USER MOD reduce.3.24.130724 H: found=0, std=0, add=756, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 759 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: C 23 ASN : amide:sc= 0.833 K(o=0.3,f=-7.3!) USER MOD Set 1.2: C 26 GLN : amide:sc= -0.589 K(o=0.3,f=-4.6!) USER MOD Set 1.3: C 55 GLN : amide:sc= 0.0523 K(o=0.3,f=-0.35) USER MOD Set 2.1: B 23 ASN : amide:sc= 0.0501 K(o=-0.014,f=-0.7) USER MOD Set 2.2: B 55 GLN : amide:sc= -0.0643 X(o=-0.014,f=-0.28) USER MOD Single : A 14 ASN : amide:sc= -1.31 K(o=-1.3,f=-3.2!) USER MOD Single : A 18 HIS : no HD1:sc= -0.123 X(o=-0.12,f=0) USER MOD Single : A 19 SER OG : rot 180:sc= -0.0176 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN :FLIP amide:sc= -5.06! C(o=-5.9!,f=-5.1!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= -0.36 X(o=-0.36,f=-0.68) USER MOD Single : B 26 GLN : amide:sc= 0.234 K(o=0.23,f=-2.8!) USER MOD Single : B 32 HIS : no HD1:sc=-0.00278 X(o=-0.0028,f=0) USER MOD Single : B 33 SER OG : rot 18:sc= 0.652 USER MOD Single : B 35 HIS : no HE2:sc= -6.44! C(o=-6.4!,f=-6.9!) USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 40 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 41 SER OG : rot 180:sc= -0.464 USER MOD Single : B 43 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : B 49 LYS NZ :NH3+ -168:sc= 1.28 (180deg=0.987) USER MOD Single : B 50 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0896) USER MOD Single : B 52 ASN : amide:sc= -1.19 K(o=-1.2,f=-3.2!) USER MOD Single : C 18 TYR OH : rot -130:sc= -0.158 USER MOD Single : C 21 ASN : amide:sc= -0.246 K(o=-0.25,f=-0.82) USER MOD Single : C 32 HIS : no HD1:sc= -0.127 X(o=-0.13,f=-0.036) USER MOD Single : C 33 SER OG : rot 76:sc= 1.27 USER MOD Single : C 35 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 39 SER OG : rot 180:sc= 0 USER MOD Single : C 40 GLN : amide:sc=-0.00624 K(o=-0.0062,f=-0.93) USER MOD Single : C 41 SER OG : rot 180:sc=-0.00658 USER MOD Single : C 43 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 50 LYS NZ :NH3+ -171:sc= 0.0512 (180deg=-0.108) USER MOD Single : C 52 ASN : amide:sc= 0.548 K(o=0.55,f=-8.1!) USER MOD ----------------------------------------------------------------- ATOM 42 N LEU A 12 -11.365 7.231 6.008 1.00 0.00 N ATOM 43 CA LEU A 12 -10.346 7.015 5.008 1.00 0.00 C ATOM 44 C LEU A 12 -9.405 5.929 5.468 1.00 0.00 C ATOM 45 O LEU A 12 -9.468 5.494 6.616 1.00 0.00 O ATOM 46 CB LEU A 12 -9.556 8.304 4.724 1.00 0.00 C ATOM 47 CG LEU A 12 -10.309 9.403 3.966 1.00 0.00 C ATOM 48 CD1 LEU A 12 -11.043 8.815 2.783 1.00 0.00 C ATOM 49 CD2 LEU A 12 -11.277 10.144 4.873 1.00 0.00 C ATOM 0 HA LEU A 12 -10.837 6.710 4.084 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.216 8.714 5.675 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -8.665 8.042 4.153 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.574 10.123 3.607 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -11.573 9.607 2.254 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -10.328 8.344 2.109 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -11.758 8.070 3.132 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.793 10.916 4.302 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -12.007 9.442 5.277 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -10.727 10.606 5.692 1.00 0.00 H new ATOM 61 N ALA A 13 -8.548 5.482 4.573 1.00 0.00 N ATOM 62 CA ALA A 13 -7.587 4.460 4.913 1.00 0.00 C ATOM 63 C ALA A 13 -6.175 4.974 4.748 1.00 0.00 C ATOM 64 O ALA A 13 -5.817 5.549 3.717 1.00 0.00 O ATOM 65 CB ALA A 13 -7.795 3.213 4.080 1.00 0.00 C ATOM 0 H ALA A 13 -8.499 5.811 3.609 1.00 0.00 H new ATOM 0 HA ALA A 13 -7.740 4.198 5.960 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -7.056 2.462 4.359 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -8.796 2.820 4.256 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -7.682 3.458 3.024 1.00 0.00 H new ATOM 71 N ASN A 14 -5.389 4.769 5.776 1.00 0.00 N ATOM 72 CA ASN A 14 -3.999 5.151 5.775 1.00 0.00 C ATOM 73 C ASN A 14 -3.167 3.955 5.356 1.00 0.00 C ATOM 74 O ASN A 14 -3.562 2.810 5.585 1.00 0.00 O ATOM 75 CB ASN A 14 -3.585 5.624 7.171 1.00 0.00 C ATOM 76 CG ASN A 14 -4.286 6.901 7.601 1.00 0.00 C ATOM 77 OD1 ASN A 14 -5.385 7.216 7.142 1.00 0.00 O ATOM 78 ND2 ASN A 14 -3.667 7.637 8.505 1.00 0.00 N ATOM 0 H ASN A 14 -5.698 4.329 6.643 1.00 0.00 H new ATOM 0 HA ASN A 14 -3.839 5.971 5.075 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -3.802 4.837 7.893 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.507 5.785 7.188 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.098 8.497 8.845 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.757 7.346 8.864 1.00 0.00 H new ATOM 85 N PHE A 15 -2.030 4.204 4.742 1.00 0.00 N ATOM 86 CA PHE A 15 -1.190 3.120 4.284 1.00 0.00 C ATOM 87 C PHE A 15 0.036 3.012 5.169 1.00 0.00 C ATOM 88 O PHE A 15 0.950 3.831 5.087 1.00 0.00 O ATOM 89 CB PHE A 15 -0.775 3.339 2.829 1.00 0.00 C ATOM 90 CG PHE A 15 -0.299 2.086 2.148 1.00 0.00 C ATOM 91 CD1 PHE A 15 1.053 1.804 2.049 1.00 0.00 C ATOM 92 CD2 PHE A 15 -1.210 1.193 1.604 1.00 0.00 C ATOM 93 CE1 PHE A 15 1.490 0.654 1.419 1.00 0.00 C ATOM 94 CE2 PHE A 15 -0.778 0.042 0.974 1.00 0.00 C ATOM 95 CZ PHE A 15 0.572 -0.226 0.881 1.00 0.00 C ATOM 0 H PHE A 15 -1.669 5.139 4.550 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.755 2.190 4.342 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -1.621 3.746 2.275 1.00 0.00 H new ATOM 0 HB3 PHE A 15 0.018 4.086 2.794 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.774 2.490 2.469 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.268 1.399 1.674 1.00 0.00 H new ATOM 0 HE1 PHE A 15 2.547 0.444 1.348 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -1.496 -0.647 0.555 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.911 -1.125 0.387 1.00 0.00 H new ATOM 105 N LEU A 16 0.039 2.017 6.033 1.00 0.00 N ATOM 106 CA LEU A 16 1.162 1.791 6.920 1.00 0.00 C ATOM 107 C LEU A 16 1.931 0.583 6.438 1.00 0.00 C ATOM 108 O LEU A 16 1.430 -0.201 5.635 1.00 0.00 O ATOM 109 CB LEU A 16 0.711 1.605 8.382 1.00 0.00 C ATOM 110 CG LEU A 16 0.159 0.224 8.769 1.00 0.00 C ATOM 111 CD1 LEU A 16 -0.380 0.250 10.189 1.00 0.00 C ATOM 112 CD2 LEU A 16 -0.920 -0.231 7.816 1.00 0.00 C ATOM 0 H LEU A 16 -0.726 1.351 6.140 1.00 0.00 H new ATOM 0 HA LEU A 16 1.805 2.671 6.900 1.00 0.00 H new ATOM 0 HB2 LEU A 16 1.560 1.825 9.029 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -0.055 2.349 8.598 1.00 0.00 H new ATOM 0 HG LEU A 16 0.982 -0.488 8.709 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -0.768 -0.735 10.449 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.421 0.518 10.878 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -1.181 0.986 10.261 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -1.286 -1.211 8.122 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -1.743 0.484 7.830 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -0.511 -0.295 6.807 1.00 0.00 H new ATOM 124 N VAL A 17 3.141 0.432 6.906 1.00 0.00 N ATOM 125 CA VAL A 17 3.966 -0.653 6.457 1.00 0.00 C ATOM 126 C VAL A 17 4.931 -1.114 7.535 1.00 0.00 C ATOM 127 O VAL A 17 5.631 -0.309 8.152 1.00 0.00 O ATOM 128 CB VAL A 17 4.737 -0.256 5.181 1.00 0.00 C ATOM 129 CG1 VAL A 17 5.332 1.127 5.301 1.00 0.00 C ATOM 130 CG2 VAL A 17 5.822 -1.262 4.879 1.00 0.00 C ATOM 0 H VAL A 17 3.575 1.045 7.596 1.00 0.00 H new ATOM 0 HA VAL A 17 3.306 -1.489 6.226 1.00 0.00 H new ATOM 0 HB VAL A 17 4.023 -0.247 4.358 1.00 0.00 H new ATOM 0 HG11 VAL A 17 5.868 1.373 4.384 1.00 0.00 H new ATOM 0 HG12 VAL A 17 4.535 1.853 5.462 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.023 1.154 6.143 1.00 0.00 H new ATOM 0 HG21 VAL A 17 6.354 -0.964 3.975 1.00 0.00 H new ATOM 0 HG22 VAL A 17 6.521 -1.305 5.714 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.375 -2.245 4.729 1.00 0.00 H new ATOM 140 N HIS A 18 4.938 -2.416 7.765 1.00 0.00 N ATOM 141 CA HIS A 18 5.926 -3.036 8.622 1.00 0.00 C ATOM 142 C HIS A 18 7.211 -3.161 7.817 1.00 0.00 C ATOM 143 O HIS A 18 7.339 -4.051 6.976 1.00 0.00 O ATOM 144 CB HIS A 18 5.442 -4.407 9.109 1.00 0.00 C ATOM 145 CG HIS A 18 6.310 -5.012 10.171 1.00 0.00 C ATOM 146 ND1 HIS A 18 6.862 -6.268 10.069 1.00 0.00 N ATOM 147 CD2 HIS A 18 6.703 -4.531 11.375 1.00 0.00 C ATOM 148 CE1 HIS A 18 7.555 -6.535 11.157 1.00 0.00 C ATOM 149 NE2 HIS A 18 7.476 -5.497 11.967 1.00 0.00 N ATOM 0 H HIS A 18 4.262 -3.067 7.364 1.00 0.00 H new ATOM 0 HA HIS A 18 6.096 -2.429 9.512 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.427 -4.308 9.495 1.00 0.00 H new ATOM 0 HB3 HIS A 18 5.395 -5.088 8.259 1.00 0.00 H new ATOM 0 HD2 HIS A 18 6.454 -3.566 11.791 1.00 0.00 H new ATOM 0 HE1 HIS A 18 8.096 -7.449 11.353 1.00 0.00 H new ATOM 0 HE2 HIS A 18 7.918 -5.425 12.884 1.00 0.00 H new ATOM 158 N SER A 19 8.141 -2.255 8.093 1.00 0.00 N ATOM 159 CA SER A 19 9.316 -1.997 7.255 1.00 0.00 C ATOM 160 C SER A 19 10.052 -3.250 6.771 1.00 0.00 C ATOM 161 O SER A 19 10.710 -3.201 5.732 1.00 0.00 O ATOM 162 CB SER A 19 10.293 -1.098 8.020 1.00 0.00 C ATOM 163 OG SER A 19 11.410 -0.743 7.220 1.00 0.00 O ATOM 0 H SER A 19 8.103 -1.664 8.923 1.00 0.00 H new ATOM 0 HA SER A 19 8.938 -1.511 6.355 1.00 0.00 H new ATOM 0 HB2 SER A 19 9.778 -0.195 8.348 1.00 0.00 H new ATOM 0 HB3 SER A 19 10.636 -1.613 8.917 1.00 0.00 H new ATOM 0 HG SER A 19 12.013 -0.168 7.737 1.00 0.00 H new ATOM 169 N SER A 20 9.961 -4.355 7.496 1.00 0.00 N ATOM 170 CA SER A 20 10.775 -5.513 7.171 1.00 0.00 C ATOM 171 C SER A 20 10.391 -6.137 5.825 1.00 0.00 C ATOM 172 O SER A 20 11.238 -6.257 4.940 1.00 0.00 O ATOM 173 CB SER A 20 10.651 -6.551 8.286 1.00 0.00 C ATOM 174 OG SER A 20 10.929 -5.967 9.549 1.00 0.00 O ATOM 0 H SER A 20 9.343 -4.473 8.299 1.00 0.00 H new ATOM 0 HA SER A 20 11.809 -5.178 7.084 1.00 0.00 H new ATOM 0 HB2 SER A 20 9.645 -6.971 8.288 1.00 0.00 H new ATOM 0 HB3 SER A 20 11.341 -7.375 8.101 1.00 0.00 H new ATOM 0 HG SER A 20 10.843 -6.647 10.250 1.00 0.00 H new ATOM 180 N ASN A 21 9.129 -6.529 5.652 1.00 0.00 N ATOM 181 CA ASN A 21 8.716 -7.145 4.389 1.00 0.00 C ATOM 182 C ASN A 21 7.355 -6.666 3.878 1.00 0.00 C ATOM 183 O ASN A 21 7.130 -6.615 2.669 1.00 0.00 O ATOM 184 CB ASN A 21 8.707 -8.674 4.504 1.00 0.00 C ATOM 185 CG ASN A 21 10.103 -9.272 4.513 1.00 0.00 C ATOM 186 OD1 ASN A 21 10.671 -9.571 3.460 1.00 0.00 O ATOM 187 ND2 ASN A 21 10.659 -9.469 5.698 1.00 0.00 N ATOM 0 H ASN A 21 8.391 -6.435 6.350 1.00 0.00 H new ATOM 0 HA ASN A 21 9.459 -6.826 3.658 1.00 0.00 H new ATOM 0 HB2 ASN A 21 8.188 -8.962 5.418 1.00 0.00 H new ATOM 0 HB3 ASN A 21 8.143 -9.093 3.671 1.00 0.00 H new ATOM 0 HD21 ASN A 21 11.590 -9.882 5.762 1.00 0.00 H new ATOM 0 HD22 ASN A 21 10.157 -9.208 6.547 1.00 0.00 H new ATOM 194 N ASN A 22 6.444 -6.323 4.780 1.00 0.00 N ATOM 195 CA ASN A 22 5.035 -6.229 4.398 1.00 0.00 C ATOM 196 C ASN A 22 4.430 -4.844 4.609 1.00 0.00 C ATOM 197 O ASN A 22 4.546 -4.250 5.680 1.00 0.00 O ATOM 198 CB ASN A 22 4.221 -7.271 5.172 1.00 0.00 C ATOM 199 CG ASN A 22 2.749 -7.271 4.799 1.00 0.00 C ATOM 200 OD1 ASN A 22 2.448 -7.028 3.531 1.00 0.00 O flip ATOM 201 ND2 ASN A 22 1.888 -7.528 5.639 1.00 0.00 N flip ATOM 0 H ASN A 22 6.644 -6.110 5.757 1.00 0.00 H new ATOM 0 HA ASN A 22 4.993 -6.422 3.326 1.00 0.00 H new ATOM 0 HB2 ASN A 22 4.637 -8.261 4.985 1.00 0.00 H new ATOM 0 HB3 ASN A 22 4.319 -7.080 6.241 1.00 0.00 H new ATOM 0 HD21 ASN A 22 2.157 -7.710 6.606 1.00 0.00 H new ATOM 0 HD22 ASN A 22 0.905 -7.559 5.369 1.00 0.00 H new ATOM 208 N PHE A 23 3.767 -4.353 3.564 1.00 0.00 N ATOM 209 CA PHE A 23 2.981 -3.134 3.624 1.00 0.00 C ATOM 210 C PHE A 23 1.516 -3.476 3.890 1.00 0.00 C ATOM 211 O PHE A 23 1.022 -4.501 3.421 1.00 0.00 O ATOM 212 CB PHE A 23 3.120 -2.360 2.306 1.00 0.00 C ATOM 213 CG PHE A 23 3.299 -3.232 1.084 1.00 0.00 C ATOM 214 CD1 PHE A 23 4.572 -3.601 0.673 1.00 0.00 C ATOM 215 CD2 PHE A 23 2.207 -3.682 0.345 1.00 0.00 C ATOM 216 CE1 PHE A 23 4.755 -4.400 -0.437 1.00 0.00 C ATOM 217 CE2 PHE A 23 2.390 -4.481 -0.766 1.00 0.00 C ATOM 218 CZ PHE A 23 3.663 -4.841 -1.158 1.00 0.00 C ATOM 0 H PHE A 23 3.764 -4.798 2.646 1.00 0.00 H new ATOM 0 HA PHE A 23 3.347 -2.507 4.437 1.00 0.00 H new ATOM 0 HB2 PHE A 23 2.234 -1.740 2.168 1.00 0.00 H new ATOM 0 HB3 PHE A 23 3.972 -1.685 2.384 1.00 0.00 H new ATOM 0 HD1 PHE A 23 5.432 -3.258 1.230 1.00 0.00 H new ATOM 0 HD2 PHE A 23 1.207 -3.403 0.644 1.00 0.00 H new ATOM 0 HE1 PHE A 23 5.752 -4.680 -0.742 1.00 0.00 H new ATOM 0 HE2 PHE A 23 1.535 -4.825 -1.329 1.00 0.00 H new ATOM 0 HZ PHE A 23 3.805 -5.466 -2.027 1.00 0.00 H new ATOM 228 N GLY A 24 0.821 -2.633 4.643 1.00 0.00 N ATOM 229 CA GLY A 24 -0.550 -2.940 4.991 1.00 0.00 C ATOM 230 C GLY A 24 -1.477 -1.757 4.833 1.00 0.00 C ATOM 231 O GLY A 24 -1.149 -0.783 4.159 1.00 0.00 O ATOM 0 H GLY A 24 1.178 -1.753 5.015 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -0.904 -3.758 4.364 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -0.588 -3.289 6.023 1.00 0.00 H new ATOM 235 N ALA A 25 -2.631 -1.836 5.474 1.00 0.00 N ATOM 236 CA ALA A 25 -3.633 -0.794 5.394 1.00 0.00 C ATOM 237 C ALA A 25 -4.287 -0.608 6.746 1.00 0.00 C ATOM 238 O ALA A 25 -4.139 -1.443 7.628 1.00 0.00 O ATOM 239 CB ALA A 25 -4.661 -1.128 4.318 1.00 0.00 C ATOM 0 H ALA A 25 -2.897 -2.625 6.063 1.00 0.00 H new ATOM 0 HA ALA A 25 -3.156 0.145 5.114 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.408 -0.335 4.270 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -4.162 -1.216 3.353 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.149 -2.072 4.561 1.00 0.00 H new ATOM 245 N ILE A 26 -4.956 0.513 6.926 1.00 0.00 N ATOM 246 CA ILE A 26 -5.638 0.801 8.174 1.00 0.00 C ATOM 247 C ILE A 26 -6.679 1.887 7.967 1.00 0.00 C ATOM 248 O ILE A 26 -6.438 2.855 7.257 1.00 0.00 O ATOM 249 CB ILE A 26 -4.643 1.221 9.273 1.00 0.00 C ATOM 250 CG1 ILE A 26 -5.393 1.605 10.550 1.00 0.00 C ATOM 251 CG2 ILE A 26 -3.768 2.372 8.801 1.00 0.00 C ATOM 252 CD1 ILE A 26 -4.494 1.717 11.746 1.00 0.00 C ATOM 0 H ILE A 26 -5.043 1.244 6.220 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.136 -0.112 8.501 1.00 0.00 H new ATOM 0 HB ILE A 26 -3.995 0.372 9.491 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -5.901 2.556 10.394 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -6.164 0.861 10.750 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -3.074 2.650 9.594 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -3.206 2.064 7.919 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.396 3.227 8.551 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.084 1.992 12.620 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.005 0.759 11.925 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -3.739 2.481 11.563 1.00 0.00 H new ATOM 264 N LEU A 27 -7.836 1.719 8.573 1.00 0.00 N ATOM 265 CA LEU A 27 -8.884 2.712 8.479 1.00 0.00 C ATOM 266 C LEU A 27 -8.743 3.767 9.552 1.00 0.00 C ATOM 267 O LEU A 27 -8.177 3.531 10.620 1.00 0.00 O ATOM 268 CB LEU A 27 -10.259 2.079 8.576 1.00 0.00 C ATOM 269 CG LEU A 27 -10.773 1.427 7.302 1.00 0.00 C ATOM 270 CD1 LEU A 27 -12.162 0.907 7.542 1.00 0.00 C ATOM 271 CD2 LEU A 27 -10.788 2.414 6.146 1.00 0.00 C ATOM 0 H LEU A 27 -8.074 0.903 9.136 1.00 0.00 H new ATOM 0 HA LEU A 27 -8.781 3.184 7.502 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.238 1.327 9.365 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.971 2.845 8.884 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.105 0.607 7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -12.537 0.438 6.632 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -12.141 0.173 8.347 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -12.817 1.733 7.821 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -11.160 1.918 5.249 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -11.438 3.254 6.393 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -9.777 2.779 5.966 1.00 0.00 H new ATOM 283 N SER A 28 -9.257 4.933 9.245 1.00 0.00 N ATOM 284 CA SER A 28 -9.151 6.074 10.127 1.00 0.00 C ATOM 285 C SER A 28 -10.484 6.799 10.176 1.00 0.00 C ATOM 286 O SER A 28 -11.212 6.862 9.183 1.00 0.00 O ATOM 287 CB SER A 28 -8.048 7.016 9.646 1.00 0.00 C ATOM 288 OG SER A 28 -7.712 7.969 10.640 1.00 0.00 O ATOM 0 H SER A 28 -9.761 5.120 8.378 1.00 0.00 H new ATOM 0 HA SER A 28 -8.893 5.732 11.129 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.163 6.437 9.381 1.00 0.00 H new ATOM 0 HB3 SER A 28 -8.375 7.530 8.742 1.00 0.00 H new ATOM 0 HG SER A 28 -7.003 8.556 10.304 1.00 0.00 H new ATOM 334 N GLU B 15 10.091 -1.197 11.673 1.00 0.00 N ATOM 335 CA GLU B 15 9.130 -0.250 12.208 1.00 0.00 C ATOM 336 C GLU B 15 7.902 -0.188 11.312 1.00 0.00 C ATOM 337 O GLU B 15 7.987 -0.459 10.115 1.00 0.00 O ATOM 338 CB GLU B 15 9.770 1.132 12.321 1.00 0.00 C ATOM 339 CG GLU B 15 10.191 1.716 10.984 1.00 0.00 C ATOM 340 CD GLU B 15 11.060 2.946 11.132 1.00 0.00 C ATOM 341 OE1 GLU B 15 12.107 2.857 11.805 1.00 0.00 O ATOM 342 OE2 GLU B 15 10.718 4.001 10.564 1.00 0.00 O ATOM 0 HA GLU B 15 8.822 -0.579 13.200 1.00 0.00 H new ATOM 0 HB2 GLU B 15 9.065 1.812 12.800 1.00 0.00 H new ATOM 0 HB3 GLU B 15 10.642 1.068 12.971 1.00 0.00 H new ATOM 0 HG2 GLU B 15 10.733 0.960 10.416 1.00 0.00 H new ATOM 0 HG3 GLU B 15 9.302 1.971 10.408 1.00 0.00 H new ATOM 349 N ILE B 16 6.762 0.129 11.892 1.00 0.00 N ATOM 350 CA ILE B 16 5.548 0.301 11.120 1.00 0.00 C ATOM 351 C ILE B 16 5.312 1.775 10.850 1.00 0.00 C ATOM 352 O ILE B 16 4.934 2.529 11.748 1.00 0.00 O ATOM 353 CB ILE B 16 4.328 -0.295 11.845 1.00 0.00 C ATOM 354 CG1 ILE B 16 4.565 -1.779 12.112 1.00 0.00 C ATOM 355 CG2 ILE B 16 3.062 -0.088 11.021 1.00 0.00 C ATOM 356 CD1 ILE B 16 3.489 -2.423 12.949 1.00 0.00 C ATOM 0 H ILE B 16 6.651 0.273 12.896 1.00 0.00 H new ATOM 0 HA ILE B 16 5.674 -0.231 10.177 1.00 0.00 H new ATOM 0 HB ILE B 16 4.194 0.217 12.798 1.00 0.00 H new ATOM 0 HG12 ILE B 16 4.635 -2.304 11.159 1.00 0.00 H new ATOM 0 HG13 ILE B 16 5.525 -1.900 12.614 1.00 0.00 H new ATOM 0 HG21 ILE B 16 2.210 -0.516 11.549 1.00 0.00 H new ATOM 0 HG22 ILE B 16 2.897 0.979 10.870 1.00 0.00 H new ATOM 0 HG23 ILE B 16 3.173 -0.579 10.054 1.00 0.00 H new ATOM 0 HD11 ILE B 16 3.725 -3.477 13.097 1.00 0.00 H new ATOM 0 HD12 ILE B 16 3.433 -1.924 13.917 1.00 0.00 H new ATOM 0 HD13 ILE B 16 2.530 -2.334 12.439 1.00 0.00 H new ATOM 368 N VAL B 17 5.561 2.186 9.620 1.00 0.00 N ATOM 369 CA VAL B 17 5.391 3.577 9.249 1.00 0.00 C ATOM 370 C VAL B 17 4.071 3.814 8.536 1.00 0.00 C ATOM 371 O VAL B 17 3.746 3.149 7.559 1.00 0.00 O ATOM 372 CB VAL B 17 6.556 4.115 8.389 1.00 0.00 C ATOM 373 CG1 VAL B 17 7.707 4.543 9.284 1.00 0.00 C ATOM 374 CG2 VAL B 17 7.038 3.092 7.377 1.00 0.00 C ATOM 0 H VAL B 17 5.880 1.579 8.865 1.00 0.00 H new ATOM 0 HA VAL B 17 5.388 4.132 10.187 1.00 0.00 H new ATOM 0 HB VAL B 17 6.183 4.975 7.833 1.00 0.00 H new ATOM 0 HG11 VAL B 17 8.524 4.921 8.670 1.00 0.00 H new ATOM 0 HG12 VAL B 17 7.369 5.327 9.961 1.00 0.00 H new ATOM 0 HG13 VAL B 17 8.054 3.688 9.864 1.00 0.00 H new ATOM 0 HG21 VAL B 17 7.857 3.514 6.795 1.00 0.00 H new ATOM 0 HG22 VAL B 17 7.385 2.200 7.898 1.00 0.00 H new ATOM 0 HG23 VAL B 17 6.218 2.826 6.710 1.00 0.00 H new ATOM 384 N TYR B 18 3.305 4.742 9.079 1.00 0.00 N ATOM 385 CA TYR B 18 2.050 5.178 8.484 1.00 0.00 C ATOM 386 C TYR B 18 2.303 6.305 7.487 1.00 0.00 C ATOM 387 O TYR B 18 2.778 7.377 7.868 1.00 0.00 O ATOM 388 CB TYR B 18 1.089 5.697 9.562 1.00 0.00 C ATOM 389 CG TYR B 18 0.647 4.675 10.589 1.00 0.00 C ATOM 390 CD1 TYR B 18 -0.609 4.089 10.512 1.00 0.00 C ATOM 391 CD2 TYR B 18 1.468 4.325 11.655 1.00 0.00 C ATOM 392 CE1 TYR B 18 -1.034 3.186 11.461 1.00 0.00 C ATOM 393 CE2 TYR B 18 1.052 3.413 12.607 1.00 0.00 C ATOM 394 CZ TYR B 18 -0.202 2.848 12.506 1.00 0.00 C ATOM 395 OH TYR B 18 -0.627 1.942 13.453 1.00 0.00 O ATOM 0 H TYR B 18 3.535 5.219 9.951 1.00 0.00 H new ATOM 0 HA TYR B 18 1.607 4.320 7.979 1.00 0.00 H new ATOM 0 HB2 TYR B 18 1.569 6.526 10.083 1.00 0.00 H new ATOM 0 HB3 TYR B 18 0.203 6.099 9.071 1.00 0.00 H new ATOM 0 HD1 TYR B 18 -1.265 4.346 9.693 1.00 0.00 H new ATOM 0 HD2 TYR B 18 2.447 4.773 11.741 1.00 0.00 H new ATOM 0 HE1 TYR B 18 -2.017 2.744 11.386 1.00 0.00 H new ATOM 0 HE2 TYR B 18 1.705 3.145 13.425 1.00 0.00 H new ATOM 0 HH TYR B 18 0.078 1.812 14.121 1.00 0.00 H new ATOM 405 N LEU B 19 2.014 6.062 6.218 1.00 0.00 N ATOM 406 CA LEU B 19 2.109 7.100 5.206 1.00 0.00 C ATOM 407 C LEU B 19 0.710 7.525 4.747 1.00 0.00 C ATOM 408 O LEU B 19 0.169 6.967 3.794 1.00 0.00 O ATOM 409 CB LEU B 19 2.909 6.605 3.994 1.00 0.00 C ATOM 410 CG LEU B 19 4.310 6.094 4.244 1.00 0.00 C ATOM 411 CD1 LEU B 19 5.041 7.068 5.104 1.00 0.00 C ATOM 412 CD2 LEU B 19 4.309 4.695 4.841 1.00 0.00 C ATOM 0 H LEU B 19 1.712 5.154 5.865 1.00 0.00 H new ATOM 0 HA LEU B 19 2.623 7.954 5.648 1.00 0.00 H new ATOM 0 HB2 LEU B 19 2.340 5.806 3.518 1.00 0.00 H new ATOM 0 HB3 LEU B 19 2.972 7.423 3.276 1.00 0.00 H new ATOM 0 HG LEU B 19 4.829 6.009 3.289 1.00 0.00 H new ATOM 0 HD11 LEU B 19 6.052 6.704 5.287 1.00 0.00 H new ATOM 0 HD12 LEU B 19 5.089 8.034 4.601 1.00 0.00 H new ATOM 0 HD13 LEU B 19 4.518 7.179 6.054 1.00 0.00 H new ATOM 0 HD21 LEU B 19 5.336 4.368 5.004 1.00 0.00 H new ATOM 0 HD22 LEU B 19 3.776 4.706 5.792 1.00 0.00 H new ATOM 0 HD23 LEU B 19 3.814 4.007 4.156 1.00 0.00 H new ATOM 424 N PRO B 20 0.102 8.518 5.413 1.00 0.00 N ATOM 425 CA PRO B 20 -1.253 8.966 5.090 1.00 0.00 C ATOM 426 C PRO B 20 -1.296 10.067 4.028 1.00 0.00 C ATOM 427 O PRO B 20 -2.330 10.298 3.399 1.00 0.00 O ATOM 428 CB PRO B 20 -1.734 9.512 6.430 1.00 0.00 C ATOM 429 CG PRO B 20 -0.508 10.072 7.071 1.00 0.00 C ATOM 430 CD PRO B 20 0.663 9.263 6.559 1.00 0.00 C ATOM 0 HA PRO B 20 -1.859 8.164 4.668 1.00 0.00 H new ATOM 0 HB2 PRO B 20 -2.496 10.279 6.295 1.00 0.00 H new ATOM 0 HB3 PRO B 20 -2.178 8.727 7.042 1.00 0.00 H new ATOM 0 HG2 PRO B 20 -0.388 11.126 6.821 1.00 0.00 H new ATOM 0 HG3 PRO B 20 -0.576 10.008 8.157 1.00 0.00 H new ATOM 0 HD2 PRO B 20 1.489 9.905 6.253 1.00 0.00 H new ATOM 0 HD3 PRO B 20 1.049 8.589 7.324 1.00 0.00 H new ATOM 438 N ASN B 21 -0.173 10.738 3.821 1.00 0.00 N ATOM 439 CA ASN B 21 -0.141 11.905 2.947 1.00 0.00 C ATOM 440 C ASN B 21 0.496 11.584 1.606 1.00 0.00 C ATOM 441 O ASN B 21 0.788 12.483 0.822 1.00 0.00 O ATOM 442 CB ASN B 21 0.613 13.055 3.612 1.00 0.00 C ATOM 443 CG ASN B 21 -0.037 13.512 4.900 1.00 0.00 C ATOM 444 OD1 ASN B 21 -1.256 13.475 5.041 1.00 0.00 O ATOM 445 ND2 ASN B 21 0.776 13.941 5.851 1.00 0.00 N ATOM 0 H ASN B 21 0.724 10.498 4.243 1.00 0.00 H new ATOM 0 HA ASN B 21 -1.174 12.205 2.771 1.00 0.00 H new ATOM 0 HB2 ASN B 21 1.637 12.742 3.818 1.00 0.00 H new ATOM 0 HB3 ASN B 21 0.669 13.895 2.920 1.00 0.00 H new ATOM 0 HD21 ASN B 21 0.395 14.257 6.743 1.00 0.00 H new ATOM 0 HD22 ASN B 21 1.784 13.955 5.693 1.00 0.00 H new ATOM 452 N LEU B 22 0.716 10.307 1.339 1.00 0.00 N ATOM 453 CA LEU B 22 1.254 9.902 0.050 1.00 0.00 C ATOM 454 C LEU B 22 0.195 10.037 -1.018 1.00 0.00 C ATOM 455 O LEU B 22 -1.004 9.989 -0.733 1.00 0.00 O ATOM 456 CB LEU B 22 1.740 8.456 0.068 1.00 0.00 C ATOM 457 CG LEU B 22 2.977 8.181 0.909 1.00 0.00 C ATOM 458 CD1 LEU B 22 3.376 6.725 0.784 1.00 0.00 C ATOM 459 CD2 LEU B 22 4.131 9.064 0.502 1.00 0.00 C ATOM 0 H LEU B 22 0.533 9.542 1.988 1.00 0.00 H new ATOM 0 HA LEU B 22 2.101 10.554 -0.165 1.00 0.00 H new ATOM 0 HB2 LEU B 22 0.929 7.825 0.432 1.00 0.00 H new ATOM 0 HB3 LEU B 22 1.946 8.150 -0.958 1.00 0.00 H new ATOM 0 HG LEU B 22 2.731 8.405 1.947 1.00 0.00 H new ATOM 0 HD11 LEU B 22 4.263 6.537 1.390 1.00 0.00 H new ATOM 0 HD12 LEU B 22 2.559 6.093 1.131 1.00 0.00 H new ATOM 0 HD13 LEU B 22 3.594 6.496 -0.259 1.00 0.00 H new ATOM 0 HD21 LEU B 22 4.998 8.840 1.124 1.00 0.00 H new ATOM 0 HD22 LEU B 22 4.378 8.881 -0.544 1.00 0.00 H new ATOM 0 HD23 LEU B 22 3.852 10.110 0.631 1.00 0.00 H new ATOM 471 N ASN B 23 0.642 10.207 -2.242 1.00 0.00 N ATOM 472 CA ASN B 23 -0.269 10.241 -3.370 1.00 0.00 C ATOM 473 C ASN B 23 -0.624 8.816 -3.755 1.00 0.00 C ATOM 474 O ASN B 23 0.249 7.948 -3.710 1.00 0.00 O ATOM 475 CB ASN B 23 0.351 10.960 -4.572 1.00 0.00 C ATOM 476 CG ASN B 23 0.765 12.390 -4.275 1.00 0.00 C ATOM 477 OD1 ASN B 23 0.183 13.064 -3.425 1.00 0.00 O ATOM 478 ND2 ASN B 23 1.778 12.865 -4.983 1.00 0.00 N ATOM 0 H ASN B 23 1.626 10.324 -2.484 1.00 0.00 H new ATOM 0 HA ASN B 23 -1.163 10.792 -3.078 1.00 0.00 H new ATOM 0 HB2 ASN B 23 1.223 10.400 -4.910 1.00 0.00 H new ATOM 0 HB3 ASN B 23 -0.365 10.961 -5.394 1.00 0.00 H new ATOM 0 HD21 ASN B 23 2.101 13.821 -4.833 1.00 0.00 H new ATOM 0 HD22 ASN B 23 2.235 12.275 -5.679 1.00 0.00 H new ATOM 485 N PRO B 24 -1.890 8.534 -4.097 1.00 0.00 N ATOM 486 CA PRO B 24 -2.322 7.186 -4.489 1.00 0.00 C ATOM 487 C PRO B 24 -1.352 6.530 -5.472 1.00 0.00 C ATOM 488 O PRO B 24 -0.937 5.381 -5.282 1.00 0.00 O ATOM 489 CB PRO B 24 -3.677 7.440 -5.144 1.00 0.00 C ATOM 490 CG PRO B 24 -4.206 8.640 -4.437 1.00 0.00 C ATOM 491 CD PRO B 24 -3.009 9.497 -4.117 1.00 0.00 C ATOM 0 HA PRO B 24 -2.365 6.499 -3.644 1.00 0.00 H new ATOM 0 HB2 PRO B 24 -3.574 7.621 -6.214 1.00 0.00 H new ATOM 0 HB3 PRO B 24 -4.342 6.584 -5.028 1.00 0.00 H new ATOM 0 HG2 PRO B 24 -4.916 9.180 -5.063 1.00 0.00 H new ATOM 0 HG3 PRO B 24 -4.736 8.355 -3.528 1.00 0.00 H new ATOM 0 HD2 PRO B 24 -2.858 10.272 -4.868 1.00 0.00 H new ATOM 0 HD3 PRO B 24 -3.122 10.001 -3.157 1.00 0.00 H new ATOM 499 N ASP B 25 -0.964 7.289 -6.494 1.00 0.00 N ATOM 500 CA ASP B 25 -0.006 6.824 -7.492 1.00 0.00 C ATOM 501 C ASP B 25 1.313 6.413 -6.849 1.00 0.00 C ATOM 502 O ASP B 25 1.886 5.381 -7.193 1.00 0.00 O ATOM 503 CB ASP B 25 0.259 7.915 -8.534 1.00 0.00 C ATOM 504 CG ASP B 25 1.422 7.575 -9.446 1.00 0.00 C ATOM 505 OD1 ASP B 25 1.225 6.808 -10.413 1.00 0.00 O ATOM 506 OD2 ASP B 25 2.544 8.067 -9.196 1.00 0.00 O ATOM 0 H ASP B 25 -1.303 8.238 -6.653 1.00 0.00 H new ATOM 0 HA ASP B 25 -0.444 5.953 -7.979 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -0.638 8.065 -9.135 1.00 0.00 H new ATOM 0 HB3 ASP B 25 0.463 8.857 -8.025 1.00 0.00 H new ATOM 511 N GLN B 26 1.782 7.216 -5.903 1.00 0.00 N ATOM 512 CA GLN B 26 3.077 6.990 -5.280 1.00 0.00 C ATOM 513 C GLN B 26 3.097 5.722 -4.439 1.00 0.00 C ATOM 514 O GLN B 26 4.142 5.097 -4.300 1.00 0.00 O ATOM 515 CB GLN B 26 3.475 8.199 -4.448 1.00 0.00 C ATOM 516 CG GLN B 26 3.716 9.431 -5.298 1.00 0.00 C ATOM 517 CD GLN B 26 4.907 9.278 -6.223 1.00 0.00 C ATOM 518 OE1 GLN B 26 6.038 9.581 -5.852 1.00 0.00 O ATOM 519 NE2 GLN B 26 4.660 8.818 -7.438 1.00 0.00 N ATOM 0 H GLN B 26 1.282 8.032 -5.550 1.00 0.00 H new ATOM 0 HA GLN B 26 3.807 6.851 -6.077 1.00 0.00 H new ATOM 0 HB2 GLN B 26 2.691 8.410 -3.721 1.00 0.00 H new ATOM 0 HB3 GLN B 26 4.379 7.967 -3.884 1.00 0.00 H new ATOM 0 HG2 GLN B 26 2.825 9.639 -5.890 1.00 0.00 H new ATOM 0 HG3 GLN B 26 3.874 10.291 -4.648 1.00 0.00 H new ATOM 0 HE21 GLN B 26 3.706 8.577 -7.708 1.00 0.00 H new ATOM 0 HE22 GLN B 26 5.423 8.704 -8.105 1.00 0.00 H new ATOM 528 N LEU B 27 1.958 5.331 -3.882 1.00 0.00 N ATOM 529 CA LEU B 27 1.878 4.048 -3.195 1.00 0.00 C ATOM 530 C LEU B 27 2.178 2.934 -4.175 1.00 0.00 C ATOM 531 O LEU B 27 3.054 2.105 -3.937 1.00 0.00 O ATOM 532 CB LEU B 27 0.499 3.829 -2.572 1.00 0.00 C ATOM 533 CG LEU B 27 0.127 4.787 -1.451 1.00 0.00 C ATOM 534 CD1 LEU B 27 -1.328 4.611 -1.069 1.00 0.00 C ATOM 535 CD2 LEU B 27 1.014 4.541 -0.254 1.00 0.00 C ATOM 0 H LEU B 27 1.093 5.871 -3.891 1.00 0.00 H new ATOM 0 HA LEU B 27 2.613 4.047 -2.390 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -0.252 3.908 -3.358 1.00 0.00 H new ATOM 0 HB3 LEU B 27 0.451 2.810 -2.187 1.00 0.00 H new ATOM 0 HG LEU B 27 0.272 5.810 -1.797 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -1.580 5.303 -0.266 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -1.959 4.815 -1.934 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -1.494 3.588 -0.732 1.00 0.00 H new ATOM 0 HD21 LEU B 27 0.744 5.230 0.547 1.00 0.00 H new ATOM 0 HD22 LEU B 27 0.884 3.515 0.090 1.00 0.00 H new ATOM 0 HD23 LEU B 27 2.055 4.701 -0.534 1.00 0.00 H new ATOM 547 N CYS B 28 1.467 2.943 -5.293 1.00 0.00 N ATOM 548 CA CYS B 28 1.703 1.978 -6.351 1.00 0.00 C ATOM 549 C CYS B 28 3.143 2.089 -6.838 1.00 0.00 C ATOM 550 O CYS B 28 3.785 1.087 -7.136 1.00 0.00 O ATOM 551 CB CYS B 28 0.732 2.212 -7.510 1.00 0.00 C ATOM 552 SG CYS B 28 0.765 0.913 -8.788 1.00 0.00 S ATOM 0 H CYS B 28 0.721 3.610 -5.489 1.00 0.00 H new ATOM 0 HA CYS B 28 1.537 0.975 -5.959 1.00 0.00 H new ATOM 0 HB2 CYS B 28 -0.280 2.288 -7.112 1.00 0.00 H new ATOM 0 HB3 CYS B 28 0.964 3.170 -7.976 1.00 0.00 H new ATOM 557 N ALA B 29 3.652 3.319 -6.875 1.00 0.00 N ATOM 558 CA ALA B 29 5.021 3.583 -7.294 1.00 0.00 C ATOM 559 C ALA B 29 6.024 2.894 -6.373 1.00 0.00 C ATOM 560 O ALA B 29 6.939 2.215 -6.843 1.00 0.00 O ATOM 561 CB ALA B 29 5.282 5.083 -7.344 1.00 0.00 C ATOM 0 H ALA B 29 3.128 4.155 -6.616 1.00 0.00 H new ATOM 0 HA ALA B 29 5.151 3.173 -8.295 1.00 0.00 H new ATOM 0 HB1 ALA B 29 6.310 5.263 -7.659 1.00 0.00 H new ATOM 0 HB2 ALA B 29 4.598 5.548 -8.054 1.00 0.00 H new ATOM 0 HB3 ALA B 29 5.125 5.513 -6.355 1.00 0.00 H new ATOM 567 N PHE B 30 5.842 3.045 -5.061 1.00 0.00 N ATOM 568 CA PHE B 30 6.754 2.434 -4.100 1.00 0.00 C ATOM 569 C PHE B 30 6.626 0.923 -4.120 1.00 0.00 C ATOM 570 O PHE B 30 7.624 0.213 -4.187 1.00 0.00 O ATOM 571 CB PHE B 30 6.505 2.959 -2.687 1.00 0.00 C ATOM 572 CG PHE B 30 6.882 4.398 -2.516 1.00 0.00 C ATOM 573 CD1 PHE B 30 6.003 5.295 -1.938 1.00 0.00 C ATOM 574 CD2 PHE B 30 8.118 4.855 -2.943 1.00 0.00 C ATOM 575 CE1 PHE B 30 6.348 6.622 -1.788 1.00 0.00 C ATOM 576 CE2 PHE B 30 8.469 6.179 -2.795 1.00 0.00 C ATOM 577 CZ PHE B 30 7.583 7.064 -2.217 1.00 0.00 C ATOM 0 H PHE B 30 5.079 3.579 -4.645 1.00 0.00 H new ATOM 0 HA PHE B 30 7.768 2.706 -4.394 1.00 0.00 H new ATOM 0 HB2 PHE B 30 5.450 2.835 -2.441 1.00 0.00 H new ATOM 0 HB3 PHE B 30 7.071 2.355 -1.977 1.00 0.00 H new ATOM 0 HD1 PHE B 30 5.036 4.953 -1.600 1.00 0.00 H new ATOM 0 HD2 PHE B 30 8.814 4.166 -3.397 1.00 0.00 H new ATOM 0 HE1 PHE B 30 5.653 7.314 -1.336 1.00 0.00 H new ATOM 0 HE2 PHE B 30 9.436 6.523 -3.131 1.00 0.00 H new ATOM 0 HZ PHE B 30 7.856 8.102 -2.100 1.00 0.00 H new ATOM 587 N ILE B 31 5.394 0.440 -4.085 1.00 0.00 N ATOM 588 CA ILE B 31 5.124 -0.992 -4.115 1.00 0.00 C ATOM 589 C ILE B 31 5.653 -1.611 -5.411 1.00 0.00 C ATOM 590 O ILE B 31 6.038 -2.784 -5.461 1.00 0.00 O ATOM 591 CB ILE B 31 3.612 -1.255 -3.959 1.00 0.00 C ATOM 592 CG1 ILE B 31 3.129 -0.651 -2.637 1.00 0.00 C ATOM 593 CG2 ILE B 31 3.312 -2.748 -4.001 1.00 0.00 C ATOM 594 CD1 ILE B 31 1.631 -0.482 -2.550 1.00 0.00 C ATOM 0 H ILE B 31 4.558 1.023 -4.035 1.00 0.00 H new ATOM 0 HA ILE B 31 5.642 -1.462 -3.279 1.00 0.00 H new ATOM 0 HB ILE B 31 3.083 -0.786 -4.789 1.00 0.00 H new ATOM 0 HG12 ILE B 31 3.461 -1.287 -1.816 1.00 0.00 H new ATOM 0 HG13 ILE B 31 3.603 0.321 -2.499 1.00 0.00 H new ATOM 0 HG21 ILE B 31 2.239 -2.907 -3.889 1.00 0.00 H new ATOM 0 HG22 ILE B 31 3.642 -3.159 -4.955 1.00 0.00 H new ATOM 0 HG23 ILE B 31 3.840 -3.248 -3.189 1.00 0.00 H new ATOM 0 HD11 ILE B 31 1.369 -0.049 -1.585 1.00 0.00 H new ATOM 0 HD12 ILE B 31 1.292 0.179 -3.348 1.00 0.00 H new ATOM 0 HD13 ILE B 31 1.149 -1.454 -2.655 1.00 0.00 H new ATOM 606 N HIS B 32 5.694 -0.795 -6.449 1.00 0.00 N ATOM 607 CA HIS B 32 6.261 -1.183 -7.730 1.00 0.00 C ATOM 608 C HIS B 32 7.770 -1.339 -7.611 1.00 0.00 C ATOM 609 O HIS B 32 8.343 -2.319 -8.085 1.00 0.00 O ATOM 610 CB HIS B 32 5.912 -0.139 -8.799 1.00 0.00 C ATOM 611 CG HIS B 32 6.305 -0.507 -10.200 1.00 0.00 C ATOM 612 ND1 HIS B 32 5.414 -1.019 -11.117 1.00 0.00 N ATOM 613 CD2 HIS B 32 7.490 -0.403 -10.849 1.00 0.00 C ATOM 614 CE1 HIS B 32 6.032 -1.215 -12.266 1.00 0.00 C ATOM 615 NE2 HIS B 32 7.291 -0.848 -12.130 1.00 0.00 N ATOM 0 H HIS B 32 5.334 0.159 -6.428 1.00 0.00 H new ATOM 0 HA HIS B 32 5.836 -2.142 -8.028 1.00 0.00 H new ATOM 0 HB2 HIS B 32 4.837 0.038 -8.774 1.00 0.00 H new ATOM 0 HB3 HIS B 32 6.396 0.802 -8.538 1.00 0.00 H new ATOM 0 HD2 HIS B 32 8.418 -0.038 -10.434 1.00 0.00 H new ATOM 0 HE1 HIS B 32 5.583 -1.609 -13.166 1.00 0.00 H new ATOM 0 HE2 HIS B 32 8.002 -0.889 -12.860 1.00 0.00 H new ATOM 624 N SER B 33 8.407 -0.382 -6.960 1.00 0.00 N ATOM 625 CA SER B 33 9.847 -0.416 -6.797 1.00 0.00 C ATOM 626 C SER B 33 10.268 -1.405 -5.710 1.00 0.00 C ATOM 627 O SER B 33 11.418 -1.806 -5.659 1.00 0.00 O ATOM 628 CB SER B 33 10.378 0.990 -6.503 1.00 0.00 C ATOM 629 OG SER B 33 9.588 1.646 -5.523 1.00 0.00 O ATOM 0 H SER B 33 7.950 0.426 -6.537 1.00 0.00 H new ATOM 0 HA SER B 33 10.286 -0.764 -7.732 1.00 0.00 H new ATOM 0 HB2 SER B 33 11.410 0.926 -6.158 1.00 0.00 H new ATOM 0 HB3 SER B 33 10.384 1.578 -7.421 1.00 0.00 H new ATOM 0 HG SER B 33 9.056 0.983 -5.034 1.00 0.00 H new ATOM 635 N ILE B 34 9.345 -1.804 -4.838 1.00 0.00 N ATOM 636 CA ILE B 34 9.660 -2.823 -3.841 1.00 0.00 C ATOM 637 C ILE B 34 9.875 -4.166 -4.500 1.00 0.00 C ATOM 638 O ILE B 34 10.938 -4.757 -4.388 1.00 0.00 O ATOM 639 CB ILE B 34 8.554 -3.007 -2.785 1.00 0.00 C ATOM 640 CG1 ILE B 34 8.337 -1.717 -1.994 1.00 0.00 C ATOM 641 CG2 ILE B 34 8.925 -4.154 -1.846 1.00 0.00 C ATOM 642 CD1 ILE B 34 9.550 -1.277 -1.198 1.00 0.00 C ATOM 0 H ILE B 34 8.391 -1.445 -4.801 1.00 0.00 H new ATOM 0 HA ILE B 34 10.564 -2.469 -3.346 1.00 0.00 H new ATOM 0 HB ILE B 34 7.621 -3.249 -3.294 1.00 0.00 H new ATOM 0 HG12 ILE B 34 8.059 -0.921 -2.684 1.00 0.00 H new ATOM 0 HG13 ILE B 34 7.498 -1.856 -1.313 1.00 0.00 H new ATOM 0 HG21 ILE B 34 8.141 -4.282 -1.100 1.00 0.00 H new ATOM 0 HG22 ILE B 34 9.033 -5.074 -2.420 1.00 0.00 H new ATOM 0 HG23 ILE B 34 9.867 -3.925 -1.347 1.00 0.00 H new ATOM 0 HD11 ILE B 34 9.320 -0.355 -0.664 1.00 0.00 H new ATOM 0 HD12 ILE B 34 9.817 -2.054 -0.482 1.00 0.00 H new ATOM 0 HD13 ILE B 34 10.387 -1.104 -1.875 1.00 0.00 H new ATOM 654 N HIS B 35 8.850 -4.643 -5.188 1.00 0.00 N ATOM 655 CA HIS B 35 8.874 -5.984 -5.729 1.00 0.00 C ATOM 656 C HIS B 35 10.048 -6.192 -6.658 1.00 0.00 C ATOM 657 O HIS B 35 10.790 -7.168 -6.549 1.00 0.00 O ATOM 658 CB HIS B 35 7.561 -6.322 -6.445 1.00 0.00 C ATOM 659 CG HIS B 35 7.175 -5.533 -7.666 1.00 0.00 C ATOM 660 ND1 HIS B 35 6.203 -4.557 -7.662 1.00 0.00 N ATOM 661 CD2 HIS B 35 7.541 -5.684 -8.961 1.00 0.00 C ATOM 662 CE1 HIS B 35 5.985 -4.153 -8.904 1.00 0.00 C ATOM 663 NE2 HIS B 35 6.787 -4.817 -9.705 1.00 0.00 N ATOM 0 H HIS B 35 7.996 -4.120 -5.382 1.00 0.00 H new ATOM 0 HA HIS B 35 8.989 -6.663 -4.884 1.00 0.00 H new ATOM 0 HB2 HIS B 35 7.603 -7.373 -6.731 1.00 0.00 H new ATOM 0 HB3 HIS B 35 6.754 -6.221 -5.719 1.00 0.00 H new ATOM 0 HD1 HIS B 35 5.726 -4.202 -6.833 1.00 0.00 H new ATOM 0 HD2 HIS B 35 8.291 -6.364 -9.338 1.00 0.00 H new ATOM 0 HE1 HIS B 35 5.269 -3.404 -9.207 1.00 0.00 H new ATOM 672 N ASP B 36 10.202 -5.263 -7.557 1.00 0.00 N ATOM 673 CA ASP B 36 11.201 -5.359 -8.596 1.00 0.00 C ATOM 674 C ASP B 36 12.529 -4.711 -8.191 1.00 0.00 C ATOM 675 O ASP B 36 13.492 -4.729 -8.958 1.00 0.00 O ATOM 676 CB ASP B 36 10.626 -4.735 -9.854 1.00 0.00 C ATOM 677 CG ASP B 36 11.432 -5.048 -11.100 1.00 0.00 C ATOM 678 OD1 ASP B 36 12.052 -4.122 -11.662 1.00 0.00 O ATOM 679 OD2 ASP B 36 11.438 -6.222 -11.528 1.00 0.00 O ATOM 0 H ASP B 36 9.639 -4.413 -7.595 1.00 0.00 H new ATOM 0 HA ASP B 36 11.438 -6.408 -8.776 1.00 0.00 H new ATOM 0 HB2 ASP B 36 9.604 -5.088 -9.992 1.00 0.00 H new ATOM 0 HB3 ASP B 36 10.575 -3.654 -9.725 1.00 0.00 H new ATOM 684 N ASP B 37 12.590 -4.148 -6.987 1.00 0.00 N ATOM 685 CA ASP B 37 13.852 -3.633 -6.453 1.00 0.00 C ATOM 686 C ASP B 37 13.865 -3.775 -4.932 1.00 0.00 C ATOM 687 O ASP B 37 13.986 -2.788 -4.203 1.00 0.00 O ATOM 688 CB ASP B 37 14.068 -2.163 -6.845 1.00 0.00 C ATOM 689 CG ASP B 37 15.535 -1.821 -7.006 1.00 0.00 C ATOM 690 OD1 ASP B 37 15.864 -1.011 -7.902 1.00 0.00 O ATOM 691 OD2 ASP B 37 16.370 -2.381 -6.264 1.00 0.00 O ATOM 0 H ASP B 37 11.789 -4.036 -6.366 1.00 0.00 H new ATOM 0 HA ASP B 37 14.666 -4.217 -6.882 1.00 0.00 H new ATOM 0 HB2 ASP B 37 13.545 -1.958 -7.779 1.00 0.00 H new ATOM 0 HB3 ASP B 37 13.628 -1.518 -6.084 1.00 0.00 H new ATOM 696 N PRO B 38 13.760 -5.017 -4.424 1.00 0.00 N ATOM 697 CA PRO B 38 13.570 -5.260 -2.996 1.00 0.00 C ATOM 698 C PRO B 38 14.855 -5.101 -2.197 1.00 0.00 C ATOM 699 O PRO B 38 14.831 -5.050 -0.969 1.00 0.00 O ATOM 700 CB PRO B 38 13.067 -6.700 -2.957 1.00 0.00 C ATOM 701 CG PRO B 38 13.719 -7.348 -4.129 1.00 0.00 C ATOM 702 CD PRO B 38 13.826 -6.281 -5.190 1.00 0.00 C ATOM 0 HA PRO B 38 12.884 -4.545 -2.542 1.00 0.00 H new ATOM 0 HB2 PRO B 38 13.343 -7.193 -2.025 1.00 0.00 H new ATOM 0 HB3 PRO B 38 11.980 -6.744 -3.031 1.00 0.00 H new ATOM 0 HG2 PRO B 38 14.703 -7.734 -3.864 1.00 0.00 H new ATOM 0 HG3 PRO B 38 13.130 -8.194 -4.484 1.00 0.00 H new ATOM 0 HD2 PRO B 38 14.759 -6.363 -5.748 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.014 -6.353 -5.914 1.00 0.00 H new ATOM 710 N SER B 39 15.977 -5.009 -2.893 1.00 0.00 N ATOM 711 CA SER B 39 17.250 -4.789 -2.236 1.00 0.00 C ATOM 712 C SER B 39 17.328 -3.353 -1.732 1.00 0.00 C ATOM 713 O SER B 39 17.992 -3.064 -0.742 1.00 0.00 O ATOM 714 CB SER B 39 18.395 -5.087 -3.199 1.00 0.00 C ATOM 715 OG SER B 39 18.235 -6.370 -3.784 1.00 0.00 O ATOM 0 H SER B 39 16.030 -5.083 -3.909 1.00 0.00 H new ATOM 0 HA SER B 39 17.337 -5.462 -1.383 1.00 0.00 H new ATOM 0 HB2 SER B 39 18.428 -4.327 -3.980 1.00 0.00 H new ATOM 0 HB3 SER B 39 19.346 -5.040 -2.668 1.00 0.00 H new ATOM 0 HG SER B 39 18.977 -6.544 -4.400 1.00 0.00 H new ATOM 721 N GLN B 40 16.642 -2.455 -2.429 1.00 0.00 N ATOM 722 CA GLN B 40 16.553 -1.064 -2.034 1.00 0.00 C ATOM 723 C GLN B 40 15.347 -0.802 -1.135 1.00 0.00 C ATOM 724 O GLN B 40 15.166 0.319 -0.678 1.00 0.00 O ATOM 725 CB GLN B 40 16.466 -0.174 -3.266 1.00 0.00 C ATOM 726 CG GLN B 40 17.563 -0.421 -4.269 1.00 0.00 C ATOM 727 CD GLN B 40 17.655 0.672 -5.316 1.00 0.00 C ATOM 728 OE1 GLN B 40 16.654 1.291 -5.673 1.00 0.00 O ATOM 729 NE2 GLN B 40 18.859 0.927 -5.803 1.00 0.00 N ATOM 0 H GLN B 40 16.133 -2.676 -3.285 1.00 0.00 H new ATOM 0 HA GLN B 40 17.455 -0.830 -1.468 1.00 0.00 H new ATOM 0 HB2 GLN B 40 15.502 -0.331 -3.749 1.00 0.00 H new ATOM 0 HB3 GLN B 40 16.500 0.870 -2.953 1.00 0.00 H new ATOM 0 HG2 GLN B 40 18.516 -0.499 -3.747 1.00 0.00 H new ATOM 0 HG3 GLN B 40 17.390 -1.378 -4.762 1.00 0.00 H new ATOM 0 HE21 GLN B 40 19.664 0.390 -5.480 1.00 0.00 H new ATOM 0 HE22 GLN B 40 18.982 1.660 -6.501 1.00 0.00 H new ATOM 738 N SER B 41 14.509 -1.825 -0.929 1.00 0.00 N ATOM 739 CA SER B 41 13.225 -1.696 -0.216 1.00 0.00 C ATOM 740 C SER B 41 13.285 -0.741 0.986 1.00 0.00 C ATOM 741 O SER B 41 12.408 0.114 1.142 1.00 0.00 O ATOM 742 CB SER B 41 12.755 -3.079 0.244 1.00 0.00 C ATOM 743 OG SER B 41 11.479 -3.018 0.852 1.00 0.00 O ATOM 0 H SER B 41 14.701 -2.773 -1.253 1.00 0.00 H new ATOM 0 HA SER B 41 12.516 -1.262 -0.921 1.00 0.00 H new ATOM 0 HB2 SER B 41 12.720 -3.755 -0.610 1.00 0.00 H new ATOM 0 HB3 SER B 41 13.476 -3.493 0.949 1.00 0.00 H new ATOM 0 HG SER B 41 11.207 -3.917 1.133 1.00 0.00 H new ATOM 749 N ALA B 42 14.323 -0.869 1.813 1.00 0.00 N ATOM 750 CA ALA B 42 14.488 -0.015 2.991 1.00 0.00 C ATOM 751 C ALA B 42 14.488 1.462 2.614 1.00 0.00 C ATOM 752 O ALA B 42 13.968 2.313 3.335 1.00 0.00 O ATOM 753 CB ALA B 42 15.784 -0.346 3.690 1.00 0.00 C ATOM 0 H ALA B 42 15.065 -1.558 1.689 1.00 0.00 H new ATOM 0 HA ALA B 42 13.645 -0.203 3.656 1.00 0.00 H new ATOM 0 HB1 ALA B 42 15.899 0.294 4.565 1.00 0.00 H new ATOM 0 HB2 ALA B 42 15.772 -1.390 4.003 1.00 0.00 H new ATOM 0 HB3 ALA B 42 16.618 -0.181 3.008 1.00 0.00 H new ATOM 759 N ASN B 43 15.088 1.746 1.480 1.00 0.00 N ATOM 760 CA ASN B 43 15.160 3.097 0.950 1.00 0.00 C ATOM 761 C ASN B 43 13.852 3.478 0.271 1.00 0.00 C ATOM 762 O ASN B 43 13.411 4.619 0.369 1.00 0.00 O ATOM 763 CB ASN B 43 16.321 3.224 -0.042 1.00 0.00 C ATOM 764 CG ASN B 43 16.404 4.606 -0.668 1.00 0.00 C ATOM 765 OD1 ASN B 43 15.850 4.851 -1.741 1.00 0.00 O ATOM 766 ND2 ASN B 43 17.094 5.517 -0.002 1.00 0.00 N ATOM 0 H ASN B 43 15.543 1.046 0.894 1.00 0.00 H new ATOM 0 HA ASN B 43 15.333 3.779 1.783 1.00 0.00 H new ATOM 0 HB2 ASN B 43 17.258 3.004 0.470 1.00 0.00 H new ATOM 0 HB3 ASN B 43 16.205 2.479 -0.829 1.00 0.00 H new ATOM 0 HD21 ASN B 43 17.182 6.463 -0.374 1.00 0.00 H new ATOM 0 HD22 ASN B 43 17.538 5.274 0.884 1.00 0.00 H new ATOM 773 N LEU B 44 13.217 2.519 -0.398 1.00 0.00 N ATOM 774 CA LEU B 44 11.964 2.791 -1.094 1.00 0.00 C ATOM 775 C LEU B 44 10.872 3.236 -0.122 1.00 0.00 C ATOM 776 O LEU B 44 10.090 4.130 -0.439 1.00 0.00 O ATOM 777 CB LEU B 44 11.482 1.588 -1.923 1.00 0.00 C ATOM 778 CG LEU B 44 12.109 1.441 -3.322 1.00 0.00 C ATOM 779 CD1 LEU B 44 12.430 2.803 -3.916 1.00 0.00 C ATOM 780 CD2 LEU B 44 13.347 0.571 -3.287 1.00 0.00 C ATOM 0 H LEU B 44 13.546 1.556 -0.472 1.00 0.00 H new ATOM 0 HA LEU B 44 12.168 3.608 -1.787 1.00 0.00 H new ATOM 0 HB2 LEU B 44 11.684 0.678 -1.358 1.00 0.00 H new ATOM 0 HB3 LEU B 44 10.400 1.660 -2.036 1.00 0.00 H new ATOM 0 HG LEU B 44 11.375 0.949 -3.960 1.00 0.00 H new ATOM 0 HD11 LEU B 44 12.872 2.674 -4.904 1.00 0.00 H new ATOM 0 HD12 LEU B 44 11.514 3.388 -4.002 1.00 0.00 H new ATOM 0 HD13 LEU B 44 13.135 3.325 -3.269 1.00 0.00 H new ATOM 0 HD21 LEU B 44 13.763 0.489 -4.291 1.00 0.00 H new ATOM 0 HD22 LEU B 44 14.087 1.018 -2.623 1.00 0.00 H new ATOM 0 HD23 LEU B 44 13.084 -0.422 -2.921 1.00 0.00 H new ATOM 792 N LEU B 45 10.819 2.644 1.070 1.00 0.00 N ATOM 793 CA LEU B 45 9.812 3.070 2.039 1.00 0.00 C ATOM 794 C LEU B 45 10.342 4.241 2.865 1.00 0.00 C ATOM 795 O LEU B 45 9.580 4.943 3.529 1.00 0.00 O ATOM 796 CB LEU B 45 9.324 1.923 2.939 1.00 0.00 C ATOM 797 CG LEU B 45 10.088 1.697 4.245 1.00 0.00 C ATOM 798 CD1 LEU B 45 9.193 1.000 5.254 1.00 0.00 C ATOM 799 CD2 LEU B 45 11.331 0.864 4.007 1.00 0.00 C ATOM 0 H LEU B 45 11.437 1.895 1.381 1.00 0.00 H new ATOM 0 HA LEU B 45 8.938 3.400 1.477 1.00 0.00 H new ATOM 0 HB2 LEU B 45 8.278 2.106 3.185 1.00 0.00 H new ATOM 0 HB3 LEU B 45 9.359 1.000 2.361 1.00 0.00 H new ATOM 0 HG LEU B 45 10.391 2.669 4.636 1.00 0.00 H new ATOM 0 HD11 LEU B 45 9.744 0.842 6.181 1.00 0.00 H new ATOM 0 HD12 LEU B 45 8.318 1.619 5.452 1.00 0.00 H new ATOM 0 HD13 LEU B 45 8.874 0.038 4.854 1.00 0.00 H new ATOM 0 HD21 LEU B 45 11.857 0.717 4.950 1.00 0.00 H new ATOM 0 HD22 LEU B 45 11.047 -0.105 3.596 1.00 0.00 H new ATOM 0 HD23 LEU B 45 11.985 1.379 3.303 1.00 0.00 H new ATOM 811 N ALA B 46 11.656 4.444 2.814 1.00 0.00 N ATOM 812 CA ALA B 46 12.276 5.627 3.404 1.00 0.00 C ATOM 813 C ALA B 46 11.771 6.872 2.699 1.00 0.00 C ATOM 814 O ALA B 46 11.472 7.893 3.321 1.00 0.00 O ATOM 815 CB ALA B 46 13.787 5.552 3.276 1.00 0.00 C ATOM 0 H ALA B 46 12.313 3.803 2.369 1.00 0.00 H new ATOM 0 HA ALA B 46 12.012 5.670 4.461 1.00 0.00 H new ATOM 0 HB1 ALA B 46 14.234 6.441 3.720 1.00 0.00 H new ATOM 0 HB2 ALA B 46 14.152 4.665 3.793 1.00 0.00 H new ATOM 0 HB3 ALA B 46 14.061 5.496 2.222 1.00 0.00 H new ATOM 821 N GLU B 47 11.691 6.765 1.383 1.00 0.00 N ATOM 822 CA GLU B 47 11.152 7.819 0.543 1.00 0.00 C ATOM 823 C GLU B 47 9.729 8.124 0.943 1.00 0.00 C ATOM 824 O GLU B 47 9.343 9.277 1.055 1.00 0.00 O ATOM 825 CB GLU B 47 11.185 7.377 -0.911 1.00 0.00 C ATOM 826 CG GLU B 47 12.560 6.960 -1.364 1.00 0.00 C ATOM 827 CD GLU B 47 13.536 8.113 -1.454 1.00 0.00 C ATOM 828 OE1 GLU B 47 13.986 8.616 -0.401 1.00 0.00 O ATOM 829 OE2 GLU B 47 13.876 8.514 -2.584 1.00 0.00 O ATOM 0 H GLU B 47 11.999 5.941 0.866 1.00 0.00 H new ATOM 0 HA GLU B 47 11.758 8.717 0.667 1.00 0.00 H new ATOM 0 HB2 GLU B 47 10.494 6.545 -1.049 1.00 0.00 H new ATOM 0 HB3 GLU B 47 10.831 8.193 -1.542 1.00 0.00 H new ATOM 0 HG2 GLU B 47 12.952 6.214 -0.672 1.00 0.00 H new ATOM 0 HG3 GLU B 47 12.484 6.481 -2.340 1.00 0.00 H new ATOM 836 N ALA B 48 8.965 7.070 1.167 1.00 0.00 N ATOM 837 CA ALA B 48 7.578 7.197 1.588 1.00 0.00 C ATOM 838 C ALA B 48 7.461 8.069 2.837 1.00 0.00 C ATOM 839 O ALA B 48 6.587 8.935 2.916 1.00 0.00 O ATOM 840 CB ALA B 48 6.986 5.818 1.824 1.00 0.00 C ATOM 0 H ALA B 48 9.284 6.107 1.064 1.00 0.00 H new ATOM 0 HA ALA B 48 7.014 7.689 0.796 1.00 0.00 H new ATOM 0 HB1 ALA B 48 5.947 5.917 2.139 1.00 0.00 H new ATOM 0 HB2 ALA B 48 7.032 5.240 0.901 1.00 0.00 H new ATOM 0 HB3 ALA B 48 7.554 5.306 2.601 1.00 0.00 H new ATOM 846 N LYS B 49 8.365 7.853 3.795 1.00 0.00 N ATOM 847 CA LYS B 49 8.398 8.643 5.026 1.00 0.00 C ATOM 848 C LYS B 49 8.682 10.114 4.713 1.00 0.00 C ATOM 849 O LYS B 49 8.114 11.019 5.325 1.00 0.00 O ATOM 850 CB LYS B 49 9.479 8.118 5.976 1.00 0.00 C ATOM 851 CG LYS B 49 9.366 6.645 6.322 1.00 0.00 C ATOM 852 CD LYS B 49 10.527 6.213 7.204 1.00 0.00 C ATOM 853 CE LYS B 49 10.718 4.706 7.206 1.00 0.00 C ATOM 854 NZ LYS B 49 11.822 4.295 8.111 1.00 0.00 N ATOM 0 H LYS B 49 9.087 7.134 3.740 1.00 0.00 H new ATOM 0 HA LYS B 49 7.422 8.555 5.504 1.00 0.00 H new ATOM 0 HB2 LYS B 49 10.455 8.296 5.526 1.00 0.00 H new ATOM 0 HB3 LYS B 49 9.443 8.697 6.899 1.00 0.00 H new ATOM 0 HG2 LYS B 49 8.423 6.458 6.835 1.00 0.00 H new ATOM 0 HG3 LYS B 49 9.355 6.051 5.408 1.00 0.00 H new ATOM 0 HD2 LYS B 49 11.442 6.693 6.857 1.00 0.00 H new ATOM 0 HD3 LYS B 49 10.354 6.557 8.224 1.00 0.00 H new ATOM 0 HE2 LYS B 49 9.792 4.222 7.517 1.00 0.00 H new ATOM 0 HE3 LYS B 49 10.931 4.364 6.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 12.060 3.297 7.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 12.658 4.886 7.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 11.522 4.413 9.100 1.00 0.00 H new ATOM 868 N LYS B 50 9.580 10.338 3.766 1.00 0.00 N ATOM 869 CA LYS B 50 9.927 11.686 3.332 1.00 0.00 C ATOM 870 C LYS B 50 8.761 12.323 2.583 1.00 0.00 C ATOM 871 O LYS B 50 8.398 13.477 2.830 1.00 0.00 O ATOM 872 CB LYS B 50 11.156 11.630 2.421 1.00 0.00 C ATOM 873 CG LYS B 50 11.517 12.961 1.780 1.00 0.00 C ATOM 874 CD LYS B 50 12.575 12.780 0.706 1.00 0.00 C ATOM 875 CE LYS B 50 12.966 14.102 0.066 1.00 0.00 C ATOM 876 NZ LYS B 50 13.666 14.999 1.021 1.00 0.00 N ATOM 0 H LYS B 50 10.086 9.598 3.279 1.00 0.00 H new ATOM 0 HA LYS B 50 10.149 12.292 4.211 1.00 0.00 H new ATOM 0 HB2 LYS B 50 12.008 11.275 3.001 1.00 0.00 H new ATOM 0 HB3 LYS B 50 10.978 10.897 1.634 1.00 0.00 H new ATOM 0 HG2 LYS B 50 10.626 13.412 1.345 1.00 0.00 H new ATOM 0 HG3 LYS B 50 11.882 13.649 2.543 1.00 0.00 H new ATOM 0 HD2 LYS B 50 13.458 12.313 1.142 1.00 0.00 H new ATOM 0 HD3 LYS B 50 12.201 12.102 -0.061 1.00 0.00 H new ATOM 0 HE2 LYS B 50 13.611 13.912 -0.792 1.00 0.00 H new ATOM 0 HE3 LYS B 50 12.073 14.600 -0.311 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 14.048 15.820 0.510 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 12.996 15.324 1.747 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 14.445 14.482 1.476 1.00 0.00 H new ATOM 890 N LEU B 51 8.178 11.547 1.682 1.00 0.00 N ATOM 891 CA LEU B 51 7.120 12.009 0.811 1.00 0.00 C ATOM 892 C LEU B 51 5.876 12.422 1.593 1.00 0.00 C ATOM 893 O LEU B 51 5.338 13.499 1.365 1.00 0.00 O ATOM 894 CB LEU B 51 6.759 10.907 -0.179 1.00 0.00 C ATOM 895 CG LEU B 51 7.341 11.039 -1.586 1.00 0.00 C ATOM 896 CD1 LEU B 51 8.800 10.582 -1.644 1.00 0.00 C ATOM 897 CD2 LEU B 51 6.477 10.263 -2.568 1.00 0.00 C ATOM 0 H LEU B 51 8.432 10.570 1.537 1.00 0.00 H new ATOM 0 HA LEU B 51 7.485 12.889 0.281 1.00 0.00 H new ATOM 0 HB2 LEU B 51 7.085 9.954 0.237 1.00 0.00 H new ATOM 0 HB3 LEU B 51 5.673 10.864 -0.261 1.00 0.00 H new ATOM 0 HG LEU B 51 7.335 12.093 -1.865 1.00 0.00 H new ATOM 0 HD11 LEU B 51 9.176 10.692 -2.661 1.00 0.00 H new ATOM 0 HD12 LEU B 51 9.399 11.192 -0.968 1.00 0.00 H new ATOM 0 HD13 LEU B 51 8.866 9.536 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU B 51 6.892 10.357 -3.571 1.00 0.00 H new ATOM 0 HD22 LEU B 51 6.455 9.212 -2.282 1.00 0.00 H new ATOM 0 HD23 LEU B 51 5.463 10.663 -2.556 1.00 0.00 H new ATOM 909 N ASN B 52 5.420 11.575 2.515 1.00 0.00 N ATOM 910 CA ASN B 52 4.193 11.863 3.259 1.00 0.00 C ATOM 911 C ASN B 52 4.358 13.114 4.118 1.00 0.00 C ATOM 912 O ASN B 52 3.379 13.765 4.474 1.00 0.00 O ATOM 913 CB ASN B 52 3.771 10.673 4.133 1.00 0.00 C ATOM 914 CG ASN B 52 4.494 10.617 5.467 1.00 0.00 C ATOM 915 OD1 ASN B 52 5.571 10.046 5.578 1.00 0.00 O ATOM 916 ND2 ASN B 52 3.896 11.199 6.495 1.00 0.00 N ATOM 0 H ASN B 52 5.874 10.696 2.763 1.00 0.00 H new ATOM 0 HA ASN B 52 3.405 12.042 2.527 1.00 0.00 H new ATOM 0 HB2 ASN B 52 2.697 10.726 4.312 1.00 0.00 H new ATOM 0 HB3 ASN B 52 3.958 9.748 3.588 1.00 0.00 H new ATOM 0 HD21 ASN B 52 4.333 11.181 7.416 1.00 0.00 H new ATOM 0 HD22 ASN B 52 2.998 11.666 6.365 1.00 0.00 H new ATOM 923 N ASP B 53 5.594 13.443 4.456 1.00 0.00 N ATOM 924 CA ASP B 53 5.870 14.662 5.201 1.00 0.00 C ATOM 925 C ASP B 53 5.917 15.856 4.257 1.00 0.00 C ATOM 926 O ASP B 53 5.394 16.925 4.562 1.00 0.00 O ATOM 927 CB ASP B 53 7.189 14.545 5.963 1.00 0.00 C ATOM 928 CG ASP B 53 7.553 15.831 6.680 1.00 0.00 C ATOM 929 OD1 ASP B 53 8.229 16.685 6.069 1.00 0.00 O ATOM 930 OD2 ASP B 53 7.165 15.995 7.858 1.00 0.00 O ATOM 0 H ASP B 53 6.418 12.887 4.228 1.00 0.00 H new ATOM 0 HA ASP B 53 5.067 14.811 5.923 1.00 0.00 H new ATOM 0 HB2 ASP B 53 7.117 13.735 6.688 1.00 0.00 H new ATOM 0 HB3 ASP B 53 7.986 14.281 5.268 1.00 0.00 H new ATOM 935 N ALA B 54 6.530 15.655 3.100 1.00 0.00 N ATOM 936 CA ALA B 54 6.667 16.713 2.107 1.00 0.00 C ATOM 937 C ALA B 54 5.324 17.029 1.455 1.00 0.00 C ATOM 938 O ALA B 54 5.096 18.145 0.987 1.00 0.00 O ATOM 939 CB ALA B 54 7.690 16.314 1.057 1.00 0.00 C ATOM 0 H ALA B 54 6.943 14.764 2.824 1.00 0.00 H new ATOM 0 HA ALA B 54 7.014 17.615 2.611 1.00 0.00 H new ATOM 0 HB1 ALA B 54 7.785 17.111 0.320 1.00 0.00 H new ATOM 0 HB2 ALA B 54 8.655 16.145 1.535 1.00 0.00 H new ATOM 0 HB3 ALA B 54 7.365 15.399 0.562 1.00 0.00 H new ATOM 945 N GLN B 55 4.438 16.042 1.428 1.00 0.00 N ATOM 946 CA GLN B 55 3.101 16.224 0.875 1.00 0.00 C ATOM 947 C GLN B 55 2.109 16.619 1.961 1.00 0.00 C ATOM 948 O GLN B 55 0.897 16.580 1.753 1.00 0.00 O ATOM 949 CB GLN B 55 2.627 14.948 0.179 1.00 0.00 C ATOM 950 CG GLN B 55 3.398 14.611 -1.085 1.00 0.00 C ATOM 951 CD GLN B 55 3.256 15.678 -2.150 1.00 0.00 C ATOM 952 OE1 GLN B 55 4.056 16.611 -2.227 1.00 0.00 O ATOM 953 NE2 GLN B 55 2.226 15.555 -2.972 1.00 0.00 N ATOM 0 H GLN B 55 4.621 15.104 1.784 1.00 0.00 H new ATOM 0 HA GLN B 55 3.152 17.029 0.142 1.00 0.00 H new ATOM 0 HB2 GLN B 55 2.710 14.114 0.876 1.00 0.00 H new ATOM 0 HB3 GLN B 55 1.571 15.053 -0.069 1.00 0.00 H new ATOM 0 HG2 GLN B 55 4.453 14.483 -0.841 1.00 0.00 H new ATOM 0 HG3 GLN B 55 3.045 13.658 -1.480 1.00 0.00 H new ATOM 0 HE21 GLN B 55 1.587 14.766 -2.874 1.00 0.00 H new ATOM 0 HE22 GLN B 55 2.072 16.249 -3.704 1.00 0.00 H new ATOM 962 N ALA B 56 2.630 16.990 3.118 1.00 0.00 N ATOM 963 CA ALA B 56 1.817 17.454 4.217 1.00 0.00 C ATOM 964 C ALA B 56 1.830 18.975 4.263 1.00 0.00 C ATOM 965 O ALA B 56 0.845 19.598 3.822 1.00 0.00 O ATOM 966 CB ALA B 56 2.362 16.879 5.505 1.00 0.00 C ATOM 0 H ALA B 56 3.630 16.976 3.317 1.00 0.00 H new ATOM 0 HA ALA B 56 0.787 17.125 4.084 1.00 0.00 H new ATOM 0 HB1 ALA B 56 1.755 17.223 6.343 1.00 0.00 H new ATOM 0 HB2 ALA B 56 2.333 15.790 5.459 1.00 0.00 H new ATOM 0 HB3 ALA B 56 3.392 17.208 5.644 1.00 0.00 H new ATOM 973 N GLY C 13 -13.898 0.587 11.675 1.00 0.00 N ATOM 974 CA GLY C 13 -13.628 2.045 11.690 1.00 0.00 C ATOM 975 C GLY C 13 -12.364 2.386 12.457 1.00 0.00 C ATOM 976 O GLY C 13 -12.406 3.110 13.453 1.00 0.00 O ATOM 0 HA2 GLY C 13 -13.538 2.407 10.666 1.00 0.00 H new ATOM 0 HA3 GLY C 13 -14.475 2.565 12.138 1.00 0.00 H new ATOM 980 N GLY C 14 -11.239 1.856 11.998 1.00 0.00 N ATOM 981 CA GLY C 14 -9.969 2.111 12.651 1.00 0.00 C ATOM 982 C GLY C 14 -9.208 0.834 12.906 1.00 0.00 C ATOM 983 O GLY C 14 -8.320 0.784 13.756 1.00 0.00 O ATOM 0 H GLY C 14 -11.183 1.250 11.180 1.00 0.00 H new ATOM 0 HA2 GLY C 14 -9.368 2.776 12.031 1.00 0.00 H new ATOM 0 HA3 GLY C 14 -10.142 2.627 13.596 1.00 0.00 H new ATOM 987 N GLU C 15 -9.577 -0.205 12.184 1.00 0.00 N ATOM 988 CA GLU C 15 -8.885 -1.472 12.250 1.00 0.00 C ATOM 989 C GLU C 15 -7.699 -1.471 11.306 1.00 0.00 C ATOM 990 O GLU C 15 -7.624 -0.660 10.379 1.00 0.00 O ATOM 991 CB GLU C 15 -9.825 -2.629 11.899 1.00 0.00 C ATOM 992 CG GLU C 15 -10.554 -2.481 10.576 1.00 0.00 C ATOM 993 CD GLU C 15 -11.767 -1.569 10.646 1.00 0.00 C ATOM 994 OE1 GLU C 15 -12.890 -2.082 10.803 1.00 0.00 O ATOM 995 OE2 GLU C 15 -11.606 -0.335 10.549 1.00 0.00 O ATOM 0 H GLU C 15 -10.365 -0.193 11.536 1.00 0.00 H new ATOM 0 HA GLU C 15 -8.532 -1.611 13.272 1.00 0.00 H new ATOM 0 HB2 GLU C 15 -9.248 -3.553 11.878 1.00 0.00 H new ATOM 0 HB3 GLU C 15 -10.563 -2.732 12.694 1.00 0.00 H new ATOM 0 HG2 GLU C 15 -9.860 -2.092 9.831 1.00 0.00 H new ATOM 0 HG3 GLU C 15 -10.870 -3.466 10.233 1.00 0.00 H new ATOM 1002 N ILE C 16 -6.780 -2.385 11.542 1.00 0.00 N ATOM 1003 CA ILE C 16 -5.596 -2.499 10.711 1.00 0.00 C ATOM 1004 C ILE C 16 -5.775 -3.645 9.731 1.00 0.00 C ATOM 1005 O ILE C 16 -6.053 -4.776 10.132 1.00 0.00 O ATOM 1006 CB ILE C 16 -4.316 -2.731 11.540 1.00 0.00 C ATOM 1007 CG1 ILE C 16 -4.226 -1.711 12.679 1.00 0.00 C ATOM 1008 CG2 ILE C 16 -3.093 -2.635 10.640 1.00 0.00 C ATOM 1009 CD1 ILE C 16 -2.865 -1.649 13.338 1.00 0.00 C ATOM 0 H ILE C 16 -6.829 -3.062 12.304 1.00 0.00 H new ATOM 0 HA ILE C 16 -5.477 -1.555 10.180 1.00 0.00 H new ATOM 0 HB ILE C 16 -4.353 -3.729 11.977 1.00 0.00 H new ATOM 0 HG12 ILE C 16 -4.476 -0.724 12.291 1.00 0.00 H new ATOM 0 HG13 ILE C 16 -4.974 -1.956 13.433 1.00 0.00 H new ATOM 0 HG21 ILE C 16 -2.192 -2.800 11.231 1.00 0.00 H new ATOM 0 HG22 ILE C 16 -3.157 -3.391 9.858 1.00 0.00 H new ATOM 0 HG23 ILE C 16 -3.053 -1.645 10.185 1.00 0.00 H new ATOM 0 HD11 ILE C 16 -2.880 -0.905 14.134 1.00 0.00 H new ATOM 0 HD12 ILE C 16 -2.619 -2.624 13.758 1.00 0.00 H new ATOM 0 HD13 ILE C 16 -2.114 -1.373 12.597 1.00 0.00 H new ATOM 1021 N VAL C 17 -5.614 -3.358 8.453 1.00 0.00 N ATOM 1022 CA VAL C 17 -5.910 -4.324 7.420 1.00 0.00 C ATOM 1023 C VAL C 17 -4.634 -4.636 6.632 1.00 0.00 C ATOM 1024 O VAL C 17 -4.343 -3.997 5.628 1.00 0.00 O ATOM 1025 CB VAL C 17 -7.019 -3.766 6.484 1.00 0.00 C ATOM 1026 CG1 VAL C 17 -7.562 -4.821 5.542 1.00 0.00 C ATOM 1027 CG2 VAL C 17 -8.150 -3.157 7.286 1.00 0.00 C ATOM 0 H VAL C 17 -5.278 -2.459 8.108 1.00 0.00 H new ATOM 0 HA VAL C 17 -6.274 -5.248 7.870 1.00 0.00 H new ATOM 0 HB VAL C 17 -6.553 -2.989 5.878 1.00 0.00 H new ATOM 0 HG11 VAL C 17 -8.333 -4.382 4.910 1.00 0.00 H new ATOM 0 HG12 VAL C 17 -6.754 -5.202 4.917 1.00 0.00 H new ATOM 0 HG13 VAL C 17 -7.990 -5.640 6.120 1.00 0.00 H new ATOM 0 HG21 VAL C 17 -8.912 -2.774 6.607 1.00 0.00 H new ATOM 0 HG22 VAL C 17 -8.588 -3.917 7.932 1.00 0.00 H new ATOM 0 HG23 VAL C 17 -7.765 -2.340 7.896 1.00 0.00 H new ATOM 1037 N TYR C 18 -3.869 -5.617 7.105 1.00 0.00 N ATOM 1038 CA TYR C 18 -2.609 -5.990 6.462 1.00 0.00 C ATOM 1039 C TYR C 18 -2.837 -7.057 5.404 1.00 0.00 C ATOM 1040 O TYR C 18 -3.385 -8.124 5.690 1.00 0.00 O ATOM 1041 CB TYR C 18 -1.596 -6.497 7.490 1.00 0.00 C ATOM 1042 CG TYR C 18 -0.585 -5.459 7.922 1.00 0.00 C ATOM 1043 CD1 TYR C 18 0.648 -5.362 7.290 1.00 0.00 C ATOM 1044 CD2 TYR C 18 -0.855 -4.589 8.964 1.00 0.00 C ATOM 1045 CE1 TYR C 18 1.581 -4.424 7.685 1.00 0.00 C ATOM 1046 CE2 TYR C 18 0.071 -3.645 9.363 1.00 0.00 C ATOM 1047 CZ TYR C 18 1.288 -3.569 8.722 1.00 0.00 C ATOM 1048 OH TYR C 18 2.213 -2.636 9.124 1.00 0.00 O ATOM 0 H TYR C 18 -4.099 -6.169 7.931 1.00 0.00 H new ATOM 0 HA TYR C 18 -2.208 -5.096 5.985 1.00 0.00 H new ATOM 0 HB2 TYR C 18 -2.133 -6.854 8.369 1.00 0.00 H new ATOM 0 HB3 TYR C 18 -1.066 -7.353 7.071 1.00 0.00 H new ATOM 0 HD1 TYR C 18 0.881 -6.032 6.476 1.00 0.00 H new ATOM 0 HD2 TYR C 18 -1.805 -4.649 9.473 1.00 0.00 H new ATOM 0 HE1 TYR C 18 2.535 -4.362 7.183 1.00 0.00 H new ATOM 0 HE2 TYR C 18 -0.158 -2.969 10.174 1.00 0.00 H new ATOM 0 HH TYR C 18 2.326 -2.685 10.096 1.00 0.00 H new ATOM 1058 N LEU C 19 -2.425 -6.760 4.178 1.00 0.00 N ATOM 1059 CA LEU C 19 -2.633 -7.667 3.059 1.00 0.00 C ATOM 1060 C LEU C 19 -1.312 -7.974 2.358 1.00 0.00 C ATOM 1061 O LEU C 19 -0.971 -7.358 1.350 1.00 0.00 O ATOM 1062 CB LEU C 19 -3.659 -7.081 2.071 1.00 0.00 C ATOM 1063 CG LEU C 19 -5.120 -7.211 2.495 1.00 0.00 C ATOM 1064 CD1 LEU C 19 -5.410 -6.431 3.750 1.00 0.00 C ATOM 1065 CD2 LEU C 19 -6.019 -6.732 1.394 1.00 0.00 C ATOM 0 H LEU C 19 -1.943 -5.895 3.934 1.00 0.00 H new ATOM 0 HA LEU C 19 -3.032 -8.604 3.446 1.00 0.00 H new ATOM 0 HB2 LEU C 19 -3.433 -6.025 1.922 1.00 0.00 H new ATOM 0 HB3 LEU C 19 -3.532 -7.573 1.107 1.00 0.00 H new ATOM 0 HG LEU C 19 -5.308 -8.265 2.699 1.00 0.00 H new ATOM 0 HD11 LEU C 19 -6.460 -6.550 4.018 1.00 0.00 H new ATOM 0 HD12 LEU C 19 -4.784 -6.802 4.562 1.00 0.00 H new ATOM 0 HD13 LEU C 19 -5.196 -5.376 3.580 1.00 0.00 H new ATOM 0 HD21 LEU C 19 -7.059 -6.829 1.706 1.00 0.00 H new ATOM 0 HD22 LEU C 19 -5.801 -5.687 1.175 1.00 0.00 H new ATOM 0 HD23 LEU C 19 -5.851 -7.332 0.500 1.00 0.00 H new ATOM 1077 N PRO C 20 -0.551 -8.944 2.895 1.00 0.00 N ATOM 1078 CA PRO C 20 0.769 -9.307 2.369 1.00 0.00 C ATOM 1079 C PRO C 20 0.708 -10.163 1.109 1.00 0.00 C ATOM 1080 O PRO C 20 1.724 -10.388 0.456 1.00 0.00 O ATOM 1081 CB PRO C 20 1.383 -10.112 3.514 1.00 0.00 C ATOM 1082 CG PRO C 20 0.220 -10.734 4.203 1.00 0.00 C ATOM 1083 CD PRO C 20 -0.917 -9.759 4.072 1.00 0.00 C ATOM 0 HA PRO C 20 1.335 -8.423 2.073 1.00 0.00 H new ATOM 0 HB2 PRO C 20 2.073 -10.868 3.141 1.00 0.00 H new ATOM 0 HB3 PRO C 20 1.948 -9.471 4.191 1.00 0.00 H new ATOM 0 HG2 PRO C 20 -0.034 -11.692 3.749 1.00 0.00 H new ATOM 0 HG3 PRO C 20 0.447 -10.928 5.251 1.00 0.00 H new ATOM 0 HD2 PRO C 20 -1.868 -10.271 3.924 1.00 0.00 H new ATOM 0 HD3 PRO C 20 -1.022 -9.145 4.966 1.00 0.00 H new ATOM 1091 N ASN C 21 -0.476 -10.641 0.765 1.00 0.00 N ATOM 1092 CA ASN C 21 -0.614 -11.568 -0.349 1.00 0.00 C ATOM 1093 C ASN C 21 -1.063 -10.854 -1.613 1.00 0.00 C ATOM 1094 O ASN C 21 -1.070 -11.443 -2.690 1.00 0.00 O ATOM 1095 CB ASN C 21 -1.595 -12.687 -0.002 1.00 0.00 C ATOM 1096 CG ASN C 21 -1.165 -13.481 1.217 1.00 0.00 C ATOM 1097 OD1 ASN C 21 0.027 -13.617 1.503 1.00 0.00 O ATOM 1098 ND2 ASN C 21 -2.133 -14.007 1.946 1.00 0.00 N ATOM 0 H ASN C 21 -1.350 -10.406 1.236 1.00 0.00 H new ATOM 0 HA ASN C 21 0.367 -12.004 -0.536 1.00 0.00 H new ATOM 0 HB2 ASN C 21 -2.581 -12.258 0.177 1.00 0.00 H new ATOM 0 HB3 ASN C 21 -1.690 -13.360 -0.854 1.00 0.00 H new ATOM 0 HD21 ASN C 21 -1.906 -14.549 2.780 1.00 0.00 H new ATOM 0 HD22 ASN C 21 -3.107 -13.871 1.675 1.00 0.00 H new ATOM 1105 N LEU C 22 -1.443 -9.588 -1.484 1.00 0.00 N ATOM 1106 CA LEU C 22 -1.844 -8.799 -2.638 1.00 0.00 C ATOM 1107 C LEU C 22 -0.684 -8.574 -3.589 1.00 0.00 C ATOM 1108 O LEU C 22 0.409 -8.174 -3.182 1.00 0.00 O ATOM 1109 CB LEU C 22 -2.419 -7.450 -2.219 1.00 0.00 C ATOM 1110 CG LEU C 22 -3.841 -7.472 -1.665 1.00 0.00 C ATOM 1111 CD1 LEU C 22 -4.296 -6.057 -1.367 1.00 0.00 C ATOM 1112 CD2 LEU C 22 -4.791 -8.136 -2.647 1.00 0.00 C ATOM 0 H LEU C 22 -1.481 -9.089 -0.595 1.00 0.00 H new ATOM 0 HA LEU C 22 -2.617 -9.370 -3.152 1.00 0.00 H new ATOM 0 HB2 LEU C 22 -1.763 -7.016 -1.464 1.00 0.00 H new ATOM 0 HB3 LEU C 22 -2.397 -6.784 -3.082 1.00 0.00 H new ATOM 0 HG LEU C 22 -3.848 -8.052 -0.742 1.00 0.00 H new ATOM 0 HD11 LEU C 22 -5.312 -6.077 -0.972 1.00 0.00 H new ATOM 0 HD12 LEU C 22 -3.629 -5.608 -0.631 1.00 0.00 H new ATOM 0 HD13 LEU C 22 -4.275 -5.467 -2.284 1.00 0.00 H new ATOM 0 HD21 LEU C 22 -5.799 -8.141 -2.232 1.00 0.00 H new ATOM 0 HD22 LEU C 22 -4.788 -7.583 -3.586 1.00 0.00 H new ATOM 0 HD23 LEU C 22 -4.469 -9.161 -2.829 1.00 0.00 H new ATOM 1124 N ASN C 23 -0.929 -8.854 -4.853 1.00 0.00 N ATOM 1125 CA ASN C 23 0.017 -8.547 -5.904 1.00 0.00 C ATOM 1126 C ASN C 23 -0.142 -7.084 -6.317 1.00 0.00 C ATOM 1127 O ASN C 23 -1.263 -6.585 -6.435 1.00 0.00 O ATOM 1128 CB ASN C 23 -0.144 -9.515 -7.096 1.00 0.00 C ATOM 1129 CG ASN C 23 -1.587 -9.747 -7.535 1.00 0.00 C ATOM 1130 OD1 ASN C 23 -2.533 -9.610 -6.756 1.00 0.00 O ATOM 1131 ND2 ASN C 23 -1.762 -10.147 -8.783 1.00 0.00 N ATOM 0 H ASN C 23 -1.787 -9.299 -5.179 1.00 0.00 H new ATOM 0 HA ASN C 23 1.032 -8.686 -5.532 1.00 0.00 H new ATOM 0 HB2 ASN C 23 0.421 -9.125 -7.943 1.00 0.00 H new ATOM 0 HB3 ASN C 23 0.300 -10.474 -6.831 1.00 0.00 H new ATOM 0 HD21 ASN C 23 -2.700 -10.352 -9.126 1.00 0.00 H new ATOM 0 HD22 ASN C 23 -0.959 -10.251 -9.403 1.00 0.00 H new ATOM 1138 N PRO C 24 0.995 -6.385 -6.512 1.00 0.00 N ATOM 1139 CA PRO C 24 1.057 -4.917 -6.628 1.00 0.00 C ATOM 1140 C PRO C 24 -0.054 -4.275 -7.458 1.00 0.00 C ATOM 1141 O PRO C 24 -0.833 -3.484 -6.935 1.00 0.00 O ATOM 1142 CB PRO C 24 2.409 -4.689 -7.292 1.00 0.00 C ATOM 1143 CG PRO C 24 3.256 -5.804 -6.794 1.00 0.00 C ATOM 1144 CD PRO C 24 2.339 -6.988 -6.634 1.00 0.00 C ATOM 0 HA PRO C 24 0.928 -4.454 -5.650 1.00 0.00 H new ATOM 0 HB2 PRO C 24 2.326 -4.707 -8.379 1.00 0.00 H new ATOM 0 HB3 PRO C 24 2.827 -3.720 -7.020 1.00 0.00 H new ATOM 0 HG2 PRO C 24 4.060 -6.026 -7.496 1.00 0.00 H new ATOM 0 HG3 PRO C 24 3.725 -5.543 -5.845 1.00 0.00 H new ATOM 0 HD2 PRO C 24 2.399 -7.658 -7.491 1.00 0.00 H new ATOM 0 HD3 PRO C 24 2.595 -7.575 -5.752 1.00 0.00 H new ATOM 1152 N ASP C 25 -0.147 -4.626 -8.734 1.00 0.00 N ATOM 1153 CA ASP C 25 -1.068 -3.935 -9.642 1.00 0.00 C ATOM 1154 C ASP C 25 -2.521 -4.057 -9.178 1.00 0.00 C ATOM 1155 O ASP C 25 -3.314 -3.126 -9.326 1.00 0.00 O ATOM 1156 CB ASP C 25 -0.923 -4.464 -11.070 1.00 0.00 C ATOM 1157 CG ASP C 25 -1.796 -3.711 -12.055 1.00 0.00 C ATOM 1158 OD1 ASP C 25 -2.781 -4.300 -12.550 1.00 0.00 O ATOM 1159 OD2 ASP C 25 -1.506 -2.524 -12.331 1.00 0.00 O ATOM 0 H ASP C 25 0.395 -5.375 -9.165 1.00 0.00 H new ATOM 0 HA ASP C 25 -0.801 -2.878 -9.629 1.00 0.00 H new ATOM 0 HB2 ASP C 25 0.119 -4.387 -11.379 1.00 0.00 H new ATOM 0 HB3 ASP C 25 -1.185 -5.522 -11.091 1.00 0.00 H new ATOM 1164 N GLN C 26 -2.864 -5.205 -8.617 1.00 0.00 N ATOM 1165 CA GLN C 26 -4.191 -5.439 -8.081 1.00 0.00 C ATOM 1166 C GLN C 26 -4.487 -4.529 -6.892 1.00 0.00 C ATOM 1167 O GLN C 26 -5.562 -3.935 -6.817 1.00 0.00 O ATOM 1168 CB GLN C 26 -4.340 -6.907 -7.681 1.00 0.00 C ATOM 1169 CG GLN C 26 -4.660 -7.831 -8.848 1.00 0.00 C ATOM 1170 CD GLN C 26 -3.629 -7.806 -9.966 1.00 0.00 C ATOM 1171 OE1 GLN C 26 -2.442 -7.572 -9.742 1.00 0.00 O ATOM 1172 NE2 GLN C 26 -4.080 -8.057 -11.183 1.00 0.00 N ATOM 0 H GLN C 26 -2.230 -5.998 -8.521 1.00 0.00 H new ATOM 0 HA GLN C 26 -4.916 -5.204 -8.861 1.00 0.00 H new ATOM 0 HB2 GLN C 26 -3.417 -7.241 -7.208 1.00 0.00 H new ATOM 0 HB3 GLN C 26 -5.130 -6.992 -6.935 1.00 0.00 H new ATOM 0 HG2 GLN C 26 -4.750 -8.851 -8.475 1.00 0.00 H new ATOM 0 HG3 GLN C 26 -5.631 -7.555 -9.259 1.00 0.00 H new ATOM 0 HE21 GLN C 26 -5.071 -8.247 -11.330 1.00 0.00 H new ATOM 0 HE22 GLN C 26 -3.437 -8.061 -11.975 1.00 0.00 H new ATOM 1181 N LEU C 27 -3.534 -4.395 -5.974 1.00 0.00 N ATOM 1182 CA LEU C 27 -3.753 -3.560 -4.798 1.00 0.00 C ATOM 1183 C LEU C 27 -3.734 -2.076 -5.168 1.00 0.00 C ATOM 1184 O LEU C 27 -4.306 -1.247 -4.458 1.00 0.00 O ATOM 1185 CB LEU C 27 -2.755 -3.887 -3.667 1.00 0.00 C ATOM 1186 CG LEU C 27 -1.260 -3.785 -3.992 1.00 0.00 C ATOM 1187 CD1 LEU C 27 -0.795 -2.339 -3.988 1.00 0.00 C ATOM 1188 CD2 LEU C 27 -0.444 -4.612 -3.000 1.00 0.00 C ATOM 0 H LEU C 27 -2.619 -4.844 -6.019 1.00 0.00 H new ATOM 0 HA LEU C 27 -4.746 -3.788 -4.411 1.00 0.00 H new ATOM 0 HB2 LEU C 27 -2.964 -3.220 -2.831 1.00 0.00 H new ATOM 0 HB3 LEU C 27 -2.956 -4.902 -3.323 1.00 0.00 H new ATOM 0 HG LEU C 27 -1.104 -4.184 -4.994 1.00 0.00 H new ATOM 0 HD11 LEU C 27 0.269 -2.298 -4.222 1.00 0.00 H new ATOM 0 HD12 LEU C 27 -1.353 -1.775 -4.736 1.00 0.00 H new ATOM 0 HD13 LEU C 27 -0.967 -1.904 -3.003 1.00 0.00 H new ATOM 0 HD21 LEU C 27 0.615 -4.530 -3.243 1.00 0.00 H new ATOM 0 HD22 LEU C 27 -0.614 -4.240 -1.990 1.00 0.00 H new ATOM 0 HD23 LEU C 27 -0.750 -5.656 -3.059 1.00 0.00 H new ATOM 1200 N CYS C 28 -3.099 -1.752 -6.294 1.00 0.00 N ATOM 1201 CA CYS C 28 -3.097 -0.385 -6.811 1.00 0.00 C ATOM 1202 C CYS C 28 -4.524 0.096 -7.065 1.00 0.00 C ATOM 1203 O CYS C 28 -4.855 1.262 -6.832 1.00 0.00 O ATOM 1204 CB CYS C 28 -2.297 -0.299 -8.113 1.00 0.00 C ATOM 1205 SG CYS C 28 -0.528 -0.708 -7.953 1.00 0.00 S ATOM 0 H CYS C 28 -2.579 -2.418 -6.865 1.00 0.00 H new ATOM 0 HA CYS C 28 -2.630 0.253 -6.061 1.00 0.00 H new ATOM 0 HB2 CYS C 28 -2.746 -0.972 -8.844 1.00 0.00 H new ATOM 0 HB3 CYS C 28 -2.387 0.711 -8.512 1.00 0.00 H new ATOM 1210 N ALA C 29 -5.369 -0.820 -7.528 1.00 0.00 N ATOM 1211 CA ALA C 29 -6.748 -0.498 -7.859 1.00 0.00 C ATOM 1212 C ALA C 29 -7.518 -0.056 -6.623 1.00 0.00 C ATOM 1213 O ALA C 29 -8.257 0.926 -6.661 1.00 0.00 O ATOM 1214 CB ALA C 29 -7.426 -1.696 -8.505 1.00 0.00 C ATOM 0 H ALA C 29 -5.118 -1.797 -7.682 1.00 0.00 H new ATOM 0 HA ALA C 29 -6.744 0.330 -8.568 1.00 0.00 H new ATOM 0 HB1 ALA C 29 -8.458 -1.443 -8.748 1.00 0.00 H new ATOM 0 HB2 ALA C 29 -6.894 -1.967 -9.417 1.00 0.00 H new ATOM 0 HB3 ALA C 29 -7.413 -2.538 -7.813 1.00 0.00 H new ATOM 1220 N PHE C 30 -7.322 -0.770 -5.520 1.00 0.00 N ATOM 1221 CA PHE C 30 -8.032 -0.473 -4.281 1.00 0.00 C ATOM 1222 C PHE C 30 -7.553 0.838 -3.680 1.00 0.00 C ATOM 1223 O PHE C 30 -8.339 1.581 -3.094 1.00 0.00 O ATOM 1224 CB PHE C 30 -7.875 -1.615 -3.280 1.00 0.00 C ATOM 1225 CG PHE C 30 -8.482 -2.895 -3.769 1.00 0.00 C ATOM 1226 CD1 PHE C 30 -9.855 -3.069 -3.761 1.00 0.00 C ATOM 1227 CD2 PHE C 30 -7.683 -3.916 -4.247 1.00 0.00 C ATOM 1228 CE1 PHE C 30 -10.418 -4.241 -4.224 1.00 0.00 C ATOM 1229 CE2 PHE C 30 -8.240 -5.090 -4.709 1.00 0.00 C ATOM 1230 CZ PHE C 30 -9.610 -5.254 -4.697 1.00 0.00 C ATOM 0 H PHE C 30 -6.678 -1.558 -5.458 1.00 0.00 H new ATOM 0 HA PHE C 30 -9.091 -0.369 -4.517 1.00 0.00 H new ATOM 0 HB2 PHE C 30 -6.816 -1.773 -3.078 1.00 0.00 H new ATOM 0 HB3 PHE C 30 -8.341 -1.333 -2.336 1.00 0.00 H new ATOM 0 HD1 PHE C 30 -10.492 -2.280 -3.389 1.00 0.00 H new ATOM 0 HD2 PHE C 30 -6.610 -3.793 -4.259 1.00 0.00 H new ATOM 0 HE1 PHE C 30 -11.491 -4.365 -4.216 1.00 0.00 H new ATOM 0 HE2 PHE C 30 -7.604 -5.880 -5.080 1.00 0.00 H new ATOM 0 HZ PHE C 30 -10.048 -6.173 -5.057 1.00 0.00 H new ATOM 1240 N ILE C 31 -6.268 1.124 -3.840 1.00 0.00 N ATOM 1241 CA ILE C 31 -5.724 2.407 -3.423 1.00 0.00 C ATOM 1242 C ILE C 31 -6.445 3.538 -4.149 1.00 0.00 C ATOM 1243 O ILE C 31 -6.896 4.505 -3.534 1.00 0.00 O ATOM 1244 CB ILE C 31 -4.208 2.493 -3.696 1.00 0.00 C ATOM 1245 CG1 ILE C 31 -3.455 1.511 -2.792 1.00 0.00 C ATOM 1246 CG2 ILE C 31 -3.707 3.915 -3.495 1.00 0.00 C ATOM 1247 CD1 ILE C 31 -1.951 1.560 -2.956 1.00 0.00 C ATOM 0 H ILE C 31 -5.587 0.488 -4.254 1.00 0.00 H new ATOM 0 HA ILE C 31 -5.879 2.504 -2.348 1.00 0.00 H new ATOM 0 HB ILE C 31 -4.021 2.218 -4.734 1.00 0.00 H new ATOM 0 HG12 ILE C 31 -3.705 1.724 -1.753 1.00 0.00 H new ATOM 0 HG13 ILE C 31 -3.801 0.499 -3.002 1.00 0.00 H new ATOM 0 HG21 ILE C 31 -2.636 3.955 -3.692 1.00 0.00 H new ATOM 0 HG22 ILE C 31 -4.227 4.584 -4.180 1.00 0.00 H new ATOM 0 HG23 ILE C 31 -3.899 4.227 -2.468 1.00 0.00 H new ATOM 0 HD11 ILE C 31 -1.488 0.838 -2.284 1.00 0.00 H new ATOM 0 HD12 ILE C 31 -1.689 1.317 -3.986 1.00 0.00 H new ATOM 0 HD13 ILE C 31 -1.591 2.561 -2.717 1.00 0.00 H new ATOM 1259 N HIS C 32 -6.573 3.394 -5.462 1.00 0.00 N ATOM 1260 CA HIS C 32 -7.321 4.358 -6.260 1.00 0.00 C ATOM 1261 C HIS C 32 -8.796 4.367 -5.868 1.00 0.00 C ATOM 1262 O HIS C 32 -9.442 5.409 -5.896 1.00 0.00 O ATOM 1263 CB HIS C 32 -7.188 4.057 -7.757 1.00 0.00 C ATOM 1264 CG HIS C 32 -5.963 4.639 -8.392 1.00 0.00 C ATOM 1265 ND1 HIS C 32 -5.425 4.160 -9.566 1.00 0.00 N ATOM 1266 CD2 HIS C 32 -5.192 5.693 -8.032 1.00 0.00 C ATOM 1267 CE1 HIS C 32 -4.380 4.893 -9.900 1.00 0.00 C ATOM 1268 NE2 HIS C 32 -4.218 5.831 -8.987 1.00 0.00 N ATOM 0 H HIS C 32 -6.171 2.623 -5.995 1.00 0.00 H new ATOM 0 HA HIS C 32 -6.897 5.342 -6.061 1.00 0.00 H new ATOM 0 HB2 HIS C 32 -7.180 2.976 -7.900 1.00 0.00 H new ATOM 0 HB3 HIS C 32 -8.068 4.440 -8.273 1.00 0.00 H new ATOM 0 HD2 HIS C 32 -5.321 6.310 -7.155 1.00 0.00 H new ATOM 0 HE1 HIS C 32 -3.762 4.749 -10.774 1.00 0.00 H new ATOM 0 HE2 HIS C 32 -3.487 6.543 -8.991 1.00 0.00 H new ATOM 1277 N SER C 33 -9.314 3.208 -5.481 1.00 0.00 N ATOM 1278 CA SER C 33 -10.727 3.072 -5.144 1.00 0.00 C ATOM 1279 C SER C 33 -11.099 3.890 -3.909 1.00 0.00 C ATOM 1280 O SER C 33 -12.206 4.410 -3.823 1.00 0.00 O ATOM 1281 CB SER C 33 -11.083 1.603 -4.932 1.00 0.00 C ATOM 1282 OG SER C 33 -10.847 0.845 -6.106 1.00 0.00 O ATOM 0 H SER C 33 -8.776 2.346 -5.392 1.00 0.00 H new ATOM 0 HA SER C 33 -11.303 3.463 -5.983 1.00 0.00 H new ATOM 0 HB2 SER C 33 -10.493 1.198 -4.110 1.00 0.00 H new ATOM 0 HB3 SER C 33 -12.131 1.518 -4.645 1.00 0.00 H new ATOM 0 HG SER C 33 -9.884 0.693 -6.209 1.00 0.00 H new ATOM 1288 N ILE C 34 -10.177 4.011 -2.959 1.00 0.00 N ATOM 1289 CA ILE C 34 -10.415 4.837 -1.775 1.00 0.00 C ATOM 1290 C ILE C 34 -10.509 6.302 -2.180 1.00 0.00 C ATOM 1291 O ILE C 34 -11.276 7.079 -1.616 1.00 0.00 O ATOM 1292 CB ILE C 34 -9.293 4.678 -0.725 1.00 0.00 C ATOM 1293 CG1 ILE C 34 -9.145 3.210 -0.313 1.00 0.00 C ATOM 1294 CG2 ILE C 34 -9.573 5.554 0.493 1.00 0.00 C ATOM 1295 CD1 ILE C 34 -10.368 2.644 0.367 1.00 0.00 C ATOM 0 H ILE C 34 -9.266 3.553 -2.982 1.00 0.00 H new ATOM 0 HA ILE C 34 -11.351 4.504 -1.327 1.00 0.00 H new ATOM 0 HB ILE C 34 -8.354 5.003 -1.172 1.00 0.00 H new ATOM 0 HG12 ILE C 34 -8.924 2.614 -1.198 1.00 0.00 H new ATOM 0 HG13 ILE C 34 -8.291 3.114 0.357 1.00 0.00 H new ATOM 0 HG21 ILE C 34 -8.773 5.430 1.222 1.00 0.00 H new ATOM 0 HG22 ILE C 34 -9.625 6.599 0.186 1.00 0.00 H new ATOM 0 HG23 ILE C 34 -10.522 5.260 0.942 1.00 0.00 H new ATOM 0 HD11 ILE C 34 -10.189 1.601 0.629 1.00 0.00 H new ATOM 0 HD12 ILE C 34 -10.578 3.215 1.271 1.00 0.00 H new ATOM 0 HD13 ILE C 34 -11.221 2.707 -0.308 1.00 0.00 H new ATOM 1307 N HIS C 35 -9.716 6.660 -3.172 1.00 0.00 N ATOM 1308 CA HIS C 35 -9.706 8.014 -3.701 1.00 0.00 C ATOM 1309 C HIS C 35 -10.969 8.270 -4.525 1.00 0.00 C ATOM 1310 O HIS C 35 -11.531 9.362 -4.496 1.00 0.00 O ATOM 1311 CB HIS C 35 -8.450 8.229 -4.554 1.00 0.00 C ATOM 1312 CG HIS C 35 -8.255 9.637 -5.030 1.00 0.00 C ATOM 1313 ND1 HIS C 35 -7.497 10.562 -4.348 1.00 0.00 N ATOM 1314 CD2 HIS C 35 -8.708 10.270 -6.137 1.00 0.00 C ATOM 1315 CE1 HIS C 35 -7.493 11.701 -5.014 1.00 0.00 C ATOM 1316 NE2 HIS C 35 -8.218 11.551 -6.103 1.00 0.00 N ATOM 0 H HIS C 35 -9.063 6.026 -3.633 1.00 0.00 H new ATOM 0 HA HIS C 35 -9.691 8.721 -2.872 1.00 0.00 H new ATOM 0 HB2 HIS C 35 -7.577 7.931 -3.974 1.00 0.00 H new ATOM 0 HB3 HIS C 35 -8.497 7.569 -5.420 1.00 0.00 H new ATOM 0 HD2 HIS C 35 -9.338 9.846 -6.905 1.00 0.00 H new ATOM 0 HE1 HIS C 35 -6.981 12.604 -4.716 1.00 0.00 H new ATOM 0 HE2 HIS C 35 -8.388 12.270 -6.806 1.00 0.00 H new ATOM 1325 N ASP C 36 -11.410 7.248 -5.249 1.00 0.00 N ATOM 1326 CA ASP C 36 -12.589 7.360 -6.104 1.00 0.00 C ATOM 1327 C ASP C 36 -13.884 7.252 -5.307 1.00 0.00 C ATOM 1328 O ASP C 36 -14.916 7.787 -5.715 1.00 0.00 O ATOM 1329 CB ASP C 36 -12.575 6.288 -7.199 1.00 0.00 C ATOM 1330 CG ASP C 36 -11.693 6.650 -8.380 1.00 0.00 C ATOM 1331 OD1 ASP C 36 -12.184 7.336 -9.303 1.00 0.00 O ATOM 1332 OD2 ASP C 36 -10.517 6.235 -8.408 1.00 0.00 O ATOM 0 H ASP C 36 -10.968 6.329 -5.262 1.00 0.00 H new ATOM 0 HA ASP C 36 -12.550 8.348 -6.563 1.00 0.00 H new ATOM 0 HB2 ASP C 36 -12.230 5.346 -6.772 1.00 0.00 H new ATOM 0 HB3 ASP C 36 -13.593 6.125 -7.551 1.00 0.00 H new ATOM 1337 N ASP C 37 -13.829 6.571 -4.175 1.00 0.00 N ATOM 1338 CA ASP C 37 -15.015 6.344 -3.356 1.00 0.00 C ATOM 1339 C ASP C 37 -14.620 6.066 -1.908 1.00 0.00 C ATOM 1340 O ASP C 37 -14.559 4.914 -1.476 1.00 0.00 O ATOM 1341 CB ASP C 37 -15.833 5.171 -3.901 1.00 0.00 C ATOM 1342 CG ASP C 37 -17.270 5.190 -3.413 1.00 0.00 C ATOM 1343 OD1 ASP C 37 -18.183 5.004 -4.247 1.00 0.00 O ATOM 1344 OD2 ASP C 37 -17.501 5.408 -2.204 1.00 0.00 O ATOM 0 H ASP C 37 -12.974 6.163 -3.798 1.00 0.00 H new ATOM 0 HA ASP C 37 -15.626 7.246 -3.391 1.00 0.00 H new ATOM 0 HB2 ASP C 37 -15.822 5.199 -4.991 1.00 0.00 H new ATOM 0 HB3 ASP C 37 -15.363 4.234 -3.602 1.00 0.00 H new ATOM 1349 N PRO C 38 -14.335 7.128 -1.141 1.00 0.00 N ATOM 1350 CA PRO C 38 -13.982 7.019 0.281 1.00 0.00 C ATOM 1351 C PRO C 38 -15.147 6.554 1.159 1.00 0.00 C ATOM 1352 O PRO C 38 -14.971 6.290 2.347 1.00 0.00 O ATOM 1353 CB PRO C 38 -13.577 8.447 0.656 1.00 0.00 C ATOM 1354 CG PRO C 38 -14.285 9.308 -0.330 1.00 0.00 C ATOM 1355 CD PRO C 38 -14.295 8.523 -1.608 1.00 0.00 C ATOM 0 HA PRO C 38 -13.202 6.274 0.439 1.00 0.00 H new ATOM 0 HB2 PRO C 38 -13.873 8.688 1.677 1.00 0.00 H new ATOM 0 HB3 PRO C 38 -12.497 8.582 0.597 1.00 0.00 H new ATOM 0 HG2 PRO C 38 -15.299 9.533 0.001 1.00 0.00 H new ATOM 0 HG3 PRO C 38 -13.773 10.262 -0.458 1.00 0.00 H new ATOM 0 HD2 PRO C 38 -15.160 8.767 -2.224 1.00 0.00 H new ATOM 0 HD3 PRO C 38 -13.408 8.721 -2.210 1.00 0.00 H new ATOM 1363 N SER C 39 -16.334 6.453 0.577 1.00 0.00 N ATOM 1364 CA SER C 39 -17.498 5.986 1.314 1.00 0.00 C ATOM 1365 C SER C 39 -17.440 4.469 1.443 1.00 0.00 C ATOM 1366 O SER C 39 -17.702 3.907 2.507 1.00 0.00 O ATOM 1367 CB SER C 39 -18.783 6.423 0.608 1.00 0.00 C ATOM 1368 OG SER C 39 -19.935 6.104 1.372 1.00 0.00 O ATOM 0 H SER C 39 -16.515 6.687 -0.399 1.00 0.00 H new ATOM 0 HA SER C 39 -17.496 6.425 2.312 1.00 0.00 H new ATOM 0 HB2 SER C 39 -18.752 7.498 0.428 1.00 0.00 H new ATOM 0 HB3 SER C 39 -18.846 5.938 -0.366 1.00 0.00 H new ATOM 0 HG SER C 39 -20.737 6.398 0.892 1.00 0.00 H new ATOM 1374 N GLN C 40 -17.063 3.815 0.350 1.00 0.00 N ATOM 1375 CA GLN C 40 -16.887 2.373 0.320 1.00 0.00 C ATOM 1376 C GLN C 40 -15.545 1.977 0.917 1.00 0.00 C ATOM 1377 O GLN C 40 -15.180 0.813 0.871 1.00 0.00 O ATOM 1378 CB GLN C 40 -16.968 1.878 -1.118 1.00 0.00 C ATOM 1379 CG GLN C 40 -18.240 2.299 -1.812 1.00 0.00 C ATOM 1380 CD GLN C 40 -19.453 1.521 -1.341 1.00 0.00 C ATOM 1381 OE1 GLN C 40 -19.356 0.350 -0.969 1.00 0.00 O ATOM 1382 NE2 GLN C 40 -20.605 2.166 -1.350 1.00 0.00 N ATOM 0 H GLN C 40 -16.871 4.274 -0.541 1.00 0.00 H new ATOM 0 HA GLN C 40 -17.679 1.917 0.914 1.00 0.00 H new ATOM 0 HB2 GLN C 40 -16.112 2.258 -1.677 1.00 0.00 H new ATOM 0 HB3 GLN C 40 -16.898 0.790 -1.127 1.00 0.00 H new ATOM 0 HG2 GLN C 40 -18.407 3.362 -1.640 1.00 0.00 H new ATOM 0 HG3 GLN C 40 -18.123 2.164 -2.887 1.00 0.00 H new ATOM 0 HE21 GLN C 40 -20.644 3.135 -1.665 1.00 0.00 H new ATOM 0 HE22 GLN C 40 -21.456 1.695 -1.042 1.00 0.00 H new ATOM 1391 N SER C 41 -14.811 2.966 1.425 1.00 0.00 N ATOM 1392 CA SER C 41 -13.455 2.782 1.962 1.00 0.00 C ATOM 1393 C SER C 41 -13.253 1.411 2.632 1.00 0.00 C ATOM 1394 O SER C 41 -12.499 0.580 2.130 1.00 0.00 O ATOM 1395 CB SER C 41 -13.152 3.902 2.962 1.00 0.00 C ATOM 1396 OG SER C 41 -11.807 3.869 3.398 1.00 0.00 O ATOM 0 H SER C 41 -15.141 3.930 1.478 1.00 0.00 H new ATOM 0 HA SER C 41 -12.764 2.822 1.120 1.00 0.00 H new ATOM 0 HB2 SER C 41 -13.361 4.867 2.500 1.00 0.00 H new ATOM 0 HB3 SER C 41 -13.815 3.810 3.822 1.00 0.00 H new ATOM 0 HG SER C 41 -11.651 4.599 4.033 1.00 0.00 H new ATOM 1402 N ALA C 42 -13.944 1.173 3.744 1.00 0.00 N ATOM 1403 CA ALA C 42 -13.841 -0.093 4.476 1.00 0.00 C ATOM 1404 C ALA C 42 -14.121 -1.292 3.582 1.00 0.00 C ATOM 1405 O ALA C 42 -13.504 -2.346 3.710 1.00 0.00 O ATOM 1406 CB ALA C 42 -14.829 -0.091 5.619 1.00 0.00 C ATOM 0 H ALA C 42 -14.587 1.845 4.163 1.00 0.00 H new ATOM 0 HA ALA C 42 -12.820 -0.179 4.847 1.00 0.00 H new ATOM 0 HB1 ALA C 42 -14.755 -1.031 6.166 1.00 0.00 H new ATOM 0 HB2 ALA C 42 -14.606 0.738 6.291 1.00 0.00 H new ATOM 0 HB3 ALA C 42 -15.840 0.022 5.226 1.00 0.00 H new ATOM 1412 N ASN C 43 -15.060 -1.108 2.683 1.00 0.00 N ATOM 1413 CA ASN C 43 -15.478 -2.150 1.760 1.00 0.00 C ATOM 1414 C ASN C 43 -14.395 -2.440 0.730 1.00 0.00 C ATOM 1415 O ASN C 43 -14.242 -3.581 0.301 1.00 0.00 O ATOM 1416 CB ASN C 43 -16.786 -1.749 1.076 1.00 0.00 C ATOM 1417 CG ASN C 43 -17.211 -2.711 -0.020 1.00 0.00 C ATOM 1418 OD1 ASN C 43 -16.843 -2.549 -1.183 1.00 0.00 O ATOM 1419 ND2 ASN C 43 -17.994 -3.714 0.342 1.00 0.00 N ATOM 0 H ASN C 43 -15.561 -0.227 2.567 1.00 0.00 H new ATOM 0 HA ASN C 43 -15.645 -3.066 2.327 1.00 0.00 H new ATOM 0 HB2 ASN C 43 -17.576 -1.690 1.825 1.00 0.00 H new ATOM 0 HB3 ASN C 43 -16.675 -0.751 0.651 1.00 0.00 H new ATOM 0 HD21 ASN C 43 -18.314 -4.388 -0.354 1.00 0.00 H new ATOM 0 HD22 ASN C 43 -18.277 -3.814 1.317 1.00 0.00 H new ATOM 1426 N LEU C 44 -13.635 -1.419 0.338 1.00 0.00 N ATOM 1427 CA LEU C 44 -12.493 -1.640 -0.539 1.00 0.00 C ATOM 1428 C LEU C 44 -11.439 -2.455 0.198 1.00 0.00 C ATOM 1429 O LEU C 44 -10.752 -3.286 -0.399 1.00 0.00 O ATOM 1430 CB LEU C 44 -11.873 -0.326 -1.043 1.00 0.00 C ATOM 1431 CG LEU C 44 -12.634 0.421 -2.155 1.00 0.00 C ATOM 1432 CD1 LEU C 44 -13.466 -0.523 -3.007 1.00 0.00 C ATOM 1433 CD2 LEU C 44 -13.495 1.533 -1.586 1.00 0.00 C ATOM 0 H LEU C 44 -13.787 -0.448 0.609 1.00 0.00 H new ATOM 0 HA LEU C 44 -12.852 -2.183 -1.413 1.00 0.00 H new ATOM 0 HB2 LEU C 44 -11.767 0.348 -0.193 1.00 0.00 H new ATOM 0 HB3 LEU C 44 -10.868 -0.542 -1.406 1.00 0.00 H new ATOM 0 HG LEU C 44 -11.883 0.872 -2.803 1.00 0.00 H new ATOM 0 HD11 LEU C 44 -13.986 0.045 -3.778 1.00 0.00 H new ATOM 0 HD12 LEU C 44 -12.814 -1.260 -3.476 1.00 0.00 H new ATOM 0 HD13 LEU C 44 -14.196 -1.033 -2.378 1.00 0.00 H new ATOM 0 HD21 LEU C 44 -14.018 2.040 -2.397 1.00 0.00 H new ATOM 0 HD22 LEU C 44 -14.223 1.111 -0.893 1.00 0.00 H new ATOM 0 HD23 LEU C 44 -12.864 2.248 -1.059 1.00 0.00 H new ATOM 1445 N LEU C 45 -11.333 -2.233 1.507 1.00 0.00 N ATOM 1446 CA LEU C 45 -10.413 -2.984 2.331 1.00 0.00 C ATOM 1447 C LEU C 45 -10.911 -4.413 2.511 1.00 0.00 C ATOM 1448 O LEU C 45 -10.132 -5.368 2.468 1.00 0.00 O ATOM 1449 CB LEU C 45 -10.234 -2.298 3.689 1.00 0.00 C ATOM 1450 CG LEU C 45 -9.185 -1.197 3.742 1.00 0.00 C ATOM 1451 CD1 LEU C 45 -8.020 -1.538 2.841 1.00 0.00 C ATOM 1452 CD2 LEU C 45 -9.797 0.124 3.364 1.00 0.00 C ATOM 0 H LEU C 45 -11.879 -1.535 2.013 1.00 0.00 H new ATOM 0 HA LEU C 45 -9.444 -3.018 1.833 1.00 0.00 H new ATOM 0 HB2 LEU C 45 -11.192 -1.875 3.990 1.00 0.00 H new ATOM 0 HB3 LEU C 45 -9.974 -3.057 4.427 1.00 0.00 H new ATOM 0 HG LEU C 45 -8.809 -1.115 4.762 1.00 0.00 H new ATOM 0 HD11 LEU C 45 -7.278 -0.741 2.889 1.00 0.00 H new ATOM 0 HD12 LEU C 45 -7.569 -2.475 3.168 1.00 0.00 H new ATOM 0 HD13 LEU C 45 -8.372 -1.644 1.815 1.00 0.00 H new ATOM 0 HD21 LEU C 45 -9.036 0.903 3.406 1.00 0.00 H new ATOM 0 HD22 LEU C 45 -10.198 0.063 2.352 1.00 0.00 H new ATOM 0 HD23 LEU C 45 -10.601 0.365 4.059 1.00 0.00 H new ATOM 1464 N ALA C 46 -12.214 -4.550 2.701 1.00 0.00 N ATOM 1465 CA ALA C 46 -12.843 -5.855 2.820 1.00 0.00 C ATOM 1466 C ALA C 46 -12.740 -6.626 1.508 1.00 0.00 C ATOM 1467 O ALA C 46 -12.607 -7.852 1.503 1.00 0.00 O ATOM 1468 CB ALA C 46 -14.297 -5.694 3.233 1.00 0.00 C ATOM 0 H ALA C 46 -12.861 -3.765 2.777 1.00 0.00 H new ATOM 0 HA ALA C 46 -12.320 -6.426 3.588 1.00 0.00 H new ATOM 0 HB1 ALA C 46 -14.761 -6.676 3.320 1.00 0.00 H new ATOM 0 HB2 ALA C 46 -14.348 -5.182 4.194 1.00 0.00 H new ATOM 0 HB3 ALA C 46 -14.826 -5.108 2.481 1.00 0.00 H new ATOM 1474 N GLU C 47 -12.801 -5.895 0.401 1.00 0.00 N ATOM 1475 CA GLU C 47 -12.693 -6.481 -0.927 1.00 0.00 C ATOM 1476 C GLU C 47 -11.277 -6.979 -1.177 1.00 0.00 C ATOM 1477 O GLU C 47 -11.070 -8.135 -1.547 1.00 0.00 O ATOM 1478 CB GLU C 47 -13.068 -5.449 -1.989 1.00 0.00 C ATOM 1479 CG GLU C 47 -13.148 -6.026 -3.388 1.00 0.00 C ATOM 1480 CD GLU C 47 -14.222 -7.084 -3.507 1.00 0.00 C ATOM 1481 OE1 GLU C 47 -15.410 -6.745 -3.339 1.00 0.00 O ATOM 1482 OE2 GLU C 47 -13.885 -8.259 -3.763 1.00 0.00 O ATOM 0 H GLU C 47 -12.926 -4.883 0.400 1.00 0.00 H new ATOM 0 HA GLU C 47 -13.380 -7.325 -0.986 1.00 0.00 H new ATOM 0 HB2 GLU C 47 -14.030 -5.006 -1.731 1.00 0.00 H new ATOM 0 HB3 GLU C 47 -12.333 -4.644 -1.978 1.00 0.00 H new ATOM 0 HG2 GLU C 47 -13.349 -5.225 -4.099 1.00 0.00 H new ATOM 0 HG3 GLU C 47 -12.184 -6.457 -3.657 1.00 0.00 H new ATOM 1489 N ALA C 48 -10.307 -6.093 -0.982 1.00 0.00 N ATOM 1490 CA ALA C 48 -8.900 -6.450 -1.117 1.00 0.00 C ATOM 1491 C ALA C 48 -8.560 -7.645 -0.241 1.00 0.00 C ATOM 1492 O ALA C 48 -7.805 -8.527 -0.650 1.00 0.00 O ATOM 1493 CB ALA C 48 -8.005 -5.273 -0.753 1.00 0.00 C ATOM 0 H ALA C 48 -10.470 -5.119 -0.729 1.00 0.00 H new ATOM 0 HA ALA C 48 -8.724 -6.716 -2.159 1.00 0.00 H new ATOM 0 HB1 ALA C 48 -6.960 -5.563 -0.861 1.00 0.00 H new ATOM 0 HB2 ALA C 48 -8.219 -4.434 -1.416 1.00 0.00 H new ATOM 0 HB3 ALA C 48 -8.194 -4.977 0.279 1.00 0.00 H new ATOM 1499 N LYS C 49 -9.117 -7.671 0.969 1.00 0.00 N ATOM 1500 CA LYS C 49 -8.867 -8.762 1.900 1.00 0.00 C ATOM 1501 C LYS C 49 -9.285 -10.103 1.303 1.00 0.00 C ATOM 1502 O LYS C 49 -8.651 -11.123 1.563 1.00 0.00 O ATOM 1503 CB LYS C 49 -9.581 -8.523 3.234 1.00 0.00 C ATOM 1504 CG LYS C 49 -8.662 -8.033 4.338 1.00 0.00 C ATOM 1505 CD LYS C 49 -9.310 -8.170 5.707 1.00 0.00 C ATOM 1506 CE LYS C 49 -10.586 -7.351 5.819 1.00 0.00 C ATOM 1507 NZ LYS C 49 -11.262 -7.558 7.126 1.00 0.00 N ATOM 0 H LYS C 49 -9.743 -6.948 1.324 1.00 0.00 H new ATOM 0 HA LYS C 49 -7.794 -8.794 2.088 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -10.376 -7.793 3.085 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -10.056 -9.451 3.553 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -7.732 -8.601 4.317 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -8.403 -6.989 4.160 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -9.535 -9.219 5.898 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -8.606 -7.850 6.475 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -10.351 -6.294 5.695 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -11.265 -7.624 5.011 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -12.128 -6.983 7.164 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -11.509 -8.563 7.234 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -10.623 -7.274 7.896 1.00 0.00 H new ATOM 1521 N LYS C 50 -10.331 -10.094 0.483 1.00 0.00 N ATOM 1522 CA LYS C 50 -10.778 -11.307 -0.196 1.00 0.00 C ATOM 1523 C LYS C 50 -9.715 -11.779 -1.178 1.00 0.00 C ATOM 1524 O LYS C 50 -9.421 -12.968 -1.260 1.00 0.00 O ATOM 1525 CB LYS C 50 -12.098 -11.062 -0.931 1.00 0.00 C ATOM 1526 CG LYS C 50 -13.238 -10.649 -0.017 1.00 0.00 C ATOM 1527 CD LYS C 50 -13.581 -11.743 0.979 1.00 0.00 C ATOM 1528 CE LYS C 50 -14.634 -11.280 1.970 1.00 0.00 C ATOM 1529 NZ LYS C 50 -14.168 -10.113 2.763 1.00 0.00 N ATOM 0 H LYS C 50 -10.884 -9.263 0.272 1.00 0.00 H new ATOM 0 HA LYS C 50 -10.939 -12.081 0.555 1.00 0.00 H new ATOM 0 HB2 LYS C 50 -11.947 -10.287 -1.682 1.00 0.00 H new ATOM 0 HB3 LYS C 50 -12.381 -11.970 -1.463 1.00 0.00 H new ATOM 0 HG2 LYS C 50 -12.964 -9.741 0.520 1.00 0.00 H new ATOM 0 HG3 LYS C 50 -14.118 -10.412 -0.616 1.00 0.00 H new ATOM 0 HD2 LYS C 50 -13.943 -12.622 0.446 1.00 0.00 H new ATOM 0 HD3 LYS C 50 -12.681 -12.044 1.516 1.00 0.00 H new ATOM 0 HE2 LYS C 50 -15.546 -11.015 1.435 1.00 0.00 H new ATOM 0 HE3 LYS C 50 -14.886 -12.100 2.643 1.00 0.00 H new ATOM 0 HZ1 LYS C 50 -14.845 -9.921 3.528 1.00 0.00 H new ATOM 0 HZ2 LYS C 50 -13.234 -10.321 3.171 1.00 0.00 H new ATOM 0 HZ3 LYS C 50 -14.098 -9.279 2.145 1.00 0.00 H new ATOM 1543 N LEU C 51 -9.140 -10.831 -1.907 1.00 0.00 N ATOM 1544 CA LEU C 51 -8.044 -11.112 -2.828 1.00 0.00 C ATOM 1545 C LEU C 51 -6.844 -11.670 -2.074 1.00 0.00 C ATOM 1546 O LEU C 51 -6.237 -12.660 -2.486 1.00 0.00 O ATOM 1547 CB LEU C 51 -7.635 -9.826 -3.537 1.00 0.00 C ATOM 1548 CG LEU C 51 -7.896 -9.771 -5.036 1.00 0.00 C ATOM 1549 CD1 LEU C 51 -7.669 -8.358 -5.531 1.00 0.00 C ATOM 1550 CD2 LEU C 51 -6.994 -10.744 -5.779 1.00 0.00 C ATOM 0 H LEU C 51 -9.418 -9.850 -1.878 1.00 0.00 H new ATOM 0 HA LEU C 51 -8.380 -11.850 -3.556 1.00 0.00 H new ATOM 0 HB2 LEU C 51 -8.160 -8.994 -3.067 1.00 0.00 H new ATOM 0 HB3 LEU C 51 -6.570 -9.666 -3.369 1.00 0.00 H new ATOM 0 HG LEU C 51 -8.929 -10.061 -5.227 1.00 0.00 H new ATOM 0 HD11 LEU C 51 -7.855 -8.314 -6.604 1.00 0.00 H new ATOM 0 HD12 LEU C 51 -8.349 -7.679 -5.017 1.00 0.00 H new ATOM 0 HD13 LEU C 51 -6.639 -8.063 -5.329 1.00 0.00 H new ATOM 0 HD21 LEU C 51 -7.199 -10.686 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU C 51 -5.951 -10.486 -5.595 1.00 0.00 H new ATOM 0 HD23 LEU C 51 -7.184 -11.758 -5.427 1.00 0.00 H new ATOM 1562 N ASN C 52 -6.505 -11.009 -0.974 1.00 0.00 N ATOM 1563 CA ASN C 52 -5.409 -11.432 -0.113 1.00 0.00 C ATOM 1564 C ASN C 52 -5.598 -12.867 0.379 1.00 0.00 C ATOM 1565 O ASN C 52 -4.643 -13.638 0.429 1.00 0.00 O ATOM 1566 CB ASN C 52 -5.286 -10.472 1.074 1.00 0.00 C ATOM 1567 CG ASN C 52 -4.189 -10.870 2.038 1.00 0.00 C ATOM 1568 OD1 ASN C 52 -3.028 -10.527 1.841 1.00 0.00 O ATOM 1569 ND2 ASN C 52 -4.551 -11.570 3.098 1.00 0.00 N ATOM 0 H ASN C 52 -6.982 -10.166 -0.654 1.00 0.00 H new ATOM 0 HA ASN C 52 -4.489 -11.407 -0.697 1.00 0.00 H new ATOM 0 HB2 ASN C 52 -5.090 -9.466 0.703 1.00 0.00 H new ATOM 0 HB3 ASN C 52 -6.236 -10.436 1.607 1.00 0.00 H new ATOM 0 HD21 ASN C 52 -3.854 -11.845 3.790 1.00 0.00 H new ATOM 0 HD22 ASN C 52 -5.528 -11.835 3.225 1.00 0.00 H new ATOM 1576 N ASP C 53 -6.826 -13.222 0.738 1.00 0.00 N ATOM 1577 CA ASP C 53 -7.123 -14.576 1.204 1.00 0.00 C ATOM 1578 C ASP C 53 -7.183 -15.548 0.036 1.00 0.00 C ATOM 1579 O ASP C 53 -6.891 -16.735 0.185 1.00 0.00 O ATOM 1580 CB ASP C 53 -8.453 -14.633 1.959 1.00 0.00 C ATOM 1581 CG ASP C 53 -8.476 -13.793 3.219 1.00 0.00 C ATOM 1582 OD1 ASP C 53 -7.454 -13.755 3.942 1.00 0.00 O ATOM 1583 OD2 ASP C 53 -9.529 -13.180 3.508 1.00 0.00 O ATOM 0 H ASP C 53 -7.631 -12.596 0.717 1.00 0.00 H new ATOM 0 HA ASP C 53 -6.318 -14.861 1.881 1.00 0.00 H new ATOM 0 HB2 ASP C 53 -9.251 -14.299 1.296 1.00 0.00 H new ATOM 0 HB3 ASP C 53 -8.668 -15.669 2.220 1.00 0.00 H new ATOM 1588 N ALA C 54 -7.563 -15.036 -1.121 1.00 0.00 N ATOM 1589 CA ALA C 54 -7.711 -15.844 -2.318 1.00 0.00 C ATOM 1590 C ALA C 54 -6.381 -16.429 -2.759 1.00 0.00 C ATOM 1591 O ALA C 54 -6.244 -17.640 -2.912 1.00 0.00 O ATOM 1592 CB ALA C 54 -8.296 -14.998 -3.424 1.00 0.00 C ATOM 0 H ALA C 54 -7.778 -14.048 -1.257 1.00 0.00 H new ATOM 0 HA ALA C 54 -8.381 -16.674 -2.093 1.00 0.00 H new ATOM 0 HB1 ALA C 54 -8.408 -15.603 -4.324 1.00 0.00 H new ATOM 0 HB2 ALA C 54 -9.271 -14.621 -3.116 1.00 0.00 H new ATOM 0 HB3 ALA C 54 -7.631 -14.159 -3.631 1.00 0.00 H new ATOM 1598 N GLN C 55 -5.399 -15.563 -2.955 1.00 0.00 N ATOM 1599 CA GLN C 55 -4.085 -16.003 -3.391 1.00 0.00 C ATOM 1600 C GLN C 55 -3.152 -16.159 -2.197 1.00 0.00 C ATOM 1601 O GLN C 55 -1.932 -16.053 -2.326 1.00 0.00 O ATOM 1602 CB GLN C 55 -3.502 -15.029 -4.422 1.00 0.00 C ATOM 1603 CG GLN C 55 -3.320 -13.609 -3.912 1.00 0.00 C ATOM 1604 CD GLN C 55 -2.889 -12.654 -5.007 1.00 0.00 C ATOM 1605 OE1 GLN C 55 -1.700 -12.484 -5.272 1.00 0.00 O ATOM 1606 NE2 GLN C 55 -3.853 -12.026 -5.658 1.00 0.00 N ATOM 0 H GLN C 55 -5.487 -14.556 -2.820 1.00 0.00 H new ATOM 0 HA GLN C 55 -4.188 -16.976 -3.871 1.00 0.00 H new ATOM 0 HB2 GLN C 55 -2.536 -15.408 -4.757 1.00 0.00 H new ATOM 0 HB3 GLN C 55 -4.156 -15.008 -5.294 1.00 0.00 H new ATOM 0 HG2 GLN C 55 -4.256 -13.259 -3.476 1.00 0.00 H new ATOM 0 HG3 GLN C 55 -2.576 -13.604 -3.115 1.00 0.00 H new ATOM 0 HE21 GLN C 55 -4.828 -12.193 -5.410 1.00 0.00 H new ATOM 0 HE22 GLN C 55 -3.622 -11.375 -6.408 1.00 0.00 H new ATOM 1615 N ALA C 56 -3.744 -16.405 -1.034 1.00 0.00 N ATOM 1616 CA ALA C 56 -2.986 -16.652 0.181 1.00 0.00 C ATOM 1617 C ALA C 56 -2.164 -17.930 0.061 1.00 0.00 C ATOM 1618 O ALA C 56 -0.921 -17.842 0.006 1.00 0.00 O ATOM 1619 CB ALA C 56 -3.931 -16.736 1.366 1.00 0.00 C ATOM 0 H ALA C 56 -4.756 -16.438 -0.910 1.00 0.00 H new ATOM 0 HA ALA C 56 -2.294 -15.824 0.335 1.00 0.00 H new ATOM 0 HB1 ALA C 56 -3.359 -16.921 2.275 1.00 0.00 H new ATOM 0 HB2 ALA C 56 -4.475 -15.797 1.465 1.00 0.00 H new ATOM 0 HB3 ALA C 56 -4.638 -17.550 1.210 1.00 0.00 H new