM 0 HA THR A 96 7.585 -57.982 -6.584 1.00 64.21 H new ATOM 0 HB THR A 96 9.913 -57.900 -7.270 1.00 13.52 H new ATOM 0 HG1 THR A 96 10.836 -57.146 -5.252 1.00 11.13 H new ATOM 0 HG21 THR A 96 11.222 -55.810 -7.197 1.00 71.21 H new ATOM 0 HG22 THR A 96 9.903 -55.718 -8.388 1.00 71.21 H new ATOM 0 HG23 THR A 96 9.740 -54.901 -6.816 1.00 71.21 H new ATOM 1536 N SER A 97 7.260 -56.202 -4.738 1.00 64.34 N ATOM 1537 CA SER A 97 6.710 -55.234 -3.797 1.00 44.32 C ATOM 1538 C SER A 97 7.500 -53.929 -3.837 1.00 1.12 C ATOM 1539 O SER A 97 6.951 -52.850 -3.611 1.00 54.24 O ATOM 1540 CB SER A 97 6.721 -55.807 -2.379 1.00 1.44 C ATOM 1541 OG SER A 97 6.137 -54.901 -1.458 1.00 71.05 O ATOM 0 H SER A 97 7.517 -57.097 -4.321 1.00 64.34 H new ATOM 0 HA SER A 97 5.681 -55.025 -4.088 1.00 44.32 H new ATOM 0 HB2 SER A 97 6.176 -56.751 -2.361 1.00 1.44 H new ATOM 0 HB3 SER A 97 7.746 -56.025 -2.079 1.00 1.44 H new ATOM 0 HG SER A 97 6.155 -55.291 -0.559 1.00 71.05 H new ATOM 1547 N LEU A 98 8.792 -54.036 -4.125 1.00 5.41 N ATOM 1548 CA LEU A 98 9.660 -52.865 -4.195 1.00 10.23 C ATOM 1549 C LEU A 98 9.124 -51.849 -5.198 1.00 15.43 C ATOM 1550 O LEU A 98 9.394 -50.653 -5.090 1.00 10.43 O ATOM 1551 CB LEU A 98 11.080 -53.280 -4.582 1.00 62.44 C ATOM 1552 CG LEU A 98 12.040 -53.551 -3.424 1.00 22.44 C ATOM 1553 CD1 LEU A 98 12.226 -52.299 -2.581 1.00 23.34 C ATOM 1554 CD2 LEU A 98 11.532 -54.702 -2.568 1.00 35.14 C ATOM 0 H LEU A 98 9.262 -54.921 -4.314 1.00 5.41 H new ATOM 0 HA LEU A 98 9.680 -52.400 -3.210 1.00 10.23 H new ATOM 0 HB2 LEU A 98 11.020 -54.179 -5.195 1.00 62.44 H new ATOM 0 HB3 LEU A 98 11.508 -52.496 -5.207 1.00 62.44 H new ATOM 0 HG LEU A 98 13.008 -53.833 -3.838 1.00 22.44 H new ATOM 0 HD11 LEU A 98 12.913 -52.511 -1.761 1.00 23.34 H new ATOM 0 HD12 LEU A 98 12.636 -51.501 -3.200 1.00 23.34 H new ATOM 0 HD13 LEU A 98 11.263 -51.987 -2.176 1.00 23.34 H new ATOM 0 HD21 LEU A 98 12.228 -54.881 -1.748 1.00 35.14 H new ATOM 0 HD22 LEU A 98 10.552 -54.449 -2.163 1.00 35.14 H new ATOM 0 HD23 LEU A 98 11.452 -55.601 -3.178 1.00 35.14 H new ATOM 1566 N SER A 99 8.360 -52.333 -6.172 1.00 40.21 N ATOM 1567 CA SER A 99 7.786 -51.467 -7.196 1.00 3.14 C ATOM 1568 C SER A 99 7.001 -50.323 -6.562 1.00 11.14 C ATOM 1569 O SER A 99 6.879 -49.244 -7.141 1.00 23.21 O ATOM 1570 CB SER A 99 6.876 -52.273 -8.124 1.00 34.03 C ATOM 1571 OG SER A 99 6.254 -51.435 -9.083 1.00 4.13 O ATOM 0 H SER A 99 8.124 -53.320 -6.274 1.00 40.21 H new ATOM 0 HA SER A 99 8.604 -51.044 -7.779 1.00 3.14 H new ATOM 0 HB2 SER A 99 7.458 -53.042 -8.632 1.00 34.03 H new ATOM 0 HB3 SER A 99 6.115 -52.786 -7.536 1.00 34.03 H new ATOM 0 HG SER A 99 5.679 -51.975 -9.665 1.00 4.13 H new ATOM 1577 N GLU A 100 6.470 -50.568 -5.368 1.00 30.23 N ATOM 1578 CA GLU A 100 5.695 -49.559 -4.655 1.00 63.10 C ATOM 1579 C GLU A 100 6.614 -48.586 -3.922 1.00 12.31 C ATOM 1580 O GLU A 100 6.370 -47.380 -3.905 1.00 52.22 O ATOM 1581 CB GLU A 100 4.741 -50.225 -3.661 1.00 5.52 C ATOM 1582 CG GLU A 100 3.542 -50.886 -4.318 1.00 32.21 C ATOM 1583 CD GLU A 100 2.751 -51.750 -3.354 1.00 65.03 C ATOM 1584 OE1 GLU A 100 2.778 -51.462 -2.140 1.00 11.23 O ATOM 1585 OE2 GLU A 100 2.106 -52.715 -3.816 1.00 1.43 O ATOM 0 H GLU A 100 6.562 -51.456 -4.874 1.00 30.23 H new ATOM 0 HA GLU A 100 5.112 -49.000 -5.387 1.00 63.10 H new ATOM 0 HB2 GLU A 100 5.290 -50.973 -3.089 1.00 5.52 H new ATOM 0 HB3 GLU A 100 4.389 -49.477 -2.951 1.00 5.52 H new ATOM 0 HG2 GLU A 100 2.889 -50.117 -4.731 1.00 32.21 H new ATOM 0 HG3 GLU A 100 3.882 -51.498 -5.154 1.00 32.21 H new ATOM 1592 N GLU A 101 7.670 -49.120 -3.317 1.00 2.44 N ATOM 1593 CA GLU A 101 8.624 -48.298 -2.581 1.00 21.34 C ATOM 1594 C GLU A 101 9.425 -47.412 -3.530 1.00 52.40 C ATOM 1595 O GLU A 101 9.884 -46.335 -3.151 1.00 43.32 O ATOM 1596 CB GLU A 101 9.573 -49.183 -1.769 1.00 40.22 C ATOM 1597 CG GLU A 101 10.714 -48.417 -1.121 1.00 64.05 C ATOM 1598 CD GLU A 101 11.683 -49.324 -0.388 1.00 64.12 C ATOM 1599 OE1 GLU A 101 11.304 -50.473 -0.080 1.00 10.13 O ATOM 1600 OE2 GLU A 101 12.822 -48.884 -0.123 1.00 71.22 O ATOM 0 H GLU A 101 7.887 -50.117 -3.322 1.00 2.44 H new ATOM 0 HA GLU A 101 8.063 -47.657 -1.900 1.00 21.34 H new ATOM 0 HB2 GLU A 101 9.004 -49.696 -0.993 1.00 40.22 H new ATOM 0 HB3 GLU A 101 9.987 -49.952 -2.421 1.00 40.22 H new ATOM 0 HG2 GLU A 101 11.253 -47.859 -1.887 1.00 64.05 H new ATOM 0 HG3 GLU A 101 10.306 -47.687 -0.422 1.00 64.05 H new ATOM 1607 N ALA A 102 9.588 -47.873 -4.766 1.00 33.45 N ATOM 1608 CA ALA A 102 10.331 -47.123 -5.770 1.00 1.32 C ATOM 1609 C ALA A 102 9.496 -45.975 -6.327 1.00 11.23 C ATOM 1610 O ALA A 102 9.978 -45.175 -7.129 1.00 13.30 O ATOM 1611 CB ALA A 102 10.779 -48.045 -6.893 1.00 65.35 C ATOM 0 H ALA A 102 9.215 -48.763 -5.096 1.00 33.45 H new ATOM 0 HA ALA A 102 11.213 -46.697 -5.291 1.00 1.32 H new ATOM 0 HB1 ALA A 102 11.333 -47.471 -7.636 1.00 65.35 H new ATOM 0 HB2 ALA A 102 11.420 -48.828 -6.487 1.00 65.35 H new ATOM 0 HB3 ALA A 102 9.906 -48.498 -7.362 1.00 65.35 H new ATOM 1617 N LYS A 103 8.241 -45.900 -5.897 1.00 11.41 N ATOM 1618 CA LYS A 103 7.338 -44.849 -6.352 1.00 35.34 C ATOM 1619 C LYS A 103 7.332 -43.676 -5.376 1.00 60.53 C ATOM 1620 O LYS A 103 7.178 -42.523 -5.779 1.00 31.23 O ATOM 1621 CB LYS A 103 5.919 -45.401 -6.510 1.00 20.41 C ATOM 1622 CG LYS A 103 5.462 -45.499 -7.955 1.00 50.31 C ATOM 1623 CD LYS A 103 4.008 -45.931 -8.052 1.00 44.43 C ATOM 1624 CE LYS A 103 3.063 -44.778 -7.748 1.00 61.44 C ATOM 1625 NZ LYS A 103 2.679 -44.740 -6.310 1.00 63.41 N ATOM 0 H LYS A 103 7.826 -46.555 -5.234 1.00 11.41 H new ATOM 0 HA LYS A 103 7.693 -44.493 -7.319 1.00 35.34 H new ATOM 0 HB2 LYS A 103 5.870 -46.390 -6.054 1.00 20.41 H new ATOM 0 HB3 LYS A 103 5.227 -44.763 -5.961 1.00 20.41 H new ATOM 0 HG2 LYS A 103 5.589 -44.533 -8.444 1.00 50.31 H new ATOM 0 HG3 LYS A 103 6.091 -46.212 -8.489 1.00 50.31 H new ATOM 0 HD2 LYS A 103 3.807 -46.314 -9.053 1.00 44.43 H new ATOM 0 HD3 LYS A 103 3.823 -46.748 -7.355 1.00 44.43 H new ATOM 0 HE2 LYS A 103 3.539 -43.836 -8.022 1.00 61.44 H new ATOM 0 HE3 LYS A 103 2.167 -44.872 -8.361 1.00 61.44 H new ATOM 0 HZ1 LYS A 103 1.654 -44.888 -6.220 1.00 63.41 H new ATOM 0 HZ2 LYS A 103 3.184 -45.490 -5.796 1.00 63.41 H new ATOM 0 HZ3 LYS A 103 2.931 -43.815 -5.908 1.00 63.41 H new ATOM 1639 N ARG A 104 7.502 -43.979 -4.093 1.00 45.24 N ATOM 1640 CA ARG A 104 7.517 -42.949 -3.061 1.00 63.13 C ATOM 1641 C ARG A 104 8.918 -42.369 -2.892 1.00 44.24 C ATOM 1642 O ARG A 104 9.081 -41.239 -2.433 1.00 14.14 O ATOM 1643 CB ARG A 104 7.028 -43.524 -1.731 1.00 11.33 C ATOM 1644 CG ARG A 104 7.865 -44.687 -1.225 1.00 71.41 C ATOM 1645 CD ARG A 104 7.559 -45.002 0.231 1.00 61.42 C ATOM 1646 NE ARG A 104 8.049 -43.961 1.131 1.00 72.54 N ATOM 1647 CZ ARG A 104 7.858 -43.977 2.445 1.00 14.40 C ATOM 1648 NH1 ARG A 104 7.191 -44.974 3.010 1.00 40.12 N ATOM 1649 NH2 ARG A 104 8.334 -42.993 3.197 1.00 10.14 N ATOM 0 H ARG A 104 7.631 -44.929 -3.744 1.00 45.24 H new ATOM 0 HA ARG A 104 6.846 -42.148 -3.372 1.00 63.13 H new ATOM 0 HB2 ARG A 104 7.029 -42.733 -0.981 1.00 11.33 H new ATOM 0 HB3 ARG A 104 5.995 -43.853 -1.845 1.00 11.33 H new ATOM 0 HG2 ARG A 104 7.673 -45.568 -1.837 1.00 71.41 H new ATOM 0 HG3 ARG A 104 8.923 -44.449 -1.332 1.00 71.41 H new ATOM 0 HD2 ARG A 104 6.482 -45.115 0.359 1.00 61.42 H new ATOM 0 HD3 ARG A 104 8.013 -45.956 0.499 1.00 61.42 H new ATOM 0 HE ARG A 104 8.566 -43.179 0.728 1.00 72.54 H new ATOM 0 HH11 ARG A 104 6.823 -45.732 2.435 1.00 40.12 H new ATOM 0 HH12 ARG A 104 7.046 -44.983 4.020 1.00 40.12 H new ATOM 0 HH21 ARG A 104 8.847 -42.224 2.766 1.00 10.14 H new ATOM 0 HH22 ARG A 104 8.187 -43.006 4.206 1.00 10.14 H new ATOM 1663 N GLN A 105 9.926 -43.150 -3.267 1.00 61.30 N ATOM 1664 CA GLN A 105 11.313 -42.714 -3.156 1.00 11.15 C ATOM 1665 C GLN A 105 11.642 -41.669 -4.217 1.00 12.03 C ATOM 1666 O GLN A 105 12.245 -40.638 -3.920 1.00 64.35 O ATOM 1667 CB GLN A 105 12.258 -43.909 -3.289 1.00 62.05 C ATOM 1668 CG GLN A 105 12.480 -44.658 -1.986 1.00 20.44 C ATOM 1669 CD GLN A 105 13.004 -43.763 -0.880 1.00 33.22 C ATOM 1670 OE1 GLN A 105 14.170 -43.368 -0.885 1.00 71.12 O ATOM 1671 NE2 GLN A 105 12.142 -43.438 0.077 1.00 42.12 N ATOM 0 H GLN A 105 9.808 -44.088 -3.650 1.00 61.30 H new ATOM 0 HA GLN A 105 11.448 -42.262 -2.173 1.00 11.15 H new ATOM 0 HB2 GLN A 105 11.855 -44.599 -4.031 1.00 62.05 H new ATOM 0 HB3 GLN A 105 13.219 -43.561 -3.666 1.00 62.05 H new ATOM 0 HG2 GLN A 105 11.541 -45.111 -1.667 1.00 20.44 H new ATOM 0 HG3 GLN A 105 13.186 -45.472 -2.155 1.00 20.44 H new ATOM 0 HE21 GLN A 105 11.185 -43.788 0.041 1.00 42.12 H new ATOM 0 HE22 GLN A 105 12.437 -42.838 0.847 1.00 42.12 H new ATOM 1680 N MET A 106 11.241 -41.943 -5.454 1.00 11.21 N ATOM 1681 CA MET A 106 11.493 -41.025 -6.559 1.00 72.30 C ATOM 1682 C MET A 106 11.015 -39.618 -6.217 1.00 13.22 C ATOM 1683 O MET A 106 11.670 -38.630 -6.552 1.00 0.03 O ATOM 1684 CB MET A 106 10.796 -41.519 -7.828 1.00 52.45 C ATOM 1685 CG MET A 106 9.368 -41.984 -7.596 1.00 33.32 C ATOM 1686 SD MET A 106 8.422 -42.115 -9.125 1.00 72.03 S ATOM 1687 CE MET A 106 9.608 -42.934 -10.188 1.00 61.40 C ATOM 0 H MET A 106 10.741 -42.792 -5.716 1.00 11.21 H new ATOM 0 HA MET A 106 12.568 -40.991 -6.733 1.00 72.30 H new ATOM 0 HB2 MET A 106 10.793 -40.717 -8.566 1.00 52.45 H new ATOM 0 HB3 MET A 106 11.372 -42.341 -8.253 1.00 52.45 H new ATOM 0 HG2 MET A 106 9.382 -42.954 -7.098 1.00 33.32 H new ATOM 0 HG3 MET A 106 8.868 -41.287 -6.923 1.00 33.32 H new ATOM 0 HE1 MET A 106 9.082 -43.444 -10.995 1.00 61.40 H new ATOM 0 HE2 MET A 106 10.290 -42.195 -10.609 1.00 61.40 H new ATOM 0 HE3 MET A 106 10.175 -43.662 -9.608 1.00 61.40 H new ATOM 1697 N LEU A 107 9.870 -39.533 -5.549 1.00 12.15 N ATOM 1698 CA LEU A 107 9.304 -38.245 -5.161 1.00 33.40 C ATOM 1699 C LEU A 107 10.200 -37.539 -4.149 1.00 30.01 C ATOM 1700 O LEU A 107 10.322 -36.314 -4.160 1.00 1.45 O ATOM 1701 CB LEU A 107 7.904 -38.437 -4.574 1.00 24.45 C ATOM 1702 CG LEU A 107 7.348 -37.263 -3.768 1.00 55.24 C ATOM 1703 CD1 LEU A 107 5.838 -37.172 -3.931 1.00 62.00 C ATOM 1704 CD2 LEU A 107 7.720 -37.399 -2.299 1.00 43.33 C ATOM 0 H LEU A 107 9.315 -40.340 -5.265 1.00 12.15 H new ATOM 0 HA LEU A 107 9.235 -37.623 -6.053 1.00 33.40 H new ATOM 0 HB2 LEU A 107 7.215 -38.649 -5.391 1.00 24.45 H new ATOM 0 HB3 LEU A 107 7.918 -39.318 -3.932 1.00 24.45 H new ATOM 0 HG LEU A 107 7.791 -36.343 -4.150 1.00 55.24 H new ATOM 0 HD11 LEU A 107 5.459 -36.331 -3.350 1.00 62.00 H new ATOM 0 HD12 LEU A 107 5.594 -37.026 -4.983 1.00 62.00 H new ATOM 0 HD13 LEU A 107 5.378 -38.094 -3.576 1.00 62.00 H new ATOM 0 HD21 LEU A 107 7.316 -36.554 -1.742 1.00 43.33 H new ATOM 0 HD22 LEU A 107 7.306 -38.326 -1.903 1.00 43.33 H new ATOM 0 HD23 LEU A 107 8.805 -37.414 -2.198 1.00 43.33 H new ATOM 1716 N THR A 108 10.828 -38.320 -3.275 1.00 71.23 N ATOM 1717 CA THR A 108 11.714 -37.770 -2.257 1.00 60.33 C ATOM 1718 C THR A 108 12.900 -37.053 -2.891 1.00 4.54 C ATOM 1719 O THR A 108 13.537 -36.210 -2.259 1.00 64.01 O ATOM 1720 CB THR A 108 12.238 -38.870 -1.315 1.00 34.24 C ATOM 1721 OG1 THR A 108 11.283 -39.933 -1.224 1.00 73.54 O ATOM 1722 CG2 THR A 108 12.512 -38.309 0.072 1.00 14.24 C ATOM 0 H THR A 108 10.739 -39.336 -3.252 1.00 71.23 H new ATOM 0 HA THR A 108 11.127 -37.056 -1.679 1.00 60.33 H new ATOM 0 HB THR A 108 13.172 -39.255 -1.726 1.00 34.24 H new ATOM 0 HG1 THR A 108 11.624 -40.629 -0.625 1.00 73.54 H new ATOM 0 HG21 THR A 108 12.881 -39.104 0.720 1.00 14.24 H new ATOM 0 HG22 THR A 108 13.261 -37.520 0.004 1.00 14.24 H new ATOM 0 HG23 THR A 108 11.591 -37.901 0.488 1.00 14.24 H new ATOM 1730 N ALA A 109 13.192 -37.391 -4.142 1.00 74.33 N ATOM 1731 CA ALA A 109 14.300 -36.777 -4.862 1.00 3.32 C ATOM 1732 C ALA A 109 13.849 -35.516 -5.592 1.00 63.31 C ATOM 1733 O ALA A 109 14.631 -34.584 -5.782 1.00 35.13 O ATOM 1734 CB ALA A 109 14.907 -37.769 -5.843 1.00 5.32 C ATOM 0 H ALA A 109 12.676 -38.088 -4.679 1.00 74.33 H new ATOM 0 HA ALA A 109 15.060 -36.492 -4.134 1.00 3.32 H new ATOM 0 HB1 ALA A 109 15.734 -37.296 -6.374 1.00 5.32 H new ATOM 0 HB2 ALA A 109 15.275 -38.639 -5.300 1.00 5.32 H new ATOM 0 HB3 ALA A 109 14.148 -38.083 -6.560 1.00 5.32 H new ATOM 1740 N SER A 110 12.585 -35.495 -6.001 1.00 34.04 N ATOM 1741 CA SER A 110 12.031 -34.350 -6.715 1.00 30.45 C ATOM 1742 C SER A 110 12.141 -33.081 -5.875 1.00 34.54 C ATOM 1743 O SER A 110 12.728 -32.088 -6.304 1.00 10.22 O ATOM 1744 CB SER A 110 10.568 -34.609 -7.080 1.00 30.14 C ATOM 1745 OG SER A 110 10.321 -35.995 -7.244 1.00 52.33 O ATOM 0 H SER A 110 11.925 -36.258 -5.850 1.00 34.04 H new ATOM 0 HA SER A 110 12.607 -34.210 -7.630 1.00 30.45 H new ATOM 0 HB2 SER A 110 9.919 -34.211 -6.300 1.00 30.14 H new ATOM 0 HB3 SER A 110 10.321 -34.081 -8.001 1.00 30.14 H new ATOM 0 HG SER A 110 10.427 -36.237 -8.188 1.00 52.33 H new ATOM 1751 N HIS A 111 11.571 -33.123 -4.674 1.00 55.45 N ATOM 1752 CA HIS A 111 11.604 -31.977 -3.773 1.00 11.25 C ATOM 1753 C HIS A 111 13.031 -31.470 -3.591 1.00 44.31 C ATOM 1754 O HIS A 111 13.256 -30.278 -3.374 1.00 61.35 O ATOM 1755 CB HIS A 111 11.007 -32.351 -2.416 1.00 21.53 C ATOM 1756 CG HIS A 111 10.849 -31.186 -1.489 1.00 15.14 C ATOM 1757 ND1 HIS A 111 10.510 -29.921 -1.921 1.00 43.10 N ATOM 1758 CD2 HIS A 111 10.982 -31.099 -0.144 1.00 62.25 C ATOM 1759 CE1 HIS A 111 10.445 -29.106 -0.883 1.00 74.22 C ATOM 1760 NE2 HIS A 111 10.726 -29.797 0.207 1.00 2.40 N ATOM 0 H HIS A 111 11.082 -33.937 -4.303 1.00 55.45 H new ATOM 0 HA HIS A 111 11.008 -31.180 -4.217 1.00 11.25 H new ATOM 0 HB2 HIS A 111 10.033 -32.815 -2.572 1.00 21.53 H new ATOM 0 HB3 HIS A 111 11.644 -33.098 -1.942 1.00 21.53 H new ATOM 0 HD2 HIS A 111 11.241 -31.904 0.527 1.00 62.25 H new ATOM 0 HE1 HIS A 111 10.203 -28.054 -0.920 1.00 74.22 H new ATOM 0 HE2 HIS A 111 10.749 -29.424 1.156 1.00 2.40 H new ATOM 1768 N THR A 112 13.994 -32.382 -3.680 1.00 44.01 N ATOM 1769 CA THR A 112 15.399 -32.028 -3.524 1.00 5.11 C ATOM 1770 C THR A 112 15.789 -30.896 -4.467 1.00 43.41 C ATOM 1771 O THR A 112 16.526 -29.984 -4.088 1.00 54.22 O ATOM 1772 CB THR A 112 16.316 -33.238 -3.786 1.00 42.30 C ATOM 1773 OG1 THR A 112 15.697 -34.435 -3.304 1.00 74.30 O ATOM 1774 CG2 THR A 112 17.666 -33.051 -3.109 1.00 14.11 C ATOM 0 H THR A 112 13.826 -33.372 -3.859 1.00 44.01 H new ATOM 0 HA THR A 112 15.529 -31.699 -2.493 1.00 5.11 H new ATOM 0 HB THR A 112 16.475 -33.319 -4.861 1.00 42.30 H new ATOM 0 HG1 THR A 112 16.379 -35.128 -3.177 1.00 74.30 H new ATOM 0 HG21 THR A 112 18.296 -33.918 -3.308 1.00 14.11 H new ATOM 0 HG22 THR A 112 18.148 -32.155 -3.500 1.00 14.11 H new ATOM 0 HG23 THR A 112 17.522 -32.946 -2.034 1.00 14.11 H new ATOM 1782 N LEU A 113 15.291 -30.959 -5.697 1.00 1.50 N ATOM 1783 CA LEU A 113 15.587 -29.937 -6.695 1.00 51.15 C ATOM 1784 C LEU A 113 15.118 -28.564 -6.225 1.00 4.31 C ATOM 1785 O LEU A 113 15.655 -27.538 -6.642 1.00 13.43 O ATOM 1786 CB LEU A 113 14.919 -30.288 -8.026 1.00 50.12 C ATOM 1787 CG LEU A 113 15.552 -31.436 -8.813 1.00 21.23 C ATOM 1788 CD1 LEU A 113 14.972 -32.770 -8.370 1.00 34.31 C ATOM 1789 CD2 LEU A 113 15.350 -31.234 -10.307 1.00 72.23 C ATOM 0 H LEU A 113 14.681 -31.707 -6.027 1.00 1.50 H new ATOM 0 HA LEU A 113 16.667 -29.903 -6.835 1.00 51.15 H new ATOM 0 HB2 LEU A 113 13.876 -30.539 -7.831 1.00 50.12 H new ATOM 0 HB3 LEU A 113 14.920 -29.398 -8.656 1.00 50.12 H new ATOM 0 HG LEU A 113 16.623 -31.443 -8.610 1.00 21.23 H new ATOM 0 HD11 LEU A 113 15.434 -33.575 -8.941 1.00 34.31 H new ATOM 0 HD12 LEU A 113 15.170 -32.918 -7.308 1.00 34.31 H new ATOM 0 HD13 LEU A 113 13.896 -32.774 -8.543 1.00 34.31 H new ATOM 0 HD21 LEU A 113 15.807 -32.061 -10.851 1.00 72.23 H new ATOM 0 HD22 LEU A 113 14.283 -31.200 -10.529 1.00 72.23 H new ATOM 0 HD23 LEU A 113 15.815 -30.297 -10.614 1.00 72.23 H new ATOM 1801 N ALA A 114 14.116 -28.553 -5.352 1.00 70.24 N ATOM 1802 CA ALA A 114 13.578 -27.307 -4.822 1.00 3.43 C ATOM 1803 C ALA A 114 14.271 -26.920 -3.519 1.00 61.42 C ATOM 1804 O ALA A 114 14.644 -25.764 -3.322 1.00 3.00 O ATOM 1805 CB ALA A 114 12.077 -27.428 -4.607 1.00 71.42 C ATOM 0 H ALA A 114 13.661 -29.394 -4.997 1.00 70.24 H new ATOM 0 HA ALA A 114 13.767 -26.520 -5.552 1.00 3.43 H new ATOM 0 HB1 ALA A 114 11.689 -26.489 -4.211 1.00 71.42 H new ATOM 0 HB2 ALA A 114 11.590 -27.650 -5.557 1.00 71.42 H new ATOM 0 HB3 ALA A 114 11.874 -28.232 -3.899 1.00 71.42 H new ATOM 1811 N VAL A 115 14.440 -27.896 -2.632 1.00 54.10 N ATOM 1812 CA VAL A 115 15.088 -27.658 -1.348 1.00 50.10 C ATOM 1813 C VAL A 115 16.488 -27.085 -1.537 1.00 61.23 C ATOM 1814 O VAL A 115 16.951 -26.273 -0.736 1.00 41.24 O ATOM 1815 CB VAL A 115 15.182 -28.952 -0.519 1.00 25.35 C ATOM 1816 CG1 VAL A 115 15.694 -28.653 0.882 1.00 3.22 C ATOM 1817 CG2 VAL A 115 13.831 -29.649 -0.464 1.00 25.32 C ATOM 0 H VAL A 115 14.137 -28.859 -2.779 1.00 54.10 H new ATOM 0 HA VAL A 115 14.473 -26.936 -0.812 1.00 50.10 H new ATOM 0 HB VAL A 115 15.892 -29.622 -1.004 1.00 25.35 H new ATOM 0 HG11 VAL A 115 15.754 -29.580 1.453 1.00 3.22 H new ATOM 0 HG12 VAL A 115 16.684 -28.201 0.819 1.00 3.22 H new ATOM 0 HG13 VAL A 115 15.012 -27.964 1.379 1.00 3.22 H new ATOM 0 HG21 VAL A 115 13.916 -30.562 0.126 1.00 25.32 H new ATOM 0 HG22 VAL A 115 13.098 -28.986 -0.004 1.00 25.32 H new ATOM 0 HG23 VAL A 115 13.509 -29.899 -1.475 1.00 25.32 H new ATOM 1827 N ASP A 116 17.158 -27.514 -2.602 1.00 15.53 N ATOM 1828 CA ASP A 116 18.505 -27.042 -2.898 1.00 24.20 C ATOM 1829 C ASP A 116 18.464 -25.743 -3.696 1.00 15.31 C ATOM 1830 O ASP A 116 19.499 -25.138 -3.971 1.00 25.11 O ATOM 1831 CB ASP A 116 19.282 -28.107 -3.674 1.00 71.01 C ATOM 1832 CG ASP A 116 19.540 -29.352 -2.848 1.00 44.14 C ATOM 1833 OD1 ASP A 116 20.303 -29.263 -1.863 1.00 33.01 O ATOM 1834 OD2 ASP A 116 18.980 -30.415 -3.187 1.00 51.01 O ATOM 0 H ASP A 116 16.790 -28.187 -3.274 1.00 15.53 H new ATOM 0 HA ASP A 116 19.011 -26.850 -1.952 1.00 24.20 H new ATOM 0 HB2 ASP A 116 18.724 -28.378 -4.570 1.00 71.01 H new ATOM 0 HB3 ASP A 116 20.233 -27.690 -4.004 1.00 71.01 H new ATOM 1839 N ALA A 117 17.259 -25.320 -4.066 1.00 1.25 N ATOM 1840 CA ALA A 117 17.082 -24.092 -4.831 1.00 62.00 C ATOM 1841 C ALA A 117 16.741 -22.920 -3.917 1.00 55.14 C ATOM 1842 O ALA A 117 17.149 -21.785 -4.166 1.00 74.35 O ATOM 1843 CB ALA A 117 15.998 -24.277 -5.883 1.00 24.33 C ATOM 0 H ALA A 117 16.391 -25.810 -3.848 1.00 1.25 H new ATOM 0 HA ALA A 117 18.024 -23.866 -5.332 1.00 62.00 H new ATOM 0 HB1 ALA A 117 15.876 -23.352 -6.447 1.00 24.33 H new ATOM 0 HB2 ALA A 117 16.283 -25.081 -6.562 1.00 24.33 H new ATOM 0 HB3 ALA A 117 15.057 -24.531 -5.395 1.00 24.33 H new ATOM 1849 N LYS A 118 15.989 -23.201 -2.859 1.00 14.35 N ATOM 1850 CA LYS A 118 15.592 -22.170 -1.906 1.00 73.34 C ATOM 1851 C LYS A 118 16.815 -21.489 -1.301 1.00 54.52 C ATOM 1852 O LYS A 118 16.792 -20.292 -1.017 1.00 3.04 O ATOM 1853 CB LYS A 118 14.731 -22.777 -0.796 1.00 22.32 C ATOM 1854 CG LYS A 118 13.240 -22.577 -1.004 1.00 20.14 C ATOM 1855 CD LYS A 118 12.645 -23.675 -1.869 1.00 62.22 C ATOM 1856 CE LYS A 118 11.203 -23.968 -1.485 1.00 51.12 C ATOM 1857 NZ LYS A 118 10.325 -22.781 -1.682 1.00 31.33 N ATOM 0 H LYS A 118 15.642 -24.134 -2.639 1.00 14.35 H new ATOM 0 HA LYS A 118 15.008 -21.421 -2.441 1.00 73.34 H new ATOM 0 HB2 LYS A 118 14.940 -23.845 -0.729 1.00 22.32 H new ATOM 0 HB3 LYS A 118 15.019 -22.335 0.158 1.00 22.32 H new ATOM 0 HG2 LYS A 118 12.736 -22.561 -0.038 1.00 20.14 H new ATOM 0 HG3 LYS A 118 13.064 -21.608 -1.472 1.00 20.14 H new ATOM 0 HD2 LYS A 118 12.690 -23.379 -2.917 1.00 62.22 H new ATOM 0 HD3 LYS A 118 13.241 -24.582 -1.768 1.00 62.22 H new ATOM 0 HE2 LYS A 118 10.830 -24.799 -2.083 1.00 51.12 H new ATOM 0 HE3 LYS A 118 11.161 -24.282 -0.442 1.00 51.12 H new ATOM 0 HZ1 LYS A 118 9.344 -23.095 -1.827 1.00 31.33 H new ATOM 0 HZ2 LYS A 118 10.372 -22.171 -0.841 1.00 31.33 H new ATOM 0 HZ3 LYS A 118 10.645 -22.247 -2.516 1.00 31.33 H new ATOM 1871 N ASN A 119 17.881 -22.258 -1.109 1.00 31.33 N ATOM 1872 CA ASN A 119 19.114 -21.727 -0.538 1.00 73.52 C ATOM 1873 C ASN A 119 19.957 -21.041 -1.608 1.00 50.04 C ATOM 1874 O ASN A 119 20.849 -20.250 -1.299 1.00 1.01 O ATOM 1875 CB ASN A 119 19.920 -22.849 0.120 1.00 13.03 C ATOM 1876 CG ASN A 119 19.033 -23.884 0.786 1.00 3.44 C ATOM 1877 OD1 ASN A 119 18.102 -23.542 1.516 1.00 24.33 O ATOM 1878 ND2 ASN A 119 19.320 -25.156 0.538 1.00 73.25 N ATOM 0 H ASN A 119 17.917 -23.251 -1.340 1.00 31.33 H new ATOM 0 HA ASN A 119 18.847 -20.989 0.218 1.00 73.52 H new ATOM 0 HB2 ASN A 119 20.541 -23.336 -0.632 1.00 13.03 H new ATOM 0 HB3 ASN A 119 20.595 -22.421 0.862 1.00 13.03 H new ATOM 0 HD21 ASN A 119 18.759 -25.897 0.959 1.00 73.25 H new ATOM 0 HD22 ASN A 119 20.101 -25.393 -0.074 1.00 73.25 H new ATOM 1885 N LEU A 120 19.668 -21.348 -2.868 1.00 63.02 N ATOM 1886 CA LEU A 120 20.399 -20.760 -3.986 1.00 22.44 C ATOM 1887 C LEU A 120 19.837 -19.388 -4.343 1.00 75.40 C ATOM 1888 O LEU A 120 20.576 -18.486 -4.739 1.00 73.32 O ATOM 1889 CB LEU A 120 20.336 -21.683 -5.204 1.00 31.42 C ATOM 1890 CG LEU A 120 21.329 -21.382 -6.326 1.00 64.25 C ATOM 1891 CD1 LEU A 120 20.907 -20.139 -7.094 1.00 32.10 C ATOM 1892 CD2 LEU A 120 22.733 -21.213 -5.765 1.00 5.11 C ATOM 0 H LEU A 120 18.933 -22.000 -3.141 1.00 63.02 H new ATOM 0 HA LEU A 120 21.439 -20.638 -3.684 1.00 22.44 H new ATOM 0 HB2 LEU A 120 20.498 -22.707 -4.868 1.00 31.42 H new ATOM 0 HB3 LEU A 120 19.328 -21.639 -5.617 1.00 31.42 H new ATOM 0 HG LEU A 120 21.334 -22.226 -7.016 1.00 64.25 H new ATOM 0 HD11 LEU A 120 21.626 -19.941 -7.889 1.00 32.10 H new ATOM 0 HD12 LEU A 120 19.920 -20.298 -7.529 1.00 32.10 H new ATOM 0 HD13 LEU A 120 20.872 -19.287 -6.416 1.00 32.10 H new ATOM 0 HD21 LEU A 120 23.427 -20.999 -6.578 1.00 5.11 H new ATOM 0 HD22 LEU A 120 22.743 -20.388 -5.053 1.00 5.11 H new ATOM 0 HD23 LEU A 120 23.036 -22.131 -5.261 1.00 5.11 H new ATOM 1904 N LEU A 121 18.525 -19.237 -4.199 1.00 33.03 N ATOM 1905 CA LEU A 121 17.862 -17.974 -4.504 1.00 41.31 C ATOM 1906 C LEU A 121 18.316 -16.876 -3.548 1.00 3.42 C ATOM 1907 O LEU A 121 18.350 -15.699 -3.909 1.00 33.03 O ATOM 1908 CB LEU A 121 16.344 -18.139 -4.424 1.00 75.24 C ATOM 1909 CG LEU A 121 15.727 -18.018 -3.030 1.00 64.31 C ATOM 1910 CD1 LEU A 121 15.347 -16.575 -2.738 1.00 25.02 C ATOM 1911 CD2 LEU A 121 14.514 -18.927 -2.903 1.00 31.54 C ATOM 0 H LEU A 121 17.899 -19.974 -3.873 1.00 33.03 H new ATOM 0 HA LEU A 121 18.137 -17.684 -5.518 1.00 41.31 H new ATOM 0 HB2 LEU A 121 15.883 -17.391 -5.069 1.00 75.24 H new ATOM 0 HB3 LEU A 121 16.083 -19.116 -4.831 1.00 75.24 H new ATOM 0 HG LEU A 121 16.470 -18.332 -2.296 1.00 64.31 H new ATOM 0 HD11 LEU A 121 14.910 -16.508 -1.742 1.00 25.02 H new ATOM 0 HD12 LEU A 121 16.237 -15.947 -2.786 1.00 25.02 H new ATOM 0 HD13 LEU A 121 14.622 -16.233 -3.476 1.00 25.02 H new ATOM 0 HD21 LEU A 121 14.088 -18.828 -1.905 1.00 31.54 H new ATOM 0 HD22 LEU A 121 13.768 -18.644 -3.646 1.00 31.54 H new ATOM 0 HD23 LEU A 121 14.816 -19.961 -3.068 1.00 31.54 H new ATOM 1923 N ASP A 122 18.667 -17.268 -2.328 1.00 71.31 N ATOM 1924 CA ASP A 122 19.123 -16.318 -1.320 1.00 53.13 C ATOM 1925 C ASP A 122 20.646 -16.242 -1.294 1.00 61.24 C ATOM 1926 O ASP A 122 21.220 -15.227 -0.902 1.00 3.01 O ATOM 1927 CB ASP A 122 18.596 -16.714 0.060 1.00 52.31 C ATOM 1928 CG ASP A 122 18.705 -15.586 1.067 1.00 44.53 C ATOM 1929 OD1 ASP A 122 18.893 -14.427 0.641 1.00 43.02 O ATOM 1930 OD2 ASP A 122 18.604 -15.861 2.281 1.00 70.32 O ATOM 0 H ASP A 122 18.644 -18.238 -2.013 1.00 71.31 H new ATOM 0 HA ASP A 122 18.733 -15.334 -1.581 1.00 53.13 H new ATOM 0 HB2 ASP A 122 17.554 -17.020 -0.027 1.00 52.31 H new ATOM 0 HB3 ASP A 122 19.153 -17.577 0.424 1.00 52.31 H new ATOM 1935 N ALA A 123 21.294 -17.324 -1.714 1.00 44.43 N ATOM 1936 CA ALA A 123 22.751 -17.379 -1.740 1.00 72.31 C ATOM 1937 C ALA A 123 23.326 -16.282 -2.630 1.00 24.45 C ATOM 1938 O ALA A 123 24.187 -15.512 -2.204 1.00 10.21 O ATOM 1939 CB ALA A 123 23.218 -18.747 -2.216 1.00 3.22 C ATOM 0 H ALA A 123 20.834 -18.174 -2.041 1.00 44.43 H new ATOM 0 HA ALA A 123 23.115 -17.215 -0.726 1.00 72.31 H new ATOM 0 HB1 ALA A 123 24.308 -18.775 -2.231 1.00 3.22 H new ATOM 0 HB2 ALA A 123 22.845 -19.515 -1.539 1.00 3.22 H new ATOM 0 HB3 ALA A 123 22.837 -18.933 -3.220 1.00 3.22 H new ATOM 1945 N VAL A 124 22.846 -16.218 -3.867 1.00 44.15 N ATOM 1946 CA VAL A 124 23.313 -15.215 -4.817 1.00 41.11 C ATOM 1947 C VAL A 124 22.937 -13.810 -4.361 1.00 45.51 C ATOM 1948 O VAL A 124 23.667 -12.849 -4.610 1.00 74.32 O ATOM 1949 CB VAL A 124 22.732 -15.459 -6.222 1.00 61.25 C ATOM 1950 CG1 VAL A 124 23.399 -14.548 -7.242 1.00 14.02 C ATOM 1951 CG2 VAL A 124 22.890 -16.920 -6.617 1.00 52.22 C ATOM 0 H VAL A 124 22.134 -16.849 -4.235 1.00 44.15 H new ATOM 0 HA VAL A 124 24.399 -15.302 -4.861 1.00 41.11 H new ATOM 0 HB VAL A 124 21.668 -15.224 -6.202 1.00 61.25 H new ATOM 0 HG11 VAL A 124 22.975 -14.735 -8.229 1.00 14.02 H new ATOM 0 HG12 VAL A 124 23.230 -13.507 -6.966 1.00 14.02 H new ATOM 0 HG13 VAL A 124 24.470 -14.748 -7.263 1.00 14.02 H new ATOM 0 HG21 VAL A 124 22.474 -17.075 -7.613 1.00 52.22 H new ATOM 0 HG22 VAL A 124 23.948 -17.184 -6.621 1.00 52.22 H new ATOM 0 HG23 VAL A 124 22.362 -17.550 -5.901 1.00 52.22 H new ATOM 1961 N ASP A 125 21.796 -13.696 -3.692 1.00 32.35 N ATOM 1962 CA ASP A 125 21.323 -12.408 -3.198 1.00 41.14 C ATOM 1963 C ASP A 125 22.368 -11.754 -2.300 1.00 14.44 C ATOM 1964 O ASP A 125 22.401 -10.531 -2.160 1.00 64.33 O ATOM 1965 CB ASP A 125 20.010 -12.581 -2.433 1.00 62.11 C ATOM 1966 CG ASP A 125 18.795 -12.406 -3.322 1.00 35.11 C ATOM 1967 OD1 ASP A 125 18.897 -12.698 -4.531 1.00 65.25 O ATOM 1968 OD2 ASP A 125 17.740 -11.976 -2.808 1.00 64.21 O ATOM 0 H ASP A 125 21.180 -14.481 -3.479 1.00 32.35 H new ATOM 0 HA ASP A 125 21.150 -11.759 -4.056 1.00 41.14 H new ATOM 0 HB2 ASP A 125 19.985 -13.572 -1.979 1.00 62.11 H new ATOM 0 HB3 ASP A 125 19.969 -11.857 -1.619 1.00 62.11 H new ATOM 1973 N GLN A 126 23.217 -12.576 -1.692 1.00 13.11 N ATOM 1974 CA GLN A 126 24.261 -12.076 -0.805 1.00 72.51 C ATOM 1975 C GLN A 126 25.559 -11.844 -1.570 1.00 45.21 C ATOM 1976 O GLN A 126 26.420 -11.080 -1.134 1.00 12.31 O ATOM 1977 CB GLN A 126 24.500 -13.061 0.341 1.00 14.33 C ATOM 1978 CG GLN A 126 23.431 -13.008 1.421 1.00 0.42 C ATOM 1979 CD GLN A 126 23.954 -13.428 2.781 1.00 50.33 C ATOM 1980 OE1 GLN A 126 23.707 -12.762 3.787 1.00 74.13 O ATOM 1981 NE2 GLN A 126 24.682 -14.538 2.818 1.00 13.12 N ATOM 0 H GLN A 126 23.203 -13.590 -1.797 1.00 13.11 H new ATOM 0 HA GLN A 126 23.928 -11.123 -0.393 1.00 72.51 H new ATOM 0 HB2 GLN A 126 24.546 -14.072 -0.064 1.00 14.33 H new ATOM 0 HB3 GLN A 126 25.471 -12.853 0.791 1.00 14.33 H new ATOM 0 HG2 GLN A 126 23.035 -11.995 1.485 1.00 0.42 H new ATOM 0 HG3 GLN A 126 22.602 -13.657 1.138 1.00 0.42 H new ATOM 0 HE21 GLN A 126 24.862 -15.059 1.960 1.00 13.12 H new ATOM 0 HE22 GLN A 126 25.061 -14.870 3.705 1.00 13.12 H new ATOM 1990 N ALA A 127 25.694 -12.508 -2.713 1.00 63.32 N ATOM 1991 CA ALA A 127 26.887 -12.373 -3.540 1.00 2.54 C ATOM 1992 C ALA A 127 26.785 -11.158 -4.456 1.00 1.34 C ATOM 1993 O ALA A 127 27.773 -10.463 -4.695 1.00 52.23 O ATOM 1994 CB ALA A 127 27.109 -13.636 -4.358 1.00 11.10 C ATOM 0 H ALA A 127 24.991 -13.145 -3.088 1.00 63.32 H new ATOM 0 HA ALA A 127 27.742 -12.227 -2.880 1.00 2.54 H new ATOM 0 HB1 ALA A 127 28.003 -13.520 -4.970 1.00 11.10 H new ATOM 0 HB2 ALA A 127 27.236 -14.486 -3.688 1.00 11.10 H new ATOM 0 HB3 ALA A 127 26.247 -13.808 -5.003 1.00 11.10 H new ATOM 2000 N LYS A 128 25.584 -10.907 -4.966 1.00 44.13 N ATOM 2001 CA LYS A 128 25.352 -9.775 -5.856 1.00 70.51 C ATOM 2002 C LYS A 128 25.477 -8.455 -5.102 1.00 31.50 C ATOM 2003 O LYS A 128 26.112 -7.515 -5.578 1.00 43.41 O ATOM 2004 CB LYS A 128 23.966 -9.880 -6.496 1.00 71.04 C ATOM 2005 CG LYS A 128 23.967 -10.597 -7.835 1.00 50.25 C ATOM 2006 CD LYS A 128 22.554 -10.872 -8.322 1.00 30.33 C ATOM 2007 CE LYS A 128 21.979 -9.678 -9.068 1.00 73.52 C ATOM 2008 NZ LYS A 128 21.151 -8.815 -8.181 1.00 23.35 N ATOM 0 H LYS A 128 24.756 -11.472 -4.778 1.00 44.13 H new ATOM 0 HA LYS A 128 26.110 -9.799 -6.639 1.00 70.51 H new ATOM 0 HB2 LYS A 128 23.298 -10.405 -5.813 1.00 71.04 H new ATOM 0 HB3 LYS A 128 23.560 -8.877 -6.631 1.00 71.04 H new ATOM 0 HG2 LYS A 128 24.495 -9.992 -8.572 1.00 50.25 H new ATOM 0 HG3 LYS A 128 24.511 -11.537 -7.745 1.00 50.25 H new ATOM 0 HD2 LYS A 128 22.557 -11.744 -8.976 1.00 30.33 H new ATOM 0 HD3 LYS A 128 21.916 -11.113 -7.472 1.00 30.33 H new ATOM 0 HE2 LYS A 128 22.792 -9.089 -9.492 1.00 73.52 H new ATOM 0 HE3 LYS A 128 21.372 -10.029 -9.902 1.00 73.52 H new ATOM 0 HZ1 LYS A 128 20.247 -8.603 -8.649 1.00 23.35 H new ATOM 0 HZ2 LYS A 128 20.969 -9.311 -7.285 1.00 23.35 H new ATOM 0 HZ3 LYS A 128 21.658 -7.928 -7.989 1.00 23.35 H new ATOM 2022 N VAL A 129 24.868 -8.393 -3.922 1.00 72.21 N ATOM 2023 CA VAL A 129 24.913 -7.189 -3.101 1.00 22.42 C ATOM 2024 C VAL A 129 26.339 -6.878 -2.661 1.00 2.04 C ATOM 2025 O VAL A 129 26.711 -5.715 -2.499 1.00 13.24 O ATOM 2026 CB VAL A 129 24.021 -7.327 -1.853 1.00 30.31 C ATOM 2027 CG1 VAL A 129 24.124 -6.084 -0.983 1.00 14.21 C ATOM 2028 CG2 VAL A 129 22.578 -7.588 -2.257 1.00 14.13 C ATOM 0 H VAL A 129 24.338 -9.163 -3.513 1.00 72.21 H new ATOM 0 HA VAL A 129 24.539 -6.371 -3.717 1.00 22.42 H new ATOM 0 HB VAL A 129 24.371 -8.179 -1.270 1.00 30.31 H new ATOM 0 HG11 VAL A 129 23.487 -6.200 -0.106 1.00 14.21 H new ATOM 0 HG12 VAL A 129 25.158 -5.947 -0.665 1.00 14.21 H new ATOM 0 HG13 VAL A 129 23.801 -5.213 -1.553 1.00 14.21 H new ATOM 0 HG21 VAL A 129 21.961 -7.683 -1.363 1.00 14.13 H new ATOM 0 HG22 VAL A 129 22.214 -6.758 -2.863 1.00 14.13 H new ATOM 0 HG23 VAL A 129 22.523 -8.510 -2.835 1.00 14.13 H new ATOM 2038 N LEU A 130 27.135 -7.924 -2.469 1.00 31.22 N ATOM 2039 CA LEU A 130 28.522 -7.763 -2.048 1.00 23.35 C ATOM 2040 C LEU A 130 29.369 -7.179 -3.174 1.00 21.23 C ATOM 2041 O LEU A 130 30.378 -6.520 -2.927 1.00 3.42 O ATOM 2042 CB LEU A 130 29.101 -9.108 -1.604 1.00 74.21 C ATOM 2043 CG LEU A 130 29.117 -9.368 -0.097 1.00 44.52 C ATOM 2044 CD1 LEU A 130 30.176 -8.512 0.580 1.00 45.41 C ATOM 2045 CD2 LEU A 130 27.746 -9.099 0.506 1.00 43.35 C ATOM 0 H LEU A 130 26.844 -8.893 -2.598 1.00 31.22 H new ATOM 0 HA LEU A 130 28.542 -7.070 -1.207 1.00 23.35 H new ATOM 0 HB2 LEU A 130 28.530 -9.903 -2.083 1.00 74.21 H new ATOM 0 HB3 LEU A 130 30.123 -9.181 -1.976 1.00 74.21 H new ATOM 0 HG LEU A 130 29.365 -10.416 0.069 1.00 44.52 H new ATOM 0 HD11 LEU A 130 30.173 -8.710 1.652 1.00 45.41 H new ATOM 0 HD12 LEU A 130 31.156 -8.753 0.169 1.00 45.41 H new ATOM 0 HD13 LEU A 130 29.959 -7.458 0.405 1.00 45.41 H new ATOM 0 HD21 LEU A 130 27.777 -9.289 1.579 1.00 43.35 H new ATOM 0 HD22 LEU A 130 27.468 -8.060 0.330 1.00 43.35 H new ATOM 0 HD23 LEU A 130 27.009 -9.755 0.042 1.00 43.35 H new ATOM 2057 N ALA A 131 28.950 -7.425 -4.411 1.00 12.43 N ATOM 2058 CA ALA A 131 29.667 -6.920 -5.575 1.00 1.52 C ATOM 2059 C ALA A 131 29.785 -5.400 -5.530 1.00 53.23 C ATOM 2060 O ALA A 131 30.759 -4.829 -6.018 1.00 51.15 O ATOM 2061 CB ALA A 131 28.972 -7.360 -6.855 1.00 4.12 C ATOM 0 H ALA A 131 28.117 -7.971 -4.633 1.00 12.43 H new ATOM 0 HA ALA A 131 30.674 -7.337 -5.560 1.00 1.52 H new ATOM 0 HB1 ALA A 131 29.518 -6.976 -7.716 1.00 4.12 H new ATOM 0 HB2 ALA A 131 28.945 -8.449 -6.899 1.00 4.12 H new ATOM 0 HB3 ALA A 131 27.954 -6.971 -6.868 1.00 4.12 H new