USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=25 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 Set 1.1: A 74 LYS NZ :NH3+ -150:sc= 0 (180deg=0) USER MOD Set 1.2: A 78 LYS NZ :NH3+ 176:sc= 0 (180deg=0) USER MOD Set 2.1: A 29 SER OG : rot 180:sc= -0.297 USER MOD Set 2.2: A 30 GLN : amide:sc= 0.465 K(o=0.17,f=1) USER MOD Set 3.1: A 25 LYS NZ :NH3+ -125:sc= -0.939 (180deg=-5.08!) USER MOD Set 3.2: A 111 HIS : no HD1:sc= -0.28 X(o=-1.2,f=-1.5) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.244 X(o=-0.24,f=-0.01) USER MOD Single : A 15 MET CE :methyl 165:sc= -0.0226 (180deg=-0.375) USER MOD Single : A 26 ASN : amide:sc= -0.382 X(o=-0.38,f=0) USER MOD Single : A 36 TYR OH : rot 93:sc= 0.0861 USER MOD Single : A 41 LYS NZ :NH3+ -116:sc= -0.861 (180deg=-1.78!) USER MOD Single : A 42 ASN : amide:sc= -3.24 K(o=-3.2,f=-4.8!) USER MOD Single : A 46 THR OG1 : rot 72:sc= 1.24 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 82:sc= 0.743 USER MOD Single : A 60 SER OG : rot -39:sc= 1.11 USER MOD Single : A 63 SER OG : rot 55:sc= 0.213 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= 0.00538 USER MOD Single : A 72 THR OG1 : rot 92:sc= 1.13 USER MOD Single : A 73 GLN : amide:sc= -4.52 K(o=-4.5,f=-8.2!) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 ASN : amide:sc= -0.57 K(o=-0.57,f=-0.0012) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 MET CE :methyl -170:sc= -1.5 (180deg=-1.8) USER MOD Single : A 91 GLN : amide:sc= -0.833 X(o=-0.83,f=-0.79) USER MOD Single : A 92 GLN : amide:sc= 0.257 X(o=0.26,f=-0.16) USER MOD Single : A 93 ASN : amide:sc= -0.0943 X(o=-0.094,f=-0.094) USER MOD Single : A 96 THR OG1 : rot -33:sc= 0.246 USER MOD Single : A 97 SER OG : rot 180:sc= 0.0239 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 158:sc= -0.0407 (180deg=-0.274) USER MOD Single : A 105 GLN : amide:sc= -0.578 X(o=-0.58,f=-0.39) USER MOD Single : A 106 MET CE :methyl 155:sc= -0.0567 (180deg=-0.753) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 121:sc= -0.558 USER MOD Single : A 112 THR OG1 : rot -160:sc= -0.517 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -0.0761 K(o=-0.076,f=-1) USER MOD Single : A 126 GLN : amide:sc= -0.439 X(o=-0.44,f=-0.22) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 106 N ASP A 8 17.741 -8.427 -9.642 1.00 41.05 N ATOM 107 CA ASP A 8 17.965 -9.868 -9.659 1.00 12.13 C ATOM 108 C ASP A 8 17.132 -10.535 -10.749 1.00 15.13 C ATOM 109 O ASP A 8 15.968 -10.187 -10.956 1.00 63.02 O ATOM 110 CB ASP A 8 17.624 -10.474 -8.296 1.00 40.23 C ATOM 111 CG ASP A 8 16.351 -9.898 -7.709 1.00 14.13 C ATOM 112 OD1 ASP A 8 15.438 -9.557 -8.490 1.00 45.22 O ATOM 113 OD2 ASP A 8 16.267 -9.787 -6.467 1.00 74.54 O ATOM 0 HA ASP A 8 19.019 -10.045 -9.874 1.00 12.13 H new ATOM 0 HB2 ASP A 8 17.517 -11.554 -8.398 1.00 40.23 H new ATOM 0 HB3 ASP A 8 18.450 -10.299 -7.607 1.00 40.23 H new ATOM 118 N LEU A 9 17.734 -11.494 -11.443 1.00 51.10 N ATOM 119 CA LEU A 9 17.048 -12.210 -12.513 1.00 40.32 C ATOM 120 C LEU A 9 17.222 -13.717 -12.359 1.00 21.21 C ATOM 121 O LEU A 9 16.784 -14.494 -13.208 1.00 0.51 O ATOM 122 CB LEU A 9 17.579 -11.760 -13.876 1.00 33.42 C ATOM 123 CG LEU A 9 18.996 -12.213 -14.227 1.00 24.45 C ATOM 124 CD1 LEU A 9 19.239 -12.097 -15.723 1.00 41.33 C ATOM 125 CD2 LEU A 9 20.023 -11.399 -13.453 1.00 22.32 C ATOM 0 H LEU A 9 18.696 -11.794 -11.284 1.00 51.10 H new ATOM 0 HA LEU A 9 15.985 -11.978 -12.449 1.00 40.32 H new ATOM 0 HB2 LEU A 9 16.901 -12.126 -14.647 1.00 33.42 H new ATOM 0 HB3 LEU A 9 17.547 -10.671 -13.914 1.00 33.42 H new ATOM 0 HG LEU A 9 19.103 -13.260 -13.943 1.00 24.45 H new ATOM 0 HD11 LEU A 9 20.253 -12.424 -15.953 1.00 41.33 H new ATOM 0 HD12 LEU A 9 18.525 -12.724 -16.257 1.00 41.33 H new ATOM 0 HD13 LEU A 9 19.113 -11.060 -16.033 1.00 41.33 H new ATOM 0 HD21 LEU A 9 21.026 -11.735 -13.715 1.00 22.32 H new ATOM 0 HD22 LEU A 9 19.916 -10.344 -13.705 1.00 22.32 H new ATOM 0 HD23 LEU A 9 19.863 -11.534 -12.383 1.00 22.32 H new ATOM 137 N VAL A 10 17.863 -14.125 -11.268 1.00 61.11 N ATOM 138 CA VAL A 10 18.092 -15.540 -11.000 1.00 42.22 C ATOM 139 C VAL A 10 16.984 -16.121 -10.129 1.00 2.41 C ATOM 140 O VAL A 10 16.931 -17.329 -9.897 1.00 51.25 O ATOM 141 CB VAL A 10 19.448 -15.767 -10.306 1.00 63.21 C ATOM 142 CG1 VAL A 10 20.574 -15.145 -11.117 1.00 45.43 C ATOM 143 CG2 VAL A 10 19.424 -15.205 -8.893 1.00 0.40 C ATOM 0 H VAL A 10 18.233 -13.496 -10.556 1.00 61.11 H new ATOM 0 HA VAL A 10 18.096 -16.048 -11.964 1.00 42.22 H new ATOM 0 HB VAL A 10 19.629 -16.840 -10.242 1.00 63.21 H new ATOM 0 HG11 VAL A 10 21.524 -15.316 -10.611 1.00 45.43 H new ATOM 0 HG12 VAL A 10 20.603 -15.600 -12.107 1.00 45.43 H new ATOM 0 HG13 VAL A 10 20.403 -14.073 -11.215 1.00 45.43 H new ATOM 0 HG21 VAL A 10 20.390 -15.374 -8.418 1.00 0.40 H new ATOM 0 HG22 VAL A 10 19.221 -14.135 -8.930 1.00 0.40 H new ATOM 0 HG23 VAL A 10 18.644 -15.703 -8.317 1.00 0.40 H new ATOM 153 N TYR A 11 16.101 -15.253 -9.649 1.00 13.23 N ATOM 154 CA TYR A 11 14.994 -15.679 -8.801 1.00 33.02 C ATOM 155 C TYR A 11 13.731 -15.906 -9.627 1.00 22.54 C ATOM 156 O TYR A 11 12.729 -16.416 -9.123 1.00 61.13 O ATOM 157 CB TYR A 11 14.725 -14.636 -7.714 1.00 60.25 C ATOM 158 CG TYR A 11 13.841 -13.499 -8.173 1.00 12.53 C ATOM 159 CD1 TYR A 11 14.311 -12.543 -9.065 1.00 72.00 C ATOM 160 CD2 TYR A 11 12.535 -13.380 -7.714 1.00 14.22 C ATOM 161 CE1 TYR A 11 13.507 -11.502 -9.486 1.00 14.44 C ATOM 162 CE2 TYR A 11 11.723 -12.342 -8.130 1.00 73.51 C ATOM 163 CZ TYR A 11 12.213 -11.406 -9.016 1.00 4.34 C ATOM 164 OH TYR A 11 11.409 -10.371 -9.433 1.00 53.52 O ATOM 0 H TYR A 11 16.130 -14.250 -9.833 1.00 13.23 H new ATOM 0 HA TYR A 11 15.273 -16.621 -8.330 1.00 33.02 H new ATOM 0 HB2 TYR A 11 14.258 -15.126 -6.859 1.00 60.25 H new ATOM 0 HB3 TYR A 11 15.676 -14.230 -7.369 1.00 60.25 H new ATOM 0 HD1 TYR A 11 15.323 -12.615 -9.436 1.00 72.00 H new ATOM 0 HD2 TYR A 11 12.148 -14.111 -7.020 1.00 14.22 H new ATOM 0 HE1 TYR A 11 13.889 -10.767 -10.179 1.00 14.44 H new ATOM 0 HE2 TYR A 11 10.710 -12.264 -7.763 1.00 73.51 H new ATOM 0 HH TYR A 11 10.529 -10.450 -9.010 1.00 53.52 H new ATOM 174 N LEU A 12 13.787 -15.526 -10.898 1.00 4.50 N ATOM 175 CA LEU A 12 12.649 -15.688 -11.796 1.00 44.23 C ATOM 176 C LEU A 12 12.730 -17.015 -12.543 1.00 62.31 C ATOM 177 O LEU A 12 11.764 -17.775 -12.584 1.00 72.32 O ATOM 178 CB LEU A 12 12.594 -14.530 -12.795 1.00 33.32 C ATOM 179 CG LEU A 12 11.940 -13.242 -12.293 1.00 71.25 C ATOM 180 CD1 LEU A 12 11.984 -12.168 -13.369 1.00 11.33 C ATOM 181 CD2 LEU A 12 10.506 -13.506 -11.859 1.00 75.22 C ATOM 0 H LEU A 12 14.608 -15.103 -11.330 1.00 4.50 H new ATOM 0 HA LEU A 12 11.740 -15.685 -11.195 1.00 44.23 H new ATOM 0 HB2 LEU A 12 13.612 -14.299 -13.109 1.00 33.32 H new ATOM 0 HB3 LEU A 12 12.055 -14.866 -13.681 1.00 33.32 H new ATOM 0 HG LEU A 12 12.500 -12.885 -11.428 1.00 71.25 H new ATOM 0 HD11 LEU A 12 11.514 -11.258 -12.995 1.00 11.33 H new ATOM 0 HD12 LEU A 12 13.021 -11.959 -13.632 1.00 11.33 H new ATOM 0 HD13 LEU A 12 11.448 -12.516 -14.252 1.00 11.33 H new ATOM 0 HD21 LEU A 12 10.056 -12.578 -11.505 1.00 75.22 H new ATOM 0 HD22 LEU A 12 9.934 -13.886 -12.705 1.00 75.22 H new ATOM 0 HD23 LEU A 12 10.499 -14.243 -11.056 1.00 75.22 H new ATOM 193 N ASN A 13 13.891 -17.288 -13.131 1.00 32.13 N ATOM 194 CA ASN A 13 14.099 -18.525 -13.875 1.00 35.12 C ATOM 195 C ASN A 13 14.096 -19.730 -12.939 1.00 14.00 C ATOM 196 O ASN A 13 13.837 -20.857 -13.361 1.00 63.23 O ATOM 197 CB ASN A 13 15.420 -18.466 -14.644 1.00 73.13 C ATOM 198 CG ASN A 13 15.341 -17.563 -15.860 1.00 11.21 C ATOM 199 OD1 ASN A 13 16.145 -16.644 -16.017 1.00 51.23 O ATOM 200 ND2 ASN A 13 14.368 -17.821 -16.727 1.00 5.14 N ATOM 0 H ASN A 13 14.702 -16.669 -13.106 1.00 32.13 H new ATOM 0 HA ASN A 13 13.278 -18.636 -14.584 1.00 35.12 H new ATOM 0 HB2 ASN A 13 16.208 -18.109 -13.981 1.00 73.13 H new ATOM 0 HB3 ASN A 13 15.699 -19.471 -14.959 1.00 73.13 H new ATOM 0 HD21 ASN A 13 14.265 -17.247 -17.564 1.00 5.14 H new ATOM 0 HD22 ASN A 13 13.724 -18.593 -16.556 1.00 5.14 H new ATOM 207 N VAL A 14 14.384 -19.484 -11.665 1.00 1.40 N ATOM 208 CA VAL A 14 14.413 -20.547 -10.668 1.00 61.32 C ATOM 209 C VAL A 14 13.006 -20.896 -10.195 1.00 44.40 C ATOM 210 O VAL A 14 12.735 -22.031 -9.806 1.00 30.10 O ATOM 211 CB VAL A 14 15.269 -20.152 -9.450 1.00 43.14 C ATOM 212 CG1 VAL A 14 14.570 -19.077 -8.632 1.00 61.20 C ATOM 213 CG2 VAL A 14 15.573 -21.372 -8.594 1.00 70.34 C ATOM 0 H VAL A 14 14.601 -18.557 -11.299 1.00 1.40 H new ATOM 0 HA VAL A 14 14.858 -21.418 -11.148 1.00 61.32 H new ATOM 0 HB VAL A 14 16.214 -19.744 -9.809 1.00 43.14 H new ATOM 0 HG11 VAL A 14 15.190 -18.811 -7.776 1.00 61.20 H new ATOM 0 HG12 VAL A 14 14.409 -18.195 -9.252 1.00 61.20 H new ATOM 0 HG13 VAL A 14 13.609 -19.454 -8.281 1.00 61.20 H new ATOM 0 HG21 VAL A 14 16.179 -21.074 -7.738 1.00 70.34 H new ATOM 0 HG22 VAL A 14 14.640 -21.812 -8.243 1.00 70.34 H new ATOM 0 HG23 VAL A 14 16.119 -22.106 -9.187 1.00 70.34 H new ATOM 223 N MET A 15 12.115 -19.911 -10.232 1.00 12.32 N ATOM 224 CA MET A 15 10.734 -20.114 -9.808 1.00 43.11 C ATOM 225 C MET A 15 9.990 -21.009 -10.793 1.00 75.42 C ATOM 226 O MET A 15 9.082 -21.747 -10.411 1.00 14.53 O ATOM 227 CB MET A 15 10.015 -18.770 -9.678 1.00 40.14 C ATOM 228 CG MET A 15 8.771 -18.828 -8.807 1.00 21.04 C ATOM 229 SD MET A 15 8.260 -17.203 -8.216 1.00 40.34 S ATOM 230 CE MET A 15 8.229 -16.280 -9.751 1.00 55.21 C ATOM 0 H MET A 15 12.324 -18.965 -10.551 1.00 12.32 H new ATOM 0 HA MET A 15 10.747 -20.606 -8.835 1.00 43.11 H new ATOM 0 HB2 MET A 15 10.706 -18.036 -9.262 1.00 40.14 H new ATOM 0 HB3 MET A 15 9.737 -18.418 -10.672 1.00 40.14 H new ATOM 0 HG2 MET A 15 7.956 -19.277 -9.374 1.00 21.04 H new ATOM 0 HG3 MET A 15 8.960 -19.478 -7.953 1.00 21.04 H new ATOM 0 HE1 MET A 15 7.685 -15.347 -9.604 1.00 55.21 H new ATOM 0 HE2 MET A 15 9.250 -16.059 -10.063 1.00 55.21 H new ATOM 0 HE3 MET A 15 7.734 -16.871 -10.521 1.00 55.21 H new ATOM 240 N GLU A 16 10.380 -20.939 -12.062 1.00 20.20 N ATOM 241 CA GLU A 16 9.747 -21.743 -13.101 1.00 24.52 C ATOM 242 C GLU A 16 9.992 -23.231 -12.862 1.00 42.32 C ATOM 243 O GLU A 16 9.108 -24.060 -13.080 1.00 13.14 O ATOM 244 CB GLU A 16 10.276 -21.343 -14.480 1.00 22.13 C ATOM 245 CG GLU A 16 9.618 -20.096 -15.046 1.00 34.24 C ATOM 246 CD GLU A 16 8.107 -20.210 -15.105 1.00 33.22 C ATOM 247 OE1 GLU A 16 7.602 -21.347 -15.223 1.00 43.44 O ATOM 248 OE2 GLU A 16 7.429 -19.164 -15.033 1.00 11.01 O ATOM 0 H GLU A 16 11.131 -20.334 -12.395 1.00 20.20 H new ATOM 0 HA GLU A 16 8.673 -21.558 -13.064 1.00 24.52 H new ATOM 0 HB2 GLU A 16 11.351 -21.178 -14.413 1.00 22.13 H new ATOM 0 HB3 GLU A 16 10.123 -22.171 -15.173 1.00 22.13 H new ATOM 0 HG2 GLU A 16 9.890 -19.236 -14.434 1.00 34.24 H new ATOM 0 HG3 GLU A 16 10.004 -19.909 -16.048 1.00 34.24 H new ATOM 255 N LEU A 17 11.198 -23.561 -12.415 1.00 25.13 N ATOM 256 CA LEU A 17 11.562 -24.948 -12.147 1.00 34.45 C ATOM 257 C LEU A 17 10.808 -25.484 -10.933 1.00 42.40 C ATOM 258 O LEU A 17 10.170 -26.535 -10.999 1.00 4.51 O ATOM 259 CB LEU A 17 13.069 -25.066 -11.918 1.00 24.51 C ATOM 260 CG LEU A 17 13.575 -26.439 -11.473 1.00 64.33 C ATOM 261 CD1 LEU A 17 14.899 -26.764 -12.148 1.00 30.40 C ATOM 262 CD2 LEU A 17 13.720 -26.490 -9.959 1.00 53.13 C ATOM 0 H LEU A 17 11.941 -22.887 -12.230 1.00 25.13 H new ATOM 0 HA LEU A 17 11.285 -25.544 -13.016 1.00 34.45 H new ATOM 0 HB2 LEU A 17 13.579 -24.795 -12.842 1.00 24.51 H new ATOM 0 HB3 LEU A 17 13.361 -24.332 -11.166 1.00 24.51 H new ATOM 0 HG LEU A 17 12.843 -27.189 -11.773 1.00 64.33 H new ATOM 0 HD11 LEU A 17 15.244 -27.744 -11.820 1.00 30.40 H new ATOM 0 HD12 LEU A 17 14.764 -26.770 -13.230 1.00 30.40 H new ATOM 0 HD13 LEU A 17 15.639 -26.010 -11.879 1.00 30.40 H new ATOM 0 HD21 LEU A 17 14.081 -27.474 -9.661 1.00 53.13 H new ATOM 0 HD22 LEU A 17 14.431 -25.730 -9.636 1.00 53.13 H new ATOM 0 HD23 LEU A 17 12.752 -26.303 -9.494 1.00 53.13 H new ATOM 274 N VAL A 18 10.885 -24.752 -9.826 1.00 34.34 N ATOM 275 CA VAL A 18 10.207 -25.151 -8.598 1.00 24.44 C ATOM 276 C VAL A 18 8.731 -25.433 -8.851 1.00 73.01 C ATOM 277 O VAL A 18 8.115 -26.242 -8.157 1.00 74.23 O ATOM 278 CB VAL A 18 10.333 -24.068 -7.510 1.00 32.11 C ATOM 279 CG1 VAL A 18 9.743 -24.559 -6.197 1.00 21.14 C ATOM 280 CG2 VAL A 18 11.787 -23.659 -7.331 1.00 61.30 C ATOM 0 H VAL A 18 11.410 -23.880 -9.754 1.00 34.34 H new ATOM 0 HA VAL A 18 10.693 -26.063 -8.251 1.00 24.44 H new ATOM 0 HB VAL A 18 9.770 -23.191 -7.828 1.00 32.11 H new ATOM 0 HG11 VAL A 18 9.841 -23.781 -5.440 1.00 21.14 H new ATOM 0 HG12 VAL A 18 8.689 -24.797 -6.338 1.00 21.14 H new ATOM 0 HG13 VAL A 18 10.276 -25.452 -5.870 1.00 21.14 H new ATOM 0 HG21 VAL A 18 11.857 -22.893 -6.559 1.00 61.30 H new ATOM 0 HG22 VAL A 18 12.376 -24.528 -7.035 1.00 61.30 H new ATOM 0 HG23 VAL A 18 12.172 -23.263 -8.271 1.00 61.30 H new ATOM 290 N ARG A 19 8.169 -24.760 -9.850 1.00 34.31 N ATOM 291 CA ARG A 19 6.763 -24.937 -10.195 1.00 63.51 C ATOM 292 C ARG A 19 6.571 -26.168 -11.077 1.00 41.54 C ATOM 293 O ARG A 19 5.574 -26.879 -10.959 1.00 22.25 O ATOM 294 CB ARG A 19 6.231 -23.695 -10.911 1.00 43.22 C ATOM 295 CG ARG A 19 4.855 -23.259 -10.434 1.00 64.24 C ATOM 296 CD ARG A 19 3.871 -23.160 -11.589 1.00 43.34 C ATOM 297 NE ARG A 19 2.746 -22.283 -11.276 1.00 31.33 N ATOM 298 CZ ARG A 19 1.811 -21.944 -12.156 1.00 70.02 C ATOM 299 NH1 ARG A 19 1.866 -22.406 -13.398 1.00 3.51 N ATOM 300 NH2 ARG A 19 0.818 -21.142 -11.795 1.00 14.20 N ATOM 0 H ARG A 19 8.665 -24.087 -10.435 1.00 34.31 H new ATOM 0 HA ARG A 19 6.203 -25.082 -9.271 1.00 63.51 H new ATOM 0 HB2 ARG A 19 6.933 -22.874 -10.766 1.00 43.22 H new ATOM 0 HB3 ARG A 19 6.189 -23.894 -11.982 1.00 43.22 H new ATOM 0 HG2 ARG A 19 4.482 -23.970 -9.697 1.00 64.24 H new ATOM 0 HG3 ARG A 19 4.931 -22.293 -9.935 1.00 64.24 H new ATOM 0 HD2 ARG A 19 4.387 -22.786 -12.474 1.00 43.34 H new ATOM 0 HD3 ARG A 19 3.498 -24.155 -11.834 1.00 43.34 H new ATOM 0 HE ARG A 19 2.674 -21.910 -10.329 1.00 31.33 H new ATOM 0 HH11 ARG A 19 2.628 -23.023 -13.679 1.00 3.51 H new ATOM 0 HH12 ARG A 19 1.147 -22.144 -14.072 1.00 3.51 H new ATOM 0 HH21 ARG A 19 0.772 -20.785 -10.841 1.00 14.20 H new ATOM 0 HH22 ARG A 19 0.100 -20.882 -12.472 1.00 14.20 H new ATOM 314 N ALA A 20 7.532 -26.410 -11.962 1.00 62.55 N ATOM 315 CA ALA A 20 7.470 -27.555 -12.864 1.00 14.55 C ATOM 316 C ALA A 20 7.803 -28.849 -12.131 1.00 22.54 C ATOM 317 O ALA A 20 7.424 -29.937 -12.566 1.00 15.40 O ATOM 318 CB ALA A 20 8.414 -27.353 -14.039 1.00 42.21 C ATOM 0 H ALA A 20 8.363 -25.829 -12.074 1.00 62.55 H new ATOM 0 HA ALA A 20 6.451 -27.634 -13.242 1.00 14.55 H new ATOM 0 HB1 ALA A 20 8.357 -28.215 -14.704 1.00 42.21 H new ATOM 0 HB2 ALA A 20 8.128 -26.454 -14.585 1.00 42.21 H new ATOM 0 HB3 ALA A 20 9.434 -27.245 -13.671 1.00 42.21 H new ATOM 324 N VAL A 21 8.516 -28.726 -11.015 1.00 62.25 N ATOM 325 CA VAL A 21 8.901 -29.887 -10.222 1.00 33.13 C ATOM 326 C VAL A 21 7.887 -30.156 -9.115 1.00 25.12 C ATOM 327 O VAL A 21 7.831 -31.256 -8.564 1.00 31.24 O ATOM 328 CB VAL A 21 10.294 -29.700 -9.593 1.00 22.34 C ATOM 329 CG1 VAL A 21 10.264 -28.599 -8.544 1.00 54.42 C ATOM 330 CG2 VAL A 21 10.786 -31.008 -8.990 1.00 12.41 C ATOM 0 H VAL A 21 8.838 -27.834 -10.640 1.00 62.25 H new ATOM 0 HA VAL A 21 8.929 -30.739 -10.901 1.00 33.13 H new ATOM 0 HB VAL A 21 10.990 -29.402 -10.377 1.00 22.34 H new ATOM 0 HG11 VAL A 21 11.257 -28.482 -8.111 1.00 54.42 H new ATOM 0 HG12 VAL A 21 9.958 -27.662 -9.009 1.00 54.42 H new ATOM 0 HG13 VAL A 21 9.555 -28.863 -7.759 1.00 54.42 H new ATOM 0 HG21 VAL A 21 11.772 -30.858 -8.550 1.00 12.41 H new ATOM 0 HG22 VAL A 21 10.090 -31.337 -8.218 1.00 12.41 H new ATOM 0 HG23 VAL A 21 10.849 -31.767 -9.770 1.00 12.41 H new ATOM 340 N LEU A 22 7.088 -29.145 -8.794 1.00 11.10 N ATOM 341 CA LEU A 22 6.074 -29.272 -7.752 1.00 45.33 C ATOM 342 C LEU A 22 4.808 -29.921 -8.301 1.00 21.33 C ATOM 343 O LEU A 22 4.086 -30.605 -7.576 1.00 4.14 O ATOM 344 CB LEU A 22 5.744 -27.898 -7.165 1.00 73.43 C ATOM 345 CG LEU A 22 6.461 -27.534 -5.865 1.00 12.11 C ATOM 346 CD1 LEU A 22 6.319 -26.048 -5.576 1.00 10.44 C ATOM 347 CD2 LEU A 22 5.918 -28.359 -4.707 1.00 54.41 C ATOM 0 H LEU A 22 7.122 -28.228 -9.240 1.00 11.10 H new ATOM 0 HA LEU A 22 6.475 -29.910 -6.964 1.00 45.33 H new ATOM 0 HB2 LEU A 22 5.981 -27.140 -7.912 1.00 73.43 H new ATOM 0 HB3 LEU A 22 4.669 -27.848 -6.990 1.00 73.43 H new ATOM 0 HG LEU A 22 7.521 -27.761 -5.981 1.00 12.11 H new ATOM 0 HD11 LEU A 22 6.836 -25.807 -4.647 1.00 10.44 H new ATOM 0 HD12 LEU A 22 6.756 -25.475 -6.394 1.00 10.44 H new ATOM 0 HD13 LEU A 22 5.263 -25.795 -5.480 1.00 10.44 H new ATOM 0 HD21 LEU A 22 6.440 -28.086 -3.790 1.00 54.41 H new ATOM 0 HD22 LEU A 22 4.852 -28.164 -4.590 1.00 54.41 H new ATOM 0 HD23 LEU A 22 6.072 -29.419 -4.911 1.00 54.41 H new ATOM 359 N GLU A 23 4.547 -29.704 -9.586 1.00 35.21 N ATOM 360 CA GLU A 23 3.368 -30.270 -10.231 1.00 73.21 C ATOM 361 C GLU A 23 3.499 -31.784 -10.372 1.00 33.12 C ATOM 362 O GLU A 23 2.506 -32.511 -10.327 1.00 74.50 O ATOM 363 CB GLU A 23 3.158 -29.635 -11.607 1.00 70.44 C ATOM 364 CG GLU A 23 4.151 -30.111 -12.655 1.00 34.21 C ATOM 365 CD GLU A 23 3.876 -29.527 -14.027 1.00 1.42 C ATOM 366 OE1 GLU A 23 3.403 -28.373 -14.097 1.00 64.12 O ATOM 367 OE2 GLU A 23 4.135 -30.224 -15.030 1.00 54.45 O ATOM 0 H GLU A 23 5.135 -29.141 -10.200 1.00 35.21 H new ATOM 0 HA GLU A 23 2.503 -30.054 -9.603 1.00 73.21 H new ATOM 0 HB2 GLU A 23 2.147 -29.856 -11.949 1.00 70.44 H new ATOM 0 HB3 GLU A 23 3.233 -28.552 -11.513 1.00 70.44 H new ATOM 0 HG2 GLU A 23 5.160 -29.839 -12.344 1.00 34.21 H new ATOM 0 HG3 GLU A 23 4.118 -31.199 -12.714 1.00 34.21 H new ATOM 374 N LEU A 24 4.730 -32.252 -10.543 1.00 2.04 N ATOM 375 CA LEU A 24 4.993 -33.679 -10.691 1.00 34.35 C ATOM 376 C LEU A 24 5.038 -34.368 -9.331 1.00 25.45 C ATOM 377 O LEU A 24 5.030 -35.597 -9.244 1.00 1.42 O ATOM 378 CB LEU A 24 6.312 -33.901 -11.432 1.00 61.11 C ATOM 379 CG LEU A 24 7.579 -33.844 -10.579 1.00 25.14 C ATOM 380 CD1 LEU A 24 7.922 -35.224 -10.039 1.00 64.24 C ATOM 381 CD2 LEU A 24 8.741 -33.281 -11.385 1.00 14.11 C ATOM 0 H LEU A 24 5.562 -31.664 -10.583 1.00 2.04 H new ATOM 0 HA LEU A 24 4.180 -34.115 -11.272 1.00 34.35 H new ATOM 0 HB2 LEU A 24 6.271 -34.874 -11.922 1.00 61.11 H new ATOM 0 HB3 LEU A 24 6.394 -33.151 -12.219 1.00 61.11 H new ATOM 0 HG LEU A 24 7.394 -33.181 -9.734 1.00 25.14 H new ATOM 0 HD11 LEU A 24 8.827 -35.163 -9.434 1.00 64.24 H new ATOM 0 HD12 LEU A 24 7.099 -35.589 -9.425 1.00 64.24 H new ATOM 0 HD13 LEU A 24 8.086 -35.909 -10.870 1.00 64.24 H new ATOM 0 HD21 LEU A 24 9.634 -33.248 -10.761 1.00 14.11 H new ATOM 0 HD22 LEU A 24 8.926 -33.918 -12.250 1.00 14.11 H new ATOM 0 HD23 LEU A 24 8.496 -32.274 -11.722 1.00 14.11 H new ATOM 393 N LYS A 25 5.085 -33.570 -8.270 1.00 12.23 N ATOM 394 CA LYS A 25 5.128 -34.101 -6.913 1.00 22.24 C ATOM 395 C LYS A 25 3.750 -34.586 -6.474 1.00 0.54 C ATOM 396 O LYS A 25 3.555 -35.770 -6.204 1.00 50.14 O ATOM 397 CB LYS A 25 5.639 -33.035 -5.941 1.00 51.52 C ATOM 398 CG LYS A 25 7.154 -32.945 -5.878 1.00 12.12 C ATOM 399 CD LYS A 25 7.608 -31.797 -4.992 1.00 31.02 C ATOM 400 CE LYS A 25 7.116 -31.968 -3.563 1.00 12.53 C ATOM 401 NZ LYS A 25 7.611 -33.232 -2.953 1.00 24.34 N ATOM 0 H LYS A 25 5.094 -32.551 -8.324 1.00 12.23 H new ATOM 0 HA LYS A 25 5.812 -34.949 -6.904 1.00 22.24 H new ATOM 0 HB2 LYS A 25 5.238 -32.065 -6.235 1.00 51.52 H new ATOM 0 HB3 LYS A 25 5.254 -33.250 -4.944 1.00 51.52 H new ATOM 0 HG2 LYS A 25 7.560 -33.882 -5.497 1.00 12.12 H new ATOM 0 HG3 LYS A 25 7.554 -32.810 -6.883 1.00 12.12 H new ATOM 0 HD2 LYS A 25 8.696 -31.739 -4.999 1.00 31.02 H new ATOM 0 HD3 LYS A 25 7.236 -30.855 -5.396 1.00 31.02 H new ATOM 0 HE2 LYS A 25 7.446 -31.121 -2.962 1.00 12.53 H new ATOM 0 HE3 LYS A 25 6.026 -31.962 -3.551 1.00 12.53 H new ATOM 0 HZ1 LYS A 25 6.804 -33.788 -2.604 1.00 24.34 H new ATOM 0 HZ2 LYS A 25 8.128 -33.783 -3.667 1.00 24.34 H new ATOM 0 HZ3 LYS A 25 8.247 -33.009 -2.160 1.00 24.34 H new ATOM 415 N ASN A 26 2.797 -33.662 -6.405 1.00 41.53 N ATOM 416 CA ASN A 26 1.436 -33.995 -6.000 1.00 25.31 C ATOM 417 C ASN A 26 0.808 -34.989 -6.972 1.00 33.33 C ATOM 418 O ASN A 26 -0.174 -35.655 -6.645 1.00 11.14 O ATOM 419 CB ASN A 26 0.580 -32.730 -5.922 1.00 43.33 C ATOM 420 CG ASN A 26 0.687 -32.041 -4.575 1.00 45.15 C ATOM 421 OD1 ASN A 26 -0.322 -31.728 -3.944 1.00 2.03 O ATOM 422 ND2 ASN A 26 1.915 -31.801 -4.130 1.00 22.12 N ATOM 0 H ASN A 26 2.942 -32.677 -6.624 1.00 41.53 H new ATOM 0 HA ASN A 26 1.480 -34.456 -5.013 1.00 25.31 H new ATOM 0 HB2 ASN A 26 0.887 -32.038 -6.706 1.00 43.33 H new ATOM 0 HB3 ASN A 26 -0.462 -32.987 -6.114 1.00 43.33 H new ATOM 0 HD21 ASN A 26 2.050 -31.339 -3.231 1.00 22.12 H new ATOM 0 HD22 ASN A 26 2.723 -32.078 -4.688 1.00 22.12 H new ATOM 429 N GLU A 27 1.382 -35.084 -8.167 1.00 54.31 N ATOM 430 CA GLU A 27 0.877 -35.996 -9.186 1.00 73.42 C ATOM 431 C GLU A 27 1.260 -37.438 -8.864 1.00 11.25 C ATOM 432 O GLU A 27 0.662 -38.382 -9.382 1.00 23.02 O ATOM 433 CB GLU A 27 1.419 -35.609 -10.563 1.00 43.14 C ATOM 434 CG GLU A 27 0.621 -34.511 -11.245 1.00 51.52 C ATOM 435 CD GLU A 27 1.275 -34.021 -12.523 1.00 31.23 C ATOM 436 OE1 GLU A 27 1.958 -34.828 -13.187 1.00 71.11 O ATOM 437 OE2 GLU A 27 1.103 -32.830 -12.858 1.00 30.40 O ATOM 0 H GLU A 27 2.197 -34.541 -8.453 1.00 54.31 H new ATOM 0 HA GLU A 27 -0.210 -35.920 -9.197 1.00 73.42 H new ATOM 0 HB2 GLU A 27 2.454 -35.283 -10.458 1.00 43.14 H new ATOM 0 HB3 GLU A 27 1.426 -36.492 -11.202 1.00 43.14 H new ATOM 0 HG2 GLU A 27 -0.379 -34.881 -11.472 1.00 51.52 H new ATOM 0 HG3 GLU A 27 0.502 -33.673 -10.558 1.00 51.52 H new ATOM 444 N LEU A 28 2.260 -37.600 -8.005 1.00 4.52 N ATOM 445 CA LEU A 28 2.725 -38.926 -7.612 1.00 40.53 C ATOM 446 C LEU A 28 1.557 -39.806 -7.179 1.00 50.31 C ATOM 447 O LEU A 28 1.523 -41.000 -7.477 1.00 13.44 O ATOM 448 CB LEU A 28 3.744 -38.815 -6.477 1.00 32.14 C ATOM 449 CG LEU A 28 4.752 -39.960 -6.366 1.00 12.55 C ATOM 450 CD1 LEU A 28 4.041 -41.269 -6.063 1.00 30.50 C ATOM 451 CD2 LEU A 28 5.569 -40.077 -7.644 1.00 54.21 C ATOM 0 H LEU A 28 2.765 -36.830 -7.567 1.00 4.52 H new ATOM 0 HA LEU A 28 3.203 -39.388 -8.476 1.00 40.53 H new ATOM 0 HB2 LEU A 28 4.295 -37.883 -6.600 1.00 32.14 H new ATOM 0 HB3 LEU A 28 3.202 -38.742 -5.534 1.00 32.14 H new ATOM 0 HG LEU A 28 5.432 -39.741 -5.543 1.00 12.55 H new ATOM 0 HD11 LEU A 28 4.774 -42.072 -5.988 1.00 30.50 H new ATOM 0 HD12 LEU A 28 3.502 -41.180 -5.120 1.00 30.50 H new ATOM 0 HD13 LEU A 28 3.337 -41.494 -6.864 1.00 30.50 H new ATOM 0 HD21 LEU A 28 6.281 -40.897 -7.547 1.00 54.21 H new ATOM 0 HD22 LEU A 28 4.903 -40.272 -8.485 1.00 54.21 H new ATOM 0 HD23 LEU A 28 6.109 -39.146 -7.817 1.00 54.21 H new ATOM 463 N SER A 29 0.600 -39.207 -6.476 1.00 65.25 N ATOM 464 CA SER A 29 -0.569 -39.937 -6.001 1.00 10.11 C ATOM 465 C SER A 29 -1.766 -39.702 -6.918 1.00 24.31 C ATOM 466 O SER A 29 -2.888 -39.505 -6.452 1.00 63.44 O ATOM 467 CB SER A 29 -0.916 -39.512 -4.573 1.00 5.14 C ATOM 468 OG SER A 29 -1.465 -38.206 -4.548 1.00 51.03 O ATOM 0 H SER A 29 0.612 -38.219 -6.223 1.00 65.25 H new ATOM 0 HA SER A 29 -0.330 -41.001 -6.009 1.00 10.11 H new ATOM 0 HB2 SER A 29 -1.628 -40.217 -4.143 1.00 5.14 H new ATOM 0 HB3 SER A 29 -0.020 -39.545 -3.953 1.00 5.14 H new ATOM 0 HG SER A 29 -1.680 -37.959 -3.624 1.00 51.03 H new ATOM 474 N GLN A 30 -1.516 -39.725 -8.223 1.00 72.12 N ATOM 475 CA GLN A 30 -2.572 -39.514 -9.206 1.00 35.20 C ATOM 476 C GLN A 30 -2.236 -40.205 -10.523 1.00 40.14 C ATOM 477 O GLN A 30 -2.815 -41.239 -10.860 1.00 5.10 O ATOM 478 CB GLN A 30 -2.788 -38.018 -9.441 1.00 61.12 C ATOM 479 CG GLN A 30 -3.799 -37.393 -8.494 1.00 1.32 C ATOM 480 CD GLN A 30 -3.187 -36.324 -7.609 1.00 63.53 C ATOM 481 OE1 GLN A 30 -2.980 -35.190 -8.040 1.00 4.53 O ATOM 482 NE2 GLN A 30 -2.894 -36.683 -6.365 1.00 5.53 N ATOM 0 H GLN A 30 -0.592 -39.887 -8.624 1.00 72.12 H new ATOM 0 HA GLN A 30 -3.491 -39.949 -8.813 1.00 35.20 H new ATOM 0 HB2 GLN A 30 -1.835 -37.501 -9.334 1.00 61.12 H new ATOM 0 HB3 GLN A 30 -3.121 -37.864 -10.467 1.00 61.12 H new ATOM 0 HG2 GLN A 30 -4.613 -36.957 -9.074 1.00 1.32 H new ATOM 0 HG3 GLN A 30 -4.235 -38.172 -7.868 1.00 1.32 H new ATOM 0 HE21 GLN A 30 -3.083 -37.635 -6.051 1.00 5.53 H new ATOM 0 HE22 GLN A 30 -2.480 -36.007 -5.723 1.00 5.53 H new ATOM 491 N LEU A 31 -1.298 -39.627 -11.266 1.00 20.13 N ATOM 492 CA LEU A 31 -0.884 -40.187 -12.548 1.00 11.03 C ATOM 493 C LEU A 31 0.156 -41.285 -12.352 1.00 30.41 C ATOM 494 O LEU A 31 0.826 -41.364 -11.322 1.00 13.33 O ATOM 495 CB LEU A 31 -0.318 -39.087 -13.448 1.00 21.42 C ATOM 496 CG LEU A 31 -1.344 -38.263 -14.226 1.00 44.23 C ATOM 497 CD1 LEU A 31 -0.665 -37.107 -14.945 1.00 1.02 C ATOM 498 CD2 LEU A 31 -2.094 -39.142 -15.216 1.00 41.23 C ATOM 0 H LEU A 31 -0.810 -38.771 -11.003 1.00 20.13 H new ATOM 0 HA LEU A 31 -1.761 -40.624 -13.026 1.00 11.03 H new ATOM 0 HB2 LEU A 31 0.271 -38.408 -12.832 1.00 21.42 H new ATOM 0 HB3 LEU A 31 0.367 -39.545 -14.162 1.00 21.42 H new ATOM 0 HG LEU A 31 -2.064 -37.852 -13.518 1.00 44.23 H new ATOM 0 HD11 LEU A 31 -1.411 -36.531 -15.494 1.00 1.02 H new ATOM 0 HD12 LEU A 31 -0.174 -36.463 -14.216 1.00 1.02 H new ATOM 0 HD13 LEU A 31 0.077 -37.497 -15.642 1.00 1.02 H new ATOM 0 HD21 LEU A 31 -2.820 -38.539 -15.761 1.00 41.23 H new ATOM 0 HD22 LEU A 31 -1.387 -39.582 -15.919 1.00 41.23 H new ATOM 0 HD23 LEU A 31 -2.613 -39.936 -14.678 1.00 41.23 H new ATOM 510 N PRO A 32 0.297 -42.154 -13.364 1.00 64.01 N ATOM 511 CA PRO A 32 1.256 -43.262 -13.328 1.00 64.11 C ATOM 512 C PRO A 32 2.701 -42.781 -13.410 1.00 22.35 C ATOM 513 O PRO A 32 2.978 -41.619 -13.705 1.00 1.55 O ATOM 514 CB PRO A 32 0.896 -44.084 -14.568 1.00 53.22 C ATOM 515 CG PRO A 32 0.255 -43.109 -15.495 1.00 72.31 C ATOM 516 CD PRO A 32 -0.468 -42.121 -14.622 1.00 5.11 C ATOM 0 HA PRO A 32 1.195 -43.823 -12.395 1.00 64.11 H new ATOM 0 HB2 PRO A 32 1.782 -44.533 -15.016 1.00 53.22 H new ATOM 0 HB3 PRO A 32 0.217 -44.899 -14.319 1.00 53.22 H new ATOM 0 HG2 PRO A 32 1.001 -42.610 -16.114 1.00 72.31 H new ATOM 0 HG3 PRO A 32 -0.436 -43.611 -16.172 1.00 72.31 H new ATOM 0 HD2 PRO A 32 -0.474 -41.124 -15.063 1.00 5.11 H new ATOM 0 HD3 PRO A 32 -1.508 -42.407 -14.467 1.00 5.11 H new ATOM 524 N PRO A 33 3.646 -43.695 -13.143 1.00 32.44 N ATOM 525 CA PRO A 33 5.079 -43.387 -13.180 1.00 75.44 C ATOM 526 C PRO A 33 5.581 -43.139 -14.599 1.00 31.15 C ATOM 527 O PRO A 33 6.719 -42.715 -14.798 1.00 32.42 O ATOM 528 CB PRO A 33 5.727 -44.645 -12.596 1.00 2.43 C ATOM 529 CG PRO A 33 4.749 -45.735 -12.864 1.00 34.40 C ATOM 530 CD PRO A 33 3.388 -45.100 -12.784 1.00 20.11 C ATOM 0 HA PRO A 33 5.315 -42.475 -12.631 1.00 75.44 H new ATOM 0 HB2 PRO A 33 6.688 -44.851 -13.068 1.00 2.43 H new ATOM 0 HB3 PRO A 33 5.914 -44.535 -11.528 1.00 2.43 H new ATOM 0 HG2 PRO A 33 4.916 -46.176 -13.846 1.00 34.40 H new ATOM 0 HG3 PRO A 33 4.849 -46.537 -12.133 1.00 34.40 H new ATOM 0 HD2 PRO A 33 2.685 -45.568 -13.473 1.00 20.11 H new ATOM 0 HD3 PRO A 33 2.962 -45.188 -11.785 1.00 20.11 H new ATOM 538 N GLU A 34 4.725 -43.405 -15.580 1.00 34.40 N ATOM 539 CA GLU A 34 5.084 -43.211 -16.980 1.00 14.42 C ATOM 540 C GLU A 34 4.620 -41.844 -17.475 1.00 40.32 C ATOM 541 O GLU A 34 4.417 -41.641 -18.671 1.00 51.04 O ATOM 542 CB GLU A 34 4.470 -44.314 -17.845 1.00 3.31 C ATOM 543 CG GLU A 34 2.953 -44.265 -17.907 1.00 71.43 C ATOM 544 CD GLU A 34 2.352 -45.530 -18.490 1.00 25.24 C ATOM 545 OE1 GLU A 34 2.316 -46.553 -17.774 1.00 10.04 O ATOM 546 OE2 GLU A 34 1.920 -45.498 -19.660 1.00 54.33 O ATOM 0 H GLU A 34 3.779 -43.755 -15.432 1.00 34.40 H new ATOM 0 HA GLU A 34 6.170 -43.259 -17.060 1.00 14.42 H new ATOM 0 HB2 GLU A 34 4.869 -44.236 -18.856 1.00 3.31 H new ATOM 0 HB3 GLU A 34 4.778 -45.284 -17.455 1.00 3.31 H new ATOM 0 HG2 GLU A 34 2.557 -44.108 -16.904 1.00 71.43 H new ATOM 0 HG3 GLU A 34 2.645 -43.410 -18.509 1.00 71.43 H new ATOM 553 N GLY A 35 4.454 -40.908 -16.545 1.00 21.43 N ATOM 554 CA GLY A 35 4.015 -39.573 -16.905 1.00 61.02 C ATOM 555 C GLY A 35 5.009 -38.505 -16.494 1.00 30.14 C ATOM 556 O GLY A 35 4.953 -37.375 -16.979 1.00 65.15 O ATOM 0 H GLY A 35 4.616 -41.051 -15.548 1.00 21.43 H new ATOM 0 HA2 GLY A 35 3.858 -39.524 -17.983 1.00 61.02 H new ATOM 0 HA3 GLY A 35 3.053 -39.371 -16.433 1.00 61.02 H new ATOM 560 N TYR A 36 5.920 -38.862 -15.595 1.00 14.23 N ATOM 561 CA TYR A 36 6.928 -37.924 -15.115 1.00 32.24 C ATOM 562 C TYR A 36 8.225 -38.067 -15.905 1.00 53.54 C ATOM 563 O TYR A 36 9.048 -37.152 -15.941 1.00 12.25 O ATOM 564 CB TYR A 36 7.198 -38.151 -13.626 1.00 55.11 C ATOM 565 CG TYR A 36 5.963 -38.527 -12.837 1.00 45.15 C ATOM 566 CD1 TYR A 36 4.783 -37.807 -12.972 1.00 74.54 C ATOM 567 CD2 TYR A 36 5.978 -39.603 -11.958 1.00 43.40 C ATOM 568 CE1 TYR A 36 3.653 -38.147 -12.253 1.00 62.12 C ATOM 569 CE2 TYR A 36 4.853 -39.950 -11.236 1.00 21.42 C ATOM 570 CZ TYR A 36 3.693 -39.219 -11.386 1.00 63.35 C ATOM 571 OH TYR A 36 2.570 -39.562 -10.669 1.00 52.33 O ATOM 0 H TYR A 36 5.981 -39.794 -15.184 1.00 14.23 H new ATOM 0 HA TYR A 36 6.545 -36.914 -15.259 1.00 32.24 H new ATOM 0 HB2 TYR A 36 7.943 -38.939 -13.516 1.00 55.11 H new ATOM 0 HB3 TYR A 36 7.628 -37.244 -13.201 1.00 55.11 H new ATOM 0 HD1 TYR A 36 4.748 -36.967 -13.650 1.00 74.54 H new ATOM 0 HD2 TYR A 36 6.885 -40.178 -11.837 1.00 43.40 H new ATOM 0 HE1 TYR A 36 2.743 -37.576 -12.369 1.00 62.12 H new ATOM 0 HE2 TYR A 36 4.881 -40.790 -10.557 1.00 21.42 H new ATOM 0 HH TYR A 36 2.059 -40.237 -11.164 1.00 52.33 H new ATOM 581 N VAL A 37 8.399 -39.221 -16.540 1.00 64.41 N ATOM 582 CA VAL A 37 9.594 -39.485 -17.333 1.00 4.13 C ATOM 583 C VAL A 37 9.851 -38.362 -18.331 1.00 54.40 C ATOM 584 O VAL A 37 10.998 -38.021 -18.618 1.00 23.00 O ATOM 585 CB VAL A 37 9.479 -40.818 -18.095 1.00 64.23 C ATOM 586 CG1 VAL A 37 8.283 -40.795 -19.035 1.00 2.24 C ATOM 587 CG2 VAL A 37 10.763 -41.107 -18.860 1.00 15.32 C ATOM 0 H VAL A 37 7.728 -39.989 -16.521 1.00 64.41 H new ATOM 0 HA VAL A 37 10.429 -39.545 -16.635 1.00 4.13 H new ATOM 0 HB VAL A 37 9.326 -41.618 -17.371 1.00 64.23 H new ATOM 0 HG11 VAL A 37 8.218 -41.745 -19.565 1.00 2.24 H new ATOM 0 HG12 VAL A 37 7.371 -40.637 -18.459 1.00 2.24 H new ATOM 0 HG13 VAL A 37 8.402 -39.986 -19.755 1.00 2.24 H new ATOM 0 HG21 VAL A 37 10.664 -42.053 -19.393 1.00 15.32 H new ATOM 0 HG22 VAL A 37 10.949 -40.306 -19.575 1.00 15.32 H new ATOM 0 HG23 VAL A 37 11.597 -41.170 -18.161 1.00 15.32 H new ATOM 597 N VAL A 38 8.773 -37.788 -18.858 1.00 21.14 N ATOM 598 CA VAL A 38 8.880 -36.701 -19.823 1.00 65.14 C ATOM 599 C VAL A 38 9.022 -35.355 -19.122 1.00 43.10 C ATOM 600 O VAL A 38 9.549 -34.399 -19.691 1.00 52.40 O ATOM 601 CB VAL A 38 7.655 -36.655 -20.755 1.00 62.45 C ATOM 602 CG1 VAL A 38 7.876 -35.655 -21.880 1.00 24.21 C ATOM 603 CG2 VAL A 38 7.358 -38.039 -21.313 1.00 23.43 C ATOM 0 H VAL A 38 7.816 -38.058 -18.632 1.00 21.14 H new ATOM 0 HA VAL A 38 9.773 -36.893 -20.418 1.00 65.14 H new ATOM 0 HB VAL A 38 6.792 -36.328 -20.175 1.00 62.45 H new ATOM 0 HG11 VAL A 38 7.000 -35.637 -22.528 1.00 24.21 H new ATOM 0 HG12 VAL A 38 8.036 -34.663 -21.458 1.00 24.21 H new ATOM 0 HG13 VAL A 38 8.751 -35.948 -22.461 1.00 24.21 H new ATOM 0 HG21 VAL A 38 6.489 -37.988 -21.969 1.00 23.43 H new ATOM 0 HG22 VAL A 38 8.219 -38.396 -21.878 1.00 23.43 H new ATOM 0 HG23 VAL A 38 7.152 -38.726 -20.492 1.00 23.43 H new ATOM 613 N VAL A 39 8.549 -35.287 -17.882 1.00 21.34 N ATOM 614 CA VAL A 39 8.624 -34.058 -17.101 1.00 24.44 C ATOM 615 C VAL A 39 10.025 -33.851 -16.536 1.00 42.01 C ATOM 616 O VAL A 39 10.507 -32.722 -16.439 1.00 75.04 O ATOM 617 CB VAL A 39 7.611 -34.068 -15.940 1.00 44.24 C ATOM 618 CG1 VAL A 39 7.554 -32.704 -15.270 1.00 4.40 C ATOM 619 CG2 VAL A 39 6.236 -34.484 -16.438 1.00 74.23 C ATOM 0 H VAL A 39 8.110 -36.069 -17.396 1.00 21.34 H new ATOM 0 HA VAL A 39 8.383 -33.238 -17.777 1.00 24.44 H new ATOM 0 HB VAL A 39 7.940 -34.797 -15.199 1.00 44.24 H new ATOM 0 HG11 VAL A 39 6.833 -32.730 -14.453 1.00 4.40 H new ATOM 0 HG12 VAL A 39 8.539 -32.450 -14.878 1.00 4.40 H new ATOM 0 HG13 VAL A 39 7.249 -31.953 -15.999 1.00 4.40 H new ATOM 0 HG21 VAL A 39 5.533 -34.486 -15.605 1.00 74.23 H new ATOM 0 HG22 VAL A 39 5.896 -33.781 -17.198 1.00 74.23 H new ATOM 0 HG23 VAL A 39 6.292 -35.484 -16.868 1.00 74.23 H new ATOM 629 N VAL A 40 10.676 -34.949 -16.164 1.00 41.24 N ATOM 630 CA VAL A 40 12.023 -34.888 -15.610 1.00 64.25 C ATOM 631 C VAL A 40 12.962 -34.117 -16.531 1.00 50.44 C ATOM 632 O VAL A 40 13.942 -33.522 -16.081 1.00 53.03 O ATOM 633 CB VAL A 40 12.597 -36.298 -15.375 1.00 4.00 C ATOM 634 CG1 VAL A 40 13.933 -36.217 -14.651 1.00 14.13 C ATOM 635 CG2 VAL A 40 11.609 -37.152 -14.595 1.00 2.54 C ATOM 0 H VAL A 40 10.292 -35.891 -16.236 1.00 41.24 H new ATOM 0 HA VAL A 40 11.949 -34.369 -14.654 1.00 64.25 H new ATOM 0 HB VAL A 40 12.764 -36.770 -16.343 1.00 4.00 H new ATOM 0 HG11 VAL A 40 14.323 -37.223 -14.494 1.00 14.13 H new ATOM 0 HG12 VAL A 40 14.639 -35.644 -15.252 1.00 14.13 H new ATOM 0 HG13 VAL A 40 13.795 -35.726 -13.687 1.00 14.13 H new ATOM 0 HG21 VAL A 40 12.031 -38.145 -14.438 1.00 2.54 H new ATOM 0 HG22 VAL A 40 11.408 -36.686 -13.630 1.00 2.54 H new ATOM 0 HG23 VAL A 40 10.679 -37.238 -15.157 1.00 2.54 H new ATOM 645 N LYS A 41 12.656 -34.130 -17.824 1.00 41.53 N ATOM 646 CA LYS A 41 13.470 -33.430 -18.811 1.00 4.32 C ATOM 647 C LYS A 41 13.437 -31.923 -18.574 1.00 21.33 C ATOM 648 O LYS A 41 14.476 -31.293 -18.383 1.00 40.41 O ATOM 649 CB LYS A 41 12.978 -33.745 -20.225 1.00 61.10 C ATOM 650 CG LYS A 41 14.072 -34.244 -21.153 1.00 22.33 C ATOM 651 CD LYS A 41 14.138 -35.762 -21.171 1.00 61.31 C ATOM 652 CE LYS A 41 14.427 -36.324 -19.788 1.00 24.43 C ATOM 653 NZ LYS A 41 15.742 -35.861 -19.265 1.00 24.24 N ATOM 0 H LYS A 41 11.849 -34.618 -18.213 1.00 41.53 H new ATOM 0 HA LYS A 41 14.499 -33.774 -18.706 1.00 4.32 H new ATOM 0 HB2 LYS A 41 12.191 -34.497 -20.168 1.00 61.10 H new ATOM 0 HB3 LYS A 41 12.531 -32.848 -20.653 1.00 61.10 H new ATOM 0 HG2 LYS A 41 13.891 -33.875 -22.162 1.00 22.33 H new ATOM 0 HG3 LYS A 41 15.033 -33.841 -20.834 1.00 22.33 H new ATOM 0 HD2 LYS A 41 13.194 -36.164 -21.538 1.00 61.31 H new ATOM 0 HD3 LYS A 41 14.913 -36.085 -21.866 1.00 61.31 H new ATOM 0 HE2 LYS A 41 13.636 -36.022 -19.101 1.00 24.43 H new ATOM 0 HE3 LYS A 41 14.415 -37.413 -19.829 1.00 24.43 H new ATOM 0 HZ1 LYS A 41 16.376 -36.677 -19.149 1.00 24.24 H new ATOM 0 HZ2 LYS A 41 16.164 -35.187 -19.935 1.00 24.24 H new ATOM 0 HZ3 LYS A 41 15.605 -35.395 -18.345 1.00 24.24 H new ATOM 667 N ASN A 42 12.237 -31.353 -18.586 1.00 35.23 N ATOM 668 CA ASN A 42 12.068 -29.921 -18.371 1.00 5.51 C ATOM 669 C ASN A 42 12.387 -29.546 -16.927 1.00 1.14 C ATOM 670 O ASN A 42 12.966 -28.493 -16.660 1.00 43.23 O ATOM 671 CB ASN A 42 10.640 -29.496 -18.716 1.00 73.13 C ATOM 672 CG ASN A 42 9.630 -29.975 -17.691 1.00 23.20 C ATOM 673 OD1 ASN A 42 9.015 -31.029 -17.854 1.00 64.23 O ATOM 674 ND2 ASN A 42 9.455 -29.201 -16.627 1.00 1.43 N ATOM 0 H ASN A 42 11.367 -31.861 -18.742 1.00 35.23 H new ATOM 0 HA ASN A 42 12.764 -29.397 -19.026 1.00 5.51 H new ATOM 0 HB2 ASN A 42 10.594 -28.409 -18.786 1.00 73.13 H new ATOM 0 HB3 ASN A 42 10.373 -29.890 -19.697 1.00 73.13 H new ATOM 0 HD21 ASN A 42 8.789 -29.472 -15.903 1.00 1.43 H new ATOM 0 HD22 ASN A 42 9.986 -28.335 -16.533 1.00 1.43 H new ATOM 681 N VAL A 43 12.005 -30.416 -15.997 1.00 60.12 N ATOM 682 CA VAL A 43 12.251 -30.178 -14.580 1.00 22.31 C ATOM 683 C VAL A 43 13.745 -30.114 -14.285 1.00 25.11 C ATOM 684 O VAL A 43 14.173 -29.466 -13.331 1.00 3.22 O ATOM 685 CB VAL A 43 11.613 -31.276 -13.708 1.00 5.14 C ATOM 686 CG1 VAL A 43 11.936 -31.046 -12.239 1.00 51.40 C ATOM 687 CG2 VAL A 43 10.109 -31.326 -13.930 1.00 65.12 C ATOM 0 H VAL A 43 11.524 -31.292 -16.200 1.00 60.12 H new ATOM 0 HA VAL A 43 11.794 -29.219 -14.336 1.00 22.31 H new ATOM 0 HB VAL A 43 12.033 -32.238 -14.001 1.00 5.14 H new ATOM 0 HG11 VAL A 43 11.477 -31.831 -11.638 1.00 51.40 H new ATOM 0 HG12 VAL A 43 13.017 -31.065 -12.097 1.00 51.40 H new ATOM 0 HG13 VAL A 43 11.546 -30.077 -11.928 1.00 51.40 H new ATOM 0 HG21 VAL A 43 9.675 -32.107 -13.306 1.00 65.12 H new ATOM 0 HG22 VAL A 43 9.670 -30.364 -13.665 1.00 65.12 H new ATOM 0 HG23 VAL A 43 9.903 -31.542 -14.978 1.00 65.12 H new ATOM 697 N GLY A 44 14.536 -30.792 -15.112 1.00 3.52 N ATOM 698 CA GLY A 44 15.975 -30.798 -14.923 1.00 61.31 C ATOM 699 C GLY A 44 16.698 -29.947 -15.948 1.00 2.55 C ATOM 700 O GLY A 44 17.898 -29.696 -15.822 1.00 53.22 O ATOM 0 H GLY A 44 14.206 -31.337 -15.909 1.00 3.52 H new ATOM 0 HA2 GLY A 44 16.208 -30.433 -13.923 1.00 61.31 H new ATOM 0 HA3 GLY A 44 16.342 -31.823 -14.982 1.00 61.31 H new ATOM 704 N LEU A 45 15.969 -29.501 -16.965 1.00 22.32 N ATOM 705 CA LEU A 45 16.549 -28.674 -18.017 1.00 52.40 C ATOM 706 C LEU A 45 16.465 -27.194 -17.654 1.00 61.44 C ATOM 707 O LEU A 45 17.148 -26.358 -18.247 1.00 24.50 O ATOM 708 CB LEU A 45 15.832 -28.926 -19.345 1.00 23.23 C ATOM 709 CG LEU A 45 16.378 -30.075 -20.194 1.00 42.41 C ATOM 710 CD1 LEU A 45 15.293 -30.628 -21.104 1.00 33.52 C ATOM 711 CD2 LEU A 45 17.576 -29.612 -21.011 1.00 11.54 C ATOM 0 H LEU A 45 14.975 -29.698 -17.083 1.00 22.32 H new ATOM 0 HA LEU A 45 17.600 -28.945 -18.121 1.00 52.40 H new ATOM 0 HB2 LEU A 45 14.781 -29.123 -19.136 1.00 23.23 H new ATOM 0 HB3 LEU A 45 15.873 -28.012 -19.937 1.00 23.23 H new ATOM 0 HG LEU A 45 16.705 -30.872 -19.526 1.00 42.41 H new ATOM 0 HD11 LEU A 45 15.700 -31.445 -21.701 1.00 33.52 H new ATOM 0 HD12 LEU A 45 14.465 -30.998 -20.500 1.00 33.52 H new ATOM 0 HD13 LEU A 45 14.936 -29.839 -21.765 1.00 33.52 H new ATOM 0 HD21 LEU A 45 17.951 -30.442 -21.609 1.00 11.54 H new ATOM 0 HD22 LEU A 45 17.274 -28.798 -21.670 1.00 11.54 H new ATOM 0 HD23 LEU A 45 18.361 -29.264 -20.340 1.00 11.54 H new ATOM 723 N THR A 46 15.624 -26.877 -16.675 1.00 1.02 N ATOM 724 CA THR A 46 15.452 -25.499 -16.232 1.00 33.31 C ATOM 725 C THR A 46 16.622 -25.050 -15.365 1.00 45.34 C ATOM 726 O THR A 46 17.137 -23.942 -15.525 1.00 63.24 O ATOM 727 CB THR A 46 14.143 -25.324 -15.438 1.00 43.12 C ATOM 728 OG1 THR A 46 13.062 -25.961 -16.129 1.00 4.25 O ATOM 729 CG2 THR A 46 13.825 -23.850 -15.238 1.00 3.21 C ATOM 0 H THR A 46 15.051 -27.556 -16.174 1.00 1.02 H new ATOM 0 HA THR A 46 15.410 -24.881 -17.129 1.00 33.31 H new ATOM 0 HB THR A 46 14.272 -25.788 -14.460 1.00 43.12 H new ATOM 0 HG1 THR A 46 13.159 -26.934 -16.062 1.00 4.25 H new ATOM 0 HG21 THR A 46 12.897 -23.751 -14.675 1.00 3.21 H new ATOM 0 HG22 THR A 46 14.636 -23.374 -14.687 1.00 3.21 H new ATOM 0 HG23 THR A 46 13.714 -23.367 -16.209 1.00 3.21 H new ATOM 737 N LEU A 47 17.040 -25.915 -14.448 1.00 13.12 N ATOM 738 CA LEU A 47 18.152 -25.607 -13.555 1.00 52.13 C ATOM 739 C LEU A 47 19.441 -25.397 -14.344 1.00 33.53 C ATOM 740 O LEU A 47 20.158 -24.420 -14.131 1.00 41.10 O ATOM 741 CB LEU A 47 18.341 -26.732 -12.537 1.00 32.34 C ATOM 742 CG LEU A 47 18.500 -28.140 -13.113 1.00 43.40 C ATOM 743 CD1 LEU A 47 19.970 -28.522 -13.188 1.00 22.30 C ATOM 744 CD2 LEU A 47 17.726 -29.149 -12.278 1.00 4.04 C ATOM 0 H LEU A 47 16.626 -26.836 -14.303 1.00 13.12 H new ATOM 0 HA LEU A 47 17.917 -24.683 -13.026 1.00 52.13 H new ATOM 0 HB2 LEU A 47 19.221 -26.506 -11.935 1.00 32.34 H new ATOM 0 HB3 LEU A 47 17.485 -26.732 -11.862 1.00 32.34 H new ATOM 0 HG LEU A 47 18.092 -28.147 -14.124 1.00 43.40 H new ATOM 0 HD11 LEU A 47 20.064 -29.527 -13.600 1.00 22.30 H new ATOM 0 HD12 LEU A 47 20.497 -27.816 -13.829 1.00 22.30 H new ATOM 0 HD13 LEU A 47 20.404 -28.498 -12.188 1.00 22.30 H new ATOM 0 HD21 LEU A 47 17.851 -30.145 -12.703 1.00 4.04 H new ATOM 0 HD22 LEU A 47 18.103 -29.141 -11.255 1.00 4.04 H new ATOM 0 HD23 LEU A 47 16.668 -28.885 -12.277 1.00 4.04 H new ATOM 756 N ARG A 48 19.727 -26.321 -15.256 1.00 1.24 N ATOM 757 CA ARG A 48 20.929 -26.237 -16.077 1.00 11.33 C ATOM 758 C ARG A 48 20.849 -25.054 -17.037 1.00 44.23 C ATOM 759 O ARG A 48 21.845 -24.672 -17.653 1.00 11.32 O ATOM 760 CB ARG A 48 21.127 -27.534 -16.863 1.00 53.23 C ATOM 761 CG ARG A 48 19.938 -27.904 -17.736 1.00 24.34 C ATOM 762 CD ARG A 48 20.235 -29.125 -18.592 1.00 63.21 C ATOM 763 NE ARG A 48 20.845 -30.202 -17.817 1.00 64.21 N ATOM 764 CZ ARG A 48 21.433 -31.260 -18.365 1.00 5.10 C ATOM 765 NH1 ARG A 48 21.491 -31.381 -19.684 1.00 71.40 N ATOM 766 NH2 ARG A 48 21.966 -32.198 -17.593 1.00 21.50 N ATOM 0 H ARG A 48 19.143 -27.136 -15.445 1.00 1.24 H new ATOM 0 HA ARG A 48 21.782 -26.088 -15.415 1.00 11.33 H new ATOM 0 HB2 ARG A 48 22.012 -27.437 -17.491 1.00 53.23 H new ATOM 0 HB3 ARG A 48 21.321 -28.347 -16.163 1.00 53.23 H new ATOM 0 HG2 ARG A 48 19.070 -28.102 -17.106 1.00 24.34 H new ATOM 0 HG3 ARG A 48 19.680 -27.062 -18.378 1.00 24.34 H new ATOM 0 HD2 ARG A 48 19.311 -29.483 -19.045 1.00 63.21 H new ATOM 0 HD3 ARG A 48 20.901 -28.843 -19.407 1.00 63.21 H new ATOM 0 HE ARG A 48 20.818 -30.139 -16.799 1.00 64.21 H new ATOM 0 HH11 ARG A 48 21.084 -30.661 -20.281 1.00 71.40 H new ATOM 0 HH12 ARG A 48 21.943 -32.194 -20.102 1.00 71.40 H new ATOM 0 HH21 ARG A 48 21.925 -32.107 -16.578 1.00 21.50 H new ATOM 0 HH22 ARG A 48 22.417 -33.010 -18.015 1.00 21.50 H new ATOM 780 N LYS A 49 19.658 -24.478 -17.161 1.00 44.02 N ATOM 781 CA LYS A 49 19.447 -23.338 -18.046 1.00 24.24 C ATOM 782 C LYS A 49 19.526 -22.027 -17.271 1.00 40.50 C ATOM 783 O LYS A 49 19.929 -20.997 -17.813 1.00 52.55 O ATOM 784 CB LYS A 49 18.089 -23.451 -18.742 1.00 21.14 C ATOM 785 CG LYS A 49 17.731 -22.234 -19.577 1.00 34.22 C ATOM 786 CD LYS A 49 16.461 -22.463 -20.380 1.00 63.40 C ATOM 787 CE LYS A 49 15.229 -22.454 -19.489 1.00 55.51 C ATOM 788 NZ LYS A 49 13.976 -22.638 -20.273 1.00 40.32 N ATOM 0 H LYS A 49 18.823 -24.782 -16.659 1.00 44.02 H new ATOM 0 HA LYS A 49 20.235 -23.343 -18.799 1.00 24.24 H new ATOM 0 HB2 LYS A 49 18.091 -24.333 -19.382 1.00 21.14 H new ATOM 0 HB3 LYS A 49 17.316 -23.605 -17.989 1.00 21.14 H new ATOM 0 HG2 LYS A 49 17.600 -21.370 -18.925 1.00 34.22 H new ATOM 0 HG3 LYS A 49 18.553 -22.001 -20.253 1.00 34.22 H new ATOM 0 HD2 LYS A 49 16.366 -21.689 -21.141 1.00 63.40 H new ATOM 0 HD3 LYS A 49 16.527 -23.417 -20.902 1.00 63.40 H new ATOM 0 HE2 LYS A 49 15.312 -23.247 -18.746 1.00 55.51 H new ATOM 0 HE3 LYS A 49 15.182 -21.511 -18.944 1.00 55.51 H new ATOM 0 HZ1 LYS A 49 13.159 -22.626 -19.630 1.00 40.32 H new ATOM 0 HZ2 LYS A 49 13.883 -21.867 -20.965 1.00 40.32 H new ATOM 0 HZ3 LYS A 49 14.010 -23.549 -20.773 1.00 40.32 H new ATOM 802 N LEU A 50 19.141 -22.071 -16.001 1.00 34.14 N ATOM 803 CA LEU A 50 19.169 -20.886 -15.150 1.00 41.03 C ATOM 804 C LEU A 50 20.500 -20.776 -14.414 1.00 44.22 C ATOM 805 O LEU A 50 20.886 -19.695 -13.966 1.00 75.33 O ATOM 806 CB LEU A 50 18.018 -20.929 -14.143 1.00 45.13 C ATOM 807 CG LEU A 50 18.108 -22.012 -13.067 1.00 43.43 C ATOM 808 CD1 LEU A 50 18.919 -21.517 -11.879 1.00 72.41 C ATOM 809 CD2 LEU A 50 16.717 -22.440 -12.625 1.00 31.53 C ATOM 0 H LEU A 50 18.805 -22.915 -15.537 1.00 34.14 H new ATOM 0 HA LEU A 50 19.053 -20.009 -15.787 1.00 41.03 H new ATOM 0 HB2 LEU A 50 17.957 -19.959 -13.650 1.00 45.13 H new ATOM 0 HB3 LEU A 50 17.086 -21.067 -14.692 1.00 45.13 H new ATOM 0 HG LEU A 50 18.615 -22.879 -13.491 1.00 43.43 H new ATOM 0 HD11 LEU A 50 18.973 -22.301 -11.123 1.00 72.41 H new ATOM 0 HD12 LEU A 50 19.926 -21.260 -12.208 1.00 72.41 H new ATOM 0 HD13 LEU A 50 18.440 -20.635 -11.454 1.00 72.41 H new ATOM 0 HD21 LEU A 50 16.800 -23.211 -11.859 1.00 31.53 H new ATOM 0 HD22 LEU A 50 16.184 -21.581 -12.218 1.00 31.53 H new ATOM 0 HD23 LEU A 50 16.169 -22.835 -13.480 1.00 31.53 H new ATOM 821 N ILE A 51 21.199 -21.900 -14.295 1.00 4.51 N ATOM 822 CA ILE A 51 22.489 -21.928 -13.616 1.00 41.03 C ATOM 823 C ILE A 51 23.453 -20.916 -14.225 1.00 42.35 C ATOM 824 O ILE A 51 24.302 -20.357 -13.533 1.00 2.43 O ATOM 825 CB ILE A 51 23.127 -23.329 -13.678 1.00 14.45 C ATOM 826 CG1 ILE A 51 22.549 -24.224 -12.580 1.00 30.23 C ATOM 827 CG2 ILE A 51 24.639 -23.228 -13.546 1.00 30.32 C ATOM 828 CD1 ILE A 51 22.516 -25.690 -12.951 1.00 20.22 C ATOM 0 H ILE A 51 20.894 -22.803 -14.660 1.00 4.51 H new ATOM 0 HA ILE A 51 22.303 -21.668 -12.574 1.00 41.03 H new ATOM 0 HB ILE A 51 22.896 -23.776 -14.645 1.00 14.45 H new ATOM 0 HG12 ILE A 51 23.140 -24.100 -11.673 1.00 30.23 H new ATOM 0 HG13 ILE A 51 21.537 -23.893 -12.348 1.00 30.23 H new ATOM 0 HG21 ILE A 51 25.076 -24.226 -13.592 1.00 30.32 H new ATOM 0 HG22 ILE A 51 25.036 -22.621 -14.360 1.00 30.32 H new ATOM 0 HG23 ILE A 51 24.891 -22.765 -12.592 1.00 30.32 H new ATOM 0 HD11 ILE A 51 22.094 -26.265 -12.126 1.00 20.22 H new ATOM 0 HD12 ILE A 51 21.901 -25.827 -13.840 1.00 20.22 H new ATOM 0 HD13 ILE A 51 23.529 -26.037 -13.154 1.00 20.22 H new ATOM 840 N GLY A 52 23.315 -20.684 -15.527 1.00 55.54 N ATOM 841 CA GLY A 52 24.179 -19.737 -16.208 1.00 73.23 C ATOM 842 C GLY A 52 23.897 -18.303 -15.808 1.00 11.42 C ATOM 843 O GLY A 52 24.697 -17.407 -16.078 1.00 50.01 O ATOM 0 H GLY A 52 22.620 -21.135 -16.122 1.00 55.54 H new ATOM 0 HA2 GLY A 52 25.219 -19.975 -15.986 1.00 73.23 H new ATOM 0 HA3 GLY A 52 24.050 -19.842 -17.285 1.00 73.23 H new ATOM 847 N SER A 53 22.756 -18.083 -15.163 1.00 75.10 N ATOM 848 CA SER A 53 22.367 -16.746 -14.730 1.00 24.15 C ATOM 849 C SER A 53 23.109 -16.351 -13.456 1.00 70.21 C ATOM 850 O SER A 53 23.511 -15.199 -13.289 1.00 73.55 O ATOM 851 CB SER A 53 20.857 -16.682 -14.494 1.00 40.45 C ATOM 852 OG SER A 53 20.164 -17.522 -15.401 1.00 15.41 O ATOM 0 H SER A 53 22.084 -18.814 -14.929 1.00 75.10 H new ATOM 0 HA SER A 53 22.634 -16.043 -15.519 1.00 24.15 H new ATOM 0 HB2 SER A 53 20.632 -16.983 -13.471 1.00 40.45 H new ATOM 0 HB3 SER A 53 20.511 -15.655 -14.608 1.00 40.45 H new ATOM 0 HG SER A 53 20.187 -18.446 -15.075 1.00 15.41 H new ATOM 858 N VAL A 54 23.287 -17.316 -12.559 1.00 50.11 N ATOM 859 CA VAL A 54 23.981 -17.071 -11.300 1.00 71.04 C ATOM 860 C VAL A 54 25.492 -17.176 -11.476 1.00 54.13 C ATOM 861 O VAL A 54 26.258 -16.573 -10.724 1.00 72.33 O ATOM 862 CB VAL A 54 23.532 -18.062 -10.210 1.00 41.00 C ATOM 863 CG1 VAL A 54 24.015 -17.605 -8.842 1.00 31.32 C ATOM 864 CG2 VAL A 54 22.019 -18.221 -10.225 1.00 43.20 C ATOM 0 H VAL A 54 22.960 -18.275 -12.681 1.00 50.11 H new ATOM 0 HA VAL A 54 23.724 -16.059 -10.988 1.00 71.04 H new ATOM 0 HB VAL A 54 23.978 -19.034 -10.420 1.00 41.00 H new ATOM 0 HG11 VAL A 54 23.688 -18.317 -8.084 1.00 31.32 H new ATOM 0 HG12 VAL A 54 25.103 -17.548 -8.841 1.00 31.32 H new ATOM 0 HG13 VAL A 54 23.600 -16.622 -8.619 1.00 31.32 H new ATOM 0 HG21 VAL A 54 21.719 -18.925 -9.448 1.00 43.20 H new ATOM 0 HG22 VAL A 54 21.550 -17.255 -10.040 1.00 43.20 H new ATOM 0 HG23 VAL A 54 21.702 -18.598 -11.198 1.00 43.20 H new ATOM 874 N ASP A 55 25.913 -17.944 -12.474 1.00 64.35 N ATOM 875 CA ASP A 55 27.333 -18.127 -12.751 1.00 65.41 C ATOM 876 C ASP A 55 27.962 -16.830 -13.250 1.00 13.34 C ATOM 877 O ASP A 55 29.167 -16.618 -13.111 1.00 34.50 O ATOM 878 CB ASP A 55 27.535 -19.236 -13.785 1.00 73.22 C ATOM 879 CG ASP A 55 28.999 -19.494 -14.080 1.00 62.10 C ATOM 880 OD1 ASP A 55 29.790 -19.592 -13.118 1.00 42.33 O ATOM 881 OD2 ASP A 55 29.354 -19.599 -15.272 1.00 64.24 O ATOM 0 H ASP A 55 25.292 -18.450 -13.105 1.00 64.35 H new ATOM 0 HA ASP A 55 27.824 -18.414 -11.821 1.00 65.41 H new ATOM 0 HB2 ASP A 55 27.073 -20.155 -13.423 1.00 73.22 H new ATOM 0 HB3 ASP A 55 27.024 -18.965 -14.709 1.00 73.22 H new ATOM 886 N ASP A 56 27.138 -15.965 -13.831 1.00 12.23 N ATOM 887 CA ASP A 56 27.612 -14.687 -14.350 1.00 64.52 C ATOM 888 C ASP A 56 27.938 -13.725 -13.212 1.00 74.02 C ATOM 889 O ASP A 56 28.632 -12.727 -13.408 1.00 52.45 O ATOM 890 CB ASP A 56 26.564 -14.068 -15.275 1.00 52.51 C ATOM 891 CG ASP A 56 27.180 -13.170 -16.330 1.00 64.21 C ATOM 892 OD1 ASP A 56 27.896 -13.693 -17.210 1.00 72.42 O ATOM 893 OD2 ASP A 56 26.947 -11.945 -16.276 1.00 50.22 O ATOM 0 H ASP A 56 26.138 -16.125 -13.954 1.00 12.23 H new ATOM 0 HA ASP A 56 28.524 -14.869 -14.919 1.00 64.52 H new ATOM 0 HB2 ASP A 56 26.000 -14.863 -15.763 1.00 52.51 H new ATOM 0 HB3 ASP A 56 25.854 -13.492 -14.681 1.00 52.51 H new ATOM 898 N LEU A 57 27.431 -14.031 -12.023 1.00 2.22 N ATOM 899 CA LEU A 57 27.667 -13.192 -10.852 1.00 73.45 C ATOM 900 C LEU A 57 28.445 -13.954 -9.785 1.00 20.34 C ATOM 901 O LEU A 57 28.952 -13.363 -8.830 1.00 63.24 O ATOM 902 CB LEU A 57 26.337 -12.700 -10.277 1.00 64.43 C ATOM 903 CG LEU A 57 25.267 -13.769 -10.052 1.00 50.20 C ATOM 904 CD1 LEU A 57 25.520 -14.511 -8.749 1.00 71.52 C ATOM 905 CD2 LEU A 57 23.880 -13.142 -10.050 1.00 62.34 C ATOM 0 H LEU A 57 26.854 -14.853 -11.844 1.00 2.22 H new ATOM 0 HA LEU A 57 28.261 -12.333 -11.164 1.00 73.45 H new ATOM 0 HB2 LEU A 57 26.536 -12.207 -9.325 1.00 64.43 H new ATOM 0 HB3 LEU A 57 25.931 -11.944 -10.949 1.00 64.43 H new ATOM 0 HG LEU A 57 25.319 -14.487 -10.871 1.00 50.20 H new ATOM 0 HD11 LEU A 57 24.749 -15.268 -8.606 1.00 71.52 H new ATOM 0 HD12 LEU A 57 26.497 -14.992 -8.788 1.00 71.52 H new ATOM 0 HD13 LEU A 57 25.495 -13.806 -7.918 1.00 71.52 H new ATOM 0 HD21 LEU A 57 23.131 -13.917 -9.889 1.00 62.34 H new ATOM 0 HD22 LEU A 57 23.816 -12.403 -9.251 1.00 62.34 H new ATOM 0 HD23 LEU A 57 23.699 -12.656 -11.009 1.00 62.34 H new ATOM 917 N LEU A 58 28.537 -15.269 -9.952 1.00 44.13 N ATOM 918 CA LEU A 58 29.256 -16.113 -9.004 1.00 5.50 C ATOM 919 C LEU A 58 30.637 -15.539 -8.703 1.00 2.43 C ATOM 920 O LEU A 58 30.980 -15.251 -7.556 1.00 23.23 O ATOM 921 CB LEU A 58 29.391 -17.533 -9.555 1.00 62.11 C ATOM 922 CG LEU A 58 30.643 -18.302 -9.131 1.00 43.41 C ATOM 923 CD1 LEU A 58 30.704 -18.430 -7.617 1.00 14.11 C ATOM 924 CD2 LEU A 58 30.674 -19.675 -9.786 1.00 54.22 C ATOM 0 H LEU A 58 28.122 -15.774 -10.735 1.00 44.13 H new ATOM 0 HA LEU A 58 28.685 -16.143 -8.076 1.00 5.50 H new ATOM 0 HB2 LEU A 58 28.516 -18.105 -9.247 1.00 62.11 H new ATOM 0 HB3 LEU A 58 29.372 -17.482 -10.644 1.00 62.11 H new ATOM 0 HG LEU A 58 31.518 -17.744 -9.463 1.00 43.41 H new ATOM 0 HD11 LEU A 58 31.602 -18.980 -7.334 1.00 14.11 H new ATOM 0 HD12 LEU A 58 30.731 -17.437 -7.169 1.00 14.11 H new ATOM 0 HD13 LEU A 58 29.823 -18.965 -7.261 1.00 14.11 H new ATOM 0 HD21 LEU A 58 31.572 -20.207 -9.473 1.00 54.22 H new ATOM 0 HD22 LEU A 58 29.793 -20.242 -9.485 1.00 54.22 H new ATOM 0 HD23 LEU A 58 30.680 -19.561 -10.870 1.00 54.22 H new ATOM 936 N PRO A 59 31.449 -15.365 -9.756 1.00 70.12 N ATOM 937 CA PRO A 59 32.804 -14.821 -9.630 1.00 64.21 C ATOM 938 C PRO A 59 32.803 -13.341 -9.263 1.00 24.31 C ATOM 939 O PRO A 59 33.850 -12.764 -8.970 1.00 23.05 O ATOM 940 CB PRO A 59 33.400 -15.026 -11.025 1.00 51.44 C ATOM 941 CG PRO A 59 32.223 -15.058 -11.938 1.00 41.14 C ATOM 942 CD PRO A 59 31.106 -15.686 -11.152 1.00 11.11 C ATOM 0 HA PRO A 59 33.367 -15.310 -8.835 1.00 64.21 H new ATOM 0 HB2 PRO A 59 34.082 -14.217 -11.287 1.00 51.44 H new ATOM 0 HB3 PRO A 59 33.969 -15.954 -11.080 1.00 51.44 H new ATOM 0 HG2 PRO A 59 31.954 -14.053 -12.263 1.00 41.14 H new ATOM 0 HG3 PRO A 59 32.441 -15.636 -12.836 1.00 41.14 H new ATOM 0 HD2 PRO A 59 30.136 -15.274 -11.432 1.00 11.11 H new ATOM 0 HD3 PRO A 59 31.055 -16.762 -11.316 1.00 11.11 H new ATOM 950 N SER A 60 31.622 -12.733 -9.281 1.00 11.43 N ATOM 951 CA SER A 60 31.485 -11.318 -8.953 1.00 25.44 C ATOM 952 C SER A 60 30.959 -11.139 -7.532 1.00 53.41 C ATOM 953 O SER A 60 30.456 -10.073 -7.174 1.00 54.31 O ATOM 954 CB SER A 60 30.548 -10.630 -9.947 1.00 63.51 C ATOM 955 OG SER A 60 30.437 -9.245 -9.669 1.00 22.41 O ATOM 0 H SER A 60 30.746 -13.197 -9.519 1.00 11.43 H new ATOM 0 HA SER A 60 32.471 -10.858 -9.018 1.00 25.44 H new ATOM 0 HB2 SER A 60 30.921 -10.772 -10.961 1.00 63.51 H new ATOM 0 HB3 SER A 60 29.562 -11.093 -9.903 1.00 63.51 H new ATOM 0 HG SER A 60 30.408 -9.107 -8.699 1.00 22.41 H new ATOM 961 N LEU A 61 31.078 -12.188 -6.727 1.00 33.23 N ATOM 962 CA LEU A 61 30.614 -12.148 -5.344 1.00 71.21 C ATOM 963 C LEU A 61 31.790 -12.042 -4.378 1.00 73.32 C ATOM 964 O LEU A 61 32.933 -12.349 -4.717 1.00 72.50 O ATOM 965 CB LEU A 61 29.789 -13.396 -5.026 1.00 34.21 C ATOM 966 CG LEU A 61 28.278 -13.191 -4.912 1.00 54.24 C ATOM 967 CD1 LEU A 61 27.670 -12.931 -6.282 1.00 51.21 C ATOM 968 CD2 LEU A 61 27.623 -14.398 -4.257 1.00 0.02 C ATOM 0 H LEU A 61 31.492 -13.077 -7.007 1.00 33.23 H new ATOM 0 HA LEU A 61 29.987 -11.265 -5.222 1.00 71.21 H new ATOM 0 HB2 LEU A 61 29.977 -14.139 -5.801 1.00 34.21 H new ATOM 0 HB3 LEU A 61 30.150 -13.816 -4.087 1.00 34.21 H new ATOM 0 HG LEU A 61 28.096 -12.319 -4.284 1.00 54.24 H new ATOM 0 HD11 LEU A 61 26.594 -12.788 -6.181 1.00 51.21 H new ATOM 0 HD12 LEU A 61 28.117 -12.036 -6.714 1.00 51.21 H new ATOM 0 HD13 LEU A 61 27.863 -13.783 -6.933 1.00 51.21 H new ATOM 0 HD21 LEU A 61 26.548 -14.234 -4.184 1.00 0.02 H new ATOM 0 HD22 LEU A 61 27.815 -15.287 -4.858 1.00 0.02 H new ATOM 0 HD23 LEU A 61 28.037 -14.539 -3.258 1.00 0.02 H new ATOM 980 N PRO A 62 31.505 -11.599 -3.145 1.00 35.12 N ATOM 981 CA PRO A 62 32.525 -11.445 -2.103 1.00 73.34 C ATOM 982 C PRO A 62 33.052 -12.787 -1.606 1.00 11.33 C ATOM 983 O PRO A 62 32.493 -13.838 -1.918 1.00 24.43 O ATOM 984 CB PRO A 62 31.781 -10.714 -0.983 1.00 75.31 C ATOM 985 CG PRO A 62 30.348 -11.068 -1.186 1.00 73.14 C ATOM 986 CD PRO A 62 30.164 -11.215 -2.672 1.00 1.34 C ATOM 0 HA PRO A 62 33.403 -10.912 -2.467 1.00 73.34 H new ATOM 0 HB2 PRO A 62 32.132 -11.032 -0.001 1.00 75.31 H new ATOM 0 HB3 PRO A 62 31.935 -9.637 -1.043 1.00 75.31 H new ATOM 0 HG2 PRO A 62 30.098 -11.994 -0.668 1.00 73.14 H new ATOM 0 HG3 PRO A 62 29.694 -10.293 -0.787 1.00 73.14 H new ATOM 0 HD2 PRO A 62 29.420 -11.975 -2.912 1.00 1.34 H new ATOM 0 HD3 PRO A 62 29.828 -10.285 -3.129 1.00 1.34 H new ATOM 994 N SER A 63 34.130 -12.743 -0.830 1.00 3.52 N ATOM 995 CA SER A 63 34.735 -13.955 -0.291 1.00 72.44 C ATOM 996 C SER A 63 33.926 -14.489 0.887 1.00 11.20 C ATOM 997 O SER A 63 34.388 -14.475 2.028 1.00 74.20 O ATOM 998 CB SER A 63 36.175 -13.682 0.146 1.00 0.22 C ATOM 999 OG SER A 63 36.236 -12.585 1.042 1.00 64.15 O ATOM 0 H SER A 63 34.603 -11.880 -0.560 1.00 3.52 H new ATOM 0 HA SER A 63 34.739 -14.709 -1.078 1.00 72.44 H new ATOM 0 HB2 SER A 63 36.588 -14.570 0.625 1.00 0.22 H new ATOM 0 HB3 SER A 63 36.791 -13.476 -0.729 1.00 0.22 H new ATOM 0 HG SER A 63 35.634 -12.747 1.799 1.00 64.15 H new ATOM 1005 N SER A 64 32.715 -14.958 0.602 1.00 64.13 N ATOM 1006 CA SER A 64 31.839 -15.493 1.637 1.00 2.24 C ATOM 1007 C SER A 64 30.643 -16.210 1.020 1.00 72.24 C ATOM 1008 O SER A 64 30.369 -17.368 1.335 1.00 54.00 O ATOM 1009 CB SER A 64 31.356 -14.369 2.556 1.00 32.12 C ATOM 1010 OG SER A 64 30.316 -14.818 3.407 1.00 34.34 O ATOM 0 H SER A 64 32.319 -14.978 -0.338 1.00 64.13 H new ATOM 0 HA SER A 64 32.409 -16.214 2.224 1.00 2.24 H new ATOM 0 HB2 SER A 64 32.189 -14.003 3.156 1.00 32.12 H new ATOM 0 HB3 SER A 64 31.003 -13.531 1.956 1.00 32.12 H new ATOM 0 HG SER A 64 30.026 -14.082 3.985 1.00 34.34 H new ATOM 1016 N SER A 65 29.934 -15.513 0.137 1.00 33.15 N ATOM 1017 CA SER A 65 28.764 -16.081 -0.523 1.00 10.13 C ATOM 1018 C SER A 65 29.134 -16.650 -1.889 1.00 21.11 C ATOM 1019 O SER A 65 28.281 -16.795 -2.765 1.00 22.12 O ATOM 1020 CB SER A 65 27.674 -15.018 -0.678 1.00 62.44 C ATOM 1021 OG SER A 65 26.878 -14.929 0.491 1.00 45.12 O ATOM 0 H SER A 65 30.149 -14.555 -0.138 1.00 33.15 H new ATOM 0 HA SER A 65 28.385 -16.892 0.098 1.00 10.13 H new ATOM 0 HB2 SER A 65 28.132 -14.051 -0.884 1.00 62.44 H new ATOM 0 HB3 SER A 65 27.044 -15.261 -1.533 1.00 62.44 H new ATOM 0 HG SER A 65 26.190 -14.242 0.367 1.00 45.12 H new ATOM 1027 N ARG A 66 30.412 -16.971 -2.063 1.00 0.31 N ATOM 1028 CA ARG A 66 30.897 -17.523 -3.322 1.00 54.12 C ATOM 1029 C ARG A 66 30.792 -19.045 -3.324 1.00 63.22 C ATOM 1030 O ARG A 66 30.369 -19.649 -4.311 1.00 13.43 O ATOM 1031 CB ARG A 66 32.347 -17.100 -3.565 1.00 33.04 C ATOM 1032 CG ARG A 66 32.960 -17.715 -4.812 1.00 21.12 C ATOM 1033 CD ARG A 66 34.456 -17.451 -4.885 1.00 71.13 C ATOM 1034 NE ARG A 66 35.178 -18.561 -5.502 1.00 52.42 N ATOM 1035 CZ ARG A 66 36.501 -18.603 -5.617 1.00 75.32 C ATOM 1036 NH1 ARG A 66 37.242 -17.604 -5.159 1.00 53.12 N ATOM 1037 NH2 ARG A 66 37.084 -19.648 -6.191 1.00 4.40 N ATOM 0 H ARG A 66 31.130 -16.858 -1.348 1.00 0.31 H new ATOM 0 HA ARG A 66 30.273 -17.132 -4.126 1.00 54.12 H new ATOM 0 HB2 ARG A 66 32.391 -16.014 -3.647 1.00 33.04 H new ATOM 0 HB3 ARG A 66 32.948 -17.379 -2.699 1.00 33.04 H new ATOM 0 HG2 ARG A 66 32.778 -18.790 -4.816 1.00 21.12 H new ATOM 0 HG3 ARG A 66 32.474 -17.306 -5.698 1.00 21.12 H new ATOM 0 HD2 ARG A 66 34.636 -16.540 -5.455 1.00 71.13 H new ATOM 0 HD3 ARG A 66 34.843 -17.280 -3.881 1.00 71.13 H new ATOM 0 HE ARG A 66 34.637 -19.346 -5.864 1.00 52.42 H new ATOM 0 HH11 ARG A 66 36.797 -16.800 -4.717 1.00 53.12 H new ATOM 0 HH12 ARG A 66 38.257 -17.639 -5.249 1.00 53.12 H new ATOM 0 HH21 ARG A 66 36.516 -20.419 -6.544 1.00 4.40 H new ATOM 0 HH22 ARG A 66 38.100 -19.681 -6.279 1.00 4.40 H new ATOM 1051 N THR A 67 31.182 -19.662 -2.213 1.00 2.54 N ATOM 1052 CA THR A 67 31.134 -21.113 -2.086 1.00 45.34 C ATOM 1053 C THR A 67 29.699 -21.622 -2.141 1.00 31.44 C ATOM 1054 O THR A 67 29.455 -22.782 -2.473 1.00 51.43 O ATOM 1055 CB THR A 67 31.785 -21.584 -0.772 1.00 42.02 C ATOM 1056 OG1 THR A 67 32.934 -20.781 -0.479 1.00 64.52 O ATOM 1057 CG2 THR A 67 32.192 -23.047 -0.864 1.00 10.11 C ATOM 0 H THR A 67 31.535 -19.178 -1.387 1.00 2.54 H new ATOM 0 HA THR A 67 31.694 -21.523 -2.927 1.00 45.34 H new ATOM 0 HB THR A 67 31.054 -21.477 0.029 1.00 42.02 H new ATOM 0 HG1 THR A 67 33.341 -21.086 0.359 1.00 64.52 H new ATOM 0 HG21 THR A 67 32.649 -23.357 0.075 1.00 10.11 H new ATOM 0 HG22 THR A 67 31.311 -23.658 -1.058 1.00 10.11 H new ATOM 0 HG23 THR A 67 32.908 -23.175 -1.676 1.00 10.11 H new ATOM 1065 N GLU A 68 28.753 -20.748 -1.812 1.00 75.42 N ATOM 1066 CA GLU A 68 27.340 -21.112 -1.824 1.00 45.00 C ATOM 1067 C GLU A 68 26.873 -21.432 -3.241 1.00 12.30 C ATOM 1068 O GLU A 68 26.406 -22.537 -3.517 1.00 32.10 O ATOM 1069 CB GLU A 68 26.494 -19.979 -1.239 1.00 64.03 C ATOM 1070 CG GLU A 68 25.950 -20.279 0.147 1.00 75.31 C ATOM 1071 CD GLU A 68 24.970 -19.227 0.629 1.00 34.31 C ATOM 1072 OE1 GLU A 68 25.170 -18.037 0.308 1.00 21.42 O ATOM 1073 OE2 GLU A 68 24.002 -19.595 1.328 1.00 54.05 O ATOM 0 H GLU A 68 28.938 -19.784 -1.534 1.00 75.42 H new ATOM 0 HA GLU A 68 27.215 -22.003 -1.209 1.00 45.00 H new ATOM 0 HB2 GLU A 68 27.097 -19.072 -1.195 1.00 64.03 H new ATOM 0 HB3 GLU A 68 25.660 -19.775 -1.911 1.00 64.03 H new ATOM 0 HG2 GLU A 68 25.458 -21.252 0.137 1.00 75.31 H new ATOM 0 HG3 GLU A 68 26.779 -20.348 0.852 1.00 75.31 H new ATOM 1080 N ILE A 69 27.001 -20.456 -4.134 1.00 64.42 N ATOM 1081 CA ILE A 69 26.593 -20.634 -5.522 1.00 52.41 C ATOM 1082 C ILE A 69 27.461 -21.673 -6.222 1.00 63.24 C ATOM 1083 O ILE A 69 26.953 -22.561 -6.906 1.00 62.12 O ATOM 1084 CB ILE A 69 26.666 -19.309 -6.304 1.00 42.11 C ATOM 1085 CG1 ILE A 69 25.704 -18.282 -5.703 1.00 32.52 C ATOM 1086 CG2 ILE A 69 26.349 -19.543 -7.774 1.00 2.05 C ATOM 1087 CD1 ILE A 69 26.232 -16.866 -5.739 1.00 0.54 C ATOM 0 H ILE A 69 27.384 -19.535 -3.921 1.00 64.42 H new ATOM 0 HA ILE A 69 25.560 -20.980 -5.505 1.00 52.41 H new ATOM 0 HB ILE A 69 27.680 -18.916 -6.229 1.00 42.11 H new ATOM 0 HG12 ILE A 69 24.758 -18.322 -6.244 1.00 32.52 H new ATOM 0 HG13 ILE A 69 25.492 -18.556 -4.669 1.00 32.52 H new ATOM 0 HG21 ILE A 69 26.405 -18.597 -8.313 1.00 2.05 H new ATOM 0 HG22 ILE A 69 27.070 -20.244 -8.195 1.00 2.05 H new ATOM 0 HG23 ILE A 69 25.345 -19.956 -7.868 1.00 2.05 H new ATOM 0 HD11 ILE A 69 25.498 -16.193 -5.297 1.00 0.54 H new ATOM 0 HD12 ILE A 69 27.162 -16.810 -5.174 1.00 0.54 H new ATOM 0 HD13 ILE A 69 26.417 -16.573 -6.772 1.00 0.54 H new ATOM 1099 N GLU A 70 28.774 -21.556 -6.045 1.00 34.50 N ATOM 1100 CA GLU A 70 29.713 -22.487 -6.660 1.00 34.54 C ATOM 1101 C GLU A 70 29.338 -23.931 -6.336 1.00 4.14 C ATOM 1102 O GLU A 70 29.506 -24.827 -7.161 1.00 74.44 O ATOM 1103 CB GLU A 70 31.137 -22.199 -6.182 1.00 64.03 C ATOM 1104 CG GLU A 70 32.209 -22.636 -7.167 1.00 3.14 C ATOM 1105 CD GLU A 70 32.716 -24.039 -6.893 1.00 2.55 C ATOM 1106 OE1 GLU A 70 32.924 -24.372 -5.707 1.00 63.41 O ATOM 1107 OE2 GLU A 70 32.905 -24.802 -7.862 1.00 41.15 O ATOM 0 H GLU A 70 29.211 -20.827 -5.481 1.00 34.50 H new ATOM 0 HA GLU A 70 29.666 -22.351 -7.740 1.00 34.54 H new ATOM 0 HB2 GLU A 70 31.240 -21.130 -5.996 1.00 64.03 H new ATOM 0 HB3 GLU A 70 31.301 -22.705 -5.231 1.00 64.03 H new ATOM 0 HG2 GLU A 70 31.807 -22.590 -8.179 1.00 3.14 H new ATOM 0 HG3 GLU A 70 33.044 -21.937 -7.123 1.00 3.14 H new ATOM 1114 N GLY A 71 28.831 -24.147 -5.126 1.00 20.43 N ATOM 1115 CA GLY A 71 28.442 -25.483 -4.713 1.00 34.12 C ATOM 1116 C GLY A 71 27.015 -25.817 -5.101 1.00 12.03 C ATOM 1117 O GLY A 71 26.715 -26.949 -5.481 1.00 60.24 O ATOM 0 H GLY A 71 28.683 -23.421 -4.425 1.00 20.43 H new ATOM 0 HA2 GLY A 71 29.117 -26.210 -5.163 1.00 34.12 H new ATOM 0 HA3 GLY A 71 28.552 -25.572 -3.632 1.00 34.12 H new ATOM 1121 N THR A 72 26.130 -24.830 -5.003 1.00 11.40 N ATOM 1122 CA THR A 72 24.726 -25.025 -5.344 1.00 4.44 C ATOM 1123 C THR A 72 24.565 -25.411 -6.809 1.00 70.43 C ATOM 1124 O THR A 72 23.923 -26.411 -7.129 1.00 32.31 O ATOM 1125 CB THR A 72 23.899 -23.755 -5.065 1.00 62.43 C ATOM 1126 OG1 THR A 72 23.965 -23.423 -3.674 1.00 42.10 O ATOM 1127 CG2 THR A 72 22.448 -23.954 -5.476 1.00 20.40 C ATOM 0 H THR A 72 26.361 -23.887 -4.690 1.00 11.40 H new ATOM 0 HA THR A 72 24.357 -25.835 -4.715 1.00 4.44 H new ATOM 0 HB THR A 72 24.318 -22.938 -5.653 1.00 62.43 H new ATOM 0 HG1 THR A 72 24.710 -22.805 -3.520 1.00 42.10 H new ATOM 0 HG21 THR A 72 21.883 -23.045 -5.270 1.00 20.40 H new ATOM 0 HG22 THR A 72 22.399 -24.178 -6.542 1.00 20.40 H new ATOM 0 HG23 THR A 72 22.020 -24.782 -4.911 1.00 20.40 H new ATOM 1135 N GLN A 73 25.152 -24.613 -7.695 1.00 61.32 N ATOM 1136 CA GLN A 73 25.072 -24.874 -9.128 1.00 5.43 C ATOM 1137 C GLN A 73 25.639 -26.249 -9.463 1.00 71.33 C ATOM 1138 O GLN A 73 25.325 -26.825 -10.505 1.00 53.24 O ATOM 1139 CB GLN A 73 25.827 -23.794 -9.906 1.00 71.52 C ATOM 1140 CG GLN A 73 25.397 -22.379 -9.556 1.00 24.01 C ATOM 1141 CD GLN A 73 24.061 -22.007 -10.166 1.00 55.22 C ATOM 1142 OE1 GLN A 73 23.993 -21.209 -11.101 1.00 53.53 O ATOM 1143 NE2 GLN A 73 22.987 -22.585 -9.639 1.00 44.04 N ATOM 0 H GLN A 73 25.688 -23.781 -7.447 1.00 61.32 H new ATOM 0 HA GLN A 73 24.022 -24.854 -9.418 1.00 5.43 H new ATOM 0 HB2 GLN A 73 26.895 -23.898 -9.713 1.00 71.52 H new ATOM 0 HB3 GLN A 73 25.679 -23.956 -10.974 1.00 71.52 H new ATOM 0 HG2 GLN A 73 25.338 -22.279 -8.472 1.00 24.01 H new ATOM 0 HG3 GLN A 73 26.157 -21.677 -9.900 1.00 24.01 H new ATOM 0 HE21 GLN A 73 23.089 -23.241 -8.864 1.00 44.04 H new ATOM 0 HE22 GLN A 73 22.060 -22.373 -10.009 1.00 44.04 H new ATOM 1152 N LYS A 74 26.476 -26.772 -8.574 1.00 3.11 N ATOM 1153 CA LYS A 74 27.087 -28.081 -8.774 1.00 50.30 C ATOM 1154 C LYS A 74 26.132 -29.196 -8.359 1.00 42.35 C ATOM 1155 O LYS A 74 25.926 -30.158 -9.101 1.00 12.34 O ATOM 1156 CB LYS A 74 28.389 -28.186 -7.976 1.00 74.52 C ATOM 1157 CG LYS A 74 28.873 -29.614 -7.789 1.00 40.20 C ATOM 1158 CD LYS A 74 28.359 -30.211 -6.490 1.00 20.30 C ATOM 1159 CE LYS A 74 29.501 -30.571 -5.551 1.00 52.55 C ATOM 1160 NZ LYS A 74 30.036 -31.933 -5.825 1.00 34.24 N ATOM 0 H LYS A 74 26.747 -26.309 -7.707 1.00 3.11 H new ATOM 0 HA LYS A 74 27.309 -28.193 -9.835 1.00 50.30 H new ATOM 0 HB2 LYS A 74 29.164 -27.612 -8.484 1.00 74.52 H new ATOM 0 HB3 LYS A 74 28.244 -27.729 -6.997 1.00 74.52 H new ATOM 0 HG2 LYS A 74 28.540 -30.225 -8.628 1.00 40.20 H new ATOM 0 HG3 LYS A 74 29.963 -29.633 -7.793 1.00 40.20 H new ATOM 0 HD2 LYS A 74 27.694 -29.500 -6.000 1.00 20.30 H new ATOM 0 HD3 LYS A 74 27.770 -31.102 -6.706 1.00 20.30 H new ATOM 0 HE2 LYS A 74 30.302 -29.839 -5.655 1.00 52.55 H new ATOM 0 HE3 LYS A 74 29.153 -30.518 -4.519 1.00 52.55 H new ATOM 0 HZ1 LYS A 74 30.404 -32.345 -4.944 1.00 34.24 H new ATOM 0 HZ2 LYS A 74 29.275 -32.536 -6.199 1.00 34.24 H new ATOM 0 HZ3 LYS A 74 30.803 -31.870 -6.524 1.00 34.24 H new ATOM 1174 N LEU A 75 25.551 -29.060 -7.173 1.00 3.14 N ATOM 1175 CA LEU A 75 24.616 -30.056 -6.660 1.00 3.40 C ATOM 1176 C LEU A 75 23.286 -29.987 -7.403 1.00 41.03 C ATOM 1177 O LEU A 75 22.460 -30.895 -7.304 1.00 54.10 O ATOM 1178 CB LEU A 75 24.388 -29.846 -5.162 1.00 50.11 C ATOM 1179 CG LEU A 75 23.286 -28.856 -4.783 1.00 41.22 C ATOM 1180 CD1 LEU A 75 21.975 -29.585 -4.537 1.00 34.21 C ATOM 1181 CD2 LEU A 75 23.690 -28.052 -3.556 1.00 22.12 C ATOM 0 H LEU A 75 25.710 -28.270 -6.548 1.00 3.14 H new ATOM 0 HA LEU A 75 25.050 -31.043 -6.820 1.00 3.40 H new ATOM 0 HB2 LEU A 75 24.153 -30.810 -4.712 1.00 50.11 H new ATOM 0 HB3 LEU A 75 25.323 -29.506 -4.717 1.00 50.11 H new ATOM 0 HG LEU A 75 23.143 -28.165 -5.614 1.00 41.22 H new ATOM 0 HD11 LEU A 75 21.203 -28.864 -4.268 1.00 34.21 H new ATOM 0 HD12 LEU A 75 21.678 -30.115 -5.442 1.00 34.21 H new ATOM 0 HD13 LEU A 75 22.103 -30.299 -3.724 1.00 34.21 H new ATOM 0 HD21 LEU A 75 22.894 -27.353 -3.301 1.00 22.12 H new ATOM 0 HD22 LEU A 75 23.861 -28.728 -2.718 1.00 22.12 H new ATOM 0 HD23 LEU A 75 24.605 -27.499 -3.769 1.00 22.12 H new ATOM 1193 N LEU A 76 23.087 -28.906 -8.149 1.00 75.25 N ATOM 1194 CA LEU A 76 21.857 -28.720 -8.912 1.00 42.35 C ATOM 1195 C LEU A 76 21.699 -29.812 -9.966 1.00 0.53 C ATOM 1196 O LEU A 76 20.612 -30.016 -10.503 1.00 74.04 O ATOM 1197 CB LEU A 76 21.853 -27.344 -9.582 1.00 62.54 C ATOM 1198 CG LEU A 76 20.642 -26.458 -9.288 1.00 65.12 C ATOM 1199 CD1 LEU A 76 20.511 -26.213 -7.793 1.00 73.50 C ATOM 1200 CD2 LEU A 76 20.752 -25.139 -10.039 1.00 4.13 C ATOM 0 H LEU A 76 23.760 -28.146 -8.242 1.00 75.25 H new ATOM 0 HA LEU A 76 21.016 -28.784 -8.221 1.00 42.35 H new ATOM 0 HB2 LEU A 76 22.752 -26.810 -9.275 1.00 62.54 H new ATOM 0 HB3 LEU A 76 21.920 -27.487 -10.660 1.00 62.54 H new ATOM 0 HG LEU A 76 19.745 -26.975 -9.631 1.00 65.12 H new ATOM 0 HD11 LEU A 76 19.644 -25.581 -7.603 1.00 73.50 H new ATOM 0 HD12 LEU A 76 20.386 -27.165 -7.278 1.00 73.50 H new ATOM 0 HD13 LEU A 76 21.409 -25.717 -7.425 1.00 73.50 H new ATOM 0 HD21 LEU A 76 19.882 -24.521 -9.818 1.00 4.13 H new ATOM 0 HD22 LEU A 76 21.657 -24.617 -9.727 1.00 4.13 H new ATOM 0 HD23 LEU A 76 20.797 -25.333 -11.111 1.00 4.13 H new ATOM 1212 N ASN A 77 22.792 -30.511 -10.254 1.00 34.42 N ATOM 1213 CA ASN A 77 22.774 -31.584 -11.242 1.00 32.13 C ATOM 1214 C ASN A 77 22.712 -32.949 -10.562 1.00 4.41 C ATOM 1215 O ASN A 77 22.799 -33.987 -11.219 1.00 3.54 O ATOM 1216 CB ASN A 77 24.012 -31.503 -12.136 1.00 44.41 C ATOM 1217 CG ASN A 77 23.849 -30.498 -13.260 1.00 73.24 C ATOM 1218 OD1 ASN A 77 23.424 -30.847 -14.362 1.00 53.30 O ATOM 1219 ND2 ASN A 77 24.186 -29.244 -12.986 1.00 44.55 N ATOM 0 H ASN A 77 23.701 -30.354 -9.818 1.00 34.42 H new ATOM 0 HA ASN A 77 21.882 -31.463 -11.857 1.00 32.13 H new ATOM 0 HB2 ASN A 77 24.877 -31.230 -11.531 1.00 44.41 H new ATOM 0 HB3 ASN A 77 24.217 -32.487 -12.559 1.00 44.41 H new ATOM 0 HD21 ASN A 77 24.097 -28.524 -13.703 1.00 44.55 H new ATOM 0 HD22 ASN A 77 24.534 -29.000 -12.059 1.00 44.55 H new ATOM 1226 N LYS A 78 22.562 -32.940 -9.242 1.00 15.41 N ATOM 1227 CA LYS A 78 22.486 -34.175 -8.471 1.00 63.24 C ATOM 1228 C LYS A 78 21.059 -34.437 -8.000 1.00 43.34 C ATOM 1229 O LYS A 78 20.629 -35.586 -7.901 1.00 40.12 O ATOM 1230 CB LYS A 78 23.428 -34.107 -7.267 1.00 31.51 C ATOM 1231 CG LYS A 78 24.892 -34.290 -7.628 1.00 72.23 C ATOM 1232 CD LYS A 78 25.710 -34.743 -6.430 1.00 75.44 C ATOM 1233 CE LYS A 78 27.164 -34.318 -6.556 1.00 4.05 C ATOM 1234 NZ LYS A 78 27.932 -34.595 -5.310 1.00 65.22 N ATOM 0 H LYS A 78 22.491 -32.090 -8.683 1.00 15.41 H new ATOM 0 HA LYS A 78 22.792 -34.997 -9.118 1.00 63.24 H new ATOM 0 HB2 LYS A 78 23.302 -33.144 -6.772 1.00 31.51 H new ATOM 0 HB3 LYS A 78 23.141 -34.875 -6.548 1.00 31.51 H new ATOM 0 HG2 LYS A 78 24.981 -35.024 -8.429 1.00 72.23 H new ATOM 0 HG3 LYS A 78 25.294 -33.351 -8.010 1.00 72.23 H new ATOM 0 HD2 LYS A 78 25.285 -34.324 -5.518 1.00 75.44 H new ATOM 0 HD3 LYS A 78 25.653 -35.828 -6.339 1.00 75.44 H new ATOM 0 HE2 LYS A 78 27.625 -34.844 -7.392 1.00 4.05 H new ATOM 0 HE3 LYS A 78 27.213 -33.253 -6.784 1.00 4.05 H new ATOM 0 HZ1 LYS A 78 28.933 -34.354 -5.458 1.00 65.22 H new ATOM 0 HZ2 LYS A 78 27.550 -34.021 -4.532 1.00 65.22 H new ATOM 0 HZ3 LYS A 78 27.851 -35.603 -5.069 1.00 65.22 H new ATOM 1248 N ASP A 79 20.330 -33.364 -7.713 1.00 23.01 N ATOM 1249 CA ASP A 79 18.950 -33.478 -7.255 1.00 4.32 C ATOM 1250 C ASP A 79 18.123 -34.314 -8.225 1.00 72.54 C ATOM 1251 O ASP A 79 17.138 -34.944 -7.836 1.00 25.22 O ATOM 1252 CB ASP A 79 18.327 -32.090 -7.098 1.00 74.02 C ATOM 1253 CG ASP A 79 18.809 -31.116 -8.155 1.00 3.33 C ATOM 1254 OD1 ASP A 79 18.871 -31.507 -9.339 1.00 54.23 O ATOM 1255 OD2 ASP A 79 19.125 -29.962 -7.797 1.00 40.20 O ATOM 0 H ASP A 79 20.671 -32.406 -7.789 1.00 23.01 H new ATOM 0 HA ASP A 79 18.954 -33.978 -6.286 1.00 4.32 H new ATOM 0 HB2 ASP A 79 17.242 -32.174 -7.153 1.00 74.02 H new ATOM 0 HB3 ASP A 79 18.566 -31.697 -6.110 1.00 74.02 H new ATOM 1260 N LEU A 80 18.527 -34.316 -9.491 1.00 4.13 N ATOM 1261 CA LEU A 80 17.823 -35.075 -10.518 1.00 53.44 C ATOM 1262 C LEU A 80 18.556 -36.374 -10.835 1.00 32.24 C ATOM 1263 O LEU A 80 18.000 -37.275 -11.463 1.00 1.24 O ATOM 1264 CB LEU A 80 17.677 -34.236 -11.789 1.00 53.22 C ATOM 1265 CG LEU A 80 18.838 -33.294 -12.109 1.00 10.11 C ATOM 1266 CD1 LEU A 80 20.137 -34.074 -12.243 1.00 14.13 C ATOM 1267 CD2 LEU A 80 18.553 -32.508 -13.380 1.00 55.32 C ATOM 0 H LEU A 80 19.339 -33.800 -9.830 1.00 4.13 H new ATOM 0 HA LEU A 80 16.832 -35.323 -10.136 1.00 53.44 H new ATOM 0 HB2 LEU A 80 17.541 -34.912 -12.633 1.00 53.22 H new ATOM 0 HB3 LEU A 80 16.766 -33.643 -11.706 1.00 53.22 H new ATOM 0 HG LEU A 80 18.945 -32.588 -11.285 1.00 10.11 H new ATOM 0 HD11 LEU A 80 20.952 -33.387 -12.471 1.00 14.13 H new ATOM 0 HD12 LEU A 80 20.349 -34.591 -11.307 1.00 14.13 H new ATOM 0 HD13 LEU A 80 20.042 -34.804 -13.047 1.00 14.13 H new ATOM 0 HD21 LEU A 80 19.390 -31.843 -13.592 1.00 55.32 H new ATOM 0 HD22 LEU A 80 18.418 -33.199 -14.212 1.00 55.32 H new ATOM 0 HD23 LEU A 80 17.646 -31.918 -13.248 1.00 55.32 H new ATOM 1279 N ALA A 81 19.806 -36.465 -10.393 1.00 41.33 N ATOM 1280 CA ALA A 81 20.614 -37.656 -10.625 1.00 51.35 C ATOM 1281 C ALA A 81 20.005 -38.874 -9.939 1.00 64.04 C ATOM 1282 O ALA A 81 20.117 -39.995 -10.434 1.00 33.44 O ATOM 1283 CB ALA A 81 22.038 -37.430 -10.140 1.00 21.43 C ATOM 0 H ALA A 81 20.281 -35.728 -9.872 1.00 41.33 H new ATOM 0 HA ALA A 81 20.634 -37.849 -11.698 1.00 51.35 H new ATOM 0 HB1 ALA A 81 22.630 -38.327 -10.319 1.00 21.43 H new ATOM 0 HB2 ALA A 81 22.477 -36.591 -10.680 1.00 21.43 H new ATOM 0 HB3 ALA A 81 22.028 -37.209 -9.073 1.00 21.43 H new ATOM 1289 N GLU A 82 19.363 -38.646 -8.798 1.00 50.41 N ATOM 1290 CA GLU A 82 18.739 -39.726 -8.044 1.00 74.43 C ATOM 1291 C GLU A 82 17.285 -39.917 -8.468 1.00 41.44 C ATOM 1292 O GLU A 82 16.753 -41.026 -8.422 1.00 31.52 O ATOM 1293 CB GLU A 82 18.810 -39.438 -6.543 1.00 72.42 C ATOM 1294 CG GLU A 82 20.155 -39.774 -5.922 1.00 62.31 C ATOM 1295 CD GLU A 82 20.122 -39.745 -4.406 1.00 53.14 C ATOM 1296 OE1 GLU A 82 19.697 -40.753 -3.803 1.00 42.13 O ATOM 1297 OE2 GLU A 82 20.519 -38.715 -3.823 1.00 43.35 O ATOM 0 H GLU A 82 19.261 -37.723 -8.376 1.00 50.41 H new ATOM 0 HA GLU A 82 19.285 -40.645 -8.257 1.00 74.43 H new ATOM 0 HB2 GLU A 82 18.594 -38.383 -6.373 1.00 72.42 H new ATOM 0 HB3 GLU A 82 18.032 -40.008 -6.035 1.00 72.42 H new ATOM 0 HG2 GLU A 82 20.468 -40.763 -6.256 1.00 62.31 H new ATOM 0 HG3 GLU A 82 20.903 -39.066 -6.279 1.00 62.31 H new ATOM 1304 N LEU A 83 16.648 -38.826 -8.881 1.00 62.44 N ATOM 1305 CA LEU A 83 15.256 -38.871 -9.314 1.00 33.52 C ATOM 1306 C LEU A 83 15.108 -39.697 -10.588 1.00 54.30 C ATOM 1307 O LEU A 83 14.259 -40.585 -10.668 1.00 71.34 O ATOM 1308 CB LEU A 83 14.727 -37.455 -9.546 1.00 0.13 C ATOM 1309 CG LEU A 83 13.467 -37.341 -10.405 1.00 0.15 C ATOM 1310 CD1 LEU A 83 12.365 -38.233 -9.856 1.00 34.41 C ATOM 1311 CD2 LEU A 83 12.999 -35.895 -10.476 1.00 1.44 C ATOM 0 H LEU A 83 17.074 -37.900 -8.925 1.00 62.44 H new ATOM 0 HA LEU A 83 14.672 -39.346 -8.526 1.00 33.52 H new ATOM 0 HB2 LEU A 83 14.523 -37.001 -8.576 1.00 0.13 H new ATOM 0 HB3 LEU A 83 15.516 -36.866 -10.014 1.00 0.13 H new ATOM 0 HG LEU A 83 13.707 -37.674 -11.415 1.00 0.15 H new ATOM 0 HD11 LEU A 83 11.476 -38.139 -10.480 1.00 34.41 H new ATOM 0 HD12 LEU A 83 12.701 -39.270 -9.858 1.00 34.41 H new ATOM 0 HD13 LEU A 83 12.126 -37.931 -8.836 1.00 34.41 H new ATOM 0 HD21 LEU A 83 12.101 -35.833 -11.091 1.00 1.44 H new ATOM 0 HD22 LEU A 83 12.776 -35.535 -9.472 1.00 1.44 H new ATOM 0 HD23 LEU A 83 13.784 -35.280 -10.916 1.00 1.44 H new ATOM 1323 N ILE A 84 15.940 -39.398 -11.580 1.00 74.20 N ATOM 1324 CA ILE A 84 15.903 -40.115 -12.849 1.00 1.12 C ATOM 1325 C ILE A 84 16.184 -41.600 -12.649 1.00 61.34 C ATOM 1326 O ILE A 84 15.445 -42.453 -13.138 1.00 73.32 O ATOM 1327 CB ILE A 84 16.923 -39.541 -13.849 1.00 44.43 C ATOM 1328 CG1 ILE A 84 16.622 -38.067 -14.129 1.00 41.22 C ATOM 1329 CG2 ILE A 84 16.909 -40.344 -15.141 1.00 33.41 C ATOM 1330 CD1 ILE A 84 17.841 -37.267 -14.533 1.00 11.02 C ATOM 0 H ILE A 84 16.647 -38.665 -11.530 1.00 74.20 H new ATOM 0 HA ILE A 84 14.899 -39.989 -13.254 1.00 1.12 H new ATOM 0 HB ILE A 84 17.918 -39.613 -13.410 1.00 44.43 H new ATOM 0 HG12 ILE A 84 15.876 -38.001 -14.921 1.00 41.22 H new ATOM 0 HG13 ILE A 84 16.182 -37.619 -13.238 1.00 41.22 H new ATOM 0 HG21 ILE A 84 17.636 -39.925 -15.837 1.00 33.41 H new ATOM 0 HG22 ILE A 84 17.167 -41.381 -14.927 1.00 33.41 H new ATOM 0 HG23 ILE A 84 15.914 -40.301 -15.585 1.00 33.41 H new ATOM 0 HD11 ILE A 84 17.553 -36.232 -14.716 1.00 11.02 H new ATOM 0 HD12 ILE A 84 18.581 -37.302 -13.733 1.00 11.02 H new ATOM 0 HD13 ILE A 84 18.269 -37.690 -15.442 1.00 11.02 H new ATOM 1342 N ASN A 85 17.258 -41.902 -11.926 1.00 54.01 N ATOM 1343 CA ASN A 85 17.636 -43.285 -11.660 1.00 62.13 C ATOM 1344 C ASN A 85 16.529 -44.017 -10.909 1.00 33.42 C ATOM 1345 O ASN A 85 16.295 -45.206 -11.129 1.00 14.04 O ATOM 1346 CB ASN A 85 18.935 -43.334 -10.853 1.00 33.14 C ATOM 1347 CG ASN A 85 20.164 -43.163 -11.724 1.00 2.44 C ATOM 1348 OD1 ASN A 85 21.000 -44.062 -11.821 1.00 54.43 O ATOM 1349 ND2 ASN A 85 20.280 -42.004 -12.361 1.00 43.34 N ATOM 0 H ASN A 85 17.881 -41.208 -11.514 1.00 54.01 H new ATOM 0 HA ASN A 85 17.792 -43.784 -12.617 1.00 62.13 H new ATOM 0 HB2 ASN A 85 18.918 -42.551 -10.095 1.00 33.14 H new ATOM 0 HB3 ASN A 85 18.996 -44.286 -10.326 1.00 33.14 H new ATOM 0 HD21 ASN A 85 21.087 -41.830 -12.960 1.00 43.34 H new ATOM 0 HD22 ASN A 85 19.562 -41.288 -12.251 1.00 43.34 H new ATOM 1356 N LYS A 86 15.849 -43.300 -10.021 1.00 2.51 N ATOM 1357 CA LYS A 86 14.765 -43.879 -9.237 1.00 55.41 C ATOM 1358 C LYS A 86 13.537 -44.127 -10.107 1.00 53.15 C ATOM 1359 O LYS A 86 12.717 -44.994 -9.807 1.00 15.41 O ATOM 1360 CB LYS A 86 14.399 -42.955 -8.073 1.00 43.20 C ATOM 1361 CG LYS A 86 13.537 -43.621 -7.015 1.00 60.21 C ATOM 1362 CD LYS A 86 14.380 -44.389 -6.011 1.00 3.01 C ATOM 1363 CE LYS A 86 13.654 -45.625 -5.503 1.00 21.21 C ATOM 1364 NZ LYS A 86 14.404 -46.298 -4.406 1.00 43.33 N ATOM 0 H LYS A 86 16.030 -42.315 -9.826 1.00 2.51 H new ATOM 0 HA LYS A 86 15.108 -44.835 -8.841 1.00 55.41 H new ATOM 0 HB2 LYS A 86 15.315 -42.591 -7.607 1.00 43.20 H new ATOM 0 HB3 LYS A 86 13.872 -42.084 -8.463 1.00 43.20 H new ATOM 0 HG2 LYS A 86 12.949 -42.865 -6.495 1.00 60.21 H new ATOM 0 HG3 LYS A 86 12.831 -44.300 -7.494 1.00 60.21 H new ATOM 0 HD2 LYS A 86 15.321 -44.684 -6.475 1.00 3.01 H new ATOM 0 HD3 LYS A 86 14.628 -43.740 -5.171 1.00 3.01 H new ATOM 0 HE2 LYS A 86 12.664 -45.343 -5.146 1.00 21.21 H new ATOM 0 HE3 LYS A 86 13.509 -46.325 -6.326 1.00 21.21 H new ATOM 0 HZ1 LYS A 86 13.876 -47.136 -4.088 1.00 43.33 H new ATOM 0 HZ2 LYS A 86 15.340 -46.590 -4.753 1.00 43.33 H new ATOM 0 HZ3 LYS A 86 14.521 -45.639 -3.610 1.00 43.33 H new ATOM 1378 N MET A 87 13.418 -43.362 -11.187 1.00 41.55 N ATOM 1379 CA MET A 87 12.291 -43.501 -12.103 1.00 22.34 C ATOM 1380 C MET A 87 12.416 -44.779 -12.927 1.00 54.41 C ATOM 1381 O MET A 87 11.517 -45.620 -12.924 1.00 22.30 O ATOM 1382 CB MET A 87 12.207 -42.288 -13.030 1.00 54.24 C ATOM 1383 CG MET A 87 11.275 -42.491 -14.214 1.00 34.42 C ATOM 1384 SD MET A 87 9.607 -42.959 -13.712 1.00 40.12 S ATOM 1385 CE MET A 87 8.876 -41.349 -13.424 1.00 25.34 C ATOM 0 H MET A 87 14.088 -42.639 -11.450 1.00 41.55 H new ATOM 0 HA MET A 87 11.378 -43.559 -11.511 1.00 22.34 H new ATOM 0 HB2 MET A 87 11.869 -41.425 -12.456 1.00 54.24 H new ATOM 0 HB3 MET A 87 13.205 -42.054 -13.400 1.00 54.24 H new ATOM 0 HG2 MET A 87 11.230 -41.572 -14.798 1.00 34.42 H new ATOM 0 HG3 MET A 87 11.684 -43.263 -14.866 1.00 34.42 H new ATOM 0 HE1 MET A 87 7.907 -41.471 -12.940 1.00 25.34 H new ATOM 0 HE2 MET A 87 9.532 -40.761 -12.781 1.00 25.34 H new ATOM 0 HE3 MET A 87 8.744 -40.834 -14.376 1.00 25.34 H new ATOM 1395 N ARG A 88 13.534 -44.916 -13.632 1.00 31.10 N ATOM 1396 CA ARG A 88 13.774 -46.090 -14.462 1.00 62.21 C ATOM 1397 C ARG A 88 13.777 -47.361 -13.618 1.00 61.41 C ATOM 1398 O ARG A 88 13.614 -48.466 -14.139 1.00 14.31 O ATOM 1399 CB ARG A 88 15.106 -45.954 -15.203 1.00 11.25 C ATOM 1400 CG ARG A 88 16.305 -45.813 -14.279 1.00 33.12 C ATOM 1401 CD ARG A 88 17.613 -46.000 -15.031 1.00 52.34 C ATOM 1402 NE ARG A 88 17.916 -47.410 -15.260 1.00 42.24 N ATOM 1403 CZ ARG A 88 19.127 -47.860 -15.571 1.00 33.12 C ATOM 1404 NH1 ARG A 88 20.142 -47.015 -15.688 1.00 71.42 N ATOM 1405 NH2 ARG A 88 19.324 -49.158 -15.764 1.00 32.01 N ATOM 0 H ARG A 88 14.288 -44.229 -13.645 1.00 31.10 H new ATOM 0 HA ARG A 88 12.966 -46.160 -15.191 1.00 62.21 H new ATOM 0 HB2 ARG A 88 15.249 -46.827 -15.839 1.00 11.25 H new ATOM 0 HB3 ARG A 88 15.060 -45.085 -15.860 1.00 11.25 H new ATOM 0 HG2 ARG A 88 16.291 -44.829 -13.811 1.00 33.12 H new ATOM 0 HG3 ARG A 88 16.237 -46.549 -13.478 1.00 33.12 H new ATOM 0 HD2 ARG A 88 17.558 -45.481 -15.988 1.00 52.34 H new ATOM 0 HD3 ARG A 88 18.425 -45.542 -14.466 1.00 52.34 H new ATOM 0 HE ARG A 88 17.157 -48.086 -15.177 1.00 42.24 H new ATOM 0 HH11 ARG A 88 19.994 -46.017 -15.539 1.00 71.42 H new ATOM 0 HH12 ARG A 88 21.071 -47.363 -15.927 1.00 71.42 H new ATOM 0 HH21 ARG A 88 18.546 -49.811 -15.674 1.00 32.01 H new ATOM 0 HH22 ARG A 88 20.254 -49.503 -16.003 1.00 32.01 H new ATOM 1419 N LEU A 89 13.965 -47.198 -12.313 1.00 75.32 N ATOM 1420 CA LEU A 89 13.989 -48.333 -11.396 1.00 44.41 C ATOM 1421 C LEU A 89 12.634 -48.516 -10.720 1.00 25.00 C ATOM 1422 O LEU A 89 12.308 -49.604 -10.247 1.00 21.12 O ATOM 1423 CB LEU A 89 15.077 -48.135 -10.339 1.00 22.21 C ATOM 1424 CG LEU A 89 14.967 -49.011 -9.091 1.00 32.34 C ATOM 1425 CD1 LEU A 89 15.184 -50.474 -9.444 1.00 62.34 C ATOM 1426 CD2 LEU A 89 15.965 -48.562 -8.034 1.00 24.22 C ATOM 0 H LEU A 89 14.103 -46.292 -11.866 1.00 75.32 H new ATOM 0 HA LEU A 89 14.210 -49.231 -11.973 1.00 44.41 H new ATOM 0 HB2 LEU A 89 16.045 -48.320 -10.804 1.00 22.21 H new ATOM 0 HB3 LEU A 89 15.067 -47.091 -10.027 1.00 22.21 H new ATOM 0 HG LEU A 89 13.962 -48.902 -8.683 1.00 32.34 H new ATOM 0 HD11 LEU A 89 15.102 -51.082 -8.543 1.00 62.34 H new ATOM 0 HD12 LEU A 89 14.430 -50.790 -10.165 1.00 62.34 H new ATOM 0 HD13 LEU A 89 16.176 -50.600 -9.878 1.00 62.34 H new ATOM 0 HD21 LEU A 89 15.872 -49.197 -7.153 1.00 24.22 H new ATOM 0 HD22 LEU A 89 16.977 -48.640 -8.432 1.00 24.22 H new ATOM 0 HD23 LEU A 89 15.762 -47.527 -7.758 1.00 24.22 H new ATOM 1438 N ALA A 90 11.849 -47.445 -10.680 1.00 51.24 N ATOM 1439 CA ALA A 90 10.528 -47.489 -10.066 1.00 54.24 C ATOM 1440 C ALA A 90 9.534 -48.229 -10.955 1.00 33.21 C ATOM 1441 O ALA A 90 8.938 -49.223 -10.540 1.00 10.20 O ATOM 1442 CB ALA A 90 10.033 -46.079 -9.778 1.00 75.20 C ATOM 0 H ALA A 90 12.105 -46.536 -11.066 1.00 51.24 H new ATOM 0 HA ALA A 90 10.610 -48.033 -9.125 1.00 54.24 H new ATOM 0 HB1 ALA A 90 9.045 -46.127 -9.320 1.00 75.20 H new ATOM 0 HB2 ALA A 90 10.725 -45.582 -9.098 1.00 75.20 H new ATOM 0 HB3 ALA A 90 9.974 -45.517 -10.710 1.00 75.20 H new ATOM 1448 N GLN A 91 9.360 -47.738 -12.178 1.00 10.04 N ATOM 1449 CA GLN A 91 8.437 -48.353 -13.123 1.00 75.44 C ATOM 1450 C GLN A 91 9.090 -49.536 -13.831 1.00 34.45 C ATOM 1451 O GLN A 91 8.477 -50.175 -14.685 1.00 74.23 O ATOM 1452 CB GLN A 91 7.967 -47.324 -14.153 1.00 71.32 C ATOM 1453 CG GLN A 91 8.968 -47.082 -15.271 1.00 71.24 C ATOM 1454 CD GLN A 91 8.943 -45.653 -15.777 1.00 65.42 C ATOM 1455 OE1 GLN A 91 9.990 -45.035 -15.977 1.00 34.32 O ATOM 1456 NE2 GLN A 91 7.746 -45.120 -15.988 1.00 32.10 N ATOM 0 H GLN A 91 9.846 -46.916 -12.537 1.00 10.04 H new ATOM 0 HA GLN A 91 7.575 -48.718 -12.564 1.00 75.44 H new ATOM 0 HB2 GLN A 91 7.025 -47.660 -14.586 1.00 71.32 H new ATOM 0 HB3 GLN A 91 7.766 -46.380 -13.646 1.00 71.32 H new ATOM 0 HG2 GLN A 91 9.970 -47.320 -14.914 1.00 71.24 H new ATOM 0 HG3 GLN A 91 8.755 -47.760 -16.097 1.00 71.24 H new ATOM 0 HE21 GLN A 91 6.905 -45.668 -15.809 1.00 32.10 H new ATOM 0 HE22 GLN A 91 7.667 -44.162 -16.329 1.00 32.10 H new ATOM 1465 N GLN A 92 10.336 -49.821 -13.468 1.00 62.41 N ATOM 1466 CA GLN A 92 11.072 -50.927 -14.069 1.00 61.24 C ATOM 1467 C GLN A 92 10.260 -52.217 -14.011 1.00 40.15 C ATOM 1468 O GLN A 92 9.316 -52.333 -13.232 1.00 12.45 O ATOM 1469 CB GLN A 92 12.412 -51.122 -13.358 1.00 63.22 C ATOM 1470 CG GLN A 92 13.528 -51.586 -14.280 1.00 64.22 C ATOM 1471 CD GLN A 92 14.891 -51.536 -13.618 1.00 21.31 C ATOM 1472 OE1 GLN A 92 15.359 -52.528 -13.058 1.00 34.32 O ATOM 1473 NE2 GLN A 92 15.537 -50.378 -13.679 1.00 0.34 N ATOM 0 H GLN A 92 10.857 -49.302 -12.761 1.00 62.41 H new ATOM 0 HA GLN A 92 11.256 -50.682 -15.115 1.00 61.24 H new ATOM 0 HB2 GLN A 92 12.706 -50.182 -12.890 1.00 63.22 H new ATOM 0 HB3 GLN A 92 12.286 -51.851 -12.558 1.00 63.22 H new ATOM 0 HG2 GLN A 92 13.324 -52.606 -14.606 1.00 64.22 H new ATOM 0 HG3 GLN A 92 13.539 -50.962 -15.173 1.00 64.22 H new ATOM 0 HE21 GLN A 92 15.112 -49.581 -14.153 1.00 0.34 H new ATOM 0 HE22 GLN A 92 16.458 -50.285 -13.252 1.00 0.34 H new ATOM 1482 N ASN A 93 10.634 -53.184 -14.843 1.00 3.11 N ATOM 1483 CA ASN A 93 9.940 -54.465 -14.887 1.00 33.51 C ATOM 1484 C ASN A 93 10.271 -55.306 -13.658 1.00 24.42 C ATOM 1485 O ASN A 93 11.159 -56.158 -13.697 1.00 10.11 O ATOM 1486 CB ASN A 93 10.316 -55.230 -16.158 1.00 54.40 C ATOM 1487 CG ASN A 93 10.462 -54.316 -17.360 1.00 22.14 C ATOM 1488 OD1 ASN A 93 11.562 -54.127 -17.879 1.00 62.54 O ATOM 1489 ND2 ASN A 93 9.351 -53.744 -17.807 1.00 15.44 N ATOM 0 H ASN A 93 11.414 -53.104 -15.496 1.00 3.11 H new ATOM 0 HA ASN A 93 8.868 -54.268 -14.893 1.00 33.51 H new ATOM 0 HB2 ASN A 93 11.252 -55.763 -15.994 1.00 54.40 H new ATOM 0 HB3 ASN A 93 9.554 -55.981 -16.366 1.00 54.40 H new ATOM 0 HD21 ASN A 93 9.388 -53.119 -18.612 1.00 15.44 H new ATOM 0 HD22 ASN A 93 8.461 -53.930 -17.345 1.00 15.44 H new ATOM 1496 N ALA A 94 9.551 -55.061 -12.568 1.00 64.30 N ATOM 1497 CA ALA A 94 9.767 -55.797 -11.328 1.00 70.25 C ATOM 1498 C ALA A 94 8.528 -56.597 -10.942 1.00 74.44 C ATOM 1499 O ALA A 94 8.629 -57.739 -10.493 1.00 75.10 O ATOM 1500 CB ALA A 94 10.151 -54.842 -10.208 1.00 23.41 C ATOM 0 H ALA A 94 8.813 -54.359 -12.518 1.00 64.30 H new ATOM 0 HA ALA A 94 10.585 -56.499 -11.489 1.00 70.25 H new ATOM 0 HB1 ALA A 94 10.309 -55.405 -9.288 1.00 23.41 H new ATOM 0 HB2 ALA A 94 11.069 -54.318 -10.475 1.00 23.41 H new ATOM 0 HB3 ALA A 94 9.351 -54.118 -10.057 1.00 23.41 H new ATOM 1506 N VAL A 95 7.358 -55.991 -11.120 1.00 2.11 N ATOM 1507 CA VAL A 95 6.099 -56.647 -10.790 1.00 73.44 C ATOM 1508 C VAL A 95 6.116 -57.186 -9.364 1.00 42.32 C ATOM 1509 O VAL A 95 6.162 -58.397 -9.146 1.00 3.23 O ATOM 1510 CB VAL A 95 5.799 -57.805 -11.761 1.00 34.22 C ATOM 1511 CG1 VAL A 95 4.397 -58.349 -11.527 1.00 5.14 C ATOM 1512 CG2 VAL A 95 5.969 -57.349 -13.202 1.00 75.42 C ATOM 0 H VAL A 95 7.256 -55.046 -11.491 1.00 2.11 H new ATOM 0 HA VAL A 95 5.317 -55.894 -10.881 1.00 73.44 H new ATOM 0 HB VAL A 95 6.511 -58.609 -11.572 1.00 34.22 H new ATOM 0 HG11 VAL A 95 4.203 -59.166 -12.222 1.00 5.14 H new ATOM 0 HG12 VAL A 95 4.315 -58.716 -10.504 1.00 5.14 H new ATOM 0 HG13 VAL A 95 3.667 -57.555 -11.687 1.00 5.14 H new ATOM 0 HG21 VAL A 95 5.753 -58.179 -13.874 1.00 75.42 H new ATOM 0 HG22 VAL A 95 5.282 -56.528 -13.407 1.00 75.42 H new ATOM 0 HG23 VAL A 95 6.994 -57.012 -13.359 1.00 75.42 H new ATOM 1522 N THR A 96 6.079 -56.277 -8.394 1.00 73.41 N ATOM 1523 CA THR A 96 6.091 -56.660 -6.988 1.00 32.11 C ATOM 1524 C THR A 96 5.581 -55.527 -6.105 1.00 53.22 C ATOM 1525 O THR A 96 5.745 -54.351 -6.431 1.00 62.21 O ATOM 1526 CB THR A 96 7.505 -57.058 -6.526 1.00 64.22 C ATOM 1527 OG1 THR A 96 8.138 -57.865 -7.526 1.00 20.12 O ATOM 1528 CG2 THR A 96 7.451 -57.821 -5.211 1.00 71.02 C ATOM 0 H THR A 96 6.040 -55.271 -8.557 1.00 73.41 H new ATOM 0 HA THR A 96 5.429 -57.520 -6.890 1.00 32.11 H new ATOM 0 HB THR A 96 8.083 -56.147 -6.375 1.00 64.22 H new ATOM 0 HG1 THR A 96 7.463 -58.408 -7.984 1.00 20.12 H new ATOM 0 HG21 THR A 96 8.462 -58.091 -4.905 1.00 71.02 H new ATOM 0 HG22 THR A 96 6.996 -57.194 -4.445 1.00 71.02 H new ATOM 0 HG23 THR A 96 6.857 -58.726 -5.339 1.00 71.02 H new ATOM 1536 N SER A 97 4.961 -55.888 -4.986 1.00 5.43 N ATOM 1537 CA SER A 97 4.424 -54.900 -4.057 1.00 23.10 C ATOM 1538 C SER A 97 5.525 -53.970 -3.556 1.00 62.03 C ATOM 1539 O SER A 97 5.266 -52.822 -3.192 1.00 24.22 O ATOM 1540 CB SER A 97 3.751 -55.596 -2.872 1.00 62.15 C ATOM 1541 OG SER A 97 3.030 -56.740 -3.296 1.00 30.11 O ATOM 0 H SER A 97 4.818 -56.857 -4.701 1.00 5.43 H new ATOM 0 HA SER A 97 3.682 -54.304 -4.589 1.00 23.10 H new ATOM 0 HB2 SER A 97 4.505 -55.888 -2.141 1.00 62.15 H new ATOM 0 HB3 SER A 97 3.076 -54.901 -2.373 1.00 62.15 H new ATOM 0 HG SER A 97 2.611 -57.168 -2.521 1.00 30.11 H new ATOM 1547 N LEU A 98 6.754 -54.473 -3.541 1.00 64.31 N ATOM 1548 CA LEU A 98 7.897 -53.689 -3.085 1.00 52.13 C ATOM 1549 C LEU A 98 8.012 -52.387 -3.871 1.00 54.33 C ATOM 1550 O LEU A 98 8.544 -51.394 -3.374 1.00 34.53 O ATOM 1551 CB LEU A 98 9.186 -54.499 -3.228 1.00 24.22 C ATOM 1552 CG LEU A 98 10.491 -53.707 -3.133 1.00 52.14 C ATOM 1553 CD1 LEU A 98 10.629 -53.068 -1.760 1.00 63.22 C ATOM 1554 CD2 LEU A 98 11.683 -54.605 -3.428 1.00 61.44 C ATOM 0 H LEU A 98 6.985 -55.421 -3.839 1.00 64.31 H new ATOM 0 HA LEU A 98 7.743 -53.446 -2.034 1.00 52.13 H new ATOM 0 HB2 LEU A 98 9.195 -55.269 -2.457 1.00 24.22 H new ATOM 0 HB3 LEU A 98 9.165 -55.011 -4.190 1.00 24.22 H new ATOM 0 HG LEU A 98 10.467 -52.913 -3.879 1.00 52.14 H new ATOM 0 HD11 LEU A 98 11.563 -52.509 -1.711 1.00 63.22 H new ATOM 0 HD12 LEU A 98 9.792 -52.392 -1.588 1.00 63.22 H new ATOM 0 HD13 LEU A 98 10.631 -53.845 -0.996 1.00 63.22 H new ATOM 0 HD21 LEU A 98 12.603 -54.024 -3.356 1.00 61.44 H new ATOM 0 HD22 LEU A 98 11.711 -55.421 -2.706 1.00 61.44 H new ATOM 0 HD23 LEU A 98 11.590 -55.014 -4.434 1.00 61.44 H new ATOM 1566 N SER A 99 7.507 -52.397 -5.101 1.00 61.30 N ATOM 1567 CA SER A 99 7.554 -51.218 -5.957 1.00 3.52 C ATOM 1568 C SER A 99 6.946 -50.009 -5.251 1.00 23.53 C ATOM 1569 O SER A 99 7.315 -48.868 -5.524 1.00 53.30 O ATOM 1570 CB SER A 99 6.812 -51.483 -7.268 1.00 45.32 C ATOM 1571 OG SER A 99 6.793 -50.326 -8.086 1.00 41.32 O ATOM 0 H SER A 99 7.060 -53.209 -5.527 1.00 61.30 H new ATOM 0 HA SER A 99 8.599 -51.001 -6.177 1.00 3.52 H new ATOM 0 HB2 SER A 99 7.293 -52.302 -7.803 1.00 45.32 H new ATOM 0 HB3 SER A 99 5.791 -51.798 -7.054 1.00 45.32 H new ATOM 0 HG SER A 99 6.314 -50.522 -8.918 1.00 41.32 H new ATOM 1577 N GLU A 100 6.013 -50.271 -4.341 1.00 72.51 N ATOM 1578 CA GLU A 100 5.353 -49.206 -3.596 1.00 53.21 C ATOM 1579 C GLU A 100 6.378 -48.288 -2.936 1.00 34.11 C ATOM 1580 O GLU A 100 6.152 -47.086 -2.799 1.00 35.45 O ATOM 1581 CB GLU A 100 4.422 -49.796 -2.535 1.00 20.23 C ATOM 1582 CG GLU A 100 3.020 -50.084 -3.046 1.00 44.32 C ATOM 1583 CD GLU A 100 2.114 -50.657 -1.974 1.00 24.10 C ATOM 1584 OE1 GLU A 100 2.575 -51.533 -1.213 1.00 63.10 O ATOM 1585 OE2 GLU A 100 0.944 -50.229 -1.896 1.00 53.22 O ATOM 0 H GLU A 100 5.698 -51.211 -4.102 1.00 72.51 H new ATOM 0 HA GLU A 100 4.763 -48.618 -4.299 1.00 53.21 H new ATOM 0 HB2 GLU A 100 4.858 -50.720 -2.155 1.00 20.23 H new ATOM 0 HB3 GLU A 100 4.358 -49.104 -1.695 1.00 20.23 H new ATOM 0 HG2 GLU A 100 2.582 -49.164 -3.432 1.00 44.32 H new ATOM 0 HG3 GLU A 100 3.078 -50.784 -3.880 1.00 44.32 H new ATOM 1592 N GLU A 101 7.504 -48.865 -2.529 1.00 43.41 N ATOM 1593 CA GLU A 101 8.563 -48.099 -1.882 1.00 1.30 C ATOM 1594 C GLU A 101 9.267 -47.189 -2.885 1.00 25.42 C ATOM 1595 O GLU A 101 9.468 -46.003 -2.628 1.00 43.22 O ATOM 1596 CB GLU A 101 9.578 -49.040 -1.230 1.00 0.23 C ATOM 1597 CG GLU A 101 10.827 -48.335 -0.728 1.00 41.33 C ATOM 1598 CD GLU A 101 11.841 -49.294 -0.136 1.00 35.44 C ATOM 1599 OE1 GLU A 101 11.536 -49.906 0.910 1.00 62.42 O ATOM 1600 OE2 GLU A 101 12.937 -49.433 -0.716 1.00 62.31 O ATOM 0 H GLU A 101 7.706 -49.859 -2.636 1.00 43.41 H new ATOM 0 HA GLU A 101 8.108 -47.477 -1.111 1.00 1.30 H new ATOM 0 HB2 GLU A 101 9.101 -49.554 -0.395 1.00 0.23 H new ATOM 0 HB3 GLU A 101 9.868 -49.804 -1.951 1.00 0.23 H new ATOM 0 HG2 GLU A 101 11.287 -47.789 -1.552 1.00 41.33 H new ATOM 0 HG3 GLU A 101 10.546 -47.599 0.025 1.00 41.33 H new ATOM 1607 N ALA A 102 9.641 -47.756 -4.028 1.00 13.23 N ATOM 1608 CA ALA A 102 10.321 -46.997 -5.070 1.00 21.12 C ATOM 1609 C ALA A 102 9.493 -45.792 -5.501 1.00 55.22 C ATOM 1610 O ALA A 102 10.027 -44.809 -6.015 1.00 25.11 O ATOM 1611 CB ALA A 102 10.618 -47.891 -6.265 1.00 0.12 C ATOM 0 H ALA A 102 9.484 -48.738 -4.255 1.00 13.23 H new ATOM 0 HA ALA A 102 11.263 -46.630 -4.662 1.00 21.12 H new ATOM 0 HB1 ALA A 102 11.126 -47.311 -7.036 1.00 0.12 H new ATOM 0 HB2 ALA A 102 11.257 -48.717 -5.952 1.00 0.12 H new ATOM 0 HB3 ALA A 102 9.684 -48.286 -6.665 1.00 0.12 H new ATOM 1617 N LYS A 103 8.183 -45.874 -5.290 1.00 42.31 N ATOM 1618 CA LYS A 103 7.279 -44.790 -5.656 1.00 44.23 C ATOM 1619 C LYS A 103 7.486 -43.580 -4.750 1.00 54.05 C ATOM 1620 O LYS A 103 7.830 -42.494 -5.218 1.00 25.52 O ATOM 1621 CB LYS A 103 5.826 -45.260 -5.574 1.00 34.45 C ATOM 1622 CG LYS A 103 5.215 -45.591 -6.925 1.00 4.24 C ATOM 1623 CD LYS A 103 3.770 -46.039 -6.789 1.00 30.50 C ATOM 1624 CE LYS A 103 2.807 -44.873 -6.949 1.00 70.11 C ATOM 1625 NZ LYS A 103 2.775 -44.369 -8.350 1.00 14.21 N ATOM 0 H LYS A 103 7.724 -46.681 -4.867 1.00 42.31 H new ATOM 0 HA LYS A 103 7.501 -44.496 -6.682 1.00 44.23 H new ATOM 0 HB2 LYS A 103 5.774 -46.142 -4.936 1.00 34.45 H new ATOM 0 HB3 LYS A 103 5.229 -44.484 -5.095 1.00 34.45 H new ATOM 0 HG2 LYS A 103 5.266 -44.716 -7.573 1.00 4.24 H new ATOM 0 HG3 LYS A 103 5.797 -46.377 -7.406 1.00 4.24 H new ATOM 0 HD2 LYS A 103 3.551 -46.798 -7.540 1.00 30.50 H new ATOM 0 HD3 LYS A 103 3.622 -46.503 -5.814 1.00 30.50 H new ATOM 0 HE2 LYS A 103 1.806 -45.185 -6.652 1.00 70.11 H new ATOM 0 HE3 LYS A 103 3.100 -44.065 -6.279 1.00 70.11 H new ATOM 0 HZ1 LYS A 103 1.884 -43.859 -8.515 1.00 14.21 H new ATOM 0 HZ2 LYS A 103 3.577 -43.725 -8.506 1.00 14.21 H new ATOM 0 HZ3 LYS A 103 2.842 -45.171 -9.009 1.00 14.21 H new ATOM 1639 N ARG A 104 7.273 -43.775 -3.453 1.00 45.11 N ATOM 1640 CA ARG A 104 7.437 -42.700 -2.482 1.00 55.53 C ATOM 1641 C ARG A 104 8.845 -42.116 -2.549 1.00 31.15 C ATOM 1642 O ARG A 104 9.027 -40.901 -2.477 1.00 61.20 O ATOM 1643 CB ARG A 104 7.151 -43.212 -1.069 1.00 41.33 C ATOM 1644 CG ARG A 104 7.926 -44.468 -0.709 1.00 23.42 C ATOM 1645 CD ARG A 104 7.601 -44.939 0.700 1.00 13.22 C ATOM 1646 NE ARG A 104 8.654 -45.787 1.251 1.00 22.11 N ATOM 1647 CZ ARG A 104 8.571 -46.387 2.433 1.00 25.32 C ATOM 1648 NH1 ARG A 104 7.490 -46.234 3.184 1.00 13.52 N ATOM 1649 NH2 ARG A 104 9.572 -47.144 2.866 1.00 40.20 N ATOM 0 H ARG A 104 6.987 -44.667 -3.050 1.00 45.11 H new ATOM 0 HA ARG A 104 6.724 -41.912 -2.726 1.00 55.53 H new ATOM 0 HB2 ARG A 104 7.393 -42.428 -0.352 1.00 41.33 H new ATOM 0 HB3 ARG A 104 6.084 -43.414 -0.974 1.00 41.33 H new ATOM 0 HG2 ARG A 104 7.691 -45.259 -1.421 1.00 23.42 H new ATOM 0 HG3 ARG A 104 8.995 -44.273 -0.791 1.00 23.42 H new ATOM 0 HD2 ARG A 104 7.457 -44.074 1.347 1.00 13.22 H new ATOM 0 HD3 ARG A 104 6.660 -45.490 0.690 1.00 13.22 H new ATOM 0 HE ARG A 104 9.500 -45.926 0.698 1.00 22.11 H new ATOM 0 HH11 ARG A 104 6.718 -45.654 2.855 1.00 13.52 H new ATOM 0 HH12 ARG A 104 7.430 -46.696 4.091 1.00 13.52 H new ATOM 0 HH21 ARG A 104 10.406 -47.265 2.291 1.00 40.20 H new ATOM 0 HH22 ARG A 104 9.507 -47.604 3.774 1.00 40.20 H new ATOM 1663 N GLN A 105 9.836 -42.991 -2.685 1.00 4.21 N ATOM 1664 CA GLN A 105 11.228 -42.562 -2.759 1.00 50.24 C ATOM 1665 C GLN A 105 11.442 -41.609 -3.931 1.00 12.45 C ATOM 1666 O GLN A 105 12.285 -40.714 -3.869 1.00 71.32 O ATOM 1667 CB GLN A 105 12.151 -43.774 -2.898 1.00 34.00 C ATOM 1668 CG GLN A 105 12.363 -44.529 -1.596 1.00 1.13 C ATOM 1669 CD GLN A 105 12.815 -43.626 -0.465 1.00 10.01 C ATOM 1670 OE1 GLN A 105 12.311 -43.715 0.655 1.00 12.31 O ATOM 1671 NE2 GLN A 105 13.771 -42.750 -0.752 1.00 73.02 N ATOM 0 H GLN A 105 9.701 -44.000 -2.746 1.00 4.21 H new ATOM 0 HA GLN A 105 11.469 -42.035 -1.836 1.00 50.24 H new ATOM 0 HB2 GLN A 105 11.734 -44.455 -3.640 1.00 34.00 H new ATOM 0 HB3 GLN A 105 13.117 -43.443 -3.278 1.00 34.00 H new ATOM 0 HG2 GLN A 105 11.434 -45.024 -1.312 1.00 1.13 H new ATOM 0 HG3 GLN A 105 13.106 -45.311 -1.751 1.00 1.13 H new ATOM 0 HE21 GLN A 105 14.161 -42.711 -1.694 1.00 73.02 H new ATOM 0 HE22 GLN A 105 14.116 -42.117 -0.031 1.00 73.02 H new ATOM 1680 N MET A 106 10.673 -41.807 -4.996 1.00 40.33 N ATOM 1681 CA MET A 106 10.778 -40.964 -6.182 1.00 4.55 C ATOM 1682 C MET A 106 10.414 -39.519 -5.855 1.00 4.31 C ATOM 1683 O MET A 106 11.157 -38.592 -6.181 1.00 3.21 O ATOM 1684 CB MET A 106 9.869 -41.492 -7.292 1.00 71.33 C ATOM 1685 CG MET A 106 10.030 -40.756 -8.612 1.00 44.31 C ATOM 1686 SD MET A 106 9.759 -41.822 -10.040 1.00 71.14 S ATOM 1687 CE MET A 106 8.293 -42.713 -9.524 1.00 43.01 C ATOM 0 H MET A 106 9.970 -42.543 -5.063 1.00 40.33 H new ATOM 0 HA MET A 106 11.812 -40.991 -6.526 1.00 4.55 H new ATOM 0 HB2 MET A 106 10.077 -42.550 -7.448 1.00 71.33 H new ATOM 0 HB3 MET A 106 8.831 -41.416 -6.967 1.00 71.33 H new ATOM 0 HG2 MET A 106 9.328 -39.923 -8.647 1.00 44.31 H new ATOM 0 HG3 MET A 106 11.032 -40.331 -8.666 1.00 44.31 H new ATOM 0 HE1 MET A 106 7.750 -43.060 -10.403 1.00 43.01 H new ATOM 0 HE2 MET A 106 8.583 -43.569 -8.915 1.00 43.01 H new ATOM 0 HE3 MET A 106 7.653 -42.053 -8.939 1.00 43.01 H new ATOM 1697 N LEU A 107 9.268 -39.333 -5.210 1.00 71.51 N ATOM 1698 CA LEU A 107 8.805 -38.001 -4.839 1.00 41.45 C ATOM 1699 C LEU A 107 9.829 -37.294 -3.957 1.00 24.51 C ATOM 1700 O LEU A 107 9.905 -36.065 -3.935 1.00 32.41 O ATOM 1701 CB LEU A 107 7.463 -38.089 -4.112 1.00 33.34 C ATOM 1702 CG LEU A 107 6.945 -36.788 -3.497 1.00 23.53 C ATOM 1703 CD1 LEU A 107 6.268 -35.931 -4.554 1.00 14.21 C ATOM 1704 CD2 LEU A 107 5.987 -37.084 -2.352 1.00 52.12 C ATOM 0 H LEU A 107 8.642 -40.089 -4.933 1.00 71.51 H new ATOM 0 HA LEU A 107 8.678 -37.421 -5.753 1.00 41.45 H new ATOM 0 HB2 LEU A 107 6.716 -38.458 -4.814 1.00 33.34 H new ATOM 0 HB3 LEU A 107 7.550 -38.832 -3.320 1.00 33.34 H new ATOM 0 HG LEU A 107 7.794 -36.233 -3.099 1.00 23.53 H new ATOM 0 HD11 LEU A 107 5.906 -35.010 -4.098 1.00 14.21 H new ATOM 0 HD12 LEU A 107 6.984 -35.690 -5.340 1.00 14.21 H new ATOM 0 HD13 LEU A 107 5.428 -36.478 -4.983 1.00 14.21 H new ATOM 0 HD21 LEU A 107 5.628 -36.147 -1.926 1.00 52.12 H new ATOM 0 HD22 LEU A 107 5.141 -37.660 -2.726 1.00 52.12 H new ATOM 0 HD23 LEU A 107 6.505 -37.657 -1.583 1.00 52.12 H new ATOM 1716 N THR A 108 10.619 -38.080 -3.231 1.00 12.14 N ATOM 1717 CA THR A 108 11.640 -37.531 -2.347 1.00 55.31 C ATOM 1718 C THR A 108 12.852 -37.053 -3.138 1.00 22.31 C ATOM 1719 O THR A 108 13.723 -36.367 -2.603 1.00 74.13 O ATOM 1720 CB THR A 108 12.097 -38.568 -1.304 1.00 51.21 C ATOM 1721 OG1 THR A 108 10.975 -39.332 -0.848 1.00 52.23 O ATOM 1722 CG2 THR A 108 12.767 -37.886 -0.121 1.00 30.02 C ATOM 0 H THR A 108 10.571 -39.099 -3.238 1.00 12.14 H new ATOM 0 HA THR A 108 11.189 -36.683 -1.831 1.00 55.31 H new ATOM 0 HB THR A 108 12.820 -39.232 -1.777 1.00 51.21 H new ATOM 0 HG1 THR A 108 11.274 -39.990 -0.186 1.00 52.23 H new ATOM 0 HG21 THR A 108 13.081 -38.638 0.602 1.00 30.02 H new ATOM 0 HG22 THR A 108 13.638 -37.329 -0.467 1.00 30.02 H new ATOM 0 HG23 THR A 108 12.063 -37.201 0.351 1.00 30.02 H new ATOM 1730 N ALA A 109 12.902 -37.420 -4.414 1.00 64.32 N ATOM 1731 CA ALA A 109 14.008 -37.027 -5.279 1.00 54.33 C ATOM 1732 C ALA A 109 13.664 -35.769 -6.070 1.00 64.15 C ATOM 1733 O ALA A 109 14.487 -34.863 -6.202 1.00 64.23 O ATOM 1734 CB ALA A 109 14.370 -38.164 -6.223 1.00 51.20 C ATOM 0 H ALA A 109 12.190 -37.989 -4.872 1.00 64.32 H new ATOM 0 HA ALA A 109 14.869 -36.805 -4.649 1.00 54.33 H new ATOM 0 HB1 ALA A 109 15.197 -37.856 -6.863 1.00 51.20 H new ATOM 0 HB2 ALA A 109 14.666 -39.038 -5.643 1.00 51.20 H new ATOM 0 HB3 ALA A 109 13.507 -38.413 -6.840 1.00 51.20 H new ATOM 1740 N SER A 110 12.444 -35.720 -6.596 1.00 24.51 N ATOM 1741 CA SER A 110 11.994 -34.575 -7.378 1.00 62.34 C ATOM 1742 C SER A 110 12.112 -33.286 -6.571 1.00 55.03 C ATOM 1743 O SER A 110 12.715 -32.311 -7.021 1.00 21.22 O ATOM 1744 CB SER A 110 10.547 -34.777 -7.831 1.00 33.33 C ATOM 1745 OG SER A 110 9.793 -33.588 -7.674 1.00 13.31 O ATOM 0 H SER A 110 11.750 -36.460 -6.495 1.00 24.51 H new ATOM 0 HA SER A 110 12.634 -34.492 -8.257 1.00 62.34 H new ATOM 0 HB2 SER A 110 10.530 -35.087 -8.876 1.00 33.33 H new ATOM 0 HB3 SER A 110 10.090 -35.580 -7.253 1.00 33.33 H new ATOM 0 HG SER A 110 9.437 -33.309 -8.544 1.00 13.31 H new ATOM 1751 N HIS A 111 11.530 -33.288 -5.376 1.00 72.40 N ATOM 1752 CA HIS A 111 11.569 -32.119 -4.504 1.00 71.54 C ATOM 1753 C HIS A 111 13.008 -31.689 -4.237 1.00 40.13 C ATOM 1754 O HIS A 111 13.275 -30.521 -3.950 1.00 64.51 O ATOM 1755 CB HIS A 111 10.860 -32.418 -3.183 1.00 61.41 C ATOM 1756 CG HIS A 111 10.242 -31.211 -2.548 1.00 41.23 C ATOM 1757 ND1 HIS A 111 9.757 -31.204 -1.257 1.00 63.15 N ATOM 1758 CD2 HIS A 111 10.033 -29.965 -3.034 1.00 11.33 C ATOM 1759 CE1 HIS A 111 9.275 -30.007 -0.977 1.00 11.41 C ATOM 1760 NE2 HIS A 111 9.430 -29.236 -2.038 1.00 45.31 N ATOM 0 H HIS A 111 11.026 -34.086 -4.989 1.00 72.40 H new ATOM 0 HA HIS A 111 11.052 -31.303 -5.008 1.00 71.54 H new ATOM 0 HB2 HIS A 111 10.084 -33.164 -3.357 1.00 61.41 H new ATOM 0 HB3 HIS A 111 11.575 -32.858 -2.488 1.00 61.41 H new ATOM 0 HD2 HIS A 111 10.292 -29.610 -4.021 1.00 11.33 H new ATOM 0 HE1 HIS A 111 8.830 -29.709 -0.039 1.00 11.41 H new ATOM 0 HE2 HIS A 111 9.148 -28.258 -2.107 1.00 45.31 H new ATOM 1768 N THR A 112 13.933 -32.639 -4.333 1.00 33.41 N ATOM 1769 CA THR A 112 15.344 -32.359 -4.100 1.00 32.22 C ATOM 1770 C THR A 112 15.870 -31.327 -5.090 1.00 63.04 C ATOM 1771 O THR A 112 16.923 -30.725 -4.875 1.00 0.13 O ATOM 1772 CB THR A 112 16.196 -33.638 -4.207 1.00 34.00 C ATOM 1773 OG1 THR A 112 15.521 -34.730 -3.572 1.00 65.33 O ATOM 1774 CG2 THR A 112 17.560 -33.435 -3.565 1.00 35.15 C ATOM 0 H THR A 112 13.730 -33.610 -4.571 1.00 33.41 H new ATOM 0 HA THR A 112 15.425 -31.962 -3.088 1.00 32.22 H new ATOM 0 HB THR A 112 16.340 -33.865 -5.263 1.00 34.00 H new ATOM 0 HG1 THR A 112 16.168 -35.435 -3.359 1.00 65.33 H new ATOM 0 HG21 THR A 112 18.144 -34.351 -3.653 1.00 35.15 H new ATOM 0 HG22 THR A 112 18.082 -32.622 -4.070 1.00 35.15 H new ATOM 0 HG23 THR A 112 17.433 -33.186 -2.512 1.00 35.15 H new ATOM 1782 N LEU A 113 15.132 -31.126 -6.176 1.00 62.14 N ATOM 1783 CA LEU A 113 15.525 -30.165 -7.201 1.00 53.21 C ATOM 1784 C LEU A 113 15.076 -28.756 -6.827 1.00 11.14 C ATOM 1785 O LEU A 113 15.655 -27.769 -7.279 1.00 53.30 O ATOM 1786 CB LEU A 113 14.929 -30.560 -8.554 1.00 11.54 C ATOM 1787 CG LEU A 113 15.561 -31.773 -9.237 1.00 53.30 C ATOM 1788 CD1 LEU A 113 14.938 -33.061 -8.721 1.00 3.45 C ATOM 1789 CD2 LEU A 113 15.408 -31.673 -10.748 1.00 24.12 C ATOM 0 H LEU A 113 14.258 -31.615 -6.370 1.00 62.14 H new ATOM 0 HA LEU A 113 16.613 -30.173 -7.274 1.00 53.21 H new ATOM 0 HB2 LEU A 113 13.866 -30.759 -8.416 1.00 11.54 H new ATOM 0 HB3 LEU A 113 15.009 -29.706 -9.227 1.00 11.54 H new ATOM 0 HG LEU A 113 16.625 -31.787 -8.999 1.00 53.30 H new ATOM 0 HD11 LEU A 113 15.400 -33.914 -9.218 1.00 3.45 H new ATOM 0 HD12 LEU A 113 15.099 -33.137 -7.646 1.00 3.45 H new ATOM 0 HD13 LEU A 113 13.868 -33.056 -8.929 1.00 3.45 H new ATOM 0 HD21 LEU A 113 15.863 -32.545 -11.218 1.00 24.12 H new ATOM 0 HD22 LEU A 113 14.349 -31.634 -11.005 1.00 24.12 H new ATOM 0 HD23 LEU A 113 15.902 -30.769 -11.105 1.00 24.12 H new ATOM 1801 N ALA A 114 14.042 -28.671 -5.996 1.00 22.13 N ATOM 1802 CA ALA A 114 13.519 -27.383 -5.557 1.00 34.53 C ATOM 1803 C ALA A 114 14.098 -26.988 -4.203 1.00 31.14 C ATOM 1804 O ALA A 114 14.376 -25.815 -3.954 1.00 2.02 O ATOM 1805 CB ALA A 114 11.999 -27.426 -5.491 1.00 22.32 C ATOM 0 H ALA A 114 13.550 -29.479 -5.613 1.00 22.13 H new ATOM 0 HA ALA A 114 13.819 -26.629 -6.285 1.00 34.53 H new ATOM 0 HB1 ALA A 114 11.622 -26.458 -5.162 1.00 22.32 H new ATOM 0 HB2 ALA A 114 11.598 -27.655 -6.478 1.00 22.32 H new ATOM 0 HB3 ALA A 114 11.687 -28.196 -4.785 1.00 22.32 H new ATOM 1811 N VAL A 115 14.277 -27.975 -3.330 1.00 14.43 N ATOM 1812 CA VAL A 115 14.823 -27.729 -2.000 1.00 62.55 C ATOM 1813 C VAL A 115 16.111 -26.917 -2.077 1.00 70.10 C ATOM 1814 O VAL A 115 16.433 -26.157 -1.163 1.00 61.53 O ATOM 1815 CB VAL A 115 15.105 -29.049 -1.257 1.00 51.14 C ATOM 1816 CG1 VAL A 115 13.850 -29.906 -1.197 1.00 30.31 C ATOM 1817 CG2 VAL A 115 16.244 -29.803 -1.926 1.00 24.43 C ATOM 0 H VAL A 115 14.052 -28.952 -3.520 1.00 14.43 H new ATOM 0 HA VAL A 115 14.072 -27.163 -1.449 1.00 62.55 H new ATOM 0 HB VAL A 115 15.405 -28.815 -0.236 1.00 51.14 H new ATOM 0 HG11 VAL A 115 14.068 -30.834 -0.669 1.00 30.31 H new ATOM 0 HG12 VAL A 115 13.064 -29.364 -0.670 1.00 30.31 H new ATOM 0 HG13 VAL A 115 13.517 -30.134 -2.209 1.00 30.31 H new ATOM 0 HG21 VAL A 115 16.430 -30.733 -1.388 1.00 24.43 H new ATOM 0 HG22 VAL A 115 15.975 -30.028 -2.958 1.00 24.43 H new ATOM 0 HG23 VAL A 115 17.145 -29.189 -1.912 1.00 24.43 H new ATOM 1827 N ASP A 116 16.843 -27.082 -3.173 1.00 5.21 N ATOM 1828 CA ASP A 116 18.096 -26.362 -3.370 1.00 65.44 C ATOM 1829 C ASP A 116 17.835 -24.938 -3.850 1.00 65.02 C ATOM 1830 O ASP A 116 18.444 -23.987 -3.362 1.00 4.33 O ATOM 1831 CB ASP A 116 18.979 -27.100 -4.379 1.00 2.35 C ATOM 1832 CG ASP A 116 20.457 -26.923 -4.091 1.00 64.45 C ATOM 1833 OD1 ASP A 116 20.828 -26.875 -2.900 1.00 63.13 O ATOM 1834 OD2 ASP A 116 21.243 -26.833 -5.058 1.00 42.11 O ATOM 0 H ASP A 116 16.591 -27.707 -3.938 1.00 5.21 H new ATOM 0 HA ASP A 116 18.614 -26.314 -2.412 1.00 65.44 H new ATOM 0 HB2 ASP A 116 18.733 -28.162 -4.364 1.00 2.35 H new ATOM 0 HB3 ASP A 116 18.761 -26.736 -5.383 1.00 2.35 H new ATOM 1839 N ALA A 117 16.927 -24.800 -4.810 1.00 41.43 N ATOM 1840 CA ALA A 117 16.585 -23.492 -5.356 1.00 10.25 C ATOM 1841 C ALA A 117 16.246 -22.505 -4.243 1.00 72.14 C ATOM 1842 O ALA A 117 16.540 -21.314 -4.345 1.00 4.04 O ATOM 1843 CB ALA A 117 15.422 -23.614 -6.329 1.00 13.53 C ATOM 0 H ALA A 117 16.415 -25.578 -5.226 1.00 41.43 H new ATOM 0 HA ALA A 117 17.454 -23.110 -5.892 1.00 10.25 H new ATOM 0 HB1 ALA A 117 15.177 -22.630 -6.729 1.00 13.53 H new ATOM 0 HB2 ALA A 117 15.700 -24.279 -7.147 1.00 13.53 H new ATOM 0 HB3 ALA A 117 14.554 -24.021 -5.810 1.00 13.53 H new ATOM 1849 N LYS A 118 15.624 -23.008 -3.182 1.00 52.33 N ATOM 1850 CA LYS A 118 15.244 -22.171 -2.050 1.00 23.31 C ATOM 1851 C LYS A 118 16.478 -21.677 -1.301 1.00 52.22 C ATOM 1852 O LYS A 118 16.510 -20.546 -0.818 1.00 40.23 O ATOM 1853 CB LYS A 118 14.334 -22.950 -1.097 1.00 2.40 C ATOM 1854 CG LYS A 118 13.336 -22.075 -0.359 1.00 52.40 C ATOM 1855 CD LYS A 118 12.347 -21.428 -1.315 1.00 64.20 C ATOM 1856 CE LYS A 118 11.099 -20.953 -0.588 1.00 53.34 C ATOM 1857 NZ LYS A 118 11.269 -19.582 -0.031 1.00 23.42 N ATOM 0 H LYS A 118 15.372 -23.991 -3.082 1.00 52.33 H new ATOM 0 HA LYS A 118 14.703 -21.306 -2.434 1.00 23.31 H new ATOM 0 HB2 LYS A 118 13.792 -23.707 -1.663 1.00 2.40 H new ATOM 0 HB3 LYS A 118 14.950 -23.477 -0.369 1.00 2.40 H new ATOM 0 HG2 LYS A 118 12.796 -22.675 0.373 1.00 52.40 H new ATOM 0 HG3 LYS A 118 13.868 -21.301 0.194 1.00 52.40 H new ATOM 0 HD2 LYS A 118 12.822 -20.584 -1.815 1.00 64.20 H new ATOM 0 HD3 LYS A 118 12.068 -22.142 -2.090 1.00 64.20 H new ATOM 0 HE2 LYS A 118 10.253 -20.964 -1.275 1.00 53.34 H new ATOM 0 HE3 LYS A 118 10.863 -21.646 0.219 1.00 53.34 H new ATOM 0 HZ1 LYS A 118 10.397 -19.295 0.457 1.00 23.42 H new ATOM 0 HZ2 LYS A 118 12.060 -19.577 0.644 1.00 23.42 H new ATOM 0 HZ3 LYS A 118 11.469 -18.916 -0.804 1.00 23.42 H new ATOM 1871 N ASN A 119 17.492 -22.532 -1.210 1.00 55.52 N ATOM 1872 CA ASN A 119 18.728 -22.180 -0.521 1.00 71.30 C ATOM 1873 C ASN A 119 19.612 -21.304 -1.403 1.00 1.22 C ATOM 1874 O ASN A 119 20.455 -20.555 -0.907 1.00 24.54 O ATOM 1875 CB ASN A 119 19.487 -23.445 -0.115 1.00 61.24 C ATOM 1876 CG ASN A 119 18.613 -24.427 0.640 1.00 75.31 C ATOM 1877 OD1 ASN A 119 17.554 -24.065 1.154 1.00 4.14 O ATOM 1878 ND2 ASN A 119 19.052 -25.678 0.710 1.00 62.41 N ATOM 0 H ASN A 119 17.482 -23.473 -1.604 1.00 55.52 H new ATOM 0 HA ASN A 119 18.468 -21.617 0.375 1.00 71.30 H new ATOM 0 HB2 ASN A 119 19.885 -23.929 -1.007 1.00 61.24 H new ATOM 0 HB3 ASN A 119 20.340 -23.170 0.506 1.00 61.24 H new ATOM 0 HD21 ASN A 119 18.506 -26.383 1.204 1.00 62.41 H new ATOM 0 HD22 ASN A 119 19.936 -25.934 0.269 1.00 62.41 H new ATOM 1885 N LEU A 120 19.413 -21.401 -2.713 1.00 24.14 N ATOM 1886 CA LEU A 120 20.192 -20.617 -3.665 1.00 11.41 C ATOM 1887 C LEU A 120 19.605 -19.218 -3.826 1.00 44.13 C ATOM 1888 O LEU A 120 20.339 -18.234 -3.931 1.00 53.24 O ATOM 1889 CB LEU A 120 20.237 -21.323 -5.021 1.00 50.21 C ATOM 1890 CG LEU A 120 21.312 -20.838 -5.995 1.00 31.33 C ATOM 1891 CD1 LEU A 120 20.943 -19.477 -6.563 1.00 12.20 C ATOM 1892 CD2 LEU A 120 22.668 -20.781 -5.307 1.00 20.33 C ATOM 0 H LEU A 120 18.719 -22.015 -3.140 1.00 24.14 H new ATOM 0 HA LEU A 120 21.207 -20.523 -3.278 1.00 11.41 H new ATOM 0 HB2 LEU A 120 20.386 -22.389 -4.848 1.00 50.21 H new ATOM 0 HB3 LEU A 120 19.264 -21.210 -5.499 1.00 50.21 H new ATOM 0 HG LEU A 120 21.375 -21.548 -6.820 1.00 31.33 H new ATOM 0 HD11 LEU A 120 21.720 -19.148 -7.254 1.00 12.20 H new ATOM 0 HD12 LEU A 120 19.993 -19.549 -7.093 1.00 12.20 H new ATOM 0 HD13 LEU A 120 20.851 -18.756 -5.750 1.00 12.20 H new ATOM 0 HD21 LEU A 120 23.421 -20.434 -6.015 1.00 20.33 H new ATOM 0 HD22 LEU A 120 22.619 -20.093 -4.463 1.00 20.33 H new ATOM 0 HD23 LEU A 120 22.937 -21.775 -4.950 1.00 20.33 H new ATOM 1904 N LEU A 121 18.280 -19.136 -3.843 1.00 74.42 N ATOM 1905 CA LEU A 121 17.593 -17.857 -3.989 1.00 65.33 C ATOM 1906 C LEU A 121 18.041 -16.873 -2.913 1.00 63.14 C ATOM 1907 O LEU A 121 18.612 -15.825 -3.216 1.00 22.04 O ATOM 1908 CB LEU A 121 16.079 -18.057 -3.915 1.00 73.30 C ATOM 1909 CG LEU A 121 15.230 -16.787 -3.978 1.00 41.14 C ATOM 1910 CD1 LEU A 121 15.084 -16.173 -2.595 1.00 3.32 C ATOM 1911 CD2 LEU A 121 15.841 -15.785 -4.947 1.00 3.10 C ATOM 0 H LEU A 121 17.659 -19.940 -3.757 1.00 74.42 H new ATOM 0 HA LEU A 121 17.851 -17.443 -4.964 1.00 65.33 H new ATOM 0 HB2 LEU A 121 15.779 -18.712 -4.733 1.00 73.30 H new ATOM 0 HB3 LEU A 121 15.847 -18.580 -2.987 1.00 73.30 H new ATOM 0 HG LEU A 121 14.237 -17.054 -4.340 1.00 41.14 H new ATOM 0 HD11 LEU A 121 14.477 -15.270 -2.660 1.00 3.32 H new ATOM 0 HD12 LEU A 121 14.601 -16.888 -1.929 1.00 3.32 H new ATOM 0 HD13 LEU A 121 16.069 -15.920 -2.203 1.00 3.32 H new ATOM 0 HD21 LEU A 121 15.224 -14.887 -4.979 1.00 3.10 H new ATOM 0 HD22 LEU A 121 16.845 -15.523 -4.614 1.00 3.10 H new ATOM 0 HD23 LEU A 121 15.892 -16.226 -5.942 1.00 3.10 H new ATOM 1923 N ASP A 122 17.780 -17.219 -1.658 1.00 4.45 N ATOM 1924 CA ASP A 122 18.159 -16.367 -0.536 1.00 25.32 C ATOM 1925 C ASP A 122 19.655 -16.070 -0.561 1.00 5.04 C ATOM 1926 O ASP A 122 20.105 -15.055 -0.030 1.00 4.02 O ATOM 1927 CB ASP A 122 17.781 -17.033 0.788 1.00 21.21 C ATOM 1928 CG ASP A 122 17.803 -16.062 1.952 1.00 54.33 C ATOM 1929 OD1 ASP A 122 17.485 -14.873 1.738 1.00 73.32 O ATOM 1930 OD2 ASP A 122 18.138 -16.490 3.076 1.00 1.52 O ATOM 0 H ASP A 122 17.308 -18.083 -1.391 1.00 4.45 H new ATOM 0 HA ASP A 122 17.618 -15.425 -0.628 1.00 25.32 H new ATOM 0 HB2 ASP A 122 16.786 -17.469 0.701 1.00 21.21 H new ATOM 0 HB3 ASP A 122 18.471 -17.852 0.989 1.00 21.21 H new ATOM 1935 N ALA A 123 20.421 -16.963 -1.180 1.00 11.23 N ATOM 1936 CA ALA A 123 21.866 -16.796 -1.274 1.00 52.53 C ATOM 1937 C ALA A 123 22.225 -15.649 -2.213 1.00 64.24 C ATOM 1938 O ALA A 123 23.149 -14.880 -1.946 1.00 30.52 O ATOM 1939 CB ALA A 123 22.517 -18.088 -1.743 1.00 22.32 C ATOM 0 H ALA A 123 20.065 -17.809 -1.624 1.00 11.23 H new ATOM 0 HA ALA A 123 22.245 -16.551 -0.282 1.00 52.53 H new ATOM 0 HB1 ALA A 123 23.596 -17.949 -1.809 1.00 22.32 H new ATOM 0 HB2 ALA A 123 22.297 -18.885 -1.033 1.00 22.32 H new ATOM 0 HB3 ALA A 123 22.126 -18.357 -2.724 1.00 22.32 H new ATOM 1945 N VAL A 124 21.490 -15.540 -3.316 1.00 23.34 N ATOM 1946 CA VAL A 124 21.732 -14.487 -4.295 1.00 33.24 C ATOM 1947 C VAL A 124 21.081 -13.177 -3.864 1.00 62.34 C ATOM 1948 O VAL A 124 21.518 -12.096 -4.259 1.00 65.20 O ATOM 1949 CB VAL A 124 21.198 -14.880 -5.685 1.00 30.41 C ATOM 1950 CG1 VAL A 124 21.417 -13.751 -6.680 1.00 61.11 C ATOM 1951 CG2 VAL A 124 21.860 -16.162 -6.166 1.00 62.44 C ATOM 0 H VAL A 124 20.722 -16.168 -3.553 1.00 23.34 H new ATOM 0 HA VAL A 124 22.812 -14.351 -4.354 1.00 33.24 H new ATOM 0 HB VAL A 124 20.126 -15.059 -5.606 1.00 30.41 H new ATOM 0 HG11 VAL A 124 21.033 -14.047 -7.656 1.00 61.11 H new ATOM 0 HG12 VAL A 124 20.892 -12.859 -6.339 1.00 61.11 H new ATOM 0 HG13 VAL A 124 22.483 -13.537 -6.759 1.00 61.11 H new ATOM 0 HG21 VAL A 124 21.471 -16.425 -7.150 1.00 62.44 H new ATOM 0 HG22 VAL A 124 22.938 -16.013 -6.230 1.00 62.44 H new ATOM 0 HG23 VAL A 124 21.646 -16.968 -5.464 1.00 62.44 H new ATOM 1961 N ASP A 125 20.035 -13.282 -3.053 1.00 12.43 N ATOM 1962 CA ASP A 125 19.324 -12.105 -2.567 1.00 10.34 C ATOM 1963 C ASP A 125 20.260 -11.190 -1.783 1.00 12.13 C ATOM 1964 O ASP A 125 20.366 -9.999 -2.075 1.00 24.14 O ATOM 1965 CB ASP A 125 18.144 -12.522 -1.688 1.00 21.15 C ATOM 1966 CG ASP A 125 17.437 -11.334 -1.065 1.00 23.33 C ATOM 1967 OD1 ASP A 125 17.420 -10.257 -1.696 1.00 3.03 O ATOM 1968 OD2 ASP A 125 16.902 -11.482 0.054 1.00 11.31 O ATOM 0 H ASP A 125 19.660 -14.170 -2.718 1.00 12.43 H new ATOM 0 HA ASP A 125 18.948 -11.556 -3.430 1.00 10.34 H new ATOM 0 HB2 ASP A 125 17.433 -13.092 -2.286 1.00 21.15 H new ATOM 0 HB3 ASP A 125 18.499 -13.185 -0.899 1.00 21.15 H new ATOM 1973 N GLN A 126 20.934 -11.755 -0.786 1.00 40.04 N ATOM 1974 CA GLN A 126 21.859 -10.989 0.040 1.00 22.14 C ATOM 1975 C GLN A 126 23.169 -10.737 -0.699 1.00 51.41 C ATOM 1976 O GLN A 126 23.806 -9.699 -0.517 1.00 74.32 O ATOM 1977 CB GLN A 126 22.134 -11.726 1.352 1.00 22.41 C ATOM 1978 CG GLN A 126 20.945 -11.749 2.299 1.00 52.55 C ATOM 1979 CD GLN A 126 20.418 -10.361 2.606 1.00 53.20 C ATOM 1980 OE1 GLN A 126 19.210 -10.122 2.577 1.00 30.41 O ATOM 1981 NE2 GLN A 126 21.323 -9.436 2.903 1.00 51.31 N ATOM 0 H GLN A 126 20.857 -12.740 -0.531 1.00 40.04 H new ATOM 0 HA GLN A 126 21.397 -10.027 0.261 1.00 22.14 H new ATOM 0 HB2 GLN A 126 22.429 -12.751 1.128 1.00 22.41 H new ATOM 0 HB3 GLN A 126 22.978 -11.254 1.854 1.00 22.41 H new ATOM 0 HG2 GLN A 126 20.147 -12.348 1.860 1.00 52.55 H new ATOM 0 HG3 GLN A 126 21.235 -12.237 3.229 1.00 52.55 H new ATOM 0 HE21 GLN A 126 22.314 -9.677 2.915 1.00 51.31 H new ATOM 0 HE22 GLN A 126 21.027 -8.484 3.119 1.00 51.31 H new ATOM 1990 N ALA A 127 23.565 -11.692 -1.533 1.00 65.22 N ATOM 1991 CA ALA A 127 24.798 -11.572 -2.301 1.00 65.43 C ATOM 1992 C ALA A 127 24.718 -10.417 -3.293 1.00 14.42 C ATOM 1993 O ALA A 127 25.663 -9.641 -3.437 1.00 13.34 O ATOM 1994 CB ALA A 127 25.095 -12.875 -3.029 1.00 64.03 C ATOM 0 H ALA A 127 23.050 -12.558 -1.694 1.00 65.22 H new ATOM 0 HA ALA A 127 25.611 -11.363 -1.605 1.00 65.43 H new ATOM 0 HB1 ALA A 127 26.019 -12.771 -3.599 1.00 64.03 H new ATOM 0 HB2 ALA A 127 25.205 -13.681 -2.303 1.00 64.03 H new ATOM 0 HB3 ALA A 127 24.274 -13.108 -3.708 1.00 64.03 H new ATOM 2000 N LYS A 128 23.583 -10.307 -3.976 1.00 21.43 N ATOM 2001 CA LYS A 128 23.377 -9.246 -4.954 1.00 65.01 C ATOM 2002 C LYS A 128 23.579 -7.874 -4.319 1.00 24.01 C ATOM 2003 O LYS A 128 23.895 -6.902 -5.005 1.00 1.43 O ATOM 2004 CB LYS A 128 21.972 -9.341 -5.552 1.00 42.04 C ATOM 2005 CG LYS A 128 21.932 -10.034 -6.903 1.00 51.14 C ATOM 2006 CD LYS A 128 22.305 -9.084 -8.029 1.00 12.51 C ATOM 2007 CE LYS A 128 21.107 -8.766 -8.911 1.00 32.53 C ATOM 2008 NZ LYS A 128 21.316 -7.525 -9.706 1.00 3.24 N ATOM 0 H LYS A 128 22.791 -10.941 -3.870 1.00 21.43 H new ATOM 0 HA LYS A 128 24.113 -9.371 -5.749 1.00 65.01 H new ATOM 0 HB2 LYS A 128 21.326 -9.879 -4.858 1.00 42.04 H new ATOM 0 HB3 LYS A 128 21.562 -8.337 -5.656 1.00 42.04 H new ATOM 0 HG2 LYS A 128 22.618 -10.881 -6.899 1.00 51.14 H new ATOM 0 HG3 LYS A 128 20.933 -10.433 -7.079 1.00 51.14 H new ATOM 0 HD2 LYS A 128 22.705 -8.161 -7.610 1.00 12.51 H new ATOM 0 HD3 LYS A 128 23.096 -9.528 -8.634 1.00 12.51 H new ATOM 0 HE2 LYS A 128 20.921 -9.602 -9.585 1.00 32.53 H new ATOM 0 HE3 LYS A 128 20.219 -8.654 -8.290 1.00 32.53 H new ATOM 0 HZ1 LYS A 128 20.477 -7.344 -10.293 1.00 3.24 H new ATOM 0 HZ2 LYS A 128 21.468 -6.722 -9.063 1.00 3.24 H new ATOM 0 HZ3 LYS A 128 22.149 -7.641 -10.318 1.00 3.24 H new ATOM 2022 N VAL A 129 23.397 -7.803 -3.004 1.00 55.21 N ATOM 2023 CA VAL A 129 23.561 -6.550 -2.276 1.00 62.41 C ATOM 2024 C VAL A 129 25.036 -6.239 -2.045 1.00 54.44 C ATOM 2025 O VAL A 129 25.465 -5.091 -2.167 1.00 43.33 O ATOM 2026 CB VAL A 129 22.838 -6.592 -0.917 1.00 12.11 C ATOM 2027 CG1 VAL A 129 23.028 -5.281 -0.170 1.00 42.52 C ATOM 2028 CG2 VAL A 129 21.360 -6.896 -1.110 1.00 13.54 C ATOM 0 H VAL A 129 23.136 -8.598 -2.421 1.00 55.21 H new ATOM 0 HA VAL A 129 23.118 -5.766 -2.890 1.00 62.41 H new ATOM 0 HB VAL A 129 23.275 -7.390 -0.317 1.00 12.11 H new ATOM 0 HG11 VAL A 129 22.510 -5.330 0.788 1.00 42.52 H new ATOM 0 HG12 VAL A 129 24.091 -5.110 0.001 1.00 42.52 H new ATOM 0 HG13 VAL A 129 22.619 -4.462 -0.762 1.00 42.52 H new ATOM 0 HG21 VAL A 129 20.864 -6.922 -0.140 1.00 13.54 H new ATOM 0 HG22 VAL A 129 20.907 -6.121 -1.728 1.00 13.54 H new ATOM 0 HG23 VAL A 129 21.248 -7.863 -1.600 1.00 13.54 H new ATOM 2038 N LEU A 130 25.807 -7.267 -1.712 1.00 31.52 N ATOM 2039 CA LEU A 130 27.235 -7.104 -1.464 1.00 62.32 C ATOM 2040 C LEU A 130 27.976 -6.761 -2.753 1.00 15.11 C ATOM 2041 O LEU A 130 28.941 -5.998 -2.741 1.00 61.12 O ATOM 2042 CB LEU A 130 27.816 -8.381 -0.854 1.00 1.14 C ATOM 2043 CG LEU A 130 26.972 -9.050 0.231 1.00 32.52 C ATOM 2044 CD1 LEU A 130 27.731 -10.208 0.860 1.00 24.13 C ATOM 2045 CD2 LEU A 130 26.565 -8.038 1.292 1.00 44.32 C ATOM 0 H LEU A 130 25.468 -8.223 -1.607 1.00 31.52 H new ATOM 0 HA LEU A 130 27.365 -6.281 -0.761 1.00 62.32 H new ATOM 0 HB2 LEU A 130 27.979 -9.101 -1.656 1.00 1.14 H new ATOM 0 HB3 LEU A 130 28.794 -8.147 -0.433 1.00 1.14 H new ATOM 0 HG LEU A 130 26.067 -9.444 -0.232 1.00 32.52 H new ATOM 0 HD11 LEU A 130 27.114 -10.672 1.630 1.00 24.13 H new ATOM 0 HD12 LEU A 130 27.970 -10.945 0.094 1.00 24.13 H new ATOM 0 HD13 LEU A 130 28.653 -9.838 1.308 1.00 24.13 H new ATOM 0 HD21 LEU A 130 25.965 -8.533 2.056 1.00 44.32 H new ATOM 0 HD22 LEU A 130 27.458 -7.613 1.751 1.00 44.32 H new ATOM 0 HD23 LEU A 130 25.980 -7.242 0.830 1.00 44.32 H new ATOM 2057 N ALA A 131 27.515 -7.328 -3.863 1.00 53.20 N ATOM 2058 CA ALA A 131 28.130 -7.078 -5.161 1.00 23.45 C ATOM 2059 C ALA A 131 28.189 -5.585 -5.462 1.00 5.30 C ATOM 2060 O ALA A 131 29.178 -5.090 -6.002 1.00 11.33 O ATOM 2061 CB ALA A 131 27.368 -7.810 -6.256 1.00 24.04 C ATOM 0 H ALA A 131 26.718 -7.964 -3.889 1.00 53.20 H new ATOM 0 HA ALA A 131 29.152 -7.456 -5.130 1.00 23.45 H new ATOM 0 HB1 ALA A 131 27.838 -7.614 -7.220 1.00 24.04 H new ATOM 0 HB2 ALA A 131 27.383 -8.881 -6.056 1.00 24.04 H new ATOM 0 HB3 ALA A 131 26.336 -7.459 -6.278 1.00 24.04 H new