USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 785 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 90 ASN : amide:sc= 1.57 K(o=3.2,f=2.2) USER MOD Set 1.2: A 102 GLN : amide:sc= 1.6 K(o=3.2,f=2.2) USER MOD Set 2.1: A 63 LYS NZ :NH3+ 175:sc= 2.04 (180deg=1.12) USER MOD Set 2.2: A 67 SER OG : rot -160:sc= 0.826 USER MOD Set 3.1: A 38 SER OG : rot 140:sc= 0.69 USER MOD Set 3.2: A 49 LYS NZ :NH3+ -175:sc= 0.768 (180deg=0) USER MOD Set 4.1: A 25 THR OG1 : rot -70:sc= 2.04 USER MOD Set 4.2: A 27 SER OG : rot -115:sc= 1.2 USER MOD Single : A 1 SER N :NH3+ -140:sc= 0.00854 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0903 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0.0311 USER MOD Single : A 10 ASN : amide:sc= 0.407 K(o=0.41,f=-5.9!) USER MOD Single : A 11 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc=-0.00682 K(o=-0.0068,f=-0.93) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.156 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= 1.06 K(o=1.1,f=-0.094) USER MOD Single : A 36 MET CE :methyl 179:sc= -0.0105 (180deg=-0.0116) USER MOD Single : A 39 THR OG1 : rot -79:sc= 1.27 USER MOD Single : A 52 SER OG : rot 82:sc= 0.756 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.00112 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0.429 USER MOD Single : A 86 GLN : amide:sc= 1.08 K(o=1.1,f=-0.18) USER MOD Single : A 87 GLN : amide:sc= 1.22 K(o=1.2,f=-0.44) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc=0.000809 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -10.303 -14.306 6.445 1.00 0.00 N ATOM 2 CA SER A 1 -10.099 -13.930 7.871 1.00 0.00 C ATOM 3 C SER A 1 -10.080 -12.407 8.067 1.00 0.00 C ATOM 4 O SER A 1 -11.074 -11.845 8.529 1.00 0.00 O ATOM 5 CB SER A 1 -8.849 -14.601 8.467 1.00 0.00 C ATOM 6 OG SER A 1 -7.714 -14.343 7.653 1.00 0.00 O ATOM 0 H1 SER A 1 -10.943 -15.124 6.390 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.721 -13.504 5.931 1.00 0.00 H new ATOM 0 H3 SER A 1 -9.388 -14.553 6.017 1.00 0.00 H new ATOM 0 HA SER A 1 -10.958 -14.309 8.424 1.00 0.00 H new ATOM 0 HB2 SER A 1 -8.674 -14.227 9.476 1.00 0.00 H new ATOM 0 HB3 SER A 1 -9.009 -15.676 8.549 1.00 0.00 H new ATOM 0 HG SER A 1 -6.926 -14.774 8.045 1.00 0.00 H new ATOM 14 N VAL A 2 -8.984 -11.721 7.706 1.00 0.00 N ATOM 15 CA VAL A 2 -8.796 -10.255 7.819 1.00 0.00 C ATOM 16 C VAL A 2 -8.232 -9.644 6.527 1.00 0.00 C ATOM 17 O VAL A 2 -7.599 -10.335 5.723 1.00 0.00 O ATOM 18 CB VAL A 2 -7.902 -9.880 9.024 1.00 0.00 C ATOM 19 CG1 VAL A 2 -8.566 -10.247 10.356 1.00 0.00 C ATOM 20 CG2 VAL A 2 -6.511 -10.527 8.981 1.00 0.00 C ATOM 0 H VAL A 2 -8.167 -12.187 7.310 1.00 0.00 H new ATOM 0 HA VAL A 2 -9.787 -9.833 7.986 1.00 0.00 H new ATOM 0 HB VAL A 2 -7.777 -8.800 8.950 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -7.908 -9.969 11.179 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -9.512 -9.713 10.450 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -8.751 -11.321 10.387 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -5.940 -10.220 9.857 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -6.614 -11.612 8.978 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -5.990 -10.209 8.078 1.00 0.00 H new ATOM 30 N SER A 3 -8.443 -8.340 6.327 1.00 0.00 N ATOM 31 CA SER A 3 -7.962 -7.590 5.153 1.00 0.00 C ATOM 32 C SER A 3 -6.442 -7.401 5.173 1.00 0.00 C ATOM 33 O SER A 3 -5.859 -7.044 6.202 1.00 0.00 O ATOM 34 CB SER A 3 -8.656 -6.220 5.074 1.00 0.00 C ATOM 35 OG SER A 3 -10.072 -6.362 5.081 1.00 0.00 O ATOM 0 H SER A 3 -8.962 -7.761 6.987 1.00 0.00 H new ATOM 0 HA SER A 3 -8.212 -8.178 4.270 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.345 -5.602 5.917 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.344 -5.702 4.167 1.00 0.00 H new ATOM 0 HG SER A 3 -10.490 -5.477 5.032 1.00 0.00 H new ATOM 41 N ILE A 4 -5.803 -7.618 4.020 1.00 0.00 N ATOM 42 CA ILE A 4 -4.334 -7.621 3.835 1.00 0.00 C ATOM 43 C ILE A 4 -3.830 -6.701 2.699 1.00 0.00 C ATOM 44 O ILE A 4 -2.629 -6.652 2.432 1.00 0.00 O ATOM 45 CB ILE A 4 -3.809 -9.076 3.712 1.00 0.00 C ATOM 46 CG1 ILE A 4 -4.647 -10.032 2.829 1.00 0.00 C ATOM 47 CG2 ILE A 4 -3.696 -9.702 5.112 1.00 0.00 C ATOM 48 CD1 ILE A 4 -4.997 -9.501 1.435 1.00 0.00 C ATOM 0 H ILE A 4 -6.306 -7.804 3.152 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.906 -7.177 4.734 1.00 0.00 H new ATOM 0 HB ILE A 4 -2.846 -8.972 3.211 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -4.100 -10.968 2.716 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -5.573 -10.265 3.354 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -3.327 -10.724 5.025 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -3.004 -9.117 5.717 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -4.677 -9.710 5.587 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -5.584 -10.246 0.899 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.576 -8.582 1.530 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.080 -9.296 0.883 1.00 0.00 H new ATOM 60 N LEU A 5 -4.715 -5.917 2.066 1.00 0.00 N ATOM 61 CA LEU A 5 -4.376 -4.929 1.021 1.00 0.00 C ATOM 62 C LEU A 5 -4.007 -3.568 1.652 1.00 0.00 C ATOM 63 O LEU A 5 -4.632 -2.535 1.386 1.00 0.00 O ATOM 64 CB LEU A 5 -5.517 -4.845 -0.016 1.00 0.00 C ATOM 65 CG LEU A 5 -5.864 -6.163 -0.735 1.00 0.00 C ATOM 66 CD1 LEU A 5 -6.997 -5.918 -1.730 1.00 0.00 C ATOM 67 CD2 LEU A 5 -4.678 -6.759 -1.499 1.00 0.00 C ATOM 0 H LEU A 5 -5.714 -5.950 2.269 1.00 0.00 H new ATOM 0 HA LEU A 5 -3.487 -5.254 0.480 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -6.413 -4.479 0.486 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -5.247 -4.103 -0.767 1.00 0.00 H new ATOM 0 HG LEU A 5 -6.156 -6.873 0.039 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -7.242 -6.850 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -7.876 -5.553 -1.198 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -6.683 -5.176 -2.464 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -4.986 -7.686 -1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -4.338 -6.050 -2.254 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -3.864 -6.966 -0.804 1.00 0.00 H new ATOM 79 N ARG A 6 -3.019 -3.593 2.557 1.00 0.00 N ATOM 80 CA ARG A 6 -2.629 -2.478 3.442 1.00 0.00 C ATOM 81 C ARG A 6 -1.549 -1.573 2.825 1.00 0.00 C ATOM 82 O ARG A 6 -0.805 -2.001 1.938 1.00 0.00 O ATOM 83 CB ARG A 6 -2.179 -3.032 4.809 1.00 0.00 C ATOM 84 CG ARG A 6 -3.270 -3.872 5.496 1.00 0.00 C ATOM 85 CD ARG A 6 -2.799 -4.410 6.852 1.00 0.00 C ATOM 86 NE ARG A 6 -3.753 -5.407 7.375 1.00 0.00 N ATOM 87 CZ ARG A 6 -3.713 -6.025 8.542 1.00 0.00 C ATOM 88 NH1 ARG A 6 -2.802 -5.768 9.437 1.00 0.00 N ATOM 89 NH2 ARG A 6 -4.609 -6.930 8.809 1.00 0.00 N ATOM 0 H ARG A 6 -2.444 -4.423 2.701 1.00 0.00 H new ATOM 0 HA ARG A 6 -3.506 -1.845 3.579 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -1.287 -3.643 4.673 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -1.901 -2.203 5.459 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -4.164 -3.264 5.636 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -3.549 -4.705 4.851 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -1.813 -4.862 6.747 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -2.699 -3.588 7.561 1.00 0.00 H new ATOM 0 HE ARG A 6 -4.534 -5.647 6.765 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -2.085 -5.067 9.248 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -2.806 -6.267 10.326 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -5.329 -7.153 8.122 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -4.592 -7.416 9.706 1.00 0.00 H new ATOM 103 N SER A 7 -1.469 -0.340 3.346 1.00 0.00 N ATOM 104 CA SER A 7 -0.456 0.691 3.042 1.00 0.00 C ATOM 105 C SER A 7 -0.187 0.915 1.534 1.00 0.00 C ATOM 106 O SER A 7 -1.110 0.828 0.718 1.00 0.00 O ATOM 107 CB SER A 7 0.799 0.476 3.914 1.00 0.00 C ATOM 108 OG SER A 7 1.540 -0.671 3.524 1.00 0.00 O ATOM 0 H SER A 7 -2.149 -0.013 4.032 1.00 0.00 H new ATOM 0 HA SER A 7 -0.876 1.656 3.325 1.00 0.00 H new ATOM 0 HB2 SER A 7 1.438 1.357 3.850 1.00 0.00 H new ATOM 0 HB3 SER A 7 0.500 0.374 4.957 1.00 0.00 H new ATOM 0 HG SER A 7 2.325 -0.765 4.103 1.00 0.00 H new ATOM 114 N SER A 8 1.041 1.297 1.159 1.00 0.00 N ATOM 115 CA SER A 8 1.460 1.650 -0.208 1.00 0.00 C ATOM 116 C SER A 8 2.956 1.351 -0.440 1.00 0.00 C ATOM 117 O SER A 8 3.644 0.843 0.451 1.00 0.00 O ATOM 118 CB SER A 8 1.143 3.135 -0.457 1.00 0.00 C ATOM 119 OG SER A 8 1.201 3.434 -1.847 1.00 0.00 O ATOM 0 H SER A 8 1.806 1.372 1.830 1.00 0.00 H new ATOM 0 HA SER A 8 0.907 1.036 -0.919 1.00 0.00 H new ATOM 0 HB2 SER A 8 0.152 3.370 -0.070 1.00 0.00 H new ATOM 0 HB3 SER A 8 1.853 3.760 0.085 1.00 0.00 H new ATOM 0 HG SER A 8 0.995 4.382 -1.987 1.00 0.00 H new ATOM 125 N VAL A 9 3.472 1.659 -1.636 1.00 0.00 N ATOM 126 CA VAL A 9 4.890 1.490 -2.019 1.00 0.00 C ATOM 127 C VAL A 9 5.807 2.275 -1.068 1.00 0.00 C ATOM 128 O VAL A 9 5.553 3.445 -0.768 1.00 0.00 O ATOM 129 CB VAL A 9 5.125 1.919 -3.484 1.00 0.00 C ATOM 130 CG1 VAL A 9 6.584 1.720 -3.920 1.00 0.00 C ATOM 131 CG2 VAL A 9 4.246 1.118 -4.454 1.00 0.00 C ATOM 0 H VAL A 9 2.903 2.044 -2.390 1.00 0.00 H new ATOM 0 HA VAL A 9 5.136 0.431 -1.936 1.00 0.00 H new ATOM 0 HB VAL A 9 4.869 2.978 -3.521 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.700 2.035 -4.957 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.238 2.316 -3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 9 6.851 0.667 -3.829 1.00 0.00 H new ATOM 0 HG21 VAL A 9 4.438 1.447 -5.475 1.00 0.00 H new ATOM 0 HG22 VAL A 9 4.479 0.057 -4.365 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.196 1.281 -4.212 1.00 0.00 H new ATOM 141 N ASN A 10 6.880 1.633 -0.591 1.00 0.00 N ATOM 142 CA ASN A 10 7.791 2.196 0.412 1.00 0.00 C ATOM 143 C ASN A 10 8.678 3.315 -0.175 1.00 0.00 C ATOM 144 O ASN A 10 9.394 3.109 -1.158 1.00 0.00 O ATOM 145 CB ASN A 10 8.606 1.029 1.016 1.00 0.00 C ATOM 146 CG ASN A 10 9.506 1.415 2.181 1.00 0.00 C ATOM 147 OD1 ASN A 10 9.680 2.573 2.525 1.00 0.00 O ATOM 148 ND2 ASN A 10 10.122 0.449 2.822 1.00 0.00 N ATOM 0 H ASN A 10 7.143 0.696 -0.895 1.00 0.00 H new ATOM 0 HA ASN A 10 7.224 2.683 1.205 1.00 0.00 H new ATOM 0 HB2 ASN A 10 7.914 0.256 1.350 1.00 0.00 H new ATOM 0 HB3 ASN A 10 9.221 0.589 0.231 1.00 0.00 H new ATOM 0 HD21 ASN A 10 10.741 0.669 3.602 1.00 0.00 H new ATOM 0 HD22 ASN A 10 9.981 -0.521 2.540 1.00 0.00 H new ATOM 155 N HIS A 11 8.683 4.491 0.466 1.00 0.00 N ATOM 156 CA HIS A 11 9.478 5.666 0.063 1.00 0.00 C ATOM 157 C HIS A 11 10.989 5.503 0.278 1.00 0.00 C ATOM 158 O HIS A 11 11.761 6.251 -0.318 1.00 0.00 O ATOM 159 CB HIS A 11 8.966 6.905 0.817 1.00 0.00 C ATOM 160 CG HIS A 11 7.504 7.196 0.580 1.00 0.00 C ATOM 161 ND1 HIS A 11 6.449 6.775 1.397 1.00 0.00 N ATOM 162 CD2 HIS A 11 6.993 7.895 -0.476 1.00 0.00 C ATOM 163 CE1 HIS A 11 5.326 7.226 0.810 1.00 0.00 C ATOM 164 NE2 HIS A 11 5.623 7.904 -0.313 1.00 0.00 N ATOM 0 H HIS A 11 8.121 4.659 1.301 1.00 0.00 H new ATOM 0 HA HIS A 11 9.344 5.782 -1.013 1.00 0.00 H new ATOM 0 HB2 HIS A 11 9.131 6.764 1.885 1.00 0.00 H new ATOM 0 HB3 HIS A 11 9.554 7.772 0.515 1.00 0.00 H new ATOM 0 HD2 HIS A 11 7.551 8.351 -1.280 1.00 0.00 H new ATOM 0 HE1 HIS A 11 4.327 7.066 1.187 1.00 0.00 H new ATOM 0 HE2 HIS A 11 4.950 8.349 -0.937 1.00 0.00 H new ATOM 172 N ARG A 12 11.435 4.519 1.072 1.00 0.00 N ATOM 173 CA ARG A 12 12.865 4.277 1.363 1.00 0.00 C ATOM 174 C ARG A 12 13.701 4.014 0.108 1.00 0.00 C ATOM 175 O ARG A 12 14.836 4.467 0.031 1.00 0.00 O ATOM 176 CB ARG A 12 12.975 3.116 2.371 1.00 0.00 C ATOM 177 CG ARG A 12 14.401 2.931 2.923 1.00 0.00 C ATOM 178 CD ARG A 12 14.486 1.803 3.961 1.00 0.00 C ATOM 179 NE ARG A 12 13.752 2.126 5.204 1.00 0.00 N ATOM 180 CZ ARG A 12 13.588 1.331 6.247 1.00 0.00 C ATOM 181 NH1 ARG A 12 14.065 0.118 6.281 1.00 0.00 N ATOM 182 NH2 ARG A 12 12.928 1.745 7.291 1.00 0.00 N ATOM 0 H ARG A 12 10.811 3.860 1.537 1.00 0.00 H new ATOM 0 HA ARG A 12 13.282 5.186 1.796 1.00 0.00 H new ATOM 0 HB2 ARG A 12 12.291 3.296 3.200 1.00 0.00 H new ATOM 0 HB3 ARG A 12 12.655 2.192 1.889 1.00 0.00 H new ATOM 0 HG2 ARG A 12 15.081 2.715 2.099 1.00 0.00 H new ATOM 0 HG3 ARG A 12 14.736 3.864 3.376 1.00 0.00 H new ATOM 0 HD2 ARG A 12 14.082 0.886 3.531 1.00 0.00 H new ATOM 0 HD3 ARG A 12 15.532 1.610 4.199 1.00 0.00 H new ATOM 0 HE ARG A 12 13.331 3.053 5.262 1.00 0.00 H new ATOM 0 HH11 ARG A 12 14.586 -0.248 5.484 1.00 0.00 H new ATOM 0 HH12 ARG A 12 13.917 -0.465 7.105 1.00 0.00 H new ATOM 0 HH21 ARG A 12 12.535 2.686 7.306 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.804 1.128 8.094 1.00 0.00 H new ATOM 196 N GLU A 13 13.133 3.355 -0.902 1.00 0.00 N ATOM 197 CA GLU A 13 13.818 3.130 -2.189 1.00 0.00 C ATOM 198 C GLU A 13 14.004 4.441 -2.980 1.00 0.00 C ATOM 199 O GLU A 13 15.052 4.667 -3.583 1.00 0.00 O ATOM 200 CB GLU A 13 13.024 2.084 -2.988 1.00 0.00 C ATOM 201 CG GLU A 13 13.756 1.626 -4.254 1.00 0.00 C ATOM 202 CD GLU A 13 12.991 0.479 -4.944 1.00 0.00 C ATOM 203 OE1 GLU A 13 12.110 0.753 -5.797 1.00 0.00 O ATOM 204 OE2 GLU A 13 13.270 -0.708 -4.642 1.00 0.00 O ATOM 0 H GLU A 13 12.193 2.962 -0.859 1.00 0.00 H new ATOM 0 HA GLU A 13 14.824 2.754 -2.002 1.00 0.00 H new ATOM 0 HB2 GLU A 13 12.829 1.220 -2.353 1.00 0.00 H new ATOM 0 HB3 GLU A 13 12.056 2.502 -3.264 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.861 2.465 -4.942 1.00 0.00 H new ATOM 0 HG3 GLU A 13 14.763 1.296 -3.998 1.00 0.00 H new ATOM 211 N VAL A 14 13.019 5.348 -2.918 1.00 0.00 N ATOM 212 CA VAL A 14 13.096 6.687 -3.535 1.00 0.00 C ATOM 213 C VAL A 14 14.114 7.566 -2.795 1.00 0.00 C ATOM 214 O VAL A 14 14.916 8.257 -3.419 1.00 0.00 O ATOM 215 CB VAL A 14 11.706 7.363 -3.570 1.00 0.00 C ATOM 216 CG1 VAL A 14 11.722 8.650 -4.404 1.00 0.00 C ATOM 217 CG2 VAL A 14 10.623 6.457 -4.175 1.00 0.00 C ATOM 0 H VAL A 14 12.137 5.175 -2.435 1.00 0.00 H new ATOM 0 HA VAL A 14 13.434 6.566 -4.564 1.00 0.00 H new ATOM 0 HB VAL A 14 11.473 7.577 -2.527 1.00 0.00 H new ATOM 0 HG11 VAL A 14 10.727 9.096 -4.404 1.00 0.00 H new ATOM 0 HG12 VAL A 14 12.435 9.354 -3.974 1.00 0.00 H new ATOM 0 HG13 VAL A 14 12.016 8.417 -5.427 1.00 0.00 H new ATOM 0 HG21 VAL A 14 9.668 6.982 -4.175 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.895 6.199 -5.198 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.537 5.547 -3.582 1.00 0.00 H new ATOM 227 N ASP A 15 14.131 7.503 -1.459 1.00 0.00 N ATOM 228 CA ASP A 15 15.114 8.205 -0.626 1.00 0.00 C ATOM 229 C ASP A 15 16.551 7.688 -0.835 1.00 0.00 C ATOM 230 O ASP A 15 17.485 8.481 -0.948 1.00 0.00 O ATOM 231 CB ASP A 15 14.693 8.058 0.841 1.00 0.00 C ATOM 232 CG ASP A 15 15.533 8.972 1.730 1.00 0.00 C ATOM 233 OD1 ASP A 15 15.335 10.208 1.630 1.00 0.00 O ATOM 234 OD2 ASP A 15 16.369 8.483 2.519 1.00 0.00 O ATOM 0 H ASP A 15 13.457 6.959 -0.921 1.00 0.00 H new ATOM 0 HA ASP A 15 15.128 9.255 -0.919 1.00 0.00 H new ATOM 0 HB2 ASP A 15 13.637 8.305 0.949 1.00 0.00 H new ATOM 0 HB3 ASP A 15 14.812 7.022 1.158 1.00 0.00 H new ATOM 239 N GLU A 16 16.725 6.370 -0.967 1.00 0.00 N ATOM 240 CA GLU A 16 18.000 5.746 -1.331 1.00 0.00 C ATOM 241 C GLU A 16 18.454 6.167 -2.734 1.00 0.00 C ATOM 242 O GLU A 16 19.632 6.469 -2.924 1.00 0.00 O ATOM 243 CB GLU A 16 17.873 4.217 -1.228 1.00 0.00 C ATOM 244 CG GLU A 16 19.140 3.485 -1.688 1.00 0.00 C ATOM 245 CD GLU A 16 19.027 1.974 -1.424 1.00 0.00 C ATOM 246 OE1 GLU A 16 18.495 1.238 -2.294 1.00 0.00 O ATOM 247 OE2 GLU A 16 19.478 1.505 -0.349 1.00 0.00 O ATOM 0 H GLU A 16 15.973 5.697 -0.822 1.00 0.00 H new ATOM 0 HA GLU A 16 18.764 6.088 -0.633 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.655 3.943 -0.196 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.028 3.885 -1.831 1.00 0.00 H new ATOM 0 HG2 GLU A 16 19.301 3.661 -2.752 1.00 0.00 H new ATOM 0 HG3 GLU A 16 20.007 3.886 -1.164 1.00 0.00 H new ATOM 254 N ALA A 17 17.545 6.238 -3.710 1.00 0.00 N ATOM 255 CA ALA A 17 17.876 6.703 -5.057 1.00 0.00 C ATOM 256 C ALA A 17 18.300 8.191 -5.066 1.00 0.00 C ATOM 257 O ALA A 17 19.282 8.552 -5.721 1.00 0.00 O ATOM 258 CB ALA A 17 16.684 6.433 -5.979 1.00 0.00 C ATOM 0 H ALA A 17 16.566 5.977 -3.589 1.00 0.00 H new ATOM 0 HA ALA A 17 18.740 6.150 -5.427 1.00 0.00 H new ATOM 0 HB1 ALA A 17 16.919 6.776 -6.987 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.474 5.364 -5.999 1.00 0.00 H new ATOM 0 HB3 ALA A 17 15.809 6.967 -5.609 1.00 0.00 H new ATOM 264 N ILE A 18 17.619 9.038 -4.284 1.00 0.00 N ATOM 265 CA ILE A 18 18.021 10.434 -4.050 1.00 0.00 C ATOM 266 C ILE A 18 19.424 10.510 -3.443 1.00 0.00 C ATOM 267 O ILE A 18 20.262 11.257 -3.946 1.00 0.00 O ATOM 268 CB ILE A 18 16.969 11.150 -3.171 1.00 0.00 C ATOM 269 CG1 ILE A 18 15.784 11.554 -4.067 1.00 0.00 C ATOM 270 CG2 ILE A 18 17.518 12.385 -2.426 1.00 0.00 C ATOM 271 CD1 ILE A 18 14.496 11.794 -3.282 1.00 0.00 C ATOM 0 H ILE A 18 16.766 8.773 -3.791 1.00 0.00 H new ATOM 0 HA ILE A 18 18.065 10.952 -5.008 1.00 0.00 H new ATOM 0 HB ILE A 18 16.659 10.452 -2.394 1.00 0.00 H new ATOM 0 HG12 ILE A 18 16.043 12.460 -4.615 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.612 10.772 -4.806 1.00 0.00 H new ATOM 0 HG21 ILE A 18 16.723 12.834 -1.831 1.00 0.00 H new ATOM 0 HG22 ILE A 18 18.335 12.081 -1.771 1.00 0.00 H new ATOM 0 HG23 ILE A 18 17.885 13.113 -3.150 1.00 0.00 H new ATOM 0 HD11 ILE A 18 13.698 12.076 -3.969 1.00 0.00 H new ATOM 0 HD12 ILE A 18 14.216 10.882 -2.755 1.00 0.00 H new ATOM 0 HD13 ILE A 18 14.654 12.596 -2.561 1.00 0.00 H new ATOM 283 N ASP A 19 19.708 9.733 -2.396 1.00 0.00 N ATOM 284 CA ASP A 19 21.026 9.753 -1.761 1.00 0.00 C ATOM 285 C ASP A 19 22.118 9.197 -2.694 1.00 0.00 C ATOM 286 O ASP A 19 23.192 9.781 -2.797 1.00 0.00 O ATOM 287 CB ASP A 19 20.976 9.012 -0.417 1.00 0.00 C ATOM 288 CG ASP A 19 22.038 9.575 0.532 1.00 0.00 C ATOM 289 OD1 ASP A 19 21.733 10.558 1.248 1.00 0.00 O ATOM 290 OD2 ASP A 19 23.184 9.076 0.560 1.00 0.00 O ATOM 0 H ASP A 19 19.045 9.084 -1.971 1.00 0.00 H new ATOM 0 HA ASP A 19 21.297 10.790 -1.562 1.00 0.00 H new ATOM 0 HB2 ASP A 19 19.987 9.116 0.028 1.00 0.00 H new ATOM 0 HB3 ASP A 19 21.144 7.947 -0.573 1.00 0.00 H new ATOM 295 N ASN A 20 21.823 8.151 -3.473 1.00 0.00 N ATOM 296 CA ASN A 20 22.734 7.633 -4.494 1.00 0.00 C ATOM 297 C ASN A 20 23.077 8.703 -5.550 1.00 0.00 C ATOM 298 O ASN A 20 24.252 8.875 -5.865 1.00 0.00 O ATOM 299 CB ASN A 20 22.114 6.373 -5.118 1.00 0.00 C ATOM 300 CG ASN A 20 23.021 5.759 -6.171 1.00 0.00 C ATOM 301 OD1 ASN A 20 22.863 5.978 -7.361 1.00 0.00 O ATOM 302 ND2 ASN A 20 24.009 4.988 -5.768 1.00 0.00 N ATOM 0 H ASN A 20 20.943 7.640 -3.411 1.00 0.00 H new ATOM 0 HA ASN A 20 23.683 7.364 -4.030 1.00 0.00 H new ATOM 0 HB2 ASN A 20 21.917 5.640 -4.336 1.00 0.00 H new ATOM 0 HB3 ASN A 20 21.154 6.625 -5.568 1.00 0.00 H new ATOM 0 HD21 ASN A 20 24.643 4.573 -6.451 1.00 0.00 H new ATOM 0 HD22 ASN A 20 24.140 4.806 -4.773 1.00 0.00 H new ATOM 309 N ILE A 21 22.093 9.476 -6.031 1.00 0.00 N ATOM 310 CA ILE A 21 22.335 10.620 -6.933 1.00 0.00 C ATOM 311 C ILE A 21 23.167 11.706 -6.234 1.00 0.00 C ATOM 312 O ILE A 21 24.135 12.198 -6.813 1.00 0.00 O ATOM 313 CB ILE A 21 20.992 11.167 -7.483 1.00 0.00 C ATOM 314 CG1 ILE A 21 20.409 10.182 -8.521 1.00 0.00 C ATOM 315 CG2 ILE A 21 21.175 12.562 -8.115 1.00 0.00 C ATOM 316 CD1 ILE A 21 18.929 10.437 -8.844 1.00 0.00 C ATOM 0 H ILE A 21 21.108 9.330 -5.809 1.00 0.00 H new ATOM 0 HA ILE A 21 22.921 10.278 -7.786 1.00 0.00 H new ATOM 0 HB ILE A 21 20.296 11.265 -6.650 1.00 0.00 H new ATOM 0 HG12 ILE A 21 20.990 10.250 -9.441 1.00 0.00 H new ATOM 0 HG13 ILE A 21 20.521 9.164 -8.147 1.00 0.00 H new ATOM 0 HG21 ILE A 21 20.217 12.919 -8.492 1.00 0.00 H new ATOM 0 HG22 ILE A 21 21.551 13.256 -7.363 1.00 0.00 H new ATOM 0 HG23 ILE A 21 21.887 12.498 -8.938 1.00 0.00 H new ATOM 0 HD11 ILE A 21 18.586 9.709 -9.579 1.00 0.00 H new ATOM 0 HD12 ILE A 21 18.336 10.341 -7.934 1.00 0.00 H new ATOM 0 HD13 ILE A 21 18.813 11.443 -9.248 1.00 0.00 H new ATOM 328 N LEU A 22 22.836 12.047 -4.988 1.00 0.00 N ATOM 329 CA LEU A 22 23.537 13.056 -4.189 1.00 0.00 C ATOM 330 C LEU A 22 25.039 12.734 -4.042 1.00 0.00 C ATOM 331 O LEU A 22 25.884 13.598 -4.291 1.00 0.00 O ATOM 332 CB LEU A 22 22.815 13.121 -2.831 1.00 0.00 C ATOM 333 CG LEU A 22 23.369 14.133 -1.825 1.00 0.00 C ATOM 334 CD1 LEU A 22 23.020 15.562 -2.239 1.00 0.00 C ATOM 335 CD2 LEU A 22 22.751 13.854 -0.454 1.00 0.00 C ATOM 0 H LEU A 22 22.054 11.619 -4.493 1.00 0.00 H new ATOM 0 HA LEU A 22 23.507 14.028 -4.681 1.00 0.00 H new ATOM 0 HB2 LEU A 22 21.765 13.354 -3.011 1.00 0.00 H new ATOM 0 HB3 LEU A 22 22.848 12.131 -2.376 1.00 0.00 H new ATOM 0 HG LEU A 22 24.454 14.033 -1.790 1.00 0.00 H new ATOM 0 HD11 LEU A 22 23.425 16.262 -1.508 1.00 0.00 H new ATOM 0 HD12 LEU A 22 23.449 15.772 -3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 22 21.937 15.673 -2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 22 23.138 14.569 0.272 1.00 0.00 H new ATOM 0 HD22 LEU A 22 21.667 13.951 -0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 22 23.007 12.842 -0.139 1.00 0.00 H new ATOM 347 N ARG A 23 25.385 11.484 -3.696 1.00 0.00 N ATOM 348 CA ARG A 23 26.795 11.057 -3.559 1.00 0.00 C ATOM 349 C ARG A 23 27.482 10.869 -4.918 1.00 0.00 C ATOM 350 O ARG A 23 28.640 11.258 -5.057 1.00 0.00 O ATOM 351 CB ARG A 23 26.946 9.782 -2.697 1.00 0.00 C ATOM 352 CG ARG A 23 26.217 9.740 -1.340 1.00 0.00 C ATOM 353 CD ARG A 23 26.332 10.985 -0.451 1.00 0.00 C ATOM 354 NE ARG A 23 25.277 10.964 0.579 1.00 0.00 N ATOM 355 CZ ARG A 23 25.150 11.738 1.638 1.00 0.00 C ATOM 356 NH1 ARG A 23 26.063 12.602 1.991 1.00 0.00 N ATOM 357 NH2 ARG A 23 24.069 11.655 2.355 1.00 0.00 N ATOM 0 H ARG A 23 24.708 10.746 -3.504 1.00 0.00 H new ATOM 0 HA ARG A 23 27.299 11.871 -3.038 1.00 0.00 H new ATOM 0 HB2 ARG A 23 26.600 8.935 -3.289 1.00 0.00 H new ATOM 0 HB3 ARG A 23 28.009 9.628 -2.511 1.00 0.00 H new ATOM 0 HG2 ARG A 23 25.160 9.555 -1.529 1.00 0.00 H new ATOM 0 HG3 ARG A 23 26.595 8.886 -0.778 1.00 0.00 H new ATOM 0 HD2 ARG A 23 27.314 11.016 0.022 1.00 0.00 H new ATOM 0 HD3 ARG A 23 26.242 11.886 -1.058 1.00 0.00 H new ATOM 0 HE ARG A 23 24.551 10.258 0.456 1.00 0.00 H new ATOM 0 HH11 ARG A 23 26.915 12.697 1.439 1.00 0.00 H new ATOM 0 HH12 ARG A 23 25.924 13.182 2.819 1.00 0.00 H new ATOM 0 HH21 ARG A 23 23.334 10.997 2.095 1.00 0.00 H new ATOM 0 HH22 ARG A 23 23.956 12.247 3.178 1.00 0.00 H new ATOM 371 N TYR A 24 26.780 10.351 -5.933 1.00 0.00 N ATOM 372 CA TYR A 24 27.331 10.163 -7.289 1.00 0.00 C ATOM 373 C TYR A 24 27.687 11.495 -7.973 1.00 0.00 C ATOM 374 O TYR A 24 28.749 11.621 -8.582 1.00 0.00 O ATOM 375 CB TYR A 24 26.318 9.380 -8.140 1.00 0.00 C ATOM 376 CG TYR A 24 26.720 9.197 -9.593 1.00 0.00 C ATOM 377 CD1 TYR A 24 27.754 8.302 -9.929 1.00 0.00 C ATOM 378 CD2 TYR A 24 26.060 9.919 -10.609 1.00 0.00 C ATOM 379 CE1 TYR A 24 28.133 8.132 -11.274 1.00 0.00 C ATOM 380 CE2 TYR A 24 26.435 9.750 -11.955 1.00 0.00 C ATOM 381 CZ TYR A 24 27.476 8.854 -12.290 1.00 0.00 C ATOM 382 OH TYR A 24 27.851 8.684 -13.588 1.00 0.00 O ATOM 0 H TYR A 24 25.810 10.048 -5.841 1.00 0.00 H new ATOM 0 HA TYR A 24 28.261 9.602 -7.197 1.00 0.00 H new ATOM 0 HB2 TYR A 24 26.169 8.398 -7.692 1.00 0.00 H new ATOM 0 HB3 TYR A 24 25.358 9.895 -8.104 1.00 0.00 H new ATOM 0 HD1 TYR A 24 28.257 7.745 -9.153 1.00 0.00 H new ATOM 0 HD2 TYR A 24 25.265 10.603 -10.353 1.00 0.00 H new ATOM 0 HE1 TYR A 24 28.929 7.447 -11.528 1.00 0.00 H new ATOM 0 HE2 TYR A 24 25.928 10.304 -12.731 1.00 0.00 H new ATOM 0 HH TYR A 24 27.300 9.253 -14.165 1.00 0.00 H new ATOM 392 N THR A 25 26.829 12.510 -7.822 1.00 0.00 N ATOM 393 CA THR A 25 27.077 13.869 -8.346 1.00 0.00 C ATOM 394 C THR A 25 27.947 14.739 -7.423 1.00 0.00 C ATOM 395 O THR A 25 28.339 15.840 -7.809 1.00 0.00 O ATOM 396 CB THR A 25 25.770 14.596 -8.690 1.00 0.00 C ATOM 397 OG1 THR A 25 24.989 14.778 -7.532 1.00 0.00 O ATOM 398 CG2 THR A 25 24.920 13.839 -9.712 1.00 0.00 C ATOM 0 H THR A 25 25.939 12.418 -7.332 1.00 0.00 H new ATOM 0 HA THR A 25 27.647 13.719 -9.263 1.00 0.00 H new ATOM 0 HB THR A 25 26.065 15.553 -9.121 1.00 0.00 H new ATOM 0 HG1 THR A 25 24.641 13.912 -7.233 1.00 0.00 H new ATOM 0 HG21 THR A 25 24.009 14.402 -9.916 1.00 0.00 H new ATOM 0 HG22 THR A 25 25.485 13.717 -10.636 1.00 0.00 H new ATOM 0 HG23 THR A 25 24.660 12.858 -9.314 1.00 0.00 H new ATOM 406 N ASN A 26 28.277 14.238 -6.220 1.00 0.00 N ATOM 407 CA ASN A 26 29.074 14.928 -5.192 1.00 0.00 C ATOM 408 C ASN A 26 28.539 16.346 -4.878 1.00 0.00 C ATOM 409 O ASN A 26 29.279 17.335 -4.845 1.00 0.00 O ATOM 410 CB ASN A 26 30.571 14.850 -5.557 1.00 0.00 C ATOM 411 CG ASN A 26 31.495 15.223 -4.405 1.00 0.00 C ATOM 412 OD1 ASN A 26 31.114 15.295 -3.243 1.00 0.00 O ATOM 413 ND2 ASN A 26 32.761 15.446 -4.684 1.00 0.00 N ATOM 0 H ASN A 26 27.985 13.306 -5.926 1.00 0.00 H new ATOM 0 HA ASN A 26 28.965 14.411 -4.239 1.00 0.00 H new ATOM 0 HB2 ASN A 26 30.805 13.838 -5.887 1.00 0.00 H new ATOM 0 HB3 ASN A 26 30.767 15.513 -6.399 1.00 0.00 H new ATOM 0 HD21 ASN A 26 33.415 15.676 -3.936 1.00 0.00 H new ATOM 0 HD22 ASN A 26 33.089 15.389 -5.648 1.00 0.00 H new ATOM 420 N SER A 27 27.217 16.433 -4.716 1.00 0.00 N ATOM 421 CA SER A 27 26.459 17.691 -4.622 1.00 0.00 C ATOM 422 C SER A 27 25.835 17.935 -3.239 1.00 0.00 C ATOM 423 O SER A 27 25.871 17.073 -2.356 1.00 0.00 O ATOM 424 CB SER A 27 25.384 17.691 -5.713 1.00 0.00 C ATOM 425 OG SER A 27 24.502 16.598 -5.544 1.00 0.00 O ATOM 0 H SER A 27 26.623 15.607 -4.644 1.00 0.00 H new ATOM 0 HA SER A 27 27.159 18.513 -4.768 1.00 0.00 H new ATOM 0 HB2 SER A 27 24.824 18.626 -5.679 1.00 0.00 H new ATOM 0 HB3 SER A 27 25.855 17.637 -6.695 1.00 0.00 H new ATOM 0 HG SER A 27 24.583 15.991 -6.309 1.00 0.00 H new ATOM 431 N THR A 28 25.258 19.129 -3.043 1.00 0.00 N ATOM 432 CA THR A 28 24.416 19.447 -1.872 1.00 0.00 C ATOM 433 C THR A 28 22.944 19.163 -2.181 1.00 0.00 C ATOM 434 O THR A 28 22.500 19.240 -3.327 1.00 0.00 O ATOM 435 CB THR A 28 24.591 20.896 -1.387 1.00 0.00 C ATOM 436 OG1 THR A 28 24.028 21.784 -2.326 1.00 0.00 O ATOM 437 CG2 THR A 28 26.054 21.282 -1.181 1.00 0.00 C ATOM 0 H THR A 28 25.360 19.908 -3.693 1.00 0.00 H new ATOM 0 HA THR A 28 24.748 18.800 -1.060 1.00 0.00 H new ATOM 0 HB THR A 28 24.085 20.964 -0.424 1.00 0.00 H new ATOM 0 HG1 THR A 28 24.140 22.706 -2.013 1.00 0.00 H new ATOM 0 HG21 THR A 28 26.113 22.315 -0.839 1.00 0.00 H new ATOM 0 HG22 THR A 28 26.502 20.626 -0.434 1.00 0.00 H new ATOM 0 HG23 THR A 28 26.593 21.180 -2.123 1.00 0.00 H new ATOM 445 N GLU A 29 22.149 18.875 -1.149 1.00 0.00 N ATOM 446 CA GLU A 29 20.725 18.536 -1.325 1.00 0.00 C ATOM 447 C GLU A 29 19.928 19.734 -1.864 1.00 0.00 C ATOM 448 O GLU A 29 19.068 19.579 -2.731 1.00 0.00 O ATOM 449 CB GLU A 29 20.142 18.031 0.004 1.00 0.00 C ATOM 450 CG GLU A 29 20.907 16.837 0.587 1.00 0.00 C ATOM 451 CD GLU A 29 20.272 16.351 1.901 1.00 0.00 C ATOM 452 OE1 GLU A 29 20.340 17.071 2.925 1.00 0.00 O ATOM 453 OE2 GLU A 29 19.719 15.225 1.909 1.00 0.00 O ATOM 0 H GLU A 29 22.463 18.868 -0.178 1.00 0.00 H new ATOM 0 HA GLU A 29 20.646 17.740 -2.065 1.00 0.00 H new ATOM 0 HB2 GLU A 29 20.147 18.846 0.728 1.00 0.00 H new ATOM 0 HB3 GLU A 29 19.101 17.747 -0.149 1.00 0.00 H new ATOM 0 HG2 GLU A 29 20.918 16.022 -0.137 1.00 0.00 H new ATOM 0 HG3 GLU A 29 21.945 17.120 0.765 1.00 0.00 H new ATOM 460 N GLN A 30 20.279 20.949 -1.425 1.00 0.00 N ATOM 461 CA GLN A 30 19.702 22.190 -1.956 1.00 0.00 C ATOM 462 C GLN A 30 20.095 22.445 -3.421 1.00 0.00 C ATOM 463 O GLN A 30 19.254 22.888 -4.200 1.00 0.00 O ATOM 464 CB GLN A 30 20.032 23.378 -1.029 1.00 0.00 C ATOM 465 CG GLN A 30 21.524 23.750 -0.938 1.00 0.00 C ATOM 466 CD GLN A 30 21.761 24.875 0.072 1.00 0.00 C ATOM 467 OE1 GLN A 30 22.125 24.649 1.220 1.00 0.00 O ATOM 468 NE2 GLN A 30 21.559 26.122 -0.300 1.00 0.00 N ATOM 0 H GLN A 30 20.971 21.099 -0.691 1.00 0.00 H new ATOM 0 HA GLN A 30 18.618 22.076 -1.969 1.00 0.00 H new ATOM 0 HB2 GLN A 30 19.478 24.251 -1.374 1.00 0.00 H new ATOM 0 HB3 GLN A 30 19.671 23.146 -0.027 1.00 0.00 H new ATOM 0 HG2 GLN A 30 22.102 22.872 -0.649 1.00 0.00 H new ATOM 0 HG3 GLN A 30 21.884 24.059 -1.919 1.00 0.00 H new ATOM 0 HE21 GLN A 30 21.256 26.327 -1.252 1.00 0.00 H new ATOM 0 HE22 GLN A 30 21.706 26.882 0.364 1.00 0.00 H new ATOM 477 N GLN A 31 21.323 22.106 -3.843 1.00 0.00 N ATOM 478 CA GLN A 31 21.736 22.257 -5.245 1.00 0.00 C ATOM 479 C GLN A 31 21.063 21.231 -6.166 1.00 0.00 C ATOM 480 O GLN A 31 20.716 21.574 -7.295 1.00 0.00 O ATOM 481 CB GLN A 31 23.273 22.231 -5.352 1.00 0.00 C ATOM 482 CG GLN A 31 23.823 22.566 -6.748 1.00 0.00 C ATOM 483 CD GLN A 31 23.418 23.959 -7.226 1.00 0.00 C ATOM 484 OE1 GLN A 31 24.083 24.953 -6.967 1.00 0.00 O ATOM 485 NE2 GLN A 31 22.301 24.089 -7.910 1.00 0.00 N ATOM 0 H GLN A 31 22.046 21.726 -3.233 1.00 0.00 H new ATOM 0 HA GLN A 31 21.393 23.230 -5.596 1.00 0.00 H new ATOM 0 HB2 GLN A 31 23.686 22.939 -4.634 1.00 0.00 H new ATOM 0 HB3 GLN A 31 23.627 21.241 -5.064 1.00 0.00 H new ATOM 0 HG2 GLN A 31 24.911 22.495 -6.732 1.00 0.00 H new ATOM 0 HG3 GLN A 31 23.466 21.824 -7.462 1.00 0.00 H new ATOM 0 HE21 GLN A 31 21.740 23.267 -8.131 1.00 0.00 H new ATOM 0 HE22 GLN A 31 21.997 25.012 -8.219 1.00 0.00 H new ATOM 494 N PHE A 32 20.801 20.009 -5.686 1.00 0.00 N ATOM 495 CA PHE A 32 19.989 19.016 -6.410 1.00 0.00 C ATOM 496 C PHE A 32 18.519 19.462 -6.518 1.00 0.00 C ATOM 497 O PHE A 32 17.947 19.420 -7.609 1.00 0.00 O ATOM 498 CB PHE A 32 20.154 17.647 -5.720 1.00 0.00 C ATOM 499 CG PHE A 32 19.441 16.439 -6.326 1.00 0.00 C ATOM 500 CD1 PHE A 32 18.954 16.427 -7.652 1.00 0.00 C ATOM 501 CD2 PHE A 32 19.284 15.286 -5.533 1.00 0.00 C ATOM 502 CE1 PHE A 32 18.280 15.298 -8.153 1.00 0.00 C ATOM 503 CE2 PHE A 32 18.620 14.153 -6.037 1.00 0.00 C ATOM 504 CZ PHE A 32 18.103 14.164 -7.343 1.00 0.00 C ATOM 0 H PHE A 32 21.145 19.678 -4.785 1.00 0.00 H new ATOM 0 HA PHE A 32 20.340 18.926 -7.438 1.00 0.00 H new ATOM 0 HB2 PHE A 32 21.219 17.420 -5.683 1.00 0.00 H new ATOM 0 HB3 PHE A 32 19.814 17.751 -4.690 1.00 0.00 H new ATOM 0 HD1 PHE A 32 19.100 17.290 -8.285 1.00 0.00 H new ATOM 0 HD2 PHE A 32 19.678 15.271 -4.527 1.00 0.00 H new ATOM 0 HE1 PHE A 32 17.898 15.303 -9.163 1.00 0.00 H new ATOM 0 HE2 PHE A 32 18.508 13.274 -5.419 1.00 0.00 H new ATOM 0 HZ PHE A 32 17.572 13.304 -7.723 1.00 0.00 H new ATOM 514 N LEU A 33 17.919 19.981 -5.439 1.00 0.00 N ATOM 515 CA LEU A 33 16.558 20.540 -5.478 1.00 0.00 C ATOM 516 C LEU A 33 16.464 21.721 -6.463 1.00 0.00 C ATOM 517 O LEU A 33 15.555 21.763 -7.291 1.00 0.00 O ATOM 518 CB LEU A 33 16.131 20.877 -4.032 1.00 0.00 C ATOM 519 CG LEU A 33 14.683 21.354 -3.774 1.00 0.00 C ATOM 520 CD1 LEU A 33 14.451 22.818 -4.144 1.00 0.00 C ATOM 521 CD2 LEU A 33 13.634 20.493 -4.478 1.00 0.00 C ATOM 0 H LEU A 33 18.358 20.026 -4.520 1.00 0.00 H new ATOM 0 HA LEU A 33 15.849 19.810 -5.868 1.00 0.00 H new ATOM 0 HB2 LEU A 33 16.299 19.989 -3.423 1.00 0.00 H new ATOM 0 HB3 LEU A 33 16.804 21.650 -3.661 1.00 0.00 H new ATOM 0 HG LEU A 33 14.561 21.247 -2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 33 13.415 23.086 -3.938 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.114 23.452 -3.555 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.659 22.963 -5.204 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.639 20.879 -4.258 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.804 20.520 -5.554 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.711 19.465 -4.125 1.00 0.00 H new ATOM 533 N GLU A 34 17.449 22.616 -6.454 1.00 0.00 N ATOM 534 CA GLU A 34 17.537 23.724 -7.416 1.00 0.00 C ATOM 535 C GLU A 34 17.690 23.229 -8.864 1.00 0.00 C ATOM 536 O GLU A 34 17.039 23.758 -9.763 1.00 0.00 O ATOM 537 CB GLU A 34 18.691 24.658 -7.015 1.00 0.00 C ATOM 538 CG GLU A 34 18.772 25.914 -7.891 1.00 0.00 C ATOM 539 CD GLU A 34 19.988 26.776 -7.504 1.00 0.00 C ATOM 540 OE1 GLU A 34 19.874 27.623 -6.584 1.00 0.00 O ATOM 541 OE2 GLU A 34 21.069 26.602 -8.121 1.00 0.00 O ATOM 0 H GLU A 34 18.214 22.598 -5.779 1.00 0.00 H new ATOM 0 HA GLU A 34 16.600 24.280 -7.385 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.567 24.955 -5.974 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.633 24.113 -7.081 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.844 25.627 -8.940 1.00 0.00 H new ATOM 0 HG3 GLU A 34 17.858 26.498 -7.782 1.00 0.00 H new ATOM 548 N ALA A 35 18.490 22.184 -9.100 1.00 0.00 N ATOM 549 CA ALA A 35 18.629 21.570 -10.424 1.00 0.00 C ATOM 550 C ALA A 35 17.309 20.942 -10.915 1.00 0.00 C ATOM 551 O ALA A 35 16.975 21.055 -12.094 1.00 0.00 O ATOM 552 CB ALA A 35 19.774 20.549 -10.381 1.00 0.00 C ATOM 0 H ALA A 35 19.059 21.740 -8.379 1.00 0.00 H new ATOM 0 HA ALA A 35 18.872 22.345 -11.151 1.00 0.00 H new ATOM 0 HB1 ALA A 35 19.886 20.086 -11.362 1.00 0.00 H new ATOM 0 HB2 ALA A 35 20.701 21.054 -10.110 1.00 0.00 H new ATOM 0 HB3 ALA A 35 19.549 19.781 -9.641 1.00 0.00 H new ATOM 558 N MET A 36 16.517 20.342 -10.022 1.00 0.00 N ATOM 559 CA MET A 36 15.168 19.845 -10.347 1.00 0.00 C ATOM 560 C MET A 36 14.183 20.985 -10.649 1.00 0.00 C ATOM 561 O MET A 36 13.466 20.906 -11.645 1.00 0.00 O ATOM 562 CB MET A 36 14.667 18.939 -9.209 1.00 0.00 C ATOM 563 CG MET A 36 15.428 17.606 -9.156 1.00 0.00 C ATOM 564 SD MET A 36 14.945 16.388 -10.412 1.00 0.00 S ATOM 565 CE MET A 36 13.414 15.766 -9.673 1.00 0.00 C ATOM 0 H MET A 36 16.789 20.185 -9.052 1.00 0.00 H new ATOM 0 HA MET A 36 15.230 19.257 -11.263 1.00 0.00 H new ATOM 0 HB2 MET A 36 14.778 19.458 -8.257 1.00 0.00 H new ATOM 0 HB3 MET A 36 13.603 18.744 -9.343 1.00 0.00 H new ATOM 0 HG2 MET A 36 16.493 17.810 -9.262 1.00 0.00 H new ATOM 0 HG3 MET A 36 15.285 17.164 -8.170 1.00 0.00 H new ATOM 0 HE1 MET A 36 12.972 15.016 -10.329 1.00 0.00 H new ATOM 0 HE2 MET A 36 13.634 15.317 -8.704 1.00 0.00 H new ATOM 0 HE3 MET A 36 12.713 16.590 -9.540 1.00 0.00 H new ATOM 575 N GLU A 37 14.187 22.083 -9.885 1.00 0.00 N ATOM 576 CA GLU A 37 13.354 23.265 -10.188 1.00 0.00 C ATOM 577 C GLU A 37 13.764 23.950 -11.509 1.00 0.00 C ATOM 578 O GLU A 37 12.902 24.383 -12.275 1.00 0.00 O ATOM 579 CB GLU A 37 13.418 24.286 -9.042 1.00 0.00 C ATOM 580 CG GLU A 37 12.697 23.810 -7.775 1.00 0.00 C ATOM 581 CD GLU A 37 12.558 24.945 -6.736 1.00 0.00 C ATOM 582 OE1 GLU A 37 13.551 25.656 -6.444 1.00 0.00 O ATOM 583 OE2 GLU A 37 11.436 25.130 -6.200 1.00 0.00 O ATOM 0 H GLU A 37 14.759 22.183 -9.047 1.00 0.00 H new ATOM 0 HA GLU A 37 12.332 22.903 -10.300 1.00 0.00 H new ATOM 0 HB2 GLU A 37 14.462 24.492 -8.804 1.00 0.00 H new ATOM 0 HB3 GLU A 37 12.976 25.225 -9.374 1.00 0.00 H new ATOM 0 HG2 GLU A 37 11.708 23.435 -8.038 1.00 0.00 H new ATOM 0 HG3 GLU A 37 13.247 22.978 -7.334 1.00 0.00 H new ATOM 590 N SER A 38 15.067 23.991 -11.805 1.00 0.00 N ATOM 591 CA SER A 38 15.619 24.554 -13.051 1.00 0.00 C ATOM 592 C SER A 38 15.225 23.750 -14.306 1.00 0.00 C ATOM 593 O SER A 38 15.133 24.307 -15.402 1.00 0.00 O ATOM 594 CB SER A 38 17.148 24.620 -12.924 1.00 0.00 C ATOM 595 OG SER A 38 17.750 25.274 -14.033 1.00 0.00 O ATOM 0 H SER A 38 15.784 23.628 -11.177 1.00 0.00 H new ATOM 0 HA SER A 38 15.196 25.550 -13.183 1.00 0.00 H new ATOM 0 HB2 SER A 38 17.413 25.146 -12.007 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.548 23.610 -12.839 1.00 0.00 H new ATOM 0 HG SER A 38 18.480 25.847 -13.718 1.00 0.00 H new ATOM 601 N THR A 39 14.959 22.445 -14.147 1.00 0.00 N ATOM 602 CA THR A 39 14.707 21.502 -15.262 1.00 0.00 C ATOM 603 C THR A 39 13.269 20.979 -15.341 1.00 0.00 C ATOM 604 O THR A 39 12.963 20.144 -16.196 1.00 0.00 O ATOM 605 CB THR A 39 15.702 20.337 -15.221 1.00 0.00 C ATOM 606 OG1 THR A 39 15.606 19.656 -13.995 1.00 0.00 O ATOM 607 CG2 THR A 39 17.140 20.826 -15.367 1.00 0.00 C ATOM 0 H THR A 39 14.911 22.002 -13.229 1.00 0.00 H new ATOM 0 HA THR A 39 14.856 22.084 -16.172 1.00 0.00 H new ATOM 0 HB THR A 39 15.453 19.677 -16.052 1.00 0.00 H new ATOM 0 HG1 THR A 39 16.083 20.160 -13.303 1.00 0.00 H new ATOM 0 HG21 THR A 39 17.819 19.974 -15.334 1.00 0.00 H new ATOM 0 HG22 THR A 39 17.253 21.343 -16.320 1.00 0.00 H new ATOM 0 HG23 THR A 39 17.376 21.510 -14.552 1.00 0.00 H new ATOM 615 N GLY A 40 12.372 21.453 -14.470 1.00 0.00 N ATOM 616 CA GLY A 40 10.959 21.044 -14.460 1.00 0.00 C ATOM 617 C GLY A 40 10.727 19.644 -13.880 1.00 0.00 C ATOM 618 O GLY A 40 9.739 18.990 -14.210 1.00 0.00 O ATOM 0 H GLY A 40 12.605 22.135 -13.748 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.385 21.767 -13.881 1.00 0.00 H new ATOM 0 HA3 GLY A 40 10.574 21.074 -15.479 1.00 0.00 H new ATOM 622 N GLY A 41 11.650 19.169 -13.034 1.00 0.00 N ATOM 623 CA GLY A 41 11.532 17.895 -12.324 1.00 0.00 C ATOM 624 C GLY A 41 11.991 16.654 -13.092 1.00 0.00 C ATOM 625 O GLY A 41 11.795 15.551 -12.588 1.00 0.00 O ATOM 0 H GLY A 41 12.513 19.670 -12.822 1.00 0.00 H new ATOM 0 HA2 GLY A 41 12.109 17.961 -11.402 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.489 17.756 -12.038 1.00 0.00 H new ATOM 629 N ARG A 42 12.615 16.788 -14.274 1.00 0.00 N ATOM 630 CA ARG A 42 13.210 15.641 -14.994 1.00 0.00 C ATOM 631 C ARG A 42 14.549 15.259 -14.375 1.00 0.00 C ATOM 632 O ARG A 42 15.536 15.964 -14.576 1.00 0.00 O ATOM 633 CB ARG A 42 13.384 15.944 -16.490 1.00 0.00 C ATOM 634 CG ARG A 42 12.068 15.820 -17.270 1.00 0.00 C ATOM 635 CD ARG A 42 12.384 15.408 -18.710 1.00 0.00 C ATOM 636 NE ARG A 42 11.152 15.191 -19.498 1.00 0.00 N ATOM 637 CZ ARG A 42 10.442 16.090 -20.164 1.00 0.00 C ATOM 638 NH1 ARG A 42 10.762 17.353 -20.196 1.00 0.00 N ATOM 639 NH2 ARG A 42 9.375 15.726 -20.818 1.00 0.00 N ATOM 0 H ARG A 42 12.723 17.681 -14.756 1.00 0.00 H new ATOM 0 HA ARG A 42 12.523 14.800 -14.900 1.00 0.00 H new ATOM 0 HB2 ARG A 42 13.780 16.952 -16.610 1.00 0.00 H new ATOM 0 HB3 ARG A 42 14.120 15.260 -16.913 1.00 0.00 H new ATOM 0 HG2 ARG A 42 11.419 15.081 -16.800 1.00 0.00 H new ATOM 0 HG3 ARG A 42 11.532 16.769 -17.258 1.00 0.00 H new ATOM 0 HD2 ARG A 42 12.989 16.180 -19.185 1.00 0.00 H new ATOM 0 HD3 ARG A 42 12.979 14.495 -18.705 1.00 0.00 H new ATOM 0 HE ARG A 42 10.806 14.232 -19.533 1.00 0.00 H new ATOM 0 HH11 ARG A 42 11.587 17.683 -19.696 1.00 0.00 H new ATOM 0 HH12 ARG A 42 10.187 18.012 -20.721 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.085 14.748 -20.818 1.00 0.00 H new ATOM 0 HH22 ARG A 42 8.829 16.419 -21.330 1.00 0.00 H new ATOM 653 N VAL A 43 14.625 14.101 -13.717 1.00 0.00 N ATOM 654 CA VAL A 43 15.849 13.669 -13.005 1.00 0.00 C ATOM 655 C VAL A 43 17.047 13.565 -13.952 1.00 0.00 C ATOM 656 O VAL A 43 18.123 14.025 -13.589 1.00 0.00 O ATOM 657 CB VAL A 43 15.617 12.361 -12.225 1.00 0.00 C ATOM 658 CG1 VAL A 43 16.882 11.845 -11.517 1.00 0.00 C ATOM 659 CG2 VAL A 43 14.575 12.594 -11.130 1.00 0.00 C ATOM 0 H VAL A 43 13.854 13.436 -13.657 1.00 0.00 H new ATOM 0 HA VAL A 43 16.089 14.440 -12.273 1.00 0.00 H new ATOM 0 HB VAL A 43 15.296 11.627 -12.964 1.00 0.00 H new ATOM 0 HG11 VAL A 43 16.651 10.922 -10.986 1.00 0.00 H new ATOM 0 HG12 VAL A 43 17.660 11.654 -12.256 1.00 0.00 H new ATOM 0 HG13 VAL A 43 17.232 12.594 -10.807 1.00 0.00 H new ATOM 0 HG21 VAL A 43 14.412 11.667 -10.579 1.00 0.00 H new ATOM 0 HG22 VAL A 43 14.932 13.364 -10.446 1.00 0.00 H new ATOM 0 HG23 VAL A 43 13.637 12.916 -11.583 1.00 0.00 H new ATOM 669 N ARG A 44 16.875 13.085 -15.193 1.00 0.00 N ATOM 670 CA ARG A 44 17.979 12.983 -16.176 1.00 0.00 C ATOM 671 C ARG A 44 18.623 14.339 -16.518 1.00 0.00 C ATOM 672 O ARG A 44 19.844 14.475 -16.495 1.00 0.00 O ATOM 673 CB ARG A 44 17.514 12.180 -17.416 1.00 0.00 C ATOM 674 CG ARG A 44 16.377 12.793 -18.270 1.00 0.00 C ATOM 675 CD ARG A 44 16.038 11.915 -19.485 1.00 0.00 C ATOM 676 NE ARG A 44 15.437 10.620 -19.099 1.00 0.00 N ATOM 677 CZ ARG A 44 15.202 9.588 -19.898 1.00 0.00 C ATOM 678 NH1 ARG A 44 15.477 9.619 -21.174 1.00 0.00 N ATOM 679 NH2 ARG A 44 14.680 8.493 -19.427 1.00 0.00 N ATOM 0 H ARG A 44 15.976 12.757 -15.547 1.00 0.00 H new ATOM 0 HA ARG A 44 18.791 12.425 -15.711 1.00 0.00 H new ATOM 0 HB2 ARG A 44 18.378 12.027 -18.063 1.00 0.00 H new ATOM 0 HB3 ARG A 44 17.190 11.195 -17.079 1.00 0.00 H new ATOM 0 HG2 ARG A 44 15.487 12.919 -17.653 1.00 0.00 H new ATOM 0 HG3 ARG A 44 16.673 13.785 -18.610 1.00 0.00 H new ATOM 0 HD2 ARG A 44 15.348 12.452 -20.136 1.00 0.00 H new ATOM 0 HD3 ARG A 44 16.945 11.733 -20.062 1.00 0.00 H new ATOM 0 HE ARG A 44 15.177 10.509 -18.119 1.00 0.00 H new ATOM 0 HH11 ARG A 44 15.887 10.457 -21.587 1.00 0.00 H new ATOM 0 HH12 ARG A 44 15.282 8.805 -21.758 1.00 0.00 H new ATOM 0 HH21 ARG A 44 14.448 8.424 -18.436 1.00 0.00 H new ATOM 0 HH22 ARG A 44 14.503 7.704 -20.049 1.00 0.00 H new ATOM 693 N ILE A 45 17.794 15.366 -16.735 1.00 0.00 N ATOM 694 CA ILE A 45 18.277 16.723 -17.067 1.00 0.00 C ATOM 695 C ILE A 45 18.810 17.418 -15.805 1.00 0.00 C ATOM 696 O ILE A 45 19.816 18.119 -15.860 1.00 0.00 O ATOM 697 CB ILE A 45 17.186 17.557 -17.784 1.00 0.00 C ATOM 698 CG1 ILE A 45 16.443 16.812 -18.919 1.00 0.00 C ATOM 699 CG2 ILE A 45 17.796 18.851 -18.360 1.00 0.00 C ATOM 700 CD1 ILE A 45 17.322 16.252 -20.048 1.00 0.00 C ATOM 0 H ILE A 45 16.778 15.288 -16.688 1.00 0.00 H new ATOM 0 HA ILE A 45 19.104 16.635 -17.772 1.00 0.00 H new ATOM 0 HB ILE A 45 16.445 17.773 -17.014 1.00 0.00 H new ATOM 0 HG12 ILE A 45 15.883 15.987 -18.479 1.00 0.00 H new ATOM 0 HG13 ILE A 45 15.714 17.494 -19.357 1.00 0.00 H new ATOM 0 HG21 ILE A 45 17.019 19.428 -18.861 1.00 0.00 H new ATOM 0 HG22 ILE A 45 18.223 19.444 -17.551 1.00 0.00 H new ATOM 0 HG23 ILE A 45 18.578 18.597 -19.076 1.00 0.00 H new ATOM 0 HD11 ILE A 45 16.693 15.752 -20.785 1.00 0.00 H new ATOM 0 HD12 ILE A 45 17.863 17.068 -20.527 1.00 0.00 H new ATOM 0 HD13 ILE A 45 18.034 15.538 -19.634 1.00 0.00 H new ATOM 712 N ALA A 46 18.198 17.165 -14.646 1.00 0.00 N ATOM 713 CA ALA A 46 18.673 17.676 -13.363 1.00 0.00 C ATOM 714 C ALA A 46 20.073 17.140 -13.035 1.00 0.00 C ATOM 715 O ALA A 46 20.970 17.939 -12.784 1.00 0.00 O ATOM 716 CB ALA A 46 17.657 17.328 -12.272 1.00 0.00 C ATOM 0 H ALA A 46 17.354 16.596 -14.573 1.00 0.00 H new ATOM 0 HA ALA A 46 18.763 18.761 -13.419 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.009 17.708 -11.313 1.00 0.00 H new ATOM 0 HB2 ALA A 46 16.696 17.782 -12.512 1.00 0.00 H new ATOM 0 HB3 ALA A 46 17.542 16.246 -12.213 1.00 0.00 H new ATOM 722 N ILE A 47 20.311 15.822 -13.125 1.00 0.00 N ATOM 723 CA ILE A 47 21.648 15.254 -12.883 1.00 0.00 C ATOM 724 C ILE A 47 22.646 15.670 -13.969 1.00 0.00 C ATOM 725 O ILE A 47 23.798 15.940 -13.639 1.00 0.00 O ATOM 726 CB ILE A 47 21.637 13.728 -12.622 1.00 0.00 C ATOM 727 CG1 ILE A 47 21.292 12.894 -13.870 1.00 0.00 C ATOM 728 CG2 ILE A 47 20.723 13.428 -11.423 1.00 0.00 C ATOM 729 CD1 ILE A 47 21.261 11.378 -13.632 1.00 0.00 C ATOM 0 H ILE A 47 19.599 15.132 -13.363 1.00 0.00 H new ATOM 0 HA ILE A 47 21.998 15.690 -11.948 1.00 0.00 H new ATOM 0 HB ILE A 47 22.652 13.417 -12.373 1.00 0.00 H new ATOM 0 HG12 ILE A 47 20.319 13.210 -14.246 1.00 0.00 H new ATOM 0 HG13 ILE A 47 22.021 13.112 -14.650 1.00 0.00 H new ATOM 0 HG21 ILE A 47 20.711 12.355 -11.234 1.00 0.00 H new ATOM 0 HG22 ILE A 47 21.098 13.947 -10.541 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.711 13.769 -11.642 1.00 0.00 H new ATOM 0 HD11 ILE A 47 21.010 10.869 -14.562 1.00 0.00 H new ATOM 0 HD12 ILE A 47 22.240 11.044 -13.288 1.00 0.00 H new ATOM 0 HD13 ILE A 47 20.511 11.144 -12.877 1.00 0.00 H new ATOM 741 N ALA A 48 22.211 15.840 -15.226 1.00 0.00 N ATOM 742 CA ALA A 48 23.051 16.418 -16.280 1.00 0.00 C ATOM 743 C ALA A 48 23.546 17.838 -15.932 1.00 0.00 C ATOM 744 O ALA A 48 24.751 18.095 -16.001 1.00 0.00 O ATOM 745 CB ALA A 48 22.266 16.387 -17.599 1.00 0.00 C ATOM 0 H ALA A 48 21.274 15.582 -15.537 1.00 0.00 H new ATOM 0 HA ALA A 48 23.956 15.819 -16.381 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.876 16.814 -18.395 1.00 0.00 H new ATOM 0 HB2 ALA A 48 22.013 15.356 -17.848 1.00 0.00 H new ATOM 0 HB3 ALA A 48 21.351 16.969 -17.491 1.00 0.00 H new ATOM 751 N LYS A 49 22.672 18.747 -15.473 1.00 0.00 N ATOM 752 CA LYS A 49 23.085 20.095 -15.021 1.00 0.00 C ATOM 753 C LYS A 49 23.889 20.060 -13.720 1.00 0.00 C ATOM 754 O LYS A 49 24.882 20.770 -13.604 1.00 0.00 O ATOM 755 CB LYS A 49 21.868 21.029 -14.891 1.00 0.00 C ATOM 756 CG LYS A 49 21.252 21.376 -16.260 1.00 0.00 C ATOM 757 CD LYS A 49 20.212 22.509 -16.187 1.00 0.00 C ATOM 758 CE LYS A 49 20.863 23.888 -15.992 1.00 0.00 C ATOM 759 NZ LYS A 49 19.852 24.985 -16.027 1.00 0.00 N ATOM 0 H LYS A 49 21.669 18.577 -15.403 1.00 0.00 H new ATOM 0 HA LYS A 49 23.748 20.493 -15.789 1.00 0.00 H new ATOM 0 HB2 LYS A 49 21.113 20.554 -14.265 1.00 0.00 H new ATOM 0 HB3 LYS A 49 22.169 21.947 -14.387 1.00 0.00 H new ATOM 0 HG2 LYS A 49 22.048 21.666 -16.946 1.00 0.00 H new ATOM 0 HG3 LYS A 49 20.781 20.485 -16.676 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.620 22.515 -17.102 1.00 0.00 H new ATOM 0 HD3 LYS A 49 19.524 22.315 -15.364 1.00 0.00 H new ATOM 0 HE2 LYS A 49 21.391 23.910 -15.039 1.00 0.00 H new ATOM 0 HE3 LYS A 49 21.606 24.053 -16.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.336 25.904 -15.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.308 24.927 -16.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 19.207 24.889 -15.217 1.00 0.00 H new ATOM 773 N LEU A 50 23.520 19.191 -12.777 1.00 0.00 N ATOM 774 CA LEU A 50 24.203 19.028 -11.484 1.00 0.00 C ATOM 775 C LEU A 50 25.657 18.541 -11.649 1.00 0.00 C ATOM 776 O LEU A 50 26.536 18.969 -10.901 1.00 0.00 O ATOM 777 CB LEU A 50 23.340 18.056 -10.656 1.00 0.00 C ATOM 778 CG LEU A 50 23.630 17.941 -9.155 1.00 0.00 C ATOM 779 CD1 LEU A 50 23.461 19.288 -8.451 1.00 0.00 C ATOM 780 CD2 LEU A 50 22.616 16.965 -8.555 1.00 0.00 C ATOM 0 H LEU A 50 22.722 18.566 -12.889 1.00 0.00 H new ATOM 0 HA LEU A 50 24.296 19.985 -10.970 1.00 0.00 H new ATOM 0 HB2 LEU A 50 22.297 18.351 -10.774 1.00 0.00 H new ATOM 0 HB3 LEU A 50 23.441 17.063 -11.093 1.00 0.00 H new ATOM 0 HG LEU A 50 24.657 17.602 -9.020 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.674 19.172 -7.388 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.151 20.013 -8.882 1.00 0.00 H new ATOM 0 HD13 LEU A 50 22.437 19.640 -8.580 1.00 0.00 H new ATOM 0 HD21 LEU A 50 22.798 16.863 -7.485 1.00 0.00 H new ATOM 0 HD22 LEU A 50 21.607 17.344 -8.717 1.00 0.00 H new ATOM 0 HD23 LEU A 50 22.720 15.992 -9.035 1.00 0.00 H new ATOM 792 N LEU A 51 25.920 17.702 -12.662 1.00 0.00 N ATOM 793 CA LEU A 51 27.272 17.296 -13.069 1.00 0.00 C ATOM 794 C LEU A 51 28.006 18.378 -13.882 1.00 0.00 C ATOM 795 O LEU A 51 29.188 18.626 -13.638 1.00 0.00 O ATOM 796 CB LEU A 51 27.179 15.987 -13.880 1.00 0.00 C ATOM 797 CG LEU A 51 26.812 14.745 -13.045 1.00 0.00 C ATOM 798 CD1 LEU A 51 26.453 13.585 -13.976 1.00 0.00 C ATOM 799 CD2 LEU A 51 27.972 14.297 -12.151 1.00 0.00 C ATOM 0 H LEU A 51 25.186 17.280 -13.231 1.00 0.00 H new ATOM 0 HA LEU A 51 27.859 17.144 -12.163 1.00 0.00 H new ATOM 0 HB2 LEU A 51 26.435 16.113 -14.667 1.00 0.00 H new ATOM 0 HB3 LEU A 51 28.136 15.810 -14.371 1.00 0.00 H new ATOM 0 HG LEU A 51 25.965 15.017 -12.415 1.00 0.00 H new ATOM 0 HD11 LEU A 51 26.194 12.708 -13.382 1.00 0.00 H new ATOM 0 HD12 LEU A 51 25.603 13.867 -14.597 1.00 0.00 H new ATOM 0 HD13 LEU A 51 27.306 13.352 -14.613 1.00 0.00 H new ATOM 0 HD21 LEU A 51 27.672 13.419 -11.579 1.00 0.00 H new ATOM 0 HD22 LEU A 51 28.834 14.050 -12.770 1.00 0.00 H new ATOM 0 HD23 LEU A 51 28.236 15.103 -11.466 1.00 0.00 H new ATOM 811 N SER A 52 27.325 19.026 -14.837 1.00 0.00 N ATOM 812 CA SER A 52 27.960 19.974 -15.777 1.00 0.00 C ATOM 813 C SER A 52 28.290 21.342 -15.162 1.00 0.00 C ATOM 814 O SER A 52 29.275 21.962 -15.563 1.00 0.00 O ATOM 815 CB SER A 52 27.077 20.187 -17.017 1.00 0.00 C ATOM 816 OG SER A 52 26.855 18.967 -17.710 1.00 0.00 O ATOM 0 H SER A 52 26.322 18.912 -14.984 1.00 0.00 H new ATOM 0 HA SER A 52 28.906 19.509 -16.052 1.00 0.00 H new ATOM 0 HB2 SER A 52 26.121 20.615 -16.716 1.00 0.00 H new ATOM 0 HB3 SER A 52 27.552 20.906 -17.685 1.00 0.00 H new ATOM 0 HG SER A 52 26.132 18.470 -17.273 1.00 0.00 H new ATOM 822 N LYS A 53 27.487 21.797 -14.185 1.00 0.00 N ATOM 823 CA LYS A 53 27.512 23.099 -13.472 1.00 0.00 C ATOM 824 C LYS A 53 27.392 24.351 -14.344 1.00 0.00 C ATOM 825 O LYS A 53 26.464 25.137 -14.155 1.00 0.00 O ATOM 826 CB LYS A 53 28.726 23.176 -12.526 1.00 0.00 C ATOM 827 CG LYS A 53 28.576 22.176 -11.376 1.00 0.00 C ATOM 828 CD LYS A 53 29.838 22.135 -10.507 1.00 0.00 C ATOM 829 CE LYS A 53 29.663 21.141 -9.349 1.00 0.00 C ATOM 830 NZ LYS A 53 30.872 21.094 -8.479 1.00 0.00 N ATOM 0 H LYS A 53 26.729 21.211 -13.836 1.00 0.00 H new ATOM 0 HA LYS A 53 26.590 23.111 -12.891 1.00 0.00 H new ATOM 0 HB2 LYS A 53 29.640 22.966 -13.081 1.00 0.00 H new ATOM 0 HB3 LYS A 53 28.820 24.186 -12.127 1.00 0.00 H new ATOM 0 HG2 LYS A 53 27.718 22.450 -10.762 1.00 0.00 H new ATOM 0 HG3 LYS A 53 28.376 21.183 -11.778 1.00 0.00 H new ATOM 0 HD2 LYS A 53 30.696 21.847 -11.115 1.00 0.00 H new ATOM 0 HD3 LYS A 53 30.047 23.129 -10.112 1.00 0.00 H new ATOM 0 HE2 LYS A 53 28.796 21.425 -8.753 1.00 0.00 H new ATOM 0 HE3 LYS A 53 29.463 20.147 -9.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 30.719 20.413 -7.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 31.694 20.799 -9.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 31.048 22.037 -8.078 1.00 0.00 H new ATOM 844 N GLN A 54 28.325 24.552 -15.270 1.00 0.00 N ATOM 845 CA GLN A 54 28.390 25.725 -16.141 1.00 0.00 C ATOM 846 C GLN A 54 27.496 25.568 -17.388 1.00 0.00 C ATOM 847 O GLN A 54 27.177 24.454 -17.810 1.00 0.00 O ATOM 848 CB GLN A 54 29.850 26.017 -16.535 1.00 0.00 C ATOM 849 CG GLN A 54 30.746 26.338 -15.324 1.00 0.00 C ATOM 850 CD GLN A 54 32.167 26.707 -15.751 1.00 0.00 C ATOM 851 OE1 GLN A 54 32.544 27.871 -15.823 1.00 0.00 O ATOM 852 NE2 GLN A 54 33.011 25.741 -16.058 1.00 0.00 N ATOM 0 H GLN A 54 29.078 23.886 -15.441 1.00 0.00 H new ATOM 0 HA GLN A 54 28.004 26.577 -15.582 1.00 0.00 H new ATOM 0 HB2 GLN A 54 30.257 25.155 -17.063 1.00 0.00 H new ATOM 0 HB3 GLN A 54 29.872 26.857 -17.230 1.00 0.00 H new ATOM 0 HG2 GLN A 54 30.311 27.162 -14.758 1.00 0.00 H new ATOM 0 HG3 GLN A 54 30.779 25.476 -14.658 1.00 0.00 H new ATOM 0 HE21 GLN A 54 32.713 24.767 -16.003 1.00 0.00 H new ATOM 0 HE22 GLN A 54 33.962 25.968 -16.350 1.00 0.00 H new ATOM 861 N THR A 55 27.118 26.692 -18.007 1.00 0.00 N ATOM 862 CA THR A 55 26.302 26.736 -19.239 1.00 0.00 C ATOM 863 C THR A 55 27.122 26.587 -20.533 1.00 0.00 C ATOM 864 O THR A 55 26.559 26.262 -21.581 1.00 0.00 O ATOM 865 CB THR A 55 25.485 28.039 -19.306 1.00 0.00 C ATOM 866 OG1 THR A 55 26.338 29.161 -19.156 1.00 0.00 O ATOM 867 CG2 THR A 55 24.427 28.102 -18.204 1.00 0.00 C ATOM 0 H THR A 55 27.373 27.618 -17.664 1.00 0.00 H new ATOM 0 HA THR A 55 25.638 25.874 -19.178 1.00 0.00 H new ATOM 0 HB THR A 55 24.993 28.054 -20.278 1.00 0.00 H new ATOM 0 HG1 THR A 55 25.808 29.984 -19.202 1.00 0.00 H new ATOM 0 HG21 THR A 55 23.872 29.037 -18.286 1.00 0.00 H new ATOM 0 HG22 THR A 55 23.741 27.262 -18.310 1.00 0.00 H new ATOM 0 HG23 THR A 55 24.913 28.053 -17.230 1.00 0.00 H new ATOM 875 N SER A 56 28.443 26.788 -20.468 1.00 0.00 N ATOM 876 CA SER A 56 29.373 26.680 -21.609 1.00 0.00 C ATOM 877 C SER A 56 29.578 25.234 -22.095 1.00 0.00 C ATOM 878 O SER A 56 29.453 24.278 -21.323 1.00 0.00 O ATOM 879 CB SER A 56 30.738 27.285 -21.245 1.00 0.00 C ATOM 880 OG SER A 56 30.591 28.634 -20.814 1.00 0.00 O ATOM 0 H SER A 56 28.913 27.038 -19.598 1.00 0.00 H new ATOM 0 HA SER A 56 28.913 27.236 -22.426 1.00 0.00 H new ATOM 0 HB2 SER A 56 31.204 26.695 -20.456 1.00 0.00 H new ATOM 0 HB3 SER A 56 31.402 27.244 -22.109 1.00 0.00 H new ATOM 0 HG SER A 56 31.470 29.002 -20.585 1.00 0.00 H new ATOM 886 N GLY A 57 29.956 25.073 -23.370 1.00 0.00 N ATOM 887 CA GLY A 57 30.264 23.773 -23.983 1.00 0.00 C ATOM 888 C GLY A 57 29.034 22.891 -24.250 1.00 0.00 C ATOM 889 O GLY A 57 27.916 23.384 -24.435 1.00 0.00 O ATOM 0 H GLY A 57 30.058 25.856 -24.016 1.00 0.00 H new ATOM 0 HA2 GLY A 57 30.785 23.943 -24.925 1.00 0.00 H new ATOM 0 HA3 GLY A 57 30.950 23.231 -23.332 1.00 0.00 H new ATOM 893 N GLY A 58 29.247 21.570 -24.285 1.00 0.00 N ATOM 894 CA GLY A 58 28.232 20.563 -24.632 1.00 0.00 C ATOM 895 C GLY A 58 27.983 20.411 -26.143 1.00 0.00 C ATOM 896 O GLY A 58 28.557 21.133 -26.967 1.00 0.00 O ATOM 0 H GLY A 58 30.155 21.159 -24.067 1.00 0.00 H new ATOM 0 HA2 GLY A 58 28.540 19.599 -24.227 1.00 0.00 H new ATOM 0 HA3 GLY A 58 27.293 20.828 -24.145 1.00 0.00 H new ATOM 900 N SER A 59 27.129 19.454 -26.510 1.00 0.00 N ATOM 901 CA SER A 59 26.815 19.115 -27.910 1.00 0.00 C ATOM 902 C SER A 59 25.972 20.194 -28.610 1.00 0.00 C ATOM 903 O SER A 59 25.092 20.811 -28.002 1.00 0.00 O ATOM 904 CB SER A 59 26.090 17.765 -27.987 1.00 0.00 C ATOM 905 OG SER A 59 26.879 16.733 -27.410 1.00 0.00 O ATOM 0 H SER A 59 26.624 18.879 -25.835 1.00 0.00 H new ATOM 0 HA SER A 59 27.769 19.054 -28.434 1.00 0.00 H new ATOM 0 HB2 SER A 59 25.134 17.831 -27.468 1.00 0.00 H new ATOM 0 HB3 SER A 59 25.872 17.523 -29.027 1.00 0.00 H new ATOM 0 HG SER A 59 26.397 15.882 -27.468 1.00 0.00 H new ATOM 911 N GLY A 60 26.212 20.397 -29.910 1.00 0.00 N ATOM 912 CA GLY A 60 25.491 21.363 -30.747 1.00 0.00 C ATOM 913 C GLY A 60 26.102 21.546 -32.145 1.00 0.00 C ATOM 914 O GLY A 60 27.108 20.918 -32.482 1.00 0.00 O ATOM 0 H GLY A 60 26.929 19.883 -30.421 1.00 0.00 H new ATOM 0 HA2 GLY A 60 24.456 21.038 -30.852 1.00 0.00 H new ATOM 0 HA3 GLY A 60 25.472 22.327 -30.239 1.00 0.00 H new ATOM 918 N GLY A 61 25.488 22.410 -32.961 1.00 0.00 N ATOM 919 CA GLY A 61 25.956 22.827 -34.296 1.00 0.00 C ATOM 920 C GLY A 61 25.776 21.796 -35.424 1.00 0.00 C ATOM 921 O GLY A 61 25.327 22.159 -36.516 1.00 0.00 O ATOM 0 H GLY A 61 24.611 22.861 -32.701 1.00 0.00 H new ATOM 0 HA2 GLY A 61 25.429 23.739 -34.576 1.00 0.00 H new ATOM 0 HA3 GLY A 61 27.014 23.079 -34.226 1.00 0.00 H new ATOM 925 N SER A 62 26.078 20.522 -35.167 1.00 0.00 N ATOM 926 CA SER A 62 26.044 19.414 -36.141 1.00 0.00 C ATOM 927 C SER A 62 24.929 18.402 -35.842 1.00 0.00 C ATOM 928 O SER A 62 24.588 18.168 -34.681 1.00 0.00 O ATOM 929 CB SER A 62 27.405 18.702 -36.190 1.00 0.00 C ATOM 930 OG SER A 62 28.429 19.603 -36.602 1.00 0.00 O ATOM 0 H SER A 62 26.366 20.215 -34.238 1.00 0.00 H new ATOM 0 HA SER A 62 25.828 19.854 -37.115 1.00 0.00 H new ATOM 0 HB2 SER A 62 27.644 18.296 -35.207 1.00 0.00 H new ATOM 0 HB3 SER A 62 27.356 17.859 -36.880 1.00 0.00 H new ATOM 0 HG SER A 62 29.288 19.133 -36.626 1.00 0.00 H new ATOM 936 N LYS A 63 24.371 17.791 -36.903 1.00 0.00 N ATOM 937 CA LYS A 63 23.272 16.798 -36.870 1.00 0.00 C ATOM 938 C LYS A 63 22.109 17.222 -35.951 1.00 0.00 C ATOM 939 O LYS A 63 21.757 16.551 -34.981 1.00 0.00 O ATOM 940 CB LYS A 63 23.854 15.384 -36.628 1.00 0.00 C ATOM 941 CG LYS A 63 22.848 14.214 -36.628 1.00 0.00 C ATOM 942 CD LYS A 63 21.801 14.258 -37.759 1.00 0.00 C ATOM 943 CE LYS A 63 20.854 13.048 -37.728 1.00 0.00 C ATOM 944 NZ LYS A 63 19.881 13.121 -36.602 1.00 0.00 N ATOM 0 H LYS A 63 24.686 17.983 -37.854 1.00 0.00 H new ATOM 0 HA LYS A 63 22.787 16.755 -37.845 1.00 0.00 H new ATOM 0 HB2 LYS A 63 24.604 15.188 -37.394 1.00 0.00 H new ATOM 0 HB3 LYS A 63 24.372 15.388 -35.669 1.00 0.00 H new ATOM 0 HG2 LYS A 63 23.402 13.278 -36.701 1.00 0.00 H new ATOM 0 HG3 LYS A 63 22.327 14.202 -35.671 1.00 0.00 H new ATOM 0 HD2 LYS A 63 21.218 15.175 -37.675 1.00 0.00 H new ATOM 0 HD3 LYS A 63 22.311 14.292 -38.722 1.00 0.00 H new ATOM 0 HE2 LYS A 63 20.311 12.990 -38.671 1.00 0.00 H new ATOM 0 HE3 LYS A 63 21.440 12.133 -37.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.210 12.329 -36.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 20.392 13.064 -35.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 19.361 14.020 -36.650 1.00 0.00 H new ATOM 958 N LEU A 64 21.512 18.368 -36.282 1.00 0.00 N ATOM 959 CA LEU A 64 20.339 18.919 -35.594 1.00 0.00 C ATOM 960 C LEU A 64 19.048 18.475 -36.307 1.00 0.00 C ATOM 961 O LEU A 64 18.911 18.652 -37.520 1.00 0.00 O ATOM 962 CB LEU A 64 20.465 20.453 -35.501 1.00 0.00 C ATOM 963 CG LEU A 64 21.772 20.964 -34.857 1.00 0.00 C ATOM 964 CD1 LEU A 64 21.782 22.493 -34.851 1.00 0.00 C ATOM 965 CD2 LEU A 64 21.950 20.482 -33.416 1.00 0.00 C ATOM 0 H LEU A 64 21.836 18.953 -37.052 1.00 0.00 H new ATOM 0 HA LEU A 64 20.289 18.532 -34.576 1.00 0.00 H new ATOM 0 HB2 LEU A 64 20.385 20.870 -36.505 1.00 0.00 H new ATOM 0 HB3 LEU A 64 19.621 20.837 -34.928 1.00 0.00 H new ATOM 0 HG LEU A 64 22.591 20.564 -35.455 1.00 0.00 H new ATOM 0 HD11 LEU A 64 22.706 22.849 -34.396 1.00 0.00 H new ATOM 0 HD12 LEU A 64 21.717 22.861 -35.875 1.00 0.00 H new ATOM 0 HD13 LEU A 64 20.930 22.860 -34.278 1.00 0.00 H new ATOM 0 HD21 LEU A 64 22.885 20.872 -33.015 1.00 0.00 H new ATOM 0 HD22 LEU A 64 21.118 20.838 -32.808 1.00 0.00 H new ATOM 0 HD23 LEU A 64 21.973 19.392 -33.397 1.00 0.00 H new ATOM 977 N GLY A 65 18.108 17.884 -35.561 1.00 0.00 N ATOM 978 CA GLY A 65 16.879 17.292 -36.108 1.00 0.00 C ATOM 979 C GLY A 65 17.140 16.077 -37.014 1.00 0.00 C ATOM 980 O GLY A 65 18.136 15.363 -36.861 1.00 0.00 O ATOM 0 H GLY A 65 18.179 17.802 -34.547 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.232 16.990 -35.285 1.00 0.00 H new ATOM 0 HA3 GLY A 65 16.340 18.051 -36.676 1.00 0.00 H new ATOM 984 N GLY A 66 16.237 15.832 -37.971 1.00 0.00 N ATOM 985 CA GLY A 66 16.388 14.813 -39.023 1.00 0.00 C ATOM 986 C GLY A 66 16.146 13.355 -38.592 1.00 0.00 C ATOM 987 O GLY A 66 16.431 12.442 -39.369 1.00 0.00 O ATOM 0 H GLY A 66 15.360 16.348 -38.039 1.00 0.00 H new ATOM 0 HA2 GLY A 66 15.698 15.051 -39.833 1.00 0.00 H new ATOM 0 HA3 GLY A 66 17.396 14.888 -39.431 1.00 0.00 H new ATOM 991 N SER A 67 15.627 13.129 -37.379 1.00 0.00 N ATOM 992 CA SER A 67 15.346 11.798 -36.804 1.00 0.00 C ATOM 993 C SER A 67 14.017 11.776 -36.034 1.00 0.00 C ATOM 994 O SER A 67 13.596 12.791 -35.471 1.00 0.00 O ATOM 995 CB SER A 67 16.485 11.362 -35.869 1.00 0.00 C ATOM 996 OG SER A 67 17.712 11.230 -36.577 1.00 0.00 O ATOM 0 H SER A 67 15.381 13.890 -36.746 1.00 0.00 H new ATOM 0 HA SER A 67 15.269 11.100 -37.638 1.00 0.00 H new ATOM 0 HB2 SER A 67 16.601 12.093 -35.068 1.00 0.00 H new ATOM 0 HB3 SER A 67 16.230 10.412 -35.399 1.00 0.00 H new ATOM 0 HG SER A 67 18.327 10.665 -36.064 1.00 0.00 H new ATOM 1002 N GLY A 68 13.370 10.605 -35.979 1.00 0.00 N ATOM 1003 CA GLY A 68 12.068 10.396 -35.324 1.00 0.00 C ATOM 1004 C GLY A 68 10.859 10.894 -36.135 1.00 0.00 C ATOM 1005 O GLY A 68 11.000 11.472 -37.217 1.00 0.00 O ATOM 0 H GLY A 68 13.745 9.754 -36.399 1.00 0.00 H new ATOM 0 HA2 GLY A 68 11.942 9.332 -35.125 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.076 10.902 -34.359 1.00 0.00 H new ATOM 1009 N GLY A 69 9.654 10.637 -35.612 1.00 0.00 N ATOM 1010 CA GLY A 69 8.375 10.962 -36.270 1.00 0.00 C ATOM 1011 C GLY A 69 7.866 12.398 -36.064 1.00 0.00 C ATOM 1012 O GLY A 69 6.899 12.794 -36.716 1.00 0.00 O ATOM 0 H GLY A 69 9.534 10.189 -34.703 1.00 0.00 H new ATOM 0 HA2 GLY A 69 8.482 10.784 -37.340 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.615 10.271 -35.907 1.00 0.00 H new ATOM 1016 N SER A 70 8.489 13.175 -35.166 1.00 0.00 N ATOM 1017 CA SER A 70 8.136 14.574 -34.835 1.00 0.00 C ATOM 1018 C SER A 70 6.663 14.788 -34.419 1.00 0.00 C ATOM 1019 O SER A 70 6.078 15.845 -34.676 1.00 0.00 O ATOM 1020 CB SER A 70 8.584 15.536 -35.950 1.00 0.00 C ATOM 1021 OG SER A 70 9.980 15.413 -36.194 1.00 0.00 O ATOM 0 H SER A 70 9.286 12.838 -34.626 1.00 0.00 H new ATOM 0 HA SER A 70 8.699 14.815 -33.933 1.00 0.00 H new ATOM 0 HB2 SER A 70 8.030 15.323 -36.864 1.00 0.00 H new ATOM 0 HB3 SER A 70 8.349 16.562 -35.667 1.00 0.00 H new ATOM 0 HG SER A 70 10.243 16.032 -36.907 1.00 0.00 H new ATOM 1027 N ARG A 71 6.050 13.782 -33.774 1.00 0.00 N ATOM 1028 CA ARG A 71 4.649 13.812 -33.300 1.00 0.00 C ATOM 1029 C ARG A 71 4.494 14.617 -31.998 1.00 0.00 C ATOM 1030 O ARG A 71 5.437 14.736 -31.211 1.00 0.00 O ATOM 1031 CB ARG A 71 4.102 12.378 -33.125 1.00 0.00 C ATOM 1032 CG ARG A 71 4.158 11.534 -34.409 1.00 0.00 C ATOM 1033 CD ARG A 71 3.500 10.159 -34.224 1.00 0.00 C ATOM 1034 NE ARG A 71 2.021 10.243 -34.228 1.00 0.00 N ATOM 1035 CZ ARG A 71 1.177 9.945 -33.254 1.00 0.00 C ATOM 1036 NH1 ARG A 71 1.562 9.644 -32.051 1.00 0.00 N ATOM 1037 NH2 ARG A 71 -0.107 9.956 -33.460 1.00 0.00 N ATOM 0 H ARG A 71 6.522 12.903 -33.561 1.00 0.00 H new ATOM 0 HA ARG A 71 4.061 14.320 -34.064 1.00 0.00 H new ATOM 0 HB2 ARG A 71 4.672 11.874 -32.344 1.00 0.00 H new ATOM 0 HB3 ARG A 71 3.069 12.432 -32.781 1.00 0.00 H new ATOM 0 HG2 ARG A 71 3.658 12.069 -35.216 1.00 0.00 H new ATOM 0 HG3 ARG A 71 5.197 11.401 -34.710 1.00 0.00 H new ATOM 0 HD2 ARG A 71 3.827 9.491 -35.021 1.00 0.00 H new ATOM 0 HD3 ARG A 71 3.835 9.721 -33.284 1.00 0.00 H new ATOM 0 HE ARG A 71 1.598 10.574 -35.095 1.00 0.00 H new ATOM 0 HH11 ARG A 71 2.556 9.630 -31.822 1.00 0.00 H new ATOM 0 HH12 ARG A 71 0.871 9.422 -31.335 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -0.474 10.196 -34.381 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -0.747 9.724 -32.701 1.00 0.00 H new ATOM 1051 N LYS A 72 3.267 15.090 -31.736 1.00 0.00 N ATOM 1052 CA LYS A 72 2.834 15.718 -30.462 1.00 0.00 C ATOM 1053 C LYS A 72 2.195 14.716 -29.475 1.00 0.00 C ATOM 1054 O LYS A 72 1.596 15.108 -28.474 1.00 0.00 O ATOM 1055 CB LYS A 72 1.918 16.922 -30.758 1.00 0.00 C ATOM 1056 CG LYS A 72 2.633 18.026 -31.558 1.00 0.00 C ATOM 1057 CD LYS A 72 1.710 19.238 -31.767 1.00 0.00 C ATOM 1058 CE LYS A 72 2.411 20.413 -32.472 1.00 0.00 C ATOM 1059 NZ LYS A 72 2.711 20.133 -33.906 1.00 0.00 N ATOM 0 H LYS A 72 2.516 15.048 -32.425 1.00 0.00 H new ATOM 0 HA LYS A 72 3.726 16.080 -29.950 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.045 16.582 -31.315 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.554 17.337 -29.818 1.00 0.00 H new ATOM 0 HG2 LYS A 72 3.534 18.337 -31.030 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.949 17.634 -32.525 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.845 18.932 -32.356 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.335 19.573 -30.800 1.00 0.00 H new ATOM 0 HE2 LYS A 72 1.780 21.299 -32.404 1.00 0.00 H new ATOM 0 HE3 LYS A 72 3.340 20.642 -31.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 3.182 20.958 -34.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 3.336 19.304 -33.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.825 19.942 -34.415 1.00 0.00 H new ATOM 1073 N ASP A 73 2.315 13.420 -29.767 1.00 0.00 N ATOM 1074 CA ASP A 73 1.716 12.290 -29.046 1.00 0.00 C ATOM 1075 C ASP A 73 2.652 11.063 -29.086 1.00 0.00 C ATOM 1076 O ASP A 73 3.301 10.807 -30.106 1.00 0.00 O ATOM 1077 CB ASP A 73 0.353 11.986 -29.693 1.00 0.00 C ATOM 1078 CG ASP A 73 -0.263 10.668 -29.200 1.00 0.00 C ATOM 1079 OD1 ASP A 73 -0.699 10.604 -28.027 1.00 0.00 O ATOM 1080 OD2 ASP A 73 -0.297 9.697 -29.994 1.00 0.00 O ATOM 0 H ASP A 73 2.869 13.109 -30.565 1.00 0.00 H new ATOM 0 HA ASP A 73 1.572 12.540 -27.995 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -0.335 12.804 -29.480 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.472 11.943 -30.776 1.00 0.00 H new ATOM 1085 N LEU A 74 2.721 10.303 -27.987 1.00 0.00 N ATOM 1086 CA LEU A 74 3.544 9.092 -27.841 1.00 0.00 C ATOM 1087 C LEU A 74 2.956 8.102 -26.816 1.00 0.00 C ATOM 1088 O LEU A 74 2.127 8.469 -25.978 1.00 0.00 O ATOM 1089 CB LEU A 74 5.004 9.472 -27.497 1.00 0.00 C ATOM 1090 CG LEU A 74 5.313 9.894 -26.044 1.00 0.00 C ATOM 1091 CD1 LEU A 74 6.821 10.108 -25.897 1.00 0.00 C ATOM 1092 CD2 LEU A 74 4.617 11.185 -25.608 1.00 0.00 C ATOM 0 H LEU A 74 2.188 10.520 -27.145 1.00 0.00 H new ATOM 0 HA LEU A 74 3.541 8.573 -28.800 1.00 0.00 H new ATOM 0 HB2 LEU A 74 5.639 8.620 -27.741 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.301 10.289 -28.154 1.00 0.00 H new ATOM 0 HG LEU A 74 4.939 9.090 -25.410 1.00 0.00 H new ATOM 0 HD11 LEU A 74 7.048 10.406 -24.874 1.00 0.00 H new ATOM 0 HD12 LEU A 74 7.344 9.181 -26.129 1.00 0.00 H new ATOM 0 HD13 LEU A 74 7.146 10.890 -26.583 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.885 11.412 -24.576 1.00 0.00 H new ATOM 0 HD22 LEU A 74 4.932 12.004 -26.254 1.00 0.00 H new ATOM 0 HD23 LEU A 74 3.537 11.059 -25.683 1.00 0.00 H new ATOM 1104 N SER A 75 3.422 6.851 -26.864 1.00 0.00 N ATOM 1105 CA SER A 75 3.051 5.760 -25.943 1.00 0.00 C ATOM 1106 C SER A 75 4.254 4.873 -25.575 1.00 0.00 C ATOM 1107 O SER A 75 5.292 4.897 -26.248 1.00 0.00 O ATOM 1108 CB SER A 75 1.913 4.920 -26.549 1.00 0.00 C ATOM 1109 OG SER A 75 2.313 4.316 -27.774 1.00 0.00 O ATOM 0 H SER A 75 4.094 6.553 -27.571 1.00 0.00 H new ATOM 0 HA SER A 75 2.702 6.215 -25.016 1.00 0.00 H new ATOM 0 HB2 SER A 75 1.612 4.148 -25.841 1.00 0.00 H new ATOM 0 HB3 SER A 75 1.042 5.553 -26.720 1.00 0.00 H new ATOM 0 HG SER A 75 1.571 3.787 -28.136 1.00 0.00 H new ATOM 1115 N VAL A 76 4.123 4.101 -24.487 1.00 0.00 N ATOM 1116 CA VAL A 76 5.162 3.192 -23.951 1.00 0.00 C ATOM 1117 C VAL A 76 4.594 1.823 -23.554 1.00 0.00 C ATOM 1118 O VAL A 76 3.400 1.689 -23.276 1.00 0.00 O ATOM 1119 CB VAL A 76 5.926 3.818 -22.759 1.00 0.00 C ATOM 1120 CG1 VAL A 76 6.847 4.948 -23.223 1.00 0.00 C ATOM 1121 CG2 VAL A 76 5.008 4.343 -21.649 1.00 0.00 C ATOM 0 H VAL A 76 3.266 4.087 -23.934 1.00 0.00 H new ATOM 0 HA VAL A 76 5.869 3.038 -24.766 1.00 0.00 H new ATOM 0 HB VAL A 76 6.516 3.004 -22.339 1.00 0.00 H new ATOM 0 HG11 VAL A 76 7.370 5.368 -22.363 1.00 0.00 H new ATOM 0 HG12 VAL A 76 7.574 4.556 -23.934 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.254 5.727 -23.703 1.00 0.00 H new ATOM 0 HG21 VAL A 76 5.612 4.767 -20.847 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.351 5.112 -22.054 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.407 3.523 -21.255 1.00 0.00 H new ATOM 1131 N LYS A 77 5.466 0.806 -23.503 1.00 0.00 N ATOM 1132 CA LYS A 77 5.109 -0.596 -23.187 1.00 0.00 C ATOM 1133 C LYS A 77 4.956 -0.883 -21.683 1.00 0.00 C ATOM 1134 O LYS A 77 4.372 -1.900 -21.307 1.00 0.00 O ATOM 1135 CB LYS A 77 6.139 -1.547 -23.825 1.00 0.00 C ATOM 1136 CG LYS A 77 6.130 -1.482 -25.363 1.00 0.00 C ATOM 1137 CD LYS A 77 7.114 -2.498 -25.958 1.00 0.00 C ATOM 1138 CE LYS A 77 7.083 -2.430 -27.491 1.00 0.00 C ATOM 1139 NZ LYS A 77 8.030 -3.403 -28.103 1.00 0.00 N ATOM 0 H LYS A 77 6.462 0.932 -23.683 1.00 0.00 H new ATOM 0 HA LYS A 77 4.121 -0.770 -23.613 1.00 0.00 H new ATOM 0 HB2 LYS A 77 7.135 -1.296 -23.460 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.931 -2.569 -23.507 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.125 -1.683 -25.734 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.396 -0.477 -25.690 1.00 0.00 H new ATOM 0 HD2 LYS A 77 8.122 -2.293 -25.598 1.00 0.00 H new ATOM 0 HD3 LYS A 77 6.855 -3.503 -25.626 1.00 0.00 H new ATOM 0 HE2 LYS A 77 6.072 -2.634 -27.844 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.337 -1.421 -27.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 7.982 -3.329 -29.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 8.998 -3.193 -27.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 7.772 -4.368 -27.813 1.00 0.00 H new ATOM 1153 N GLY A 78 5.460 0.010 -20.830 1.00 0.00 N ATOM 1154 CA GLY A 78 5.384 -0.055 -19.367 1.00 0.00 C ATOM 1155 C GLY A 78 5.764 1.278 -18.709 1.00 0.00 C ATOM 1156 O GLY A 78 6.219 2.200 -19.388 1.00 0.00 O ATOM 0 H GLY A 78 5.957 0.839 -21.155 1.00 0.00 H new ATOM 0 HA2 GLY A 78 4.372 -0.330 -19.069 1.00 0.00 H new ATOM 0 HA3 GLY A 78 6.048 -0.840 -19.005 1.00 0.00 H new ATOM 1160 N MET A 79 5.552 1.389 -17.391 1.00 0.00 N ATOM 1161 CA MET A 79 5.747 2.622 -16.599 1.00 0.00 C ATOM 1162 C MET A 79 4.989 3.843 -17.173 1.00 0.00 C ATOM 1163 O MET A 79 5.497 4.966 -17.197 1.00 0.00 O ATOM 1164 CB MET A 79 7.248 2.879 -16.343 1.00 0.00 C ATOM 1165 CG MET A 79 7.936 1.712 -15.623 1.00 0.00 C ATOM 1166 SD MET A 79 9.681 2.017 -15.233 1.00 0.00 S ATOM 1167 CE MET A 79 10.078 0.452 -14.405 1.00 0.00 C ATOM 0 H MET A 79 5.231 0.604 -16.825 1.00 0.00 H new ATOM 0 HA MET A 79 5.286 2.462 -15.624 1.00 0.00 H new ATOM 0 HB2 MET A 79 7.749 3.059 -17.294 1.00 0.00 H new ATOM 0 HB3 MET A 79 7.361 3.785 -15.747 1.00 0.00 H new ATOM 0 HG2 MET A 79 7.399 1.500 -14.699 1.00 0.00 H new ATOM 0 HG3 MET A 79 7.863 0.820 -16.245 1.00 0.00 H new ATOM 0 HE1 MET A 79 11.122 0.460 -14.093 1.00 0.00 H new ATOM 0 HE2 MET A 79 9.439 0.331 -13.531 1.00 0.00 H new ATOM 0 HE3 MET A 79 9.912 -0.376 -15.094 1.00 0.00 H new ATOM 1177 N LEU A 80 3.759 3.612 -17.655 1.00 0.00 N ATOM 1178 CA LEU A 80 2.916 4.621 -18.318 1.00 0.00 C ATOM 1179 C LEU A 80 2.412 5.725 -17.363 1.00 0.00 C ATOM 1180 O LEU A 80 2.158 6.848 -17.805 1.00 0.00 O ATOM 1181 CB LEU A 80 1.755 3.875 -19.007 1.00 0.00 C ATOM 1182 CG LEU A 80 0.787 4.748 -19.834 1.00 0.00 C ATOM 1183 CD1 LEU A 80 1.480 5.488 -20.980 1.00 0.00 C ATOM 1184 CD2 LEU A 80 -0.290 3.855 -20.451 1.00 0.00 C ATOM 0 H LEU A 80 3.311 2.698 -17.594 1.00 0.00 H new ATOM 0 HA LEU A 80 3.515 5.158 -19.054 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.177 3.114 -19.663 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.179 3.354 -18.242 1.00 0.00 H new ATOM 0 HG LEU A 80 0.370 5.487 -19.150 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.747 6.084 -21.524 1.00 0.00 H new ATOM 0 HD12 LEU A 80 2.253 6.142 -20.576 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.935 4.765 -21.658 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.977 4.466 -21.037 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.179 3.114 -21.098 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -0.840 3.348 -19.658 1.00 0.00 H new ATOM 1196 N TYR A 81 2.293 5.416 -16.064 1.00 0.00 N ATOM 1197 CA TYR A 81 1.775 6.313 -15.020 1.00 0.00 C ATOM 1198 C TYR A 81 2.705 6.388 -13.792 1.00 0.00 C ATOM 1199 O TYR A 81 3.463 5.456 -13.516 1.00 0.00 O ATOM 1200 CB TYR A 81 0.365 5.858 -14.606 1.00 0.00 C ATOM 1201 CG TYR A 81 -0.632 5.725 -15.747 1.00 0.00 C ATOM 1202 CD1 TYR A 81 -1.102 6.876 -16.411 1.00 0.00 C ATOM 1203 CD2 TYR A 81 -1.087 4.450 -16.142 1.00 0.00 C ATOM 1204 CE1 TYR A 81 -2.029 6.754 -17.465 1.00 0.00 C ATOM 1205 CE2 TYR A 81 -2.021 4.325 -17.190 1.00 0.00 C ATOM 1206 CZ TYR A 81 -2.493 5.479 -17.856 1.00 0.00 C ATOM 1207 OH TYR A 81 -3.396 5.373 -18.872 1.00 0.00 O ATOM 0 H TYR A 81 2.564 4.503 -15.698 1.00 0.00 H new ATOM 0 HA TYR A 81 1.730 7.319 -15.437 1.00 0.00 H new ATOM 0 HB2 TYR A 81 0.445 4.896 -14.100 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -0.030 6.568 -13.880 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.751 7.853 -16.112 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -0.719 3.567 -15.640 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -2.385 7.637 -17.975 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -2.376 3.348 -17.484 1.00 0.00 H new ATOM 0 HH TYR A 81 -3.613 4.429 -19.019 1.00 0.00 H new ATOM 1217 N ASP A 82 2.621 7.499 -13.046 1.00 0.00 N ATOM 1218 CA ASP A 82 3.425 7.803 -11.849 1.00 0.00 C ATOM 1219 C ASP A 82 4.943 7.566 -12.033 1.00 0.00 C ATOM 1220 O ASP A 82 5.573 6.774 -11.322 1.00 0.00 O ATOM 1221 CB ASP A 82 2.822 7.137 -10.601 1.00 0.00 C ATOM 1222 CG ASP A 82 3.505 7.622 -9.305 1.00 0.00 C ATOM 1223 OD1 ASP A 82 3.729 8.850 -9.162 1.00 0.00 O ATOM 1224 OD2 ASP A 82 3.792 6.785 -8.414 1.00 0.00 O ATOM 0 H ASP A 82 1.962 8.245 -13.269 1.00 0.00 H new ATOM 0 HA ASP A 82 3.366 8.879 -11.687 1.00 0.00 H new ATOM 0 HB2 ASP A 82 1.755 7.355 -10.553 1.00 0.00 H new ATOM 0 HB3 ASP A 82 2.923 6.055 -10.682 1.00 0.00 H new ATOM 1229 N SER A 83 5.522 8.250 -13.025 1.00 0.00 N ATOM 1230 CA SER A 83 6.934 8.136 -13.418 1.00 0.00 C ATOM 1231 C SER A 83 7.910 8.439 -12.273 1.00 0.00 C ATOM 1232 O SER A 83 7.647 9.283 -11.413 1.00 0.00 O ATOM 1233 CB SER A 83 7.230 9.078 -14.594 1.00 0.00 C ATOM 1234 OG SER A 83 6.317 8.856 -15.662 1.00 0.00 O ATOM 0 H SER A 83 5.006 8.920 -13.596 1.00 0.00 H new ATOM 0 HA SER A 83 7.088 7.097 -13.708 1.00 0.00 H new ATOM 0 HB2 SER A 83 7.163 10.114 -14.262 1.00 0.00 H new ATOM 0 HB3 SER A 83 8.250 8.921 -14.944 1.00 0.00 H new ATOM 0 HG SER A 83 6.522 9.467 -16.400 1.00 0.00 H new ATOM 1240 N ASP A 84 9.088 7.809 -12.291 1.00 0.00 N ATOM 1241 CA ASP A 84 10.089 7.942 -11.222 1.00 0.00 C ATOM 1242 C ASP A 84 10.563 9.391 -11.004 1.00 0.00 C ATOM 1243 O ASP A 84 10.827 9.776 -9.868 1.00 0.00 O ATOM 1244 CB ASP A 84 11.268 6.995 -11.480 1.00 0.00 C ATOM 1245 CG ASP A 84 12.164 7.446 -12.647 1.00 0.00 C ATOM 1246 OD1 ASP A 84 11.760 7.283 -13.824 1.00 0.00 O ATOM 1247 OD2 ASP A 84 13.280 7.956 -12.387 1.00 0.00 O ATOM 0 H ASP A 84 9.378 7.190 -13.048 1.00 0.00 H new ATOM 0 HA ASP A 84 9.600 7.654 -10.291 1.00 0.00 H new ATOM 0 HB2 ASP A 84 11.871 6.921 -10.575 1.00 0.00 H new ATOM 0 HB3 ASP A 84 10.884 5.997 -11.690 1.00 0.00 H new ATOM 1252 N SER A 85 10.578 10.234 -12.046 1.00 0.00 N ATOM 1253 CA SER A 85 10.954 11.650 -11.906 1.00 0.00 C ATOM 1254 C SER A 85 10.037 12.422 -10.949 1.00 0.00 C ATOM 1255 O SER A 85 10.538 13.142 -10.083 1.00 0.00 O ATOM 1256 CB SER A 85 11.023 12.339 -13.275 1.00 0.00 C ATOM 1257 OG SER A 85 12.307 12.142 -13.857 1.00 0.00 O ATOM 0 H SER A 85 10.334 9.960 -12.998 1.00 0.00 H new ATOM 0 HA SER A 85 11.948 11.662 -11.459 1.00 0.00 H new ATOM 0 HB2 SER A 85 10.252 11.938 -13.932 1.00 0.00 H new ATOM 0 HB3 SER A 85 10.825 13.405 -13.165 1.00 0.00 H new ATOM 0 HG SER A 85 12.341 12.584 -14.731 1.00 0.00 H new ATOM 1263 N GLN A 86 8.708 12.234 -11.010 1.00 0.00 N ATOM 1264 CA GLN A 86 7.795 12.886 -10.054 1.00 0.00 C ATOM 1265 C GLN A 86 7.879 12.283 -8.640 1.00 0.00 C ATOM 1266 O GLN A 86 7.766 13.023 -7.664 1.00 0.00 O ATOM 1267 CB GLN A 86 6.362 13.022 -10.598 1.00 0.00 C ATOM 1268 CG GLN A 86 5.525 11.736 -10.695 1.00 0.00 C ATOM 1269 CD GLN A 86 4.053 12.029 -10.999 1.00 0.00 C ATOM 1270 OE1 GLN A 86 3.700 12.981 -11.688 1.00 0.00 O ATOM 1271 NE2 GLN A 86 3.134 11.226 -10.506 1.00 0.00 N ATOM 0 H GLN A 86 8.246 11.644 -11.702 1.00 0.00 H new ATOM 0 HA GLN A 86 8.149 13.911 -9.939 1.00 0.00 H new ATOM 0 HB2 GLN A 86 5.825 13.728 -9.964 1.00 0.00 H new ATOM 0 HB3 GLN A 86 6.418 13.465 -11.592 1.00 0.00 H new ATOM 0 HG2 GLN A 86 5.935 11.095 -11.475 1.00 0.00 H new ATOM 0 HG3 GLN A 86 5.598 11.184 -9.758 1.00 0.00 H new ATOM 0 HE21 GLN A 86 3.408 10.429 -9.931 1.00 0.00 H new ATOM 0 HE22 GLN A 86 2.148 11.400 -10.699 1.00 0.00 H new ATOM 1280 N GLN A 87 8.152 10.979 -8.507 1.00 0.00 N ATOM 1281 CA GLN A 87 8.414 10.345 -7.199 1.00 0.00 C ATOM 1282 C GLN A 87 9.677 10.927 -6.534 1.00 0.00 C ATOM 1283 O GLN A 87 9.640 11.344 -5.375 1.00 0.00 O ATOM 1284 CB GLN A 87 8.556 8.823 -7.362 1.00 0.00 C ATOM 1285 CG GLN A 87 7.292 8.113 -7.884 1.00 0.00 C ATOM 1286 CD GLN A 87 7.482 6.598 -8.028 1.00 0.00 C ATOM 1287 OE1 GLN A 87 8.581 6.058 -8.002 1.00 0.00 O ATOM 1288 NE2 GLN A 87 6.420 5.840 -8.176 1.00 0.00 N ATOM 0 H GLN A 87 8.198 10.333 -9.295 1.00 0.00 H new ATOM 0 HA GLN A 87 7.564 10.557 -6.551 1.00 0.00 H new ATOM 0 HB2 GLN A 87 9.380 8.619 -8.046 1.00 0.00 H new ATOM 0 HB3 GLN A 87 8.828 8.391 -6.399 1.00 0.00 H new ATOM 0 HG2 GLN A 87 6.463 8.308 -7.203 1.00 0.00 H new ATOM 0 HG3 GLN A 87 7.017 8.534 -8.851 1.00 0.00 H new ATOM 0 HE21 GLN A 87 5.492 6.262 -8.201 1.00 0.00 H new ATOM 0 HE22 GLN A 87 6.523 4.829 -8.266 1.00 0.00 H new ATOM 1297 N ILE A 88 10.777 11.026 -7.292 1.00 0.00 N ATOM 1298 CA ILE A 88 12.035 11.643 -6.842 1.00 0.00 C ATOM 1299 C ILE A 88 11.819 13.125 -6.507 1.00 0.00 C ATOM 1300 O ILE A 88 12.267 13.567 -5.455 1.00 0.00 O ATOM 1301 CB ILE A 88 13.139 11.437 -7.910 1.00 0.00 C ATOM 1302 CG1 ILE A 88 13.534 9.948 -8.076 1.00 0.00 C ATOM 1303 CG2 ILE A 88 14.394 12.282 -7.618 1.00 0.00 C ATOM 1304 CD1 ILE A 88 14.425 9.349 -6.981 1.00 0.00 C ATOM 0 H ILE A 88 10.820 10.675 -8.249 1.00 0.00 H new ATOM 0 HA ILE A 88 12.369 11.155 -5.926 1.00 0.00 H new ATOM 0 HB ILE A 88 12.704 11.778 -8.850 1.00 0.00 H new ATOM 0 HG12 ILE A 88 12.620 9.357 -8.133 1.00 0.00 H new ATOM 0 HG13 ILE A 88 14.046 9.836 -9.032 1.00 0.00 H new ATOM 0 HG21 ILE A 88 15.140 12.105 -8.393 1.00 0.00 H new ATOM 0 HG22 ILE A 88 14.127 13.339 -7.606 1.00 0.00 H new ATOM 0 HG23 ILE A 88 14.804 12.001 -6.648 1.00 0.00 H new ATOM 0 HD11 ILE A 88 14.631 8.304 -7.211 1.00 0.00 H new ATOM 0 HD12 ILE A 88 15.363 9.902 -6.933 1.00 0.00 H new ATOM 0 HD13 ILE A 88 13.915 9.416 -6.020 1.00 0.00 H new ATOM 1316 N LEU A 89 11.076 13.883 -7.324 1.00 0.00 N ATOM 1317 CA LEU A 89 10.730 15.275 -7.007 1.00 0.00 C ATOM 1318 C LEU A 89 9.940 15.391 -5.700 1.00 0.00 C ATOM 1319 O LEU A 89 10.314 16.198 -4.854 1.00 0.00 O ATOM 1320 CB LEU A 89 9.951 15.898 -8.186 1.00 0.00 C ATOM 1321 CG LEU A 89 9.507 17.360 -7.974 1.00 0.00 C ATOM 1322 CD1 LEU A 89 10.689 18.317 -7.799 1.00 0.00 C ATOM 1323 CD2 LEU A 89 8.690 17.827 -9.177 1.00 0.00 C ATOM 0 H LEU A 89 10.701 13.554 -8.214 1.00 0.00 H new ATOM 0 HA LEU A 89 11.657 15.829 -6.858 1.00 0.00 H new ATOM 0 HB2 LEU A 89 10.573 15.849 -9.079 1.00 0.00 H new ATOM 0 HB3 LEU A 89 9.067 15.290 -8.380 1.00 0.00 H new ATOM 0 HG LEU A 89 8.915 17.379 -7.059 1.00 0.00 H new ATOM 0 HD11 LEU A 89 10.317 19.331 -7.654 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.275 18.017 -6.930 1.00 0.00 H new ATOM 0 HD13 LEU A 89 11.318 18.285 -8.689 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.377 18.860 -9.025 1.00 0.00 H new ATOM 0 HD22 LEU A 89 9.299 17.761 -10.078 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.810 17.194 -9.287 1.00 0.00 H new ATOM 1335 N ASN A 90 8.901 14.578 -5.496 1.00 0.00 N ATOM 1336 CA ASN A 90 8.121 14.583 -4.257 1.00 0.00 C ATOM 1337 C ASN A 90 9.009 14.320 -3.029 1.00 0.00 C ATOM 1338 O ASN A 90 9.044 15.146 -2.113 1.00 0.00 O ATOM 1339 CB ASN A 90 6.973 13.563 -4.382 1.00 0.00 C ATOM 1340 CG ASN A 90 6.327 13.267 -3.034 1.00 0.00 C ATOM 1341 OD1 ASN A 90 6.425 12.172 -2.502 1.00 0.00 O ATOM 1342 ND2 ASN A 90 5.699 14.236 -2.420 1.00 0.00 N ATOM 0 H ASN A 90 8.577 13.899 -6.184 1.00 0.00 H new ATOM 0 HA ASN A 90 7.689 15.572 -4.104 1.00 0.00 H new ATOM 0 HB2 ASN A 90 6.219 13.947 -5.069 1.00 0.00 H new ATOM 0 HB3 ASN A 90 7.355 12.637 -4.813 1.00 0.00 H new ATOM 0 HD21 ASN A 90 5.292 14.077 -1.498 1.00 0.00 H new ATOM 0 HD22 ASN A 90 5.616 15.151 -2.863 1.00 0.00 H new ATOM 1349 N ARG A 91 9.787 13.226 -3.018 1.00 0.00 N ATOM 1350 CA ARG A 91 10.649 12.916 -1.862 1.00 0.00 C ATOM 1351 C ARG A 91 11.776 13.936 -1.694 1.00 0.00 C ATOM 1352 O ARG A 91 12.070 14.288 -0.559 1.00 0.00 O ATOM 1353 CB ARG A 91 11.133 11.452 -1.917 1.00 0.00 C ATOM 1354 CG ARG A 91 12.104 11.050 -0.782 1.00 0.00 C ATOM 1355 CD ARG A 91 11.550 11.222 0.638 1.00 0.00 C ATOM 1356 NE ARG A 91 12.620 11.040 1.645 1.00 0.00 N ATOM 1357 CZ ARG A 91 12.524 11.170 2.955 1.00 0.00 C ATOM 1358 NH1 ARG A 91 11.407 11.474 3.550 1.00 0.00 N ATOM 1359 NH2 ARG A 91 13.584 10.992 3.682 1.00 0.00 N ATOM 0 H ARG A 91 9.839 12.551 -3.781 1.00 0.00 H new ATOM 0 HA ARG A 91 10.053 13.008 -0.954 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.264 10.795 -1.883 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.625 11.282 -2.875 1.00 0.00 H new ATOM 0 HG2 ARG A 91 12.389 10.007 -0.921 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.013 11.644 -0.875 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.110 12.213 0.744 1.00 0.00 H new ATOM 0 HD3 ARG A 91 10.753 10.499 0.813 1.00 0.00 H new ATOM 0 HE ARG A 91 13.539 10.784 1.284 1.00 0.00 H new ATOM 0 HH11 ARG A 91 10.560 11.622 3.001 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.378 11.564 4.566 1.00 0.00 H new ATOM 0 HH21 ARG A 91 14.472 10.756 3.239 1.00 0.00 H new ATOM 0 HH22 ARG A 91 13.529 11.088 4.696 1.00 0.00 H new ATOM 1373 N LEU A 92 12.369 14.470 -2.765 1.00 0.00 N ATOM 1374 CA LEU A 92 13.427 15.485 -2.648 1.00 0.00 C ATOM 1375 C LEU A 92 12.871 16.814 -2.122 1.00 0.00 C ATOM 1376 O LEU A 92 13.489 17.428 -1.258 1.00 0.00 O ATOM 1377 CB LEU A 92 14.125 15.656 -4.014 1.00 0.00 C ATOM 1378 CG LEU A 92 15.350 16.591 -4.001 1.00 0.00 C ATOM 1379 CD1 LEU A 92 16.529 16.007 -3.228 1.00 0.00 C ATOM 1380 CD2 LEU A 92 15.804 16.829 -5.435 1.00 0.00 C ATOM 0 H LEU A 92 12.136 14.218 -3.726 1.00 0.00 H new ATOM 0 HA LEU A 92 14.165 15.148 -1.920 1.00 0.00 H new ATOM 0 HB2 LEU A 92 14.438 14.675 -4.372 1.00 0.00 H new ATOM 0 HB3 LEU A 92 13.400 16.040 -4.731 1.00 0.00 H new ATOM 0 HG LEU A 92 15.044 17.515 -3.509 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.363 16.708 -3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 92 16.234 15.830 -2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.833 15.065 -3.685 1.00 0.00 H new ATOM 0 HD21 LEU A 92 16.671 17.490 -5.437 1.00 0.00 H new ATOM 0 HD22 LEU A 92 16.072 15.878 -5.895 1.00 0.00 H new ATOM 0 HD23 LEU A 92 14.995 17.290 -6.001 1.00 0.00 H new ATOM 1392 N ARG A 93 11.691 17.242 -2.584 1.00 0.00 N ATOM 1393 CA ARG A 93 11.067 18.502 -2.151 1.00 0.00 C ATOM 1394 C ARG A 93 10.600 18.422 -0.701 1.00 0.00 C ATOM 1395 O ARG A 93 10.813 19.364 0.050 1.00 0.00 O ATOM 1396 CB ARG A 93 9.952 18.870 -3.151 1.00 0.00 C ATOM 1397 CG ARG A 93 9.439 20.308 -2.972 1.00 0.00 C ATOM 1398 CD ARG A 93 8.544 20.703 -4.155 1.00 0.00 C ATOM 1399 NE ARG A 93 8.132 22.118 -4.059 1.00 0.00 N ATOM 1400 CZ ARG A 93 8.768 23.185 -4.519 1.00 0.00 C ATOM 1401 NH1 ARG A 93 9.884 23.096 -5.178 1.00 0.00 N ATOM 1402 NH2 ARG A 93 8.275 24.369 -4.310 1.00 0.00 N ATOM 0 H ARG A 93 11.139 16.726 -3.269 1.00 0.00 H new ATOM 0 HA ARG A 93 11.797 19.311 -2.160 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.327 18.747 -4.167 1.00 0.00 H new ATOM 0 HB3 ARG A 93 9.120 18.175 -3.032 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.879 20.389 -2.040 1.00 0.00 H new ATOM 0 HG3 ARG A 93 10.281 20.996 -2.898 1.00 0.00 H new ATOM 0 HD2 ARG A 93 9.079 20.539 -5.091 1.00 0.00 H new ATOM 0 HD3 ARG A 93 7.661 20.064 -4.176 1.00 0.00 H new ATOM 0 HE ARG A 93 7.249 22.295 -3.580 1.00 0.00 H new ATOM 0 HH11 ARG A 93 10.299 22.182 -5.357 1.00 0.00 H new ATOM 0 HH12 ARG A 93 10.345 23.940 -5.517 1.00 0.00 H new ATOM 0 HH21 ARG A 93 7.402 24.474 -3.794 1.00 0.00 H new ATOM 0 HH22 ARG A 93 8.761 25.193 -4.662 1.00 0.00 H new ATOM 1416 N GLU A 94 10.087 17.272 -0.265 1.00 0.00 N ATOM 1417 CA GLU A 94 9.792 17.027 1.157 1.00 0.00 C ATOM 1418 C GLU A 94 11.076 16.978 2.007 1.00 0.00 C ATOM 1419 O GLU A 94 11.174 17.696 3.003 1.00 0.00 O ATOM 1420 CB GLU A 94 8.962 15.744 1.309 1.00 0.00 C ATOM 1421 CG GLU A 94 7.544 15.931 0.746 1.00 0.00 C ATOM 1422 CD GLU A 94 6.657 14.667 0.816 1.00 0.00 C ATOM 1423 OE1 GLU A 94 7.077 13.626 1.377 1.00 0.00 O ATOM 1424 OE2 GLU A 94 5.508 14.727 0.310 1.00 0.00 O ATOM 0 H GLU A 94 9.864 16.487 -0.877 1.00 0.00 H new ATOM 0 HA GLU A 94 9.203 17.864 1.533 1.00 0.00 H new ATOM 0 HB2 GLU A 94 9.457 14.923 0.790 1.00 0.00 H new ATOM 0 HB3 GLU A 94 8.905 15.467 2.362 1.00 0.00 H new ATOM 0 HG2 GLU A 94 7.052 16.736 1.293 1.00 0.00 H new ATOM 0 HG3 GLU A 94 7.618 16.251 -0.293 1.00 0.00 H new ATOM 1431 N ARG A 95 12.091 16.209 1.583 1.00 0.00 N ATOM 1432 CA ARG A 95 13.378 16.053 2.295 1.00 0.00 C ATOM 1433 C ARG A 95 14.154 17.368 2.450 1.00 0.00 C ATOM 1434 O ARG A 95 14.773 17.589 3.491 1.00 0.00 O ATOM 1435 CB ARG A 95 14.193 14.965 1.562 1.00 0.00 C ATOM 1436 CG ARG A 95 15.614 14.722 2.099 1.00 0.00 C ATOM 1437 CD ARG A 95 16.193 13.434 1.490 1.00 0.00 C ATOM 1438 NE ARG A 95 17.655 13.357 1.652 1.00 0.00 N ATOM 1439 CZ ARG A 95 18.438 12.300 1.535 1.00 0.00 C ATOM 1440 NH1 ARG A 95 17.990 11.090 1.367 1.00 0.00 N ATOM 1441 NH2 ARG A 95 19.720 12.487 1.588 1.00 0.00 N ATOM 0 H ARG A 95 12.044 15.667 0.720 1.00 0.00 H new ATOM 0 HA ARG A 95 13.182 15.743 3.322 1.00 0.00 H new ATOM 0 HB2 ARG A 95 13.640 14.027 1.612 1.00 0.00 H new ATOM 0 HB3 ARG A 95 14.264 15.237 0.509 1.00 0.00 H new ATOM 0 HG2 ARG A 95 16.254 15.570 1.854 1.00 0.00 H new ATOM 0 HG3 ARG A 95 15.592 14.642 3.186 1.00 0.00 H new ATOM 0 HD2 ARG A 95 15.729 12.569 1.964 1.00 0.00 H new ATOM 0 HD3 ARG A 95 15.943 13.389 0.430 1.00 0.00 H new ATOM 0 HE ARG A 95 18.123 14.233 1.885 1.00 0.00 H new ATOM 0 HH11 ARG A 95 16.985 10.920 1.320 1.00 0.00 H new ATOM 0 HH12 ARG A 95 18.643 10.311 1.283 1.00 0.00 H new ATOM 0 HH21 ARG A 95 20.093 13.427 1.716 1.00 0.00 H new ATOM 0 HH22 ARG A 95 20.355 11.694 1.501 1.00 0.00 H new ATOM 1455 N VAL A 96 14.116 18.240 1.436 1.00 0.00 N ATOM 1456 CA VAL A 96 14.868 19.513 1.418 1.00 0.00 C ATOM 1457 C VAL A 96 14.051 20.707 1.932 1.00 0.00 C ATOM 1458 O VAL A 96 14.600 21.549 2.646 1.00 0.00 O ATOM 1459 CB VAL A 96 15.429 19.782 0.007 1.00 0.00 C ATOM 1460 CG1 VAL A 96 16.201 21.103 -0.089 1.00 0.00 C ATOM 1461 CG2 VAL A 96 16.411 18.667 -0.382 1.00 0.00 C ATOM 0 H VAL A 96 13.560 18.086 0.595 1.00 0.00 H new ATOM 0 HA VAL A 96 15.699 19.401 2.115 1.00 0.00 H new ATOM 0 HB VAL A 96 14.566 19.825 -0.657 1.00 0.00 H new ATOM 0 HG11 VAL A 96 16.571 21.235 -1.106 1.00 0.00 H new ATOM 0 HG12 VAL A 96 15.539 21.931 0.167 1.00 0.00 H new ATOM 0 HG13 VAL A 96 17.043 21.084 0.603 1.00 0.00 H new ATOM 0 HG21 VAL A 96 16.805 18.861 -1.380 1.00 0.00 H new ATOM 0 HG22 VAL A 96 17.233 18.640 0.334 1.00 0.00 H new ATOM 0 HG23 VAL A 96 15.893 17.708 -0.377 1.00 0.00 H new ATOM 1471 N SER A 97 12.752 20.774 1.615 1.00 0.00 N ATOM 1472 CA SER A 97 11.911 21.965 1.837 1.00 0.00 C ATOM 1473 C SER A 97 10.655 21.725 2.696 1.00 0.00 C ATOM 1474 O SER A 97 9.931 22.683 2.983 1.00 0.00 O ATOM 1475 CB SER A 97 11.515 22.587 0.490 1.00 0.00 C ATOM 1476 OG SER A 97 12.657 22.813 -0.328 1.00 0.00 O ATOM 0 H SER A 97 12.246 19.996 1.192 1.00 0.00 H new ATOM 0 HA SER A 97 12.530 22.652 2.415 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.819 21.927 -0.027 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.994 23.529 0.661 1.00 0.00 H new ATOM 0 HG SER A 97 12.376 23.208 -1.180 1.00 0.00 H new ATOM 1482 N GLY A 98 10.388 20.488 3.143 1.00 0.00 N ATOM 1483 CA GLY A 98 9.185 20.135 3.913 1.00 0.00 C ATOM 1484 C GLY A 98 7.923 19.955 3.058 1.00 0.00 C ATOM 1485 O GLY A 98 7.893 20.279 1.869 1.00 0.00 O ATOM 0 H GLY A 98 11.009 19.696 2.978 1.00 0.00 H new ATOM 0 HA2 GLY A 98 9.375 19.211 4.460 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.000 20.912 4.655 1.00 0.00 H new ATOM 1489 N SER A 99 6.858 19.417 3.658 1.00 0.00 N ATOM 1490 CA SER A 99 5.590 19.112 2.967 1.00 0.00 C ATOM 1491 C SER A 99 4.834 20.361 2.491 1.00 0.00 C ATOM 1492 O SER A 99 4.218 20.340 1.425 1.00 0.00 O ATOM 1493 CB SER A 99 4.693 18.268 3.882 1.00 0.00 C ATOM 1494 OG SER A 99 4.475 18.928 5.120 1.00 0.00 O ATOM 0 H SER A 99 6.846 19.176 4.649 1.00 0.00 H new ATOM 0 HA SER A 99 5.849 18.552 2.068 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.738 18.081 3.391 1.00 0.00 H new ATOM 0 HB3 SER A 99 5.156 17.297 4.059 1.00 0.00 H new ATOM 0 HG SER A 99 3.900 18.375 5.689 1.00 0.00 H new ATOM 1500 N THR A 100 4.946 21.476 3.224 1.00 0.00 N ATOM 1501 CA THR A 100 4.284 22.764 2.927 1.00 0.00 C ATOM 1502 C THR A 100 4.793 23.443 1.652 1.00 0.00 C ATOM 1503 O THR A 100 4.076 24.248 1.056 1.00 0.00 O ATOM 1504 CB THR A 100 4.426 23.734 4.112 1.00 0.00 C ATOM 1505 OG1 THR A 100 5.787 23.853 4.478 1.00 0.00 O ATOM 1506 CG2 THR A 100 3.642 23.251 5.334 1.00 0.00 C ATOM 0 H THR A 100 5.517 21.513 4.068 1.00 0.00 H new ATOM 0 HA THR A 100 3.235 22.520 2.760 1.00 0.00 H new ATOM 0 HB THR A 100 4.027 24.696 3.792 1.00 0.00 H new ATOM 0 HG1 THR A 100 5.870 24.474 5.232 1.00 0.00 H new ATOM 0 HG21 THR A 100 3.767 23.962 6.151 1.00 0.00 H new ATOM 0 HG22 THR A 100 2.585 23.172 5.080 1.00 0.00 H new ATOM 0 HG23 THR A 100 4.015 22.275 5.643 1.00 0.00 H new ATOM 1514 N ALA A 101 5.981 23.065 1.157 1.00 0.00 N ATOM 1515 CA ALA A 101 6.527 23.533 -0.120 1.00 0.00 C ATOM 1516 C ALA A 101 5.783 22.977 -1.359 1.00 0.00 C ATOM 1517 O ALA A 101 6.096 23.366 -2.487 1.00 0.00 O ATOM 1518 CB ALA A 101 8.024 23.197 -0.152 1.00 0.00 C ATOM 0 H ALA A 101 6.598 22.414 1.643 1.00 0.00 H new ATOM 0 HA ALA A 101 6.380 24.611 -0.181 1.00 0.00 H new ATOM 0 HB1 ALA A 101 8.453 23.536 -1.095 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.527 23.696 0.676 1.00 0.00 H new ATOM 0 HB3 ALA A 101 8.157 22.119 -0.060 1.00 0.00 H new ATOM 1524 N GLN A 102 4.825 22.060 -1.173 1.00 0.00 N ATOM 1525 CA GLN A 102 3.998 21.465 -2.236 1.00 0.00 C ATOM 1526 C GLN A 102 2.578 22.073 -2.315 1.00 0.00 C ATOM 1527 O GLN A 102 1.825 21.749 -3.237 1.00 0.00 O ATOM 1528 CB GLN A 102 3.944 19.939 -2.036 1.00 0.00 C ATOM 1529 CG GLN A 102 5.346 19.302 -2.018 1.00 0.00 C ATOM 1530 CD GLN A 102 5.310 17.786 -1.832 1.00 0.00 C ATOM 1531 OE1 GLN A 102 5.708 17.020 -2.700 1.00 0.00 O ATOM 1532 NE2 GLN A 102 4.866 17.305 -0.691 1.00 0.00 N ATOM 0 H GLN A 102 4.595 21.698 -0.248 1.00 0.00 H new ATOM 0 HA GLN A 102 4.466 21.696 -3.193 1.00 0.00 H new ATOM 0 HB2 GLN A 102 3.434 19.715 -1.099 1.00 0.00 H new ATOM 0 HB3 GLN A 102 3.354 19.491 -2.835 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.857 19.536 -2.952 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.931 19.748 -1.214 1.00 0.00 H new ATOM 0 HE21 GLN A 102 4.533 17.940 0.035 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.854 16.297 -0.532 1.00 0.00 H new ATOM 1541 N SER A 103 2.200 22.940 -1.368 1.00 0.00 N ATOM 1542 CA SER A 103 0.878 23.586 -1.301 1.00 0.00 C ATOM 1543 C SER A 103 0.682 24.669 -2.374 1.00 0.00 C ATOM 1544 O SER A 103 1.641 25.334 -2.782 1.00 0.00 O ATOM 1545 CB SER A 103 0.642 24.197 0.088 1.00 0.00 C ATOM 1546 OG SER A 103 0.729 23.198 1.101 1.00 0.00 O ATOM 0 H SER A 103 2.818 23.221 -0.607 1.00 0.00 H new ATOM 0 HA SER A 103 0.148 22.800 -1.492 1.00 0.00 H new ATOM 0 HB2 SER A 103 1.379 24.978 0.277 1.00 0.00 H new ATOM 0 HB3 SER A 103 -0.340 24.670 0.120 1.00 0.00 H new ATOM 0 HG SER A 103 0.577 23.608 1.978 1.00 0.00 H new ATOM 1552 N ALA A 104 -0.571 24.870 -2.807 1.00 0.00 N ATOM 1553 CA ALA A 104 -0.997 25.873 -3.795 1.00 0.00 C ATOM 1554 C ALA A 104 -2.362 26.500 -3.437 1.00 0.00 C ATOM 1555 O ALA A 104 -2.501 27.740 -3.552 1.00 0.00 O ATOM 1556 CB ALA A 104 -1.015 25.215 -5.184 1.00 0.00 C ATOM 1557 OXT ALA A 104 -3.289 25.755 -3.037 1.00 0.00 O ATOM 0 H ALA A 104 -1.352 24.312 -2.462 1.00 0.00 H new ATOM 0 HA ALA A 104 -0.286 26.699 -3.795 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -1.329 25.946 -5.929 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -0.016 24.854 -5.429 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -1.713 24.378 -5.181 1.00 0.00 H new TER 1563 ALA A 104