USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1036 hydrogens (94 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 NoAdj-H: A 78 ASNHD21 : A 78 ASN ND2 : A 136 NAG C1 :(H bumps) USER MOD NoAdj-H: A 111 ASNHD21 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD Set 1.1: A 51 THR OG1 : rot 178:sc= 0.797 USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 30 THR OG1 : rot 180:sc= -1.45 USER MOD Set 2.2: A 53 MET CE :methyl 180:sc= -7.03! (180deg=-7.03!) USER MOD Set 3.1: A 23 TYR OH : rot -138:sc= 0.685 USER MOD Set 3.2: A 75 ASN : amide:sc= -0.011 X(o=0.67,f=0.69) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1AALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc=-0.00593 X(o=-0.0059,f=-0.0059) USER MOD Single : A 5 GLN : amide:sc= -3.76 K(o=-3.8,f=-8.8!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0.215 USER MOD Single : A 18 SER OG : rot 180:sc= -0.0774 USER MOD Single : A 25 SER OG : rot 91:sc= 1.17 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0325 USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot -72:sc= 0.206 USER MOD Single : A 54 MET CE :methyl -117:sc= -4.59! (180deg=-11!) USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0193 USER MOD Single : A 64 SER OG : rot 13:sc= 0.0241 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 110:sc=-0.00188 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc=-0.00408 X(o=-0.0041,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc=-0.00291 X(o=-0.0029,f=-0.42) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 94:sc= -2.72! USER MOD Single : A 92 TYR OH : rot -20:sc= 0.0331 USER MOD Single : A 95 LYS NZ :NH3+ -155:sc= -0.0368 (180deg=-0.312) USER MOD Single : A 99 MET CE :methyl -143:sc= -4.66! (180deg=-8.76!) USER MOD Single : A 104 TYR OH : rot 126:sc= -0.178 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 THR OG1 : rot -30:sc= 0.382 USER MOD Single : A 114 GLN : amide:sc= -4.87 K(o=-4.9,f=-7.4!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -43:sc= 0.463 USER MOD Single : A 128 GLN : amide:sc=-0.00581 K(o=-0.0058,f=-1.4!) USER MOD Single : A 131 LYS NZ :NH3+ 161:sc= -0.632 (180deg=-1.6) USER MOD Single : A 132 NAG O3 : rot 127:sc= 1.16 USER MOD Single : A 133 NAG O3 : rot -79:sc= 0.00223 USER MOD Single : A 133 NAG O6 : rot 180:sc= 0 USER MOD Single : A 134 FUL O2 : rot -28:sc= 0.00183 USER MOD Single : A 134 FUL O3 : rot -91:sc= 0.0694 USER MOD Single : A 134 FUL O4 : rot 150:sc= -0.228 USER MOD Single : A 135 BMA O2 : rot 145:sc= 0.0585 USER MOD Single : A 135 BMA O3 : rot 180:sc= 0.0607 USER MOD Single : A 135 BMA O4 : rot -140:sc= 0.454 USER MOD Single : A 135 BMA O6 : rot 180:sc= 0.452 USER MOD Single : A 136 NAG O3 : rot 180:sc= -0.123 USER MOD Single : A 137 NAG O3 : rot 12:sc= 0.335 USER MOD Single : A 137 NAG O6 : rot 180:sc= -0.0256 USER MOD Single : A 138 FUC O2 : rot 90:sc= -1.3 USER MOD Single : A 138 FUC O3 : rot -96:sc= 0.133 USER MOD Single : A 138 FUC O4 : rot 150:sc= 0.141 USER MOD Single : A 139 BMA O2 : rot 148:sc= 0.058 USER MOD Single : A 139 BMA O3 : rot 180:sc= 0.072 USER MOD Single : A 139 BMA O4 : rot 150:sc= 0 USER MOD Single : A 139 BMA O6 : rot 27:sc= 0.088 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1A -9.307 3.785 9.241 1.00 0.00 N ATOM 2 CA ALA A 1A -10.133 3.585 8.014 1.00 0.00 C ATOM 3 C ALA A 1A -9.242 3.596 6.769 1.00 0.00 C ATOM 4 O ALA A 1A -9.263 2.677 5.975 1.00 0.00 O ATOM 5 CB ALA A 1A -11.100 4.769 7.992 1.00 0.00 C ATOM 0 H1 ALA A 1A -9.923 3.776 10.079 1.00 0.00 H new ATOM 0 H2 ALA A 1A -8.607 3.020 9.317 1.00 0.00 H new ATOM 0 H3 ALA A 1A -8.815 4.699 9.183 1.00 0.00 H new ATOM 0 HA ALA A 1A -10.658 2.630 8.020 1.00 0.00 H new ATOM 0 HB1 ALA A 1A -11.745 4.696 7.116 1.00 0.00 H new ATOM 0 HB2 ALA A 1A -11.711 4.757 8.895 1.00 0.00 H new ATOM 0 HB3 ALA A 1A -10.535 5.700 7.949 1.00 0.00 H new ATOM 13 N MET A 1 -8.457 4.635 6.601 1.00 0.00 N ATOM 14 CA MET A 1 -7.547 4.740 5.412 1.00 0.00 C ATOM 15 C MET A 1 -8.341 4.623 4.104 1.00 0.00 C ATOM 16 O MET A 1 -9.494 4.238 4.095 1.00 0.00 O ATOM 17 CB MET A 1 -6.547 3.584 5.545 1.00 0.00 C ATOM 18 CG MET A 1 -5.699 3.784 6.802 1.00 0.00 C ATOM 19 SD MET A 1 -4.710 5.290 6.631 1.00 0.00 S ATOM 20 CE MET A 1 -3.618 5.006 8.047 1.00 0.00 C ATOM 0 H MET A 1 -8.407 5.425 7.245 1.00 0.00 H new ATOM 0 HA MET A 1 -7.041 5.705 5.384 1.00 0.00 H new ATOM 0 HB2 MET A 1 -7.079 2.634 5.600 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.906 3.541 4.664 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.342 3.856 7.679 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.047 2.924 6.954 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.911 5.831 8.132 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.213 4.942 8.958 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.072 4.073 7.904 1.00 0.00 H new ATOM 30 N HIS A 2 -7.724 4.963 3.000 1.00 0.00 N ATOM 31 CA HIS A 2 -8.428 4.882 1.684 1.00 0.00 C ATOM 32 C HIS A 2 -7.636 4.002 0.717 1.00 0.00 C ATOM 33 O HIS A 2 -7.563 4.271 -0.467 1.00 0.00 O ATOM 34 CB HIS A 2 -8.499 6.323 1.174 1.00 0.00 C ATOM 35 CG HIS A 2 -9.302 7.159 2.133 1.00 0.00 C ATOM 36 ND1 HIS A 2 -10.666 6.983 2.303 1.00 0.00 N ATOM 37 CD2 HIS A 2 -8.947 8.180 2.979 1.00 0.00 C ATOM 38 CE1 HIS A 2 -11.079 7.877 3.221 1.00 0.00 C ATOM 39 NE2 HIS A 2 -10.070 8.632 3.665 1.00 0.00 N ATOM 0 H HIS A 2 -6.760 5.294 2.954 1.00 0.00 H new ATOM 0 HA HIS A 2 -9.420 4.440 1.774 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -7.494 6.733 1.072 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -8.955 6.347 0.184 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -7.948 8.573 3.095 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -12.101 7.972 3.557 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -10.114 9.379 4.358 1.00 0.00 H new ATOM 47 N VAL A 3 -7.041 2.956 1.222 1.00 0.00 N ATOM 48 CA VAL A 3 -6.241 2.044 0.349 1.00 0.00 C ATOM 49 C VAL A 3 -7.045 0.777 0.033 1.00 0.00 C ATOM 50 O VAL A 3 -7.656 0.186 0.904 1.00 0.00 O ATOM 51 CB VAL A 3 -4.991 1.708 1.171 1.00 0.00 C ATOM 52 CG1 VAL A 3 -4.096 0.742 0.390 1.00 0.00 C ATOM 53 CG2 VAL A 3 -4.212 2.993 1.463 1.00 0.00 C ATOM 0 H VAL A 3 -7.074 2.691 2.206 1.00 0.00 H new ATOM 0 HA VAL A 3 -5.985 2.499 -0.608 1.00 0.00 H new ATOM 0 HB VAL A 3 -5.295 1.240 2.107 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.210 0.508 0.981 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -4.646 -0.176 0.182 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.794 1.205 -0.549 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.323 2.755 2.047 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -3.915 3.460 0.524 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.843 3.681 2.026 1.00 0.00 H new ATOM 63 N ALA A 4 -7.047 0.359 -1.209 1.00 0.00 N ATOM 64 CA ALA A 4 -7.808 -0.869 -1.593 1.00 0.00 C ATOM 65 C ALA A 4 -6.842 -2.017 -1.895 1.00 0.00 C ATOM 66 O ALA A 4 -5.886 -1.856 -2.630 1.00 0.00 O ATOM 67 CB ALA A 4 -8.579 -0.480 -2.852 1.00 0.00 C ATOM 0 H ALA A 4 -6.553 0.817 -1.975 1.00 0.00 H new ATOM 0 HA ALA A 4 -8.470 -1.209 -0.796 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -9.165 -1.332 -3.198 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -9.246 0.352 -2.628 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.877 -0.182 -3.631 1.00 0.00 H new ATOM 73 N GLN A 5 -7.086 -3.173 -1.331 1.00 0.00 N ATOM 74 CA GLN A 5 -6.181 -4.339 -1.581 1.00 0.00 C ATOM 75 C GLN A 5 -6.903 -5.675 -1.314 1.00 0.00 C ATOM 76 O GLN A 5 -7.849 -5.718 -0.553 1.00 0.00 O ATOM 77 CB GLN A 5 -5.010 -4.146 -0.614 1.00 0.00 C ATOM 78 CG GLN A 5 -5.535 -4.138 0.817 1.00 0.00 C ATOM 79 CD GLN A 5 -4.877 -3.009 1.616 1.00 0.00 C ATOM 80 OE1 GLN A 5 -3.864 -2.471 1.213 1.00 0.00 O ATOM 81 NE2 GLN A 5 -5.418 -2.622 2.739 1.00 0.00 N ATOM 0 H GLN A 5 -7.872 -3.361 -0.708 1.00 0.00 H new ATOM 0 HA GLN A 5 -5.852 -4.380 -2.619 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -4.282 -4.947 -0.742 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -4.495 -3.210 -0.830 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -6.617 -4.008 0.814 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -5.330 -5.097 1.293 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -6.268 -3.073 3.078 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -4.991 -1.869 3.278 1.00 0.00 H new ATOM 90 N PRO A 6 -6.421 -6.732 -1.938 1.00 0.00 N ATOM 91 CA PRO A 6 -7.029 -8.074 -1.739 1.00 0.00 C ATOM 92 C PRO A 6 -6.673 -8.618 -0.357 1.00 0.00 C ATOM 93 O PRO A 6 -5.621 -8.331 0.180 1.00 0.00 O ATOM 94 CB PRO A 6 -6.394 -8.927 -2.834 1.00 0.00 C ATOM 95 CG PRO A 6 -5.098 -8.253 -3.150 1.00 0.00 C ATOM 96 CD PRO A 6 -5.284 -6.784 -2.876 1.00 0.00 C ATOM 0 HA PRO A 6 -8.118 -8.061 -1.794 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.234 -9.950 -2.494 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -7.035 -8.981 -3.714 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -4.293 -8.660 -2.538 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -4.822 -8.419 -4.191 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -4.387 -6.344 -2.440 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -5.497 -6.232 -3.791 1.00 0.00 H new ATOM 104 N ALA A 7 -7.539 -9.411 0.215 1.00 0.00 N ATOM 105 CA ALA A 7 -7.251 -9.992 1.557 1.00 0.00 C ATOM 106 C ALA A 7 -6.488 -11.299 1.398 1.00 0.00 C ATOM 107 O ALA A 7 -5.777 -11.714 2.296 1.00 0.00 O ATOM 108 CB ALA A 7 -8.618 -10.234 2.197 1.00 0.00 C ATOM 0 H ALA A 7 -8.435 -9.682 -0.191 1.00 0.00 H new ATOM 0 HA ALA A 7 -6.637 -9.334 2.172 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.484 -10.662 3.190 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.154 -9.288 2.279 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.192 -10.924 1.579 1.00 0.00 H new ATOM 114 N VAL A 8 -6.609 -11.948 0.263 1.00 0.00 N ATOM 115 CA VAL A 8 -5.869 -13.208 0.073 1.00 0.00 C ATOM 116 C VAL A 8 -5.650 -13.452 -1.416 1.00 0.00 C ATOM 117 O VAL A 8 -6.395 -12.969 -2.250 1.00 0.00 O ATOM 118 CB VAL A 8 -6.759 -14.287 0.717 1.00 0.00 C ATOM 119 CG1 VAL A 8 -7.922 -14.768 -0.186 1.00 0.00 C ATOM 120 CG2 VAL A 8 -5.906 -15.471 1.120 1.00 0.00 C ATOM 0 H VAL A 8 -7.186 -11.653 -0.525 1.00 0.00 H new ATOM 0 HA VAL A 8 -4.878 -13.202 0.527 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.222 -13.823 1.588 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -8.501 -15.527 0.340 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.567 -13.924 -0.429 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -7.518 -15.192 -1.105 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -6.536 -16.235 1.576 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -5.416 -15.884 0.238 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -5.151 -15.148 1.837 1.00 0.00 H new ATOM 130 N VAL A 9 -4.660 -14.214 -1.741 1.00 0.00 N ATOM 131 CA VAL A 9 -4.396 -14.525 -3.168 1.00 0.00 C ATOM 132 C VAL A 9 -4.066 -16.013 -3.324 1.00 0.00 C ATOM 133 O VAL A 9 -3.639 -16.667 -2.392 1.00 0.00 O ATOM 134 CB VAL A 9 -3.226 -13.616 -3.564 1.00 0.00 C ATOM 135 CG1 VAL A 9 -2.507 -14.134 -4.818 1.00 0.00 C ATOM 136 CG2 VAL A 9 -3.762 -12.216 -3.859 1.00 0.00 C ATOM 0 H VAL A 9 -4.013 -14.641 -1.078 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.255 -14.344 -3.814 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.516 -13.601 -2.737 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -1.684 -13.464 -5.068 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.116 -15.133 -4.627 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.210 -14.172 -5.651 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.937 -11.562 -4.142 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.481 -12.267 -4.677 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.251 -11.819 -2.970 1.00 0.00 H new ATOM 146 N LEU A 10 -4.265 -16.541 -4.502 1.00 0.00 N ATOM 147 CA LEU A 10 -3.967 -17.984 -4.739 1.00 0.00 C ATOM 148 C LEU A 10 -2.812 -18.114 -5.740 1.00 0.00 C ATOM 149 O LEU A 10 -2.846 -17.540 -6.812 1.00 0.00 O ATOM 150 CB LEU A 10 -5.258 -18.568 -5.326 1.00 0.00 C ATOM 151 CG LEU A 10 -6.429 -18.349 -4.355 1.00 0.00 C ATOM 152 CD1 LEU A 10 -7.719 -18.879 -4.987 1.00 0.00 C ATOM 153 CD2 LEU A 10 -6.164 -19.079 -3.029 1.00 0.00 C ATOM 0 H LEU A 10 -4.622 -16.034 -5.312 1.00 0.00 H new ATOM 0 HA LEU A 10 -3.668 -18.504 -3.829 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.477 -18.096 -6.284 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.130 -19.633 -5.518 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.531 -17.283 -4.154 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.551 -18.725 -4.300 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.914 -18.346 -5.918 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.612 -19.944 -5.194 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -7.001 -18.916 -2.350 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.053 -20.147 -3.217 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.250 -18.693 -2.577 1.00 0.00 H new ATOM 165 N ALA A 11 -1.794 -18.863 -5.398 1.00 0.00 N ATOM 166 CA ALA A 11 -0.635 -19.035 -6.328 1.00 0.00 C ATOM 167 C ALA A 11 -0.940 -20.143 -7.341 1.00 0.00 C ATOM 168 O ALA A 11 -1.868 -20.907 -7.166 1.00 0.00 O ATOM 169 CB ALA A 11 0.541 -19.421 -5.429 1.00 0.00 C ATOM 0 H ALA A 11 -1.715 -19.364 -4.513 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.420 -18.134 -6.902 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.433 -19.566 -6.039 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.721 -18.627 -4.705 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.308 -20.346 -4.902 1.00 0.00 H new ATOM 175 N SER A 12 -0.177 -20.231 -8.405 1.00 0.00 N ATOM 176 CA SER A 12 -0.442 -21.290 -9.428 1.00 0.00 C ATOM 177 C SER A 12 0.845 -21.680 -10.165 1.00 0.00 C ATOM 178 O SER A 12 1.809 -20.941 -10.189 1.00 0.00 O ATOM 179 CB SER A 12 -1.438 -20.657 -10.398 1.00 0.00 C ATOM 180 OG SER A 12 -1.830 -21.621 -11.366 1.00 0.00 O ATOM 0 H SER A 12 0.613 -19.619 -8.608 1.00 0.00 H new ATOM 0 HA SER A 12 -0.826 -22.203 -8.974 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.311 -20.294 -9.855 1.00 0.00 H new ATOM 0 HB3 SER A 12 -0.987 -19.795 -10.889 1.00 0.00 H new ATOM 0 HG SER A 12 -2.470 -21.218 -11.989 1.00 0.00 H new ATOM 186 N SER A 13 0.854 -22.841 -10.781 1.00 0.00 N ATOM 187 CA SER A 13 2.060 -23.305 -11.542 1.00 0.00 C ATOM 188 C SER A 13 3.314 -23.302 -10.636 1.00 0.00 C ATOM 189 O SER A 13 3.272 -23.797 -9.526 1.00 0.00 O ATOM 190 CB SER A 13 2.182 -22.323 -12.717 1.00 0.00 C ATOM 191 OG SER A 13 3.255 -22.727 -13.558 1.00 0.00 O ATOM 0 H SER A 13 0.069 -23.493 -10.789 1.00 0.00 H new ATOM 0 HA SER A 13 1.967 -24.332 -11.896 1.00 0.00 H new ATOM 0 HB2 SER A 13 1.251 -22.298 -13.283 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.356 -21.313 -12.345 1.00 0.00 H new ATOM 0 HG SER A 13 3.334 -22.103 -14.310 1.00 0.00 H new ATOM 197 N ARG A 14 4.429 -22.762 -11.093 1.00 0.00 N ATOM 198 CA ARG A 14 5.672 -22.746 -10.253 1.00 0.00 C ATOM 199 C ARG A 14 5.402 -22.159 -8.863 1.00 0.00 C ATOM 200 O ARG A 14 6.121 -22.431 -7.919 1.00 0.00 O ATOM 201 CB ARG A 14 6.669 -21.883 -11.028 1.00 0.00 C ATOM 202 CG ARG A 14 8.015 -21.854 -10.288 1.00 0.00 C ATOM 203 CD ARG A 14 9.133 -22.270 -11.245 1.00 0.00 C ATOM 204 NE ARG A 14 10.360 -22.388 -10.395 1.00 0.00 N ATOM 205 CZ ARG A 14 11.450 -22.983 -10.841 1.00 0.00 C ATOM 206 NH1 ARG A 14 11.511 -23.492 -12.050 1.00 0.00 N ATOM 207 NH2 ARG A 14 12.494 -23.066 -10.062 1.00 0.00 N ATOM 0 H ARG A 14 4.527 -22.332 -12.013 1.00 0.00 H new ATOM 0 HA ARG A 14 6.051 -23.753 -10.081 1.00 0.00 H new ATOM 0 HB2 ARG A 14 6.805 -22.281 -12.033 1.00 0.00 H new ATOM 0 HB3 ARG A 14 6.281 -20.870 -11.136 1.00 0.00 H new ATOM 0 HG2 ARG A 14 8.207 -20.854 -9.900 1.00 0.00 H new ATOM 0 HG3 ARG A 14 7.986 -22.528 -9.432 1.00 0.00 H new ATOM 0 HD2 ARG A 14 8.901 -23.217 -11.733 1.00 0.00 H new ATOM 0 HD3 ARG A 14 9.271 -21.530 -12.034 1.00 0.00 H new ATOM 0 HE ARG A 14 10.353 -22.000 -9.452 1.00 0.00 H new ATOM 0 HH11 ARG A 14 10.703 -23.433 -12.670 1.00 0.00 H new ATOM 0 HH12 ARG A 14 12.366 -23.947 -12.369 1.00 0.00 H new ATOM 0 HH21 ARG A 14 12.461 -22.674 -9.121 1.00 0.00 H new ATOM 0 HH22 ARG A 14 13.343 -23.523 -10.394 1.00 0.00 H new ATOM 221 N GLY A 15 4.383 -21.353 -8.734 1.00 0.00 N ATOM 222 CA GLY A 15 4.070 -20.738 -7.412 1.00 0.00 C ATOM 223 C GLY A 15 4.151 -19.226 -7.560 1.00 0.00 C ATOM 224 O GLY A 15 4.746 -18.538 -6.752 1.00 0.00 O ATOM 0 H GLY A 15 3.751 -21.093 -9.491 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.075 -21.035 -7.081 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.774 -21.084 -6.655 1.00 0.00 H new ATOM 228 N ILE A 16 3.557 -18.713 -8.602 1.00 0.00 N ATOM 229 CA ILE A 16 3.581 -17.257 -8.847 1.00 0.00 C ATOM 230 C ILE A 16 2.232 -16.646 -8.478 1.00 0.00 C ATOM 231 O ILE A 16 1.221 -16.891 -9.108 1.00 0.00 O ATOM 232 CB ILE A 16 3.919 -17.108 -10.348 1.00 0.00 C ATOM 233 CG1 ILE A 16 5.430 -17.275 -10.547 1.00 0.00 C ATOM 234 CG2 ILE A 16 3.518 -15.719 -10.873 1.00 0.00 C ATOM 235 CD1 ILE A 16 5.901 -18.677 -10.150 1.00 0.00 C ATOM 0 H ILE A 16 3.050 -19.256 -9.301 1.00 0.00 H new ATOM 0 HA ILE A 16 4.316 -16.729 -8.239 1.00 0.00 H new ATOM 0 HB ILE A 16 3.365 -17.871 -10.895 1.00 0.00 H new ATOM 0 HG12 ILE A 16 5.683 -17.088 -11.591 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.960 -16.531 -9.952 1.00 0.00 H new ATOM 0 HG21 ILE A 16 3.768 -15.644 -11.931 1.00 0.00 H new ATOM 0 HG22 ILE A 16 2.445 -15.576 -10.743 1.00 0.00 H new ATOM 0 HG23 ILE A 16 4.056 -14.951 -10.318 1.00 0.00 H new ATOM 0 HD11 ILE A 16 6.977 -18.757 -10.305 1.00 0.00 H new ATOM 0 HD12 ILE A 16 5.672 -18.854 -9.099 1.00 0.00 H new ATOM 0 HD13 ILE A 16 5.390 -19.420 -10.763 1.00 0.00 H new ATOM 247 N ALA A 17 2.238 -15.837 -7.464 1.00 0.00 N ATOM 248 CA ALA A 17 0.984 -15.163 -7.021 1.00 0.00 C ATOM 249 C ALA A 17 1.106 -13.664 -7.274 1.00 0.00 C ATOM 250 O ALA A 17 2.059 -13.034 -6.851 1.00 0.00 O ATOM 251 CB ALA A 17 0.872 -15.445 -5.524 1.00 0.00 C ATOM 0 H ALA A 17 3.066 -15.608 -6.913 1.00 0.00 H new ATOM 0 HA ALA A 17 0.105 -15.522 -7.557 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.031 -14.977 -5.132 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.823 -16.521 -5.359 1.00 0.00 H new ATOM 0 HB3 ALA A 17 1.744 -15.038 -5.011 1.00 0.00 H new ATOM 257 N SER A 18 0.161 -13.091 -7.968 1.00 0.00 N ATOM 258 CA SER A 18 0.233 -11.631 -8.259 1.00 0.00 C ATOM 259 C SER A 18 -1.018 -10.913 -7.757 1.00 0.00 C ATOM 260 O SER A 18 -2.126 -11.398 -7.886 1.00 0.00 O ATOM 261 CB SER A 18 0.329 -11.538 -9.780 1.00 0.00 C ATOM 262 OG SER A 18 -0.915 -11.920 -10.353 1.00 0.00 O ATOM 0 H SER A 18 -0.657 -13.570 -8.346 1.00 0.00 H new ATOM 0 HA SER A 18 1.080 -11.159 -7.762 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.583 -10.521 -10.078 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.125 -12.186 -10.146 1.00 0.00 H new ATOM 0 HG SER A 18 -0.858 -11.860 -11.329 1.00 0.00 H new ATOM 268 N PHE A 19 -0.837 -9.747 -7.202 1.00 0.00 N ATOM 269 CA PHE A 19 -1.991 -8.953 -6.696 1.00 0.00 C ATOM 270 C PHE A 19 -1.664 -7.467 -6.800 1.00 0.00 C ATOM 271 O PHE A 19 -0.516 -7.088 -6.938 1.00 0.00 O ATOM 272 CB PHE A 19 -2.191 -9.379 -5.240 1.00 0.00 C ATOM 273 CG PHE A 19 -0.932 -9.135 -4.438 1.00 0.00 C ATOM 274 CD1 PHE A 19 0.128 -10.080 -4.481 1.00 0.00 C ATOM 275 CD2 PHE A 19 -0.814 -7.970 -3.633 1.00 0.00 C ATOM 276 CE1 PHE A 19 1.308 -9.859 -3.720 1.00 0.00 C ATOM 277 CE2 PHE A 19 0.367 -7.748 -2.873 1.00 0.00 C ATOM 278 CZ PHE A 19 1.428 -8.694 -2.917 1.00 0.00 C ATOM 0 H PHE A 19 0.074 -9.305 -7.076 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.900 -9.125 -7.272 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.021 -8.823 -4.803 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.457 -10.435 -5.197 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.037 -10.966 -5.092 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.621 -7.253 -3.598 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.114 -10.577 -3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.458 -6.862 -2.263 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.325 -8.526 -2.340 1.00 0.00 H new ATOM 288 N VAL A 20 -2.660 -6.628 -6.743 1.00 0.00 N ATOM 289 CA VAL A 20 -2.400 -5.163 -6.851 1.00 0.00 C ATOM 290 C VAL A 20 -2.995 -4.418 -5.654 1.00 0.00 C ATOM 291 O VAL A 20 -4.187 -4.459 -5.413 1.00 0.00 O ATOM 292 CB VAL A 20 -3.071 -4.731 -8.156 1.00 0.00 C ATOM 293 CG1 VAL A 20 -2.882 -3.225 -8.369 1.00 0.00 C ATOM 294 CG2 VAL A 20 -2.441 -5.486 -9.330 1.00 0.00 C ATOM 0 H VAL A 20 -3.639 -6.890 -6.627 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.334 -4.937 -6.853 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.136 -4.958 -8.099 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.363 -2.926 -9.300 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.331 -2.681 -7.538 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -1.818 -2.996 -8.420 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -2.920 -5.178 -10.260 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.376 -5.260 -9.378 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.579 -6.558 -9.189 1.00 0.00 H new ATOM 304 N CYS A 21 -2.168 -3.724 -4.915 1.00 0.00 N ATOM 305 CA CYS A 21 -2.668 -2.955 -3.741 1.00 0.00 C ATOM 306 C CYS A 21 -2.812 -1.481 -4.126 1.00 0.00 C ATOM 307 O CYS A 21 -1.842 -0.756 -4.226 1.00 0.00 O ATOM 308 CB CYS A 21 -1.593 -3.132 -2.671 1.00 0.00 C ATOM 309 SG CYS A 21 -2.125 -2.339 -1.133 1.00 0.00 S ATOM 0 H CYS A 21 -1.163 -3.658 -5.077 1.00 0.00 H new ATOM 0 HA CYS A 21 -3.642 -3.296 -3.392 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -1.408 -4.192 -2.499 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.654 -2.696 -3.010 1.00 0.00 H new ATOM 314 N GLU A 22 -4.016 -1.038 -4.350 1.00 0.00 N ATOM 315 CA GLU A 22 -4.232 0.384 -4.746 1.00 0.00 C ATOM 316 C GLU A 22 -4.188 1.304 -3.528 1.00 0.00 C ATOM 317 O GLU A 22 -4.652 0.961 -2.457 1.00 0.00 O ATOM 318 CB GLU A 22 -5.607 0.385 -5.413 1.00 0.00 C ATOM 319 CG GLU A 22 -5.981 1.801 -5.858 1.00 0.00 C ATOM 320 CD GLU A 22 -7.314 1.769 -6.611 1.00 0.00 C ATOM 321 OE1 GLU A 22 -7.578 0.777 -7.270 1.00 0.00 O ATOM 322 OE2 GLU A 22 -8.046 2.740 -6.517 1.00 0.00 O ATOM 0 H GLU A 22 -4.864 -1.600 -4.276 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.457 0.758 -5.415 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.602 -0.284 -6.273 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.356 0.005 -4.718 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.058 2.457 -4.991 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -5.200 2.210 -6.499 1.00 0.00 H new ATOM 329 N TYR A 23 -3.622 2.473 -3.694 1.00 0.00 N ATOM 330 CA TYR A 23 -3.524 3.431 -2.573 1.00 0.00 C ATOM 331 C TYR A 23 -4.222 4.738 -2.969 1.00 0.00 C ATOM 332 O TYR A 23 -4.692 4.889 -4.081 1.00 0.00 O ATOM 333 CB TYR A 23 -2.009 3.626 -2.347 1.00 0.00 C ATOM 334 CG TYR A 23 -1.379 4.385 -3.498 1.00 0.00 C ATOM 335 CD1 TYR A 23 -1.394 5.806 -3.498 1.00 0.00 C ATOM 336 CD2 TYR A 23 -0.771 3.681 -4.573 1.00 0.00 C ATOM 337 CE1 TYR A 23 -0.802 6.523 -4.571 1.00 0.00 C ATOM 338 CE2 TYR A 23 -0.178 4.399 -5.647 1.00 0.00 C ATOM 339 CZ TYR A 23 -0.193 5.821 -5.646 1.00 0.00 C ATOM 340 OH TYR A 23 0.383 6.518 -6.687 1.00 0.00 O ATOM 0 H TYR A 23 -3.221 2.800 -4.573 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.007 3.084 -1.659 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -1.844 4.168 -1.416 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.526 2.655 -2.240 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -1.856 6.341 -2.681 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -0.760 2.601 -4.574 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -0.815 7.603 -4.570 1.00 0.00 H new ATOM 0 HE2 TYR A 23 0.284 3.864 -6.464 1.00 0.00 H new ATOM 0 HH TYR A 23 0.158 6.083 -7.536 1.00 0.00 H new ATOM 350 N ALA A 24 -4.293 5.669 -2.067 1.00 0.00 N ATOM 351 CA ALA A 24 -4.963 6.969 -2.372 1.00 0.00 C ATOM 352 C ALA A 24 -4.127 8.140 -1.852 1.00 0.00 C ATOM 353 O ALA A 24 -3.607 8.102 -0.753 1.00 0.00 O ATOM 354 CB ALA A 24 -6.303 6.902 -1.640 1.00 0.00 C ATOM 0 H ALA A 24 -3.915 5.590 -1.123 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.087 7.125 -3.444 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -6.859 7.823 -1.814 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.879 6.055 -2.012 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -6.128 6.780 -0.571 1.00 0.00 H new ATOM 360 N SER A 25 -3.999 9.180 -2.637 1.00 0.00 N ATOM 361 CA SER A 25 -3.200 10.362 -2.197 1.00 0.00 C ATOM 362 C SER A 25 -3.855 11.665 -2.686 1.00 0.00 C ATOM 363 O SER A 25 -4.531 11.667 -3.695 1.00 0.00 O ATOM 364 CB SER A 25 -1.837 10.176 -2.857 1.00 0.00 C ATOM 365 OG SER A 25 -1.980 10.288 -4.267 1.00 0.00 O ATOM 0 H SER A 25 -4.414 9.261 -3.565 1.00 0.00 H new ATOM 0 HA SER A 25 -3.130 10.431 -1.111 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.137 10.926 -2.490 1.00 0.00 H new ATOM 0 HB3 SER A 25 -1.424 9.201 -2.598 1.00 0.00 H new ATOM 0 HG SER A 25 -1.848 11.221 -4.536 1.00 0.00 H new ATOM 371 N PRO A 26 -3.625 12.742 -1.964 1.00 0.00 N ATOM 372 CA PRO A 26 -4.201 14.053 -2.363 1.00 0.00 C ATOM 373 C PRO A 26 -3.538 14.576 -3.648 1.00 0.00 C ATOM 374 O PRO A 26 -4.027 15.500 -4.270 1.00 0.00 O ATOM 375 CB PRO A 26 -3.886 14.962 -1.176 1.00 0.00 C ATOM 376 CG PRO A 26 -2.698 14.338 -0.521 1.00 0.00 C ATOM 377 CD PRO A 26 -2.823 12.853 -0.733 1.00 0.00 C ATOM 0 HA PRO A 26 -5.268 13.998 -2.581 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -3.668 15.979 -1.503 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.730 15.022 -0.489 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -1.773 14.715 -0.956 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -2.671 14.577 0.542 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.847 12.381 -0.847 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -3.315 12.368 0.110 1.00 0.00 H new ATOM 385 N GLY A 27 -2.432 13.993 -4.049 1.00 0.00 N ATOM 386 CA GLY A 27 -1.738 14.454 -5.287 1.00 0.00 C ATOM 387 C GLY A 27 -0.851 13.325 -5.813 1.00 0.00 C ATOM 388 O GLY A 27 -0.795 12.254 -5.236 1.00 0.00 O ATOM 0 H GLY A 27 -1.981 13.215 -3.568 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.469 14.741 -6.043 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.136 15.337 -5.074 1.00 0.00 H new ATOM 392 N LYS A 28 -0.158 13.552 -6.900 1.00 0.00 N ATOM 393 CA LYS A 28 0.722 12.485 -7.465 1.00 0.00 C ATOM 394 C LYS A 28 2.186 12.937 -7.464 1.00 0.00 C ATOM 395 O LYS A 28 2.496 14.076 -7.760 1.00 0.00 O ATOM 396 CB LYS A 28 0.225 12.273 -8.894 1.00 0.00 C ATOM 397 CG LYS A 28 -1.209 11.742 -8.860 1.00 0.00 C ATOM 398 CD LYS A 28 -1.674 11.432 -10.284 1.00 0.00 C ATOM 399 CE LYS A 28 -0.955 10.181 -10.794 1.00 0.00 C ATOM 400 NZ LYS A 28 -1.549 9.916 -12.134 1.00 0.00 N ATOM 0 H LYS A 28 -0.164 14.429 -7.420 1.00 0.00 H new ATOM 0 HA LYS A 28 0.679 11.567 -6.878 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.264 13.211 -9.447 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.873 11.569 -9.415 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.260 10.843 -8.246 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -1.870 12.479 -8.403 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.753 11.277 -10.300 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -1.464 12.278 -10.939 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.120 10.345 -10.864 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.106 9.337 -10.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -1.106 9.071 -12.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -2.572 9.758 -12.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -1.384 10.734 -12.755 1.00 0.00 H new ATOM 414 N ALA A 29 3.083 12.042 -7.141 1.00 0.00 N ATOM 415 CA ALA A 29 4.535 12.391 -7.120 1.00 0.00 C ATOM 416 C ALA A 29 5.335 11.289 -7.818 1.00 0.00 C ATOM 417 O ALA A 29 4.799 10.250 -8.158 1.00 0.00 O ATOM 418 CB ALA A 29 4.905 12.471 -5.639 1.00 0.00 C ATOM 0 H ALA A 29 2.870 11.077 -6.889 1.00 0.00 H new ATOM 0 HA ALA A 29 4.750 13.326 -7.637 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.961 12.724 -5.541 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.301 13.238 -5.154 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.717 11.508 -5.165 1.00 0.00 H new ATOM 424 N THR A 30 6.612 11.500 -8.031 1.00 0.00 N ATOM 425 CA THR A 30 7.434 10.453 -8.712 1.00 0.00 C ATOM 426 C THR A 30 7.832 9.366 -7.738 1.00 0.00 C ATOM 427 O THR A 30 7.781 8.190 -8.042 1.00 0.00 O ATOM 428 CB THR A 30 8.730 11.138 -9.143 1.00 0.00 C ATOM 429 OG1 THR A 30 9.346 11.731 -8.010 1.00 0.00 O ATOM 430 CG2 THR A 30 8.471 12.200 -10.186 1.00 0.00 C ATOM 0 H THR A 30 7.116 12.346 -7.765 1.00 0.00 H new ATOM 0 HA THR A 30 6.868 10.019 -9.536 1.00 0.00 H new ATOM 0 HB THR A 30 9.386 10.385 -9.580 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.179 12.170 -8.283 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.413 12.668 -10.471 1.00 0.00 H new ATOM 0 HG22 THR A 30 8.012 11.744 -11.063 1.00 0.00 H new ATOM 0 HG23 THR A 30 7.800 12.955 -9.777 1.00 0.00 H new ATOM 438 N GLU A 31 8.294 9.766 -6.596 1.00 0.00 N ATOM 439 CA GLU A 31 8.793 8.779 -5.610 1.00 0.00 C ATOM 440 C GLU A 31 7.653 8.125 -4.837 1.00 0.00 C ATOM 441 O GLU A 31 7.036 8.738 -3.985 1.00 0.00 O ATOM 442 CB GLU A 31 9.668 9.580 -4.630 1.00 0.00 C ATOM 443 CG GLU A 31 10.701 10.452 -5.377 1.00 0.00 C ATOM 444 CD GLU A 31 12.084 9.792 -5.314 1.00 0.00 C ATOM 445 OE1 GLU A 31 12.141 8.581 -5.171 1.00 0.00 O ATOM 446 OE2 GLU A 31 13.065 10.512 -5.413 1.00 0.00 O ATOM 0 H GLU A 31 8.348 10.741 -6.300 1.00 0.00 H new ATOM 0 HA GLU A 31 9.337 7.980 -6.114 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.035 10.215 -4.010 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.186 8.895 -3.959 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.397 10.582 -6.416 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.742 11.446 -4.931 1.00 0.00 H new ATOM 453 N VAL A 32 7.412 6.869 -5.089 1.00 0.00 N ATOM 454 CA VAL A 32 6.359 6.144 -4.328 1.00 0.00 C ATOM 455 C VAL A 32 7.041 4.984 -3.610 1.00 0.00 C ATOM 456 O VAL A 32 7.066 3.865 -4.086 1.00 0.00 O ATOM 457 CB VAL A 32 5.347 5.648 -5.363 1.00 0.00 C ATOM 458 CG1 VAL A 32 4.273 4.802 -4.665 1.00 0.00 C ATOM 459 CG2 VAL A 32 4.689 6.852 -6.040 1.00 0.00 C ATOM 0 H VAL A 32 7.900 6.313 -5.791 1.00 0.00 H new ATOM 0 HA VAL A 32 5.849 6.761 -3.588 1.00 0.00 H new ATOM 0 HB VAL A 32 5.856 5.040 -6.111 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.552 4.449 -5.402 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.743 3.947 -4.178 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.761 5.408 -3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.967 6.504 -6.779 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.179 7.457 -5.290 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.452 7.454 -6.534 1.00 0.00 H new ATOM 469 N ARG A 33 7.623 5.267 -2.479 1.00 0.00 N ATOM 470 CA ARG A 33 8.351 4.212 -1.715 1.00 0.00 C ATOM 471 C ARG A 33 7.409 3.079 -1.334 1.00 0.00 C ATOM 472 O ARG A 33 6.630 3.196 -0.406 1.00 0.00 O ATOM 473 CB ARG A 33 8.870 4.919 -0.459 1.00 0.00 C ATOM 474 CG ARG A 33 9.715 3.951 0.371 1.00 0.00 C ATOM 475 CD ARG A 33 10.827 4.725 1.086 1.00 0.00 C ATOM 476 NE ARG A 33 11.038 4.001 2.379 1.00 0.00 N ATOM 477 CZ ARG A 33 11.676 4.564 3.386 1.00 0.00 C ATOM 478 NH1 ARG A 33 12.155 5.785 3.302 1.00 0.00 N ATOM 479 NH2 ARG A 33 11.836 3.893 4.494 1.00 0.00 N ATOM 0 H ARG A 33 7.627 6.191 -2.046 1.00 0.00 H new ATOM 0 HA ARG A 33 9.156 3.767 -2.300 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.466 5.787 -0.740 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.033 5.286 0.135 1.00 0.00 H new ATOM 0 HG2 ARG A 33 9.088 3.438 1.100 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.147 3.185 -0.273 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.740 4.743 0.491 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.538 5.762 1.258 1.00 0.00 H new ATOM 0 HE ARG A 33 10.680 3.051 2.483 1.00 0.00 H new ATOM 0 HH11 ARG A 33 12.037 6.321 2.442 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.645 6.197 4.097 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.469 2.945 4.573 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.328 4.317 5.281 1.00 0.00 H new ATOM 493 N VAL A 34 7.491 1.971 -2.029 1.00 0.00 N ATOM 494 CA VAL A 34 6.618 0.823 -1.685 1.00 0.00 C ATOM 495 C VAL A 34 7.477 -0.332 -1.187 1.00 0.00 C ATOM 496 O VAL A 34 8.580 -0.552 -1.651 1.00 0.00 O ATOM 497 CB VAL A 34 5.870 0.436 -2.960 1.00 0.00 C ATOM 498 CG1 VAL A 34 4.960 1.590 -3.390 1.00 0.00 C ATOM 499 CG2 VAL A 34 6.865 0.110 -4.084 1.00 0.00 C ATOM 0 H VAL A 34 8.124 1.819 -2.815 1.00 0.00 H new ATOM 0 HA VAL A 34 5.910 1.076 -0.896 1.00 0.00 H new ATOM 0 HB VAL A 34 5.265 -0.449 -2.762 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.427 1.313 -4.300 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.241 1.801 -2.598 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.563 2.478 -3.579 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.318 -0.164 -4.986 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.484 0.984 -4.287 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.500 -0.722 -3.778 1.00 0.00 H new ATOM 509 N THR A 35 6.976 -1.051 -0.232 1.00 0.00 N ATOM 510 CA THR A 35 7.744 -2.193 0.340 1.00 0.00 C ATOM 511 C THR A 35 6.828 -3.386 0.619 1.00 0.00 C ATOM 512 O THR A 35 5.783 -3.250 1.227 1.00 0.00 O ATOM 513 CB THR A 35 8.321 -1.649 1.652 1.00 0.00 C ATOM 514 OG1 THR A 35 9.094 -0.489 1.380 1.00 0.00 O ATOM 515 CG2 THR A 35 9.208 -2.711 2.305 1.00 0.00 C ATOM 0 H THR A 35 6.058 -0.899 0.185 1.00 0.00 H new ATOM 0 HA THR A 35 8.515 -2.549 -0.344 1.00 0.00 H new ATOM 0 HB THR A 35 7.505 -1.396 2.329 1.00 0.00 H new ATOM 0 HG1 THR A 35 9.463 -0.138 2.217 1.00 0.00 H new ATOM 0 HG21 THR A 35 9.616 -2.321 3.237 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.616 -3.602 2.513 1.00 0.00 H new ATOM 0 HG23 THR A 35 10.025 -2.968 1.630 1.00 0.00 H new ATOM 523 N VAL A 36 7.235 -4.557 0.213 1.00 0.00 N ATOM 524 CA VAL A 36 6.420 -5.773 0.485 1.00 0.00 C ATOM 525 C VAL A 36 7.020 -6.471 1.711 1.00 0.00 C ATOM 526 O VAL A 36 8.220 -6.649 1.774 1.00 0.00 O ATOM 527 CB VAL A 36 6.551 -6.631 -0.780 1.00 0.00 C ATOM 528 CG1 VAL A 36 5.827 -7.965 -0.578 1.00 0.00 C ATOM 529 CG2 VAL A 36 5.920 -5.888 -1.968 1.00 0.00 C ATOM 0 H VAL A 36 8.102 -4.724 -0.298 1.00 0.00 H new ATOM 0 HA VAL A 36 5.370 -5.570 0.698 1.00 0.00 H new ATOM 0 HB VAL A 36 7.606 -6.818 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.923 -8.571 -1.479 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.270 -8.495 0.265 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.772 -7.779 -0.376 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.012 -6.496 -2.868 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.866 -5.702 -1.762 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.434 -4.938 -2.118 1.00 0.00 H new ATOM 539 N LEU A 37 6.229 -6.835 2.707 1.00 0.00 N ATOM 540 CA LEU A 37 6.842 -7.485 3.913 1.00 0.00 C ATOM 541 C LEU A 37 6.287 -8.882 4.143 1.00 0.00 C ATOM 542 O LEU A 37 5.217 -9.219 3.689 1.00 0.00 O ATOM 543 CB LEU A 37 6.458 -6.605 5.102 1.00 0.00 C ATOM 544 CG LEU A 37 7.002 -5.192 4.917 1.00 0.00 C ATOM 545 CD1 LEU A 37 6.139 -4.215 5.726 1.00 0.00 C ATOM 546 CD2 LEU A 37 8.453 -5.139 5.416 1.00 0.00 C ATOM 0 H LEU A 37 5.217 -6.713 2.734 1.00 0.00 H new ATOM 0 HA LEU A 37 7.920 -7.580 3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.373 -6.573 5.203 1.00 0.00 H new ATOM 0 HB3 LEU A 37 6.852 -7.035 6.023 1.00 0.00 H new ATOM 0 HG LEU A 37 6.974 -4.916 3.863 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.521 -3.202 5.600 1.00 0.00 H new ATOM 0 HD12 LEU A 37 5.109 -4.261 5.373 1.00 0.00 H new ATOM 0 HD13 LEU A 37 6.173 -4.487 6.781 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.846 -4.131 5.286 1.00 0.00 H new ATOM 0 HD22 LEU A 37 8.485 -5.407 6.472 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.060 -5.842 4.845 1.00 0.00 H new ATOM 558 N ARG A 38 7.006 -9.679 4.885 1.00 0.00 N ATOM 559 CA ARG A 38 6.527 -11.055 5.199 1.00 0.00 C ATOM 560 C ARG A 38 6.320 -11.175 6.707 1.00 0.00 C ATOM 561 O ARG A 38 7.189 -10.825 7.485 1.00 0.00 O ATOM 562 CB ARG A 38 7.639 -11.994 4.730 1.00 0.00 C ATOM 563 CG ARG A 38 7.199 -13.445 4.935 1.00 0.00 C ATOM 564 CD ARG A 38 8.332 -14.388 4.519 1.00 0.00 C ATOM 565 NE ARG A 38 7.767 -15.767 4.663 1.00 0.00 N ATOM 566 CZ ARG A 38 8.541 -16.834 4.611 1.00 0.00 C ATOM 567 NH1 ARG A 38 9.838 -16.736 4.434 1.00 0.00 N ATOM 568 NH2 ARG A 38 8.003 -18.017 4.739 1.00 0.00 N ATOM 0 H ARG A 38 7.910 -9.435 5.290 1.00 0.00 H new ATOM 0 HA ARG A 38 5.582 -11.294 4.712 1.00 0.00 H new ATOM 0 HB2 ARG A 38 7.862 -11.815 3.678 1.00 0.00 H new ATOM 0 HB3 ARG A 38 8.555 -11.798 5.287 1.00 0.00 H new ATOM 0 HG2 ARG A 38 6.938 -13.612 5.980 1.00 0.00 H new ATOM 0 HG3 ARG A 38 6.305 -13.652 4.346 1.00 0.00 H new ATOM 0 HD2 ARG A 38 8.647 -14.197 3.493 1.00 0.00 H new ATOM 0 HD3 ARG A 38 9.209 -14.254 5.152 1.00 0.00 H new ATOM 0 HE ARG A 38 6.764 -15.884 4.804 1.00 0.00 H new ATOM 0 HH11 ARG A 38 10.271 -15.818 4.333 1.00 0.00 H new ATOM 0 HH12 ARG A 38 10.413 -17.578 4.398 1.00 0.00 H new ATOM 0 HH21 ARG A 38 6.996 -18.107 4.877 1.00 0.00 H new ATOM 0 HH22 ARG A 38 8.589 -18.851 4.701 1.00 0.00 H new ATOM 582 N GLN A 39 5.178 -11.652 7.128 1.00 0.00 N ATOM 583 CA GLN A 39 4.920 -11.776 8.595 1.00 0.00 C ATOM 584 C GLN A 39 4.974 -13.238 9.031 1.00 0.00 C ATOM 585 O GLN A 39 4.650 -14.139 8.280 1.00 0.00 O ATOM 586 CB GLN A 39 3.521 -11.209 8.810 1.00 0.00 C ATOM 587 CG GLN A 39 3.248 -11.056 10.307 1.00 0.00 C ATOM 588 CD GLN A 39 1.761 -10.776 10.529 1.00 0.00 C ATOM 589 OE1 GLN A 39 1.049 -11.599 11.071 1.00 0.00 O ATOM 590 NE2 GLN A 39 1.257 -9.640 10.131 1.00 0.00 N ATOM 0 H GLN A 39 4.416 -11.960 6.524 1.00 0.00 H new ATOM 0 HA GLN A 39 5.670 -11.245 9.181 1.00 0.00 H new ATOM 0 HB2 GLN A 39 3.430 -10.243 8.314 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.778 -11.869 8.361 1.00 0.00 H new ATOM 0 HG2 GLN A 39 3.541 -11.963 10.835 1.00 0.00 H new ATOM 0 HG3 GLN A 39 3.847 -10.242 10.715 1.00 0.00 H new ATOM 0 HE21 GLN A 39 1.854 -8.949 9.676 1.00 0.00 H new ATOM 0 HE22 GLN A 39 0.267 -9.443 10.275 1.00 0.00 H new ATOM 599 N ALA A 40 5.379 -13.469 10.248 1.00 0.00 N ATOM 600 CA ALA A 40 5.461 -14.863 10.773 1.00 0.00 C ATOM 601 C ALA A 40 4.703 -14.962 12.099 1.00 0.00 C ATOM 602 O ALA A 40 4.031 -14.032 12.505 1.00 0.00 O ATOM 603 CB ALA A 40 6.953 -15.130 10.977 1.00 0.00 C ATOM 0 H ALA A 40 5.660 -12.745 10.909 1.00 0.00 H new ATOM 0 HA ALA A 40 5.016 -15.591 10.095 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.092 -16.140 11.363 1.00 0.00 H new ATOM 0 HB2 ALA A 40 7.474 -15.030 10.025 1.00 0.00 H new ATOM 0 HB3 ALA A 40 7.357 -14.410 11.689 1.00 0.00 H new ATOM 609 N ASP A 41 4.799 -16.081 12.771 1.00 0.00 N ATOM 610 CA ASP A 41 4.068 -16.241 14.067 1.00 0.00 C ATOM 611 C ASP A 41 4.519 -15.192 15.089 1.00 0.00 C ATOM 612 O ASP A 41 3.704 -14.601 15.774 1.00 0.00 O ATOM 613 CB ASP A 41 4.422 -17.642 14.555 1.00 0.00 C ATOM 614 CG ASP A 41 3.716 -18.691 13.688 1.00 0.00 C ATOM 615 OD1 ASP A 41 2.658 -18.387 13.162 1.00 0.00 O ATOM 616 OD2 ASP A 41 4.245 -19.784 13.573 1.00 0.00 O ATOM 0 H ASP A 41 5.350 -16.889 12.481 1.00 0.00 H new ATOM 0 HA ASP A 41 2.994 -16.106 13.939 1.00 0.00 H new ATOM 0 HB2 ASP A 41 5.501 -17.789 14.513 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.125 -17.759 15.597 1.00 0.00 H new ATOM 621 N SER A 42 5.804 -14.961 15.208 1.00 0.00 N ATOM 622 CA SER A 42 6.292 -13.953 16.204 1.00 0.00 C ATOM 623 C SER A 42 7.325 -12.988 15.599 1.00 0.00 C ATOM 624 O SER A 42 7.644 -11.975 16.196 1.00 0.00 O ATOM 625 CB SER A 42 6.935 -14.784 17.312 1.00 0.00 C ATOM 626 OG SER A 42 5.941 -15.588 17.934 1.00 0.00 O ATOM 0 H SER A 42 6.532 -15.423 14.663 1.00 0.00 H new ATOM 0 HA SER A 42 5.474 -13.325 16.558 1.00 0.00 H new ATOM 0 HB2 SER A 42 7.723 -15.414 16.899 1.00 0.00 H new ATOM 0 HB3 SER A 42 7.403 -14.130 18.048 1.00 0.00 H new ATOM 0 HG SER A 42 6.351 -16.124 18.645 1.00 0.00 H new ATOM 632 N GLN A 43 7.865 -13.287 14.440 1.00 0.00 N ATOM 633 CA GLN A 43 8.884 -12.383 13.834 1.00 0.00 C ATOM 634 C GLN A 43 8.453 -11.920 12.440 1.00 0.00 C ATOM 635 O GLN A 43 7.886 -12.670 11.672 1.00 0.00 O ATOM 636 CB GLN A 43 10.149 -13.234 13.742 1.00 0.00 C ATOM 637 CG GLN A 43 11.300 -12.376 13.222 1.00 0.00 C ATOM 638 CD GLN A 43 12.571 -13.223 13.124 1.00 0.00 C ATOM 639 OE1 GLN A 43 12.504 -14.430 13.003 1.00 0.00 O ATOM 640 NE2 GLN A 43 13.736 -12.637 13.170 1.00 0.00 N ATOM 0 H GLN A 43 7.642 -14.118 13.892 1.00 0.00 H new ATOM 0 HA GLN A 43 9.028 -11.479 14.426 1.00 0.00 H new ATOM 0 HB2 GLN A 43 10.398 -13.642 14.722 1.00 0.00 H new ATOM 0 HB3 GLN A 43 9.983 -14.081 13.077 1.00 0.00 H new ATOM 0 HG2 GLN A 43 11.048 -11.966 12.244 1.00 0.00 H new ATOM 0 HG3 GLN A 43 11.466 -11.530 13.889 1.00 0.00 H new ATOM 0 HE21 GLN A 43 13.794 -11.624 13.272 1.00 0.00 H new ATOM 0 HE22 GLN A 43 14.589 -13.192 13.104 1.00 0.00 H new ATOM 649 N VAL A 44 8.741 -10.690 12.109 1.00 0.00 N ATOM 650 CA VAL A 44 8.379 -10.162 10.759 1.00 0.00 C ATOM 651 C VAL A 44 9.598 -9.455 10.163 1.00 0.00 C ATOM 652 O VAL A 44 10.263 -8.687 10.833 1.00 0.00 O ATOM 653 CB VAL A 44 7.236 -9.171 10.991 1.00 0.00 C ATOM 654 CG1 VAL A 44 6.756 -8.619 9.647 1.00 0.00 C ATOM 655 CG2 VAL A 44 6.072 -9.878 11.694 1.00 0.00 C ATOM 0 H VAL A 44 9.214 -10.023 12.719 1.00 0.00 H new ATOM 0 HA VAL A 44 8.075 -10.948 10.067 1.00 0.00 H new ATOM 0 HB VAL A 44 7.593 -8.352 11.616 1.00 0.00 H new ATOM 0 HG11 VAL A 44 5.942 -7.913 9.813 1.00 0.00 H new ATOM 0 HG12 VAL A 44 7.580 -8.111 9.147 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.403 -9.439 9.022 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.261 -9.169 11.857 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.716 -10.699 11.072 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.410 -10.269 12.653 1.00 0.00 H new ATOM 665 N THR A 45 9.906 -9.720 8.921 1.00 0.00 N ATOM 666 CA THR A 45 11.100 -9.075 8.291 1.00 0.00 C ATOM 667 C THR A 45 10.744 -8.475 6.930 1.00 0.00 C ATOM 668 O THR A 45 9.705 -8.761 6.365 1.00 0.00 O ATOM 669 CB THR A 45 12.123 -10.201 8.126 1.00 0.00 C ATOM 670 OG1 THR A 45 11.577 -11.216 7.295 1.00 0.00 O ATOM 671 CG2 THR A 45 12.470 -10.789 9.496 1.00 0.00 C ATOM 0 H THR A 45 9.385 -10.354 8.315 1.00 0.00 H new ATOM 0 HA THR A 45 11.483 -8.256 8.900 1.00 0.00 H new ATOM 0 HB THR A 45 13.029 -9.803 7.668 1.00 0.00 H new ATOM 0 HG1 THR A 45 12.231 -11.937 7.187 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.199 -11.590 9.374 1.00 0.00 H new ATOM 0 HG22 THR A 45 12.891 -10.009 10.131 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.568 -11.187 9.960 1.00 0.00 H new ATOM 679 N GLU A 46 11.607 -7.643 6.404 1.00 0.00 N ATOM 680 CA GLU A 46 11.339 -7.012 5.079 1.00 0.00 C ATOM 681 C GLU A 46 11.671 -7.982 3.946 1.00 0.00 C ATOM 682 O GLU A 46 12.539 -8.826 4.067 1.00 0.00 O ATOM 683 CB GLU A 46 12.254 -5.787 5.023 1.00 0.00 C ATOM 684 CG GLU A 46 11.805 -4.766 6.071 1.00 0.00 C ATOM 685 CD GLU A 46 12.776 -3.582 6.088 1.00 0.00 C ATOM 686 OE1 GLU A 46 13.329 -3.276 5.043 1.00 0.00 O ATOM 687 OE2 GLU A 46 12.950 -3.001 7.146 1.00 0.00 O ATOM 0 H GLU A 46 12.489 -7.373 6.839 1.00 0.00 H new ATOM 0 HA GLU A 46 10.290 -6.741 4.963 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.287 -6.083 5.207 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.222 -5.341 4.029 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.797 -4.419 5.845 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.769 -5.233 7.055 1.00 0.00 H new ATOM 694 N VAL A 47 10.975 -7.862 2.849 1.00 0.00 N ATOM 695 CA VAL A 47 11.221 -8.763 1.688 1.00 0.00 C ATOM 696 C VAL A 47 11.814 -7.952 0.527 1.00 0.00 C ATOM 697 O VAL A 47 12.967 -8.111 0.173 1.00 0.00 O ATOM 698 CB VAL A 47 9.830 -9.307 1.340 1.00 0.00 C ATOM 699 CG1 VAL A 47 9.892 -10.183 0.090 1.00 0.00 C ATOM 700 CG2 VAL A 47 9.298 -10.131 2.516 1.00 0.00 C ATOM 0 H VAL A 47 10.239 -7.171 2.706 1.00 0.00 H new ATOM 0 HA VAL A 47 11.928 -9.565 1.898 1.00 0.00 H new ATOM 0 HB VAL A 47 9.164 -8.467 1.144 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.895 -10.559 -0.140 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.260 -9.593 -0.750 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.565 -11.022 0.267 1.00 0.00 H new ATOM 0 HG21 VAL A 47 8.309 -10.519 2.271 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.975 -10.962 2.714 1.00 0.00 H new ATOM 0 HG23 VAL A 47 9.231 -9.499 3.402 1.00 0.00 H new ATOM 710 N CYS A 48 11.036 -7.073 -0.050 1.00 0.00 N ATOM 711 CA CYS A 48 11.544 -6.227 -1.173 1.00 0.00 C ATOM 712 C CYS A 48 11.146 -4.771 -0.936 1.00 0.00 C ATOM 713 O CYS A 48 10.135 -4.499 -0.314 1.00 0.00 O ATOM 714 CB CYS A 48 10.880 -6.783 -2.432 1.00 0.00 C ATOM 715 SG CYS A 48 11.672 -8.345 -2.894 1.00 0.00 S ATOM 0 H CYS A 48 10.064 -6.903 0.210 1.00 0.00 H new ATOM 0 HA CYS A 48 12.630 -6.251 -1.260 1.00 0.00 H new ATOM 0 HB2 CYS A 48 9.816 -6.941 -2.255 1.00 0.00 H new ATOM 0 HB3 CYS A 48 10.964 -6.065 -3.248 1.00 0.00 H new ATOM 720 N ALA A 49 11.933 -3.829 -1.407 1.00 0.00 N ATOM 721 CA ALA A 49 11.581 -2.393 -1.173 1.00 0.00 C ATOM 722 C ALA A 49 12.412 -1.447 -2.050 1.00 0.00 C ATOM 723 O ALA A 49 13.615 -1.578 -2.167 1.00 0.00 O ATOM 724 CB ALA A 49 11.893 -2.158 0.306 1.00 0.00 C ATOM 0 H ALA A 49 12.791 -3.990 -1.935 1.00 0.00 H new ATOM 0 HA ALA A 49 10.540 -2.192 -1.427 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.663 -1.125 0.567 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.289 -2.829 0.916 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.950 -2.352 0.490 1.00 0.00 H new ATOM 730 N ALA A 50 11.764 -0.478 -2.642 1.00 0.00 N ATOM 731 CA ALA A 50 12.473 0.522 -3.497 1.00 0.00 C ATOM 732 C ALA A 50 11.485 1.633 -3.880 1.00 0.00 C ATOM 733 O ALA A 50 10.283 1.430 -3.851 1.00 0.00 O ATOM 734 CB ALA A 50 12.944 -0.247 -4.737 1.00 0.00 C ATOM 0 H ALA A 50 10.757 -0.335 -2.568 1.00 0.00 H new ATOM 0 HA ALA A 50 13.318 0.988 -2.990 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.473 0.431 -5.407 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.613 -1.052 -4.433 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.081 -0.668 -5.254 1.00 0.00 H new ATOM 740 N THR A 51 11.969 2.802 -4.229 1.00 0.00 N ATOM 741 CA THR A 51 11.035 3.910 -4.603 1.00 0.00 C ATOM 742 C THR A 51 10.675 3.796 -6.081 1.00 0.00 C ATOM 743 O THR A 51 11.543 3.751 -6.933 1.00 0.00 O ATOM 744 CB THR A 51 11.796 5.213 -4.341 1.00 0.00 C ATOM 745 OG1 THR A 51 12.543 5.090 -3.140 1.00 0.00 O ATOM 746 CG2 THR A 51 10.794 6.355 -4.191 1.00 0.00 C ATOM 0 H THR A 51 12.961 3.035 -4.271 1.00 0.00 H new ATOM 0 HA THR A 51 10.109 3.873 -4.030 1.00 0.00 H new ATOM 0 HB THR A 51 12.471 5.417 -5.173 1.00 0.00 H new ATOM 0 HG1 THR A 51 13.061 5.909 -2.991 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.329 7.286 -4.004 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.210 6.449 -5.107 1.00 0.00 H new ATOM 0 HG23 THR A 51 10.127 6.146 -3.355 1.00 0.00 H new ATOM 754 N TYR A 52 9.407 3.737 -6.392 1.00 0.00 N ATOM 755 CA TYR A 52 9.000 3.613 -7.813 1.00 0.00 C ATOM 756 C TYR A 52 8.867 4.986 -8.453 1.00 0.00 C ATOM 757 O TYR A 52 7.938 5.720 -8.163 1.00 0.00 O ATOM 758 CB TYR A 52 7.631 2.943 -7.783 1.00 0.00 C ATOM 759 CG TYR A 52 7.262 2.510 -9.180 1.00 0.00 C ATOM 760 CD1 TYR A 52 6.736 3.447 -10.116 1.00 0.00 C ATOM 761 CD2 TYR A 52 7.449 1.157 -9.559 1.00 0.00 C ATOM 762 CE1 TYR A 52 6.397 3.021 -11.429 1.00 0.00 C ATOM 763 CE2 TYR A 52 7.110 0.731 -10.871 1.00 0.00 C ATOM 764 CZ TYR A 52 6.583 1.663 -11.806 1.00 0.00 C ATOM 765 OH TYR A 52 6.253 1.250 -13.081 1.00 0.00 O ATOM 0 H TYR A 52 8.640 3.770 -5.721 1.00 0.00 H new ATOM 0 HA TYR A 52 9.734 3.048 -8.388 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.648 2.082 -7.115 1.00 0.00 H new ATOM 0 HB3 TYR A 52 6.883 3.634 -7.394 1.00 0.00 H new ATOM 0 HD1 TYR A 52 6.595 4.478 -9.828 1.00 0.00 H new ATOM 0 HD2 TYR A 52 7.850 0.449 -8.849 1.00 0.00 H new ATOM 0 HE1 TYR A 52 5.998 3.729 -12.140 1.00 0.00 H new ATOM 0 HE2 TYR A 52 7.253 -0.300 -11.158 1.00 0.00 H new ATOM 0 HH TYR A 52 5.278 1.224 -13.174 1.00 0.00 H new ATOM 775 N MET A 53 9.754 5.319 -9.352 1.00 0.00 N ATOM 776 CA MET A 53 9.633 6.621 -10.055 1.00 0.00 C ATOM 777 C MET A 53 8.585 6.411 -11.146 1.00 0.00 C ATOM 778 O MET A 53 8.249 5.279 -11.447 1.00 0.00 O ATOM 779 CB MET A 53 11.001 6.897 -10.686 1.00 0.00 C ATOM 780 CG MET A 53 12.085 6.932 -9.606 1.00 0.00 C ATOM 781 SD MET A 53 12.668 8.629 -9.404 1.00 0.00 S ATOM 782 CE MET A 53 11.465 9.114 -8.149 1.00 0.00 C ATOM 0 H MET A 53 10.552 4.746 -9.627 1.00 0.00 H new ATOM 0 HA MET A 53 9.347 7.449 -9.407 1.00 0.00 H new ATOM 0 HB2 MET A 53 11.233 6.125 -11.420 1.00 0.00 H new ATOM 0 HB3 MET A 53 10.978 7.847 -11.219 1.00 0.00 H new ATOM 0 HG2 MET A 53 11.688 6.557 -8.663 1.00 0.00 H new ATOM 0 HG3 MET A 53 12.914 6.281 -9.884 1.00 0.00 H new ATOM 0 HE1 MET A 53 11.636 10.152 -7.863 1.00 0.00 H new ATOM 0 HE2 MET A 53 10.457 9.010 -8.551 1.00 0.00 H new ATOM 0 HE3 MET A 53 11.574 8.474 -7.274 1.00 0.00 H new ATOM 792 N MET A 54 8.057 7.444 -11.748 1.00 0.00 N ATOM 793 CA MET A 54 7.033 7.210 -12.817 1.00 0.00 C ATOM 794 C MET A 54 7.648 6.368 -13.944 1.00 0.00 C ATOM 795 O MET A 54 6.973 5.589 -14.590 1.00 0.00 O ATOM 796 CB MET A 54 6.623 8.593 -13.317 1.00 0.00 C ATOM 797 CG MET A 54 5.952 9.359 -12.180 1.00 0.00 C ATOM 798 SD MET A 54 4.658 8.327 -11.441 1.00 0.00 S ATOM 799 CE MET A 54 5.640 7.659 -10.072 1.00 0.00 C ATOM 0 H MET A 54 8.281 8.420 -11.554 1.00 0.00 H new ATOM 0 HA MET A 54 6.166 6.664 -12.447 1.00 0.00 H new ATOM 0 HB2 MET A 54 7.497 9.138 -13.673 1.00 0.00 H new ATOM 0 HB3 MET A 54 5.940 8.500 -14.161 1.00 0.00 H new ATOM 0 HG2 MET A 54 6.690 9.632 -11.426 1.00 0.00 H new ATOM 0 HG3 MET A 54 5.522 10.287 -12.556 1.00 0.00 H new ATOM 0 HE1 MET A 54 5.726 6.578 -10.180 1.00 0.00 H new ATOM 0 HE2 MET A 54 6.634 8.106 -10.086 1.00 0.00 H new ATOM 0 HE3 MET A 54 5.151 7.891 -9.126 1.00 0.00 H new ATOM 809 N GLY A 55 8.934 6.503 -14.157 1.00 0.00 N ATOM 810 CA GLY A 55 9.618 5.692 -15.207 1.00 0.00 C ATOM 811 C GLY A 55 10.109 4.397 -14.556 1.00 0.00 C ATOM 812 O GLY A 55 9.422 3.824 -13.730 1.00 0.00 O ATOM 0 H GLY A 55 9.541 7.144 -13.645 1.00 0.00 H new ATOM 0 HA2 GLY A 55 8.933 5.472 -16.025 1.00 0.00 H new ATOM 0 HA3 GLY A 55 10.455 6.246 -15.632 1.00 0.00 H new ATOM 816 N ASN A 56 11.290 3.937 -14.896 1.00 0.00 N ATOM 817 CA ASN A 56 11.803 2.686 -14.259 1.00 0.00 C ATOM 818 C ASN A 56 13.049 2.977 -13.427 1.00 0.00 C ATOM 819 O ASN A 56 13.961 3.652 -13.860 1.00 0.00 O ATOM 820 CB ASN A 56 12.147 1.730 -15.386 1.00 0.00 C ATOM 821 CG ASN A 56 10.878 1.359 -16.156 1.00 0.00 C ATOM 822 OD1 ASN A 56 9.922 0.880 -15.580 1.00 0.00 O ATOM 823 ND2 ASN A 56 10.828 1.563 -17.445 1.00 0.00 N ATOM 0 H ASN A 56 11.913 4.369 -15.579 1.00 0.00 H new ATOM 0 HA ASN A 56 11.054 2.260 -13.591 1.00 0.00 H new ATOM 0 HB2 ASN A 56 12.870 2.191 -16.059 1.00 0.00 H new ATOM 0 HB3 ASN A 56 12.615 0.832 -14.983 1.00 0.00 H new ATOM 0 HD21 ASN A 56 9.986 1.320 -17.968 1.00 0.00 H new ATOM 0 HD22 ASN A 56 11.631 1.965 -17.929 1.00 0.00 H new ATOM 830 N GLU A 57 13.078 2.449 -12.236 1.00 0.00 N ATOM 831 CA GLU A 57 14.242 2.645 -11.306 1.00 0.00 C ATOM 832 C GLU A 57 13.950 1.944 -9.977 1.00 0.00 C ATOM 833 O GLU A 57 12.806 1.704 -9.641 1.00 0.00 O ATOM 834 CB GLU A 57 14.355 4.160 -11.064 1.00 0.00 C ATOM 835 CG GLU A 57 15.581 4.450 -10.193 1.00 0.00 C ATOM 836 CD GLU A 57 15.666 5.951 -9.911 1.00 0.00 C ATOM 837 OE1 GLU A 57 14.967 6.407 -9.020 1.00 0.00 O ATOM 838 OE2 GLU A 57 16.427 6.620 -10.590 1.00 0.00 O ATOM 0 H GLU A 57 12.328 1.874 -11.852 1.00 0.00 H new ATOM 0 HA GLU A 57 15.161 2.236 -11.725 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.439 4.685 -12.015 1.00 0.00 H new ATOM 0 HB3 GLU A 57 13.453 4.529 -10.575 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.513 3.897 -9.256 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.486 4.113 -10.698 1.00 0.00 H new ATOM 845 N LEU A 58 14.966 1.638 -9.199 1.00 0.00 N ATOM 846 CA LEU A 58 14.738 0.983 -7.873 1.00 0.00 C ATOM 847 C LEU A 58 13.835 -0.249 -8.008 1.00 0.00 C ATOM 848 O LEU A 58 12.654 -0.204 -7.723 1.00 0.00 O ATOM 849 CB LEU A 58 14.088 2.075 -7.021 1.00 0.00 C ATOM 850 CG LEU A 58 15.175 3.039 -6.545 1.00 0.00 C ATOM 851 CD1 LEU A 58 14.532 4.294 -5.958 1.00 0.00 C ATOM 852 CD2 LEU A 58 16.015 2.349 -5.467 1.00 0.00 C ATOM 0 H LEU A 58 15.944 1.815 -9.429 1.00 0.00 H new ATOM 0 HA LEU A 58 15.660 0.611 -7.426 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.337 2.610 -7.602 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.575 1.633 -6.167 1.00 0.00 H new ATOM 0 HG LEU A 58 15.807 3.320 -7.387 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.311 4.978 -5.620 1.00 0.00 H new ATOM 0 HD12 LEU A 58 13.926 4.783 -6.721 1.00 0.00 H new ATOM 0 HD13 LEU A 58 13.900 4.018 -5.114 1.00 0.00 H new ATOM 0 HD21 LEU A 58 16.793 3.029 -5.121 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.375 2.073 -4.629 1.00 0.00 H new ATOM 0 HD23 LEU A 58 16.475 1.453 -5.883 1.00 0.00 H new ATOM 864 N THR A 59 14.393 -1.343 -8.454 1.00 0.00 N ATOM 865 CA THR A 59 13.607 -2.585 -8.627 1.00 0.00 C ATOM 866 C THR A 59 13.780 -3.494 -7.406 1.00 0.00 C ATOM 867 O THR A 59 14.697 -3.328 -6.623 1.00 0.00 O ATOM 868 CB THR A 59 14.219 -3.231 -9.865 1.00 0.00 C ATOM 869 OG1 THR A 59 15.603 -3.463 -9.641 1.00 0.00 O ATOM 870 CG2 THR A 59 14.037 -2.318 -11.081 1.00 0.00 C ATOM 0 H THR A 59 15.378 -1.423 -8.708 1.00 0.00 H new ATOM 0 HA THR A 59 12.537 -2.403 -8.731 1.00 0.00 H new ATOM 0 HB THR A 59 13.717 -4.179 -10.059 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.998 -3.880 -10.435 1.00 0.00 H new ATOM 0 HG21 THR A 59 14.478 -2.790 -11.959 1.00 0.00 H new ATOM 0 HG22 THR A 59 12.974 -2.150 -11.254 1.00 0.00 H new ATOM 0 HG23 THR A 59 14.529 -1.363 -10.896 1.00 0.00 H new ATOM 878 N PHE A 60 12.909 -4.456 -7.246 1.00 0.00 N ATOM 879 CA PHE A 60 13.015 -5.390 -6.083 1.00 0.00 C ATOM 880 C PHE A 60 13.873 -6.615 -6.454 1.00 0.00 C ATOM 881 O PHE A 60 13.924 -7.584 -5.721 1.00 0.00 O ATOM 882 CB PHE A 60 11.571 -5.827 -5.800 1.00 0.00 C ATOM 883 CG PHE A 60 10.709 -4.683 -5.267 1.00 0.00 C ATOM 884 CD1 PHE A 60 11.193 -3.338 -5.191 1.00 0.00 C ATOM 885 CD2 PHE A 60 9.387 -4.974 -4.832 1.00 0.00 C ATOM 886 CE1 PHE A 60 10.355 -2.307 -4.686 1.00 0.00 C ATOM 887 CE2 PHE A 60 8.554 -3.942 -4.327 1.00 0.00 C ATOM 888 CZ PHE A 60 9.038 -2.610 -4.255 1.00 0.00 C ATOM 0 H PHE A 60 12.125 -4.637 -7.873 1.00 0.00 H new ATOM 0 HA PHE A 60 13.486 -4.919 -5.220 1.00 0.00 H new ATOM 0 HB2 PHE A 60 11.126 -6.217 -6.716 1.00 0.00 H new ATOM 0 HB3 PHE A 60 11.576 -6.642 -5.076 1.00 0.00 H new ATOM 0 HD1 PHE A 60 12.196 -3.106 -5.518 1.00 0.00 H new ATOM 0 HD2 PHE A 60 9.015 -5.986 -4.886 1.00 0.00 H new ATOM 0 HE1 PHE A 60 10.721 -1.292 -4.630 1.00 0.00 H new ATOM 0 HE2 PHE A 60 7.551 -4.170 -3.997 1.00 0.00 H new ATOM 0 HZ PHE A 60 8.402 -1.826 -3.871 1.00 0.00 H new ATOM 898 N LEU A 61 14.532 -6.584 -7.591 1.00 0.00 N ATOM 899 CA LEU A 61 15.374 -7.748 -8.016 1.00 0.00 C ATOM 900 C LEU A 61 16.475 -8.032 -6.991 1.00 0.00 C ATOM 901 O LEU A 61 16.904 -9.160 -6.834 1.00 0.00 O ATOM 902 CB LEU A 61 15.988 -7.337 -9.357 1.00 0.00 C ATOM 903 CG LEU A 61 16.798 -8.503 -9.933 1.00 0.00 C ATOM 904 CD1 LEU A 61 15.866 -9.676 -10.244 1.00 0.00 C ATOM 905 CD2 LEU A 61 17.492 -8.051 -11.220 1.00 0.00 C ATOM 0 H LEU A 61 14.522 -5.800 -8.243 1.00 0.00 H new ATOM 0 HA LEU A 61 14.782 -8.660 -8.098 1.00 0.00 H new ATOM 0 HB2 LEU A 61 15.202 -7.048 -10.055 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.630 -6.467 -9.222 1.00 0.00 H new ATOM 0 HG LEU A 61 17.544 -8.819 -9.204 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.446 -10.503 -10.653 1.00 0.00 H new ATOM 0 HD12 LEU A 61 15.370 -9.999 -9.329 1.00 0.00 H new ATOM 0 HD13 LEU A 61 15.117 -9.363 -10.972 1.00 0.00 H new ATOM 0 HD21 LEU A 61 18.069 -8.879 -11.632 1.00 0.00 H new ATOM 0 HD22 LEU A 61 16.743 -7.734 -11.946 1.00 0.00 H new ATOM 0 HD23 LEU A 61 18.159 -7.217 -11.000 1.00 0.00 H new ATOM 917 N ASP A 62 16.946 -7.021 -6.304 1.00 0.00 N ATOM 918 CA ASP A 62 18.036 -7.238 -5.300 1.00 0.00 C ATOM 919 C ASP A 62 17.619 -8.268 -4.253 1.00 0.00 C ATOM 920 O ASP A 62 18.439 -8.968 -3.689 1.00 0.00 O ATOM 921 CB ASP A 62 18.295 -5.865 -4.661 1.00 0.00 C ATOM 922 CG ASP A 62 17.045 -5.372 -3.920 1.00 0.00 C ATOM 923 OD1 ASP A 62 15.954 -5.747 -4.313 1.00 0.00 O ATOM 924 OD2 ASP A 62 17.205 -4.621 -2.971 1.00 0.00 O ATOM 0 H ASP A 62 16.625 -6.057 -6.394 1.00 0.00 H new ATOM 0 HA ASP A 62 18.938 -7.632 -5.768 1.00 0.00 H new ATOM 0 HB2 ASP A 62 19.133 -5.933 -3.967 1.00 0.00 H new ATOM 0 HB3 ASP A 62 18.576 -5.146 -5.431 1.00 0.00 H new ATOM 929 N ASP A 63 16.354 -8.358 -4.006 1.00 0.00 N ATOM 930 CA ASP A 63 15.841 -9.332 -3.014 1.00 0.00 C ATOM 931 C ASP A 63 15.651 -10.723 -3.632 1.00 0.00 C ATOM 932 O ASP A 63 15.365 -11.677 -2.940 1.00 0.00 O ATOM 933 CB ASP A 63 14.511 -8.755 -2.531 1.00 0.00 C ATOM 934 CG ASP A 63 14.768 -7.432 -1.809 1.00 0.00 C ATOM 935 OD1 ASP A 63 15.220 -7.475 -0.677 1.00 0.00 O ATOM 936 OD2 ASP A 63 14.513 -6.397 -2.402 1.00 0.00 O ATOM 0 H ASP A 63 15.638 -7.789 -4.456 1.00 0.00 H new ATOM 0 HA ASP A 63 16.544 -9.471 -2.193 1.00 0.00 H new ATOM 0 HB2 ASP A 63 13.841 -8.597 -3.376 1.00 0.00 H new ATOM 0 HB3 ASP A 63 14.018 -9.459 -1.861 1.00 0.00 H new ATOM 941 N SER A 64 15.825 -10.834 -4.922 1.00 0.00 N ATOM 942 CA SER A 64 15.680 -12.151 -5.638 1.00 0.00 C ATOM 943 C SER A 64 14.466 -12.960 -5.147 1.00 0.00 C ATOM 944 O SER A 64 14.470 -14.176 -5.199 1.00 0.00 O ATOM 945 CB SER A 64 16.976 -12.906 -5.342 1.00 0.00 C ATOM 946 OG SER A 64 17.065 -13.165 -3.947 1.00 0.00 O ATOM 0 H SER A 64 16.068 -10.052 -5.530 1.00 0.00 H new ATOM 0 HA SER A 64 15.512 -11.995 -6.704 1.00 0.00 H new ATOM 0 HB2 SER A 64 16.999 -13.843 -5.899 1.00 0.00 H new ATOM 0 HB3 SER A 64 17.834 -12.319 -5.669 1.00 0.00 H new ATOM 0 HG SER A 64 16.197 -12.993 -3.526 1.00 0.00 H new ATOM 952 N ILE A 67 13.436 -12.302 -4.674 1.00 0.00 N ATOM 953 CA ILE A 67 12.232 -13.045 -4.185 1.00 0.00 C ATOM 954 C ILE A 67 10.940 -12.366 -4.665 1.00 0.00 C ATOM 955 O ILE A 67 10.038 -13.021 -5.153 1.00 0.00 O ATOM 956 CB ILE A 67 12.346 -13.024 -2.655 1.00 0.00 C ATOM 957 CG1 ILE A 67 13.498 -13.939 -2.242 1.00 0.00 C ATOM 958 CG2 ILE A 67 11.048 -13.536 -2.008 1.00 0.00 C ATOM 959 CD1 ILE A 67 13.741 -13.796 -0.748 1.00 0.00 C ATOM 0 H ILE A 67 13.376 -11.286 -4.605 1.00 0.00 H new ATOM 0 HA ILE A 67 12.192 -14.065 -4.568 1.00 0.00 H new ATOM 0 HB ILE A 67 12.524 -12.001 -2.324 1.00 0.00 H new ATOM 0 HG12 ILE A 67 13.261 -14.974 -2.486 1.00 0.00 H new ATOM 0 HG13 ILE A 67 14.400 -13.680 -2.796 1.00 0.00 H new ATOM 0 HG21 ILE A 67 11.149 -13.513 -0.923 1.00 0.00 H new ATOM 0 HG22 ILE A 67 10.216 -12.899 -2.308 1.00 0.00 H new ATOM 0 HG23 ILE A 67 10.858 -14.559 -2.333 1.00 0.00 H new ATOM 0 HD11 ILE A 67 14.562 -14.447 -0.449 1.00 0.00 H new ATOM 0 HD12 ILE A 67 13.996 -12.761 -0.518 1.00 0.00 H new ATOM 0 HD13 ILE A 67 12.839 -14.077 -0.204 1.00 0.00 H new ATOM 971 N CYS A 68 10.836 -11.068 -4.513 1.00 0.00 N ATOM 972 CA CYS A 68 9.590 -10.366 -4.944 1.00 0.00 C ATOM 973 C CYS A 68 9.878 -9.332 -6.037 1.00 0.00 C ATOM 974 O CYS A 68 10.770 -8.515 -5.921 1.00 0.00 O ATOM 975 CB CYS A 68 9.070 -9.678 -3.679 1.00 0.00 C ATOM 976 SG CYS A 68 10.330 -9.764 -2.382 1.00 0.00 S ATOM 0 H CYS A 68 11.557 -10.468 -4.111 1.00 0.00 H new ATOM 0 HA CYS A 68 8.866 -11.060 -5.370 1.00 0.00 H new ATOM 0 HB2 CYS A 68 8.824 -8.638 -3.893 1.00 0.00 H new ATOM 0 HB3 CYS A 68 8.152 -10.160 -3.342 1.00 0.00 H new ATOM 981 N THR A 69 9.106 -9.363 -7.091 1.00 0.00 N ATOM 982 CA THR A 69 9.285 -8.385 -8.204 1.00 0.00 C ATOM 983 C THR A 69 7.905 -7.941 -8.701 1.00 0.00 C ATOM 984 O THR A 69 6.962 -8.709 -8.668 1.00 0.00 O ATOM 985 CB THR A 69 10.050 -9.149 -9.294 1.00 0.00 C ATOM 986 OG1 THR A 69 10.270 -8.290 -10.404 1.00 0.00 O ATOM 987 CG2 THR A 69 9.247 -10.375 -9.742 1.00 0.00 C ATOM 0 H THR A 69 8.349 -10.033 -7.230 1.00 0.00 H new ATOM 0 HA THR A 69 9.827 -7.488 -7.904 1.00 0.00 H new ATOM 0 HB THR A 69 11.007 -9.483 -8.893 1.00 0.00 H new ATOM 0 HG1 THR A 69 10.760 -8.775 -11.101 1.00 0.00 H new ATOM 0 HG21 THR A 69 9.799 -10.909 -10.515 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.085 -11.035 -8.890 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.284 -10.054 -10.140 1.00 0.00 H new ATOM 995 N GLY A 70 7.768 -6.717 -9.153 1.00 0.00 N ATOM 996 CA GLY A 70 6.429 -6.261 -9.632 1.00 0.00 C ATOM 997 C GLY A 70 6.519 -4.887 -10.296 1.00 0.00 C ATOM 998 O GLY A 70 7.586 -4.356 -10.533 1.00 0.00 O ATOM 0 H GLY A 70 8.515 -6.025 -9.210 1.00 0.00 H new ATOM 0 HA2 GLY A 70 6.027 -6.985 -10.341 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.735 -6.218 -8.793 1.00 0.00 H new ATOM 1002 N THR A 71 5.382 -4.322 -10.600 1.00 0.00 N ATOM 1003 CA THR A 71 5.328 -2.989 -11.260 1.00 0.00 C ATOM 1004 C THR A 71 4.359 -2.072 -10.502 1.00 0.00 C ATOM 1005 O THR A 71 3.622 -2.511 -9.650 1.00 0.00 O ATOM 1006 CB THR A 71 4.799 -3.293 -12.659 1.00 0.00 C ATOM 1007 OG1 THR A 71 5.731 -4.108 -13.354 1.00 0.00 O ATOM 1008 CG2 THR A 71 4.559 -2.002 -13.441 1.00 0.00 C ATOM 0 H THR A 71 4.470 -4.739 -10.414 1.00 0.00 H new ATOM 0 HA THR A 71 6.292 -2.480 -11.281 1.00 0.00 H new ATOM 0 HB THR A 71 3.850 -3.820 -12.564 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.361 -5.009 -13.461 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.182 -2.243 -14.435 1.00 0.00 H new ATOM 0 HG22 THR A 71 3.828 -1.388 -12.915 1.00 0.00 H new ATOM 0 HG23 THR A 71 5.496 -1.452 -13.532 1.00 0.00 H new ATOM 1016 N SER A 72 4.354 -0.808 -10.826 1.00 0.00 N ATOM 1017 CA SER A 72 3.423 0.156 -10.156 1.00 0.00 C ATOM 1018 C SER A 72 2.781 1.045 -11.230 1.00 0.00 C ATOM 1019 O SER A 72 3.476 1.596 -12.065 1.00 0.00 O ATOM 1020 CB SER A 72 4.306 0.990 -9.229 1.00 0.00 C ATOM 1021 OG SER A 72 3.488 1.866 -8.465 1.00 0.00 O ATOM 0 H SER A 72 4.961 -0.394 -11.534 1.00 0.00 H new ATOM 0 HA SER A 72 2.623 -0.337 -9.603 1.00 0.00 H new ATOM 0 HB2 SER A 72 4.877 0.338 -8.568 1.00 0.00 H new ATOM 0 HB3 SER A 72 5.027 1.563 -9.812 1.00 0.00 H new ATOM 0 HG SER A 72 4.051 2.402 -7.868 1.00 0.00 H new ATOM 1027 N SER A 73 1.474 1.191 -11.233 1.00 0.00 N ATOM 1028 CA SER A 73 0.829 2.045 -12.278 1.00 0.00 C ATOM 1029 C SER A 73 -0.225 2.961 -11.658 1.00 0.00 C ATOM 1030 O SER A 73 -1.086 2.517 -10.923 1.00 0.00 O ATOM 1031 CB SER A 73 0.178 1.058 -13.245 1.00 0.00 C ATOM 1032 OG SER A 73 1.188 0.275 -13.868 1.00 0.00 O ATOM 0 H SER A 73 0.835 0.760 -10.564 1.00 0.00 H new ATOM 0 HA SER A 73 1.550 2.695 -12.774 1.00 0.00 H new ATOM 0 HB2 SER A 73 -0.520 0.414 -12.710 1.00 0.00 H new ATOM 0 HB3 SER A 73 -0.398 1.595 -13.998 1.00 0.00 H new ATOM 0 HG SER A 73 0.773 -0.361 -14.488 1.00 0.00 H new ATOM 1038 N GLY A 74 -0.168 4.238 -11.959 1.00 0.00 N ATOM 1039 CA GLY A 74 -1.171 5.202 -11.402 1.00 0.00 C ATOM 1040 C GLY A 74 -1.275 5.035 -9.883 1.00 0.00 C ATOM 1041 O GLY A 74 -0.295 5.137 -9.168 1.00 0.00 O ATOM 0 H GLY A 74 0.534 4.655 -12.570 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.878 6.224 -11.644 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -2.145 5.032 -11.862 1.00 0.00 H new ATOM 1045 N ASN A 75 -2.456 4.763 -9.396 1.00 0.00 N ATOM 1046 CA ASN A 75 -2.640 4.567 -7.930 1.00 0.00 C ATOM 1047 C ASN A 75 -2.695 3.069 -7.591 1.00 0.00 C ATOM 1048 O ASN A 75 -3.051 2.697 -6.489 1.00 0.00 O ATOM 1049 CB ASN A 75 -3.978 5.236 -7.608 1.00 0.00 C ATOM 1050 CG ASN A 75 -3.880 6.739 -7.880 1.00 0.00 C ATOM 1051 OD1 ASN A 75 -4.744 7.310 -8.515 1.00 0.00 O ATOM 1052 ND2 ASN A 75 -2.859 7.410 -7.420 1.00 0.00 N ATOM 0 H ASN A 75 -3.305 4.668 -9.954 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.818 4.991 -7.353 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.770 4.797 -8.215 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -4.241 5.062 -6.565 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -2.787 8.413 -7.594 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.133 6.932 -6.887 1.00 0.00 H new ATOM 1059 N GLN A 76 -2.342 2.205 -8.522 1.00 0.00 N ATOM 1060 CA GLN A 76 -2.380 0.741 -8.237 1.00 0.00 C ATOM 1061 C GLN A 76 -0.973 0.163 -8.311 1.00 0.00 C ATOM 1062 O GLN A 76 -0.264 0.372 -9.279 1.00 0.00 O ATOM 1063 CB GLN A 76 -3.262 0.146 -9.336 1.00 0.00 C ATOM 1064 CG GLN A 76 -4.713 0.580 -9.119 1.00 0.00 C ATOM 1065 CD GLN A 76 -5.577 0.069 -10.273 1.00 0.00 C ATOM 1066 OE1 GLN A 76 -6.188 0.845 -10.980 1.00 0.00 O ATOM 1067 NE2 GLN A 76 -5.654 -1.215 -10.495 1.00 0.00 N ATOM 0 H GLN A 76 -2.032 2.456 -9.461 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.767 0.520 -7.242 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.915 0.478 -10.315 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.191 -0.942 -9.324 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.083 0.187 -8.172 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.774 1.667 -9.059 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.141 -1.867 -9.901 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -6.227 -1.566 -11.262 1.00 0.00 H new ATOM 1076 N VAL A 77 -0.554 -0.553 -7.298 1.00 0.00 N ATOM 1077 CA VAL A 77 0.813 -1.128 -7.320 1.00 0.00 C ATOM 1078 C VAL A 77 0.754 -2.640 -7.591 1.00 0.00 C ATOM 1079 O VAL A 77 0.184 -3.398 -6.834 1.00 0.00 O ATOM 1080 CB VAL A 77 1.407 -0.821 -5.938 1.00 0.00 C ATOM 1081 CG1 VAL A 77 1.330 0.687 -5.644 1.00 0.00 C ATOM 1082 CG2 VAL A 77 0.670 -1.601 -4.840 1.00 0.00 C ATOM 0 H VAL A 77 -1.101 -0.760 -6.463 1.00 0.00 H new ATOM 0 HA VAL A 77 1.428 -0.703 -8.113 1.00 0.00 H new ATOM 0 HB VAL A 77 2.452 -1.131 -5.945 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.755 0.888 -4.661 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.892 1.234 -6.401 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.289 1.008 -5.662 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.109 -1.367 -3.870 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -0.383 -1.320 -4.839 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.760 -2.670 -5.030 1.00 0.00 H new ATOM 1092 N ASN A 78 1.337 -3.069 -8.674 1.00 0.00 N ATOM 1093 CA ASN A 78 1.326 -4.519 -9.029 1.00 0.00 C ATOM 1094 C ASN A 78 2.533 -5.249 -8.415 1.00 0.00 C ATOM 1095 O ASN A 78 3.656 -5.062 -8.836 1.00 0.00 O ATOM 1096 CB ASN A 78 1.419 -4.528 -10.561 1.00 0.00 C ATOM 1097 CG ASN A 78 1.209 -5.950 -11.085 1.00 0.00 C ATOM 1098 OD1 ASN A 78 1.358 -6.916 -10.364 1.00 0.00 O ATOM 1099 ND2 ASN A 78 0.866 -6.085 -12.340 1.00 0.00 N ATOM 0 H ASN A 78 1.828 -2.471 -9.338 1.00 0.00 H new ATOM 0 HA ASN A 78 0.439 -5.030 -8.653 1.00 0.00 H new ATOM 0 HB2 ASN A 78 0.668 -3.860 -10.984 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.393 -4.154 -10.878 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.746 -5.260 -12.928 1.00 0.00 H new ATOM 1105 N LEU A 79 2.303 -6.096 -7.438 1.00 0.00 N ATOM 1106 CA LEU A 79 3.434 -6.860 -6.815 1.00 0.00 C ATOM 1107 C LEU A 79 3.312 -8.347 -7.180 1.00 0.00 C ATOM 1108 O LEU A 79 2.251 -8.931 -7.067 1.00 0.00 O ATOM 1109 CB LEU A 79 3.287 -6.673 -5.298 1.00 0.00 C ATOM 1110 CG LEU A 79 3.614 -5.228 -4.899 1.00 0.00 C ATOM 1111 CD1 LEU A 79 3.403 -5.057 -3.394 1.00 0.00 C ATOM 1112 CD2 LEU A 79 5.073 -4.910 -5.244 1.00 0.00 C ATOM 0 H LEU A 79 1.382 -6.291 -7.045 1.00 0.00 H new ATOM 0 HA LEU A 79 4.404 -6.508 -7.165 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.270 -6.919 -4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.952 -7.360 -4.775 1.00 0.00 H new ATOM 0 HG LEU A 79 2.958 -4.549 -5.444 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.635 -4.031 -3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.365 -5.277 -3.145 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.059 -5.741 -2.855 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.299 -3.883 -4.958 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.731 -5.590 -4.703 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.228 -5.031 -6.316 1.00 0.00 H new ATOM 1124 N THR A 80 4.385 -8.960 -7.624 1.00 0.00 N ATOM 1125 CA THR A 80 4.323 -10.407 -8.004 1.00 0.00 C ATOM 1126 C THR A 80 5.479 -11.188 -7.362 1.00 0.00 C ATOM 1127 O THR A 80 6.581 -10.691 -7.230 1.00 0.00 O ATOM 1128 CB THR A 80 4.445 -10.415 -9.530 1.00 0.00 C ATOM 1129 OG1 THR A 80 3.371 -9.675 -10.092 1.00 0.00 O ATOM 1130 CG2 THR A 80 4.394 -11.855 -10.047 1.00 0.00 C ATOM 0 H THR A 80 5.299 -8.521 -7.739 1.00 0.00 H new ATOM 0 HA THR A 80 3.404 -10.883 -7.662 1.00 0.00 H new ATOM 0 HB THR A 80 5.394 -9.963 -9.818 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.448 -9.677 -11.069 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.481 -11.855 -11.134 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.217 -12.425 -9.617 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.447 -12.312 -9.759 1.00 0.00 H new ATOM 1138 N ILE A 81 5.229 -12.413 -6.970 1.00 0.00 N ATOM 1139 CA ILE A 81 6.300 -13.245 -6.342 1.00 0.00 C ATOM 1140 C ILE A 81 6.478 -14.556 -7.109 1.00 0.00 C ATOM 1141 O ILE A 81 5.511 -15.184 -7.490 1.00 0.00 O ATOM 1142 CB ILE A 81 5.789 -13.551 -4.930 1.00 0.00 C ATOM 1143 CG1 ILE A 81 5.668 -12.253 -4.134 1.00 0.00 C ATOM 1144 CG2 ILE A 81 6.760 -14.506 -4.214 1.00 0.00 C ATOM 1145 CD1 ILE A 81 4.720 -12.478 -2.956 1.00 0.00 C ATOM 0 H ILE A 81 4.324 -12.874 -7.059 1.00 0.00 H new ATOM 0 HA ILE A 81 7.261 -12.730 -6.342 1.00 0.00 H new ATOM 0 HB ILE A 81 4.810 -14.025 -5.002 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.648 -11.939 -3.774 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.292 -11.454 -4.772 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.389 -14.718 -3.211 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.836 -15.436 -4.777 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.744 -14.041 -4.146 1.00 0.00 H new ATOM 0 HD11 ILE A 81 4.628 -11.556 -2.382 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.739 -12.773 -3.329 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.116 -13.266 -2.316 1.00 0.00 H new ATOM 1157 N GLN A 82 7.701 -14.993 -7.284 1.00 0.00 N ATOM 1158 CA GLN A 82 7.940 -16.296 -7.969 1.00 0.00 C ATOM 1159 C GLN A 82 8.686 -17.239 -7.029 1.00 0.00 C ATOM 1160 O GLN A 82 9.765 -16.938 -6.554 1.00 0.00 O ATOM 1161 CB GLN A 82 8.808 -16.005 -9.188 1.00 0.00 C ATOM 1162 CG GLN A 82 8.007 -15.241 -10.241 1.00 0.00 C ATOM 1163 CD GLN A 82 8.950 -14.364 -11.065 1.00 0.00 C ATOM 1164 OE1 GLN A 82 9.563 -13.453 -10.544 1.00 0.00 O ATOM 1165 NE2 GLN A 82 9.093 -14.601 -12.340 1.00 0.00 N ATOM 0 H GLN A 82 8.542 -14.502 -6.981 1.00 0.00 H new ATOM 0 HA GLN A 82 6.999 -16.764 -8.258 1.00 0.00 H new ATOM 0 HB2 GLN A 82 9.680 -15.422 -8.891 1.00 0.00 H new ATOM 0 HB3 GLN A 82 9.178 -16.939 -9.610 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.483 -15.940 -10.892 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.248 -14.624 -9.759 1.00 0.00 H new ATOM 0 HE21 GLN A 82 8.579 -15.366 -12.777 1.00 0.00 H new ATOM 0 HE22 GLN A 82 9.719 -14.022 -12.899 1.00 0.00 H new ATOM 1174 N GLY A 83 8.116 -18.377 -6.770 1.00 0.00 N ATOM 1175 CA GLY A 83 8.773 -19.368 -5.867 1.00 0.00 C ATOM 1176 C GLY A 83 7.982 -19.478 -4.565 1.00 0.00 C ATOM 1177 O GLY A 83 8.547 -19.615 -3.496 1.00 0.00 O ATOM 0 H GLY A 83 7.215 -18.670 -7.146 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.826 -20.341 -6.355 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.797 -19.061 -5.657 1.00 0.00 H new ATOM 1181 N LEU A 84 6.679 -19.417 -4.650 1.00 0.00 N ATOM 1182 CA LEU A 84 5.840 -19.515 -3.420 1.00 0.00 C ATOM 1183 C LEU A 84 5.682 -20.973 -2.986 1.00 0.00 C ATOM 1184 O LEU A 84 4.714 -21.630 -3.319 1.00 0.00 O ATOM 1185 CB LEU A 84 4.489 -18.920 -3.813 1.00 0.00 C ATOM 1186 CG LEU A 84 4.651 -17.419 -4.044 1.00 0.00 C ATOM 1187 CD1 LEU A 84 3.351 -16.847 -4.607 1.00 0.00 C ATOM 1188 CD2 LEU A 84 4.974 -16.735 -2.714 1.00 0.00 C ATOM 0 H LEU A 84 6.159 -19.303 -5.520 1.00 0.00 H new ATOM 0 HA LEU A 84 6.289 -18.989 -2.578 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.115 -19.401 -4.717 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.755 -19.102 -3.028 1.00 0.00 H new ATOM 0 HG LEU A 84 5.461 -17.244 -4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.466 -15.776 -4.772 1.00 0.00 H new ATOM 0 HD12 LEU A 84 3.117 -17.337 -5.552 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.541 -17.020 -3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.090 -15.663 -2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.162 -16.910 -2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 84 5.900 -17.144 -2.310 1.00 0.00 H new ATOM 1200 N ARG A 85 6.622 -21.471 -2.228 1.00 0.00 N ATOM 1201 CA ARG A 85 6.537 -22.879 -1.739 1.00 0.00 C ATOM 1202 C ARG A 85 5.517 -22.954 -0.604 1.00 0.00 C ATOM 1203 O ARG A 85 5.083 -21.940 -0.091 1.00 0.00 O ATOM 1204 CB ARG A 85 7.937 -23.210 -1.222 1.00 0.00 C ATOM 1205 CG ARG A 85 8.044 -24.715 -0.975 1.00 0.00 C ATOM 1206 CD ARG A 85 9.506 -25.078 -0.711 1.00 0.00 C ATOM 1207 NE ARG A 85 9.515 -26.559 -0.492 1.00 0.00 N ATOM 1208 CZ ARG A 85 10.644 -27.239 -0.451 1.00 0.00 C ATOM 1209 NH1 ARG A 85 11.809 -26.649 -0.598 1.00 0.00 N ATOM 1210 NH2 ARG A 85 10.604 -28.529 -0.258 1.00 0.00 N ATOM 0 H ARG A 85 7.451 -20.960 -1.924 1.00 0.00 H new ATOM 0 HA ARG A 85 6.223 -23.577 -2.515 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.688 -22.895 -1.946 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.135 -22.664 -0.300 1.00 0.00 H new ATOM 0 HG2 ARG A 85 7.426 -25.001 -0.124 1.00 0.00 H new ATOM 0 HG3 ARG A 85 7.670 -25.265 -1.839 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.138 -24.802 -1.555 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.891 -24.550 0.161 1.00 0.00 H new ATOM 0 HE ARG A 85 8.630 -27.052 -0.372 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.855 -25.641 -0.748 1.00 0.00 H new ATOM 0 HH12 ARG A 85 12.667 -27.199 -0.562 1.00 0.00 H new ATOM 0 HH21 ARG A 85 9.707 -29.000 -0.141 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.470 -29.067 -0.224 1.00 0.00 H new ATOM 1224 N ALA A 86 5.130 -24.141 -0.199 1.00 0.00 N ATOM 1225 CA ALA A 86 4.135 -24.268 0.917 1.00 0.00 C ATOM 1226 C ALA A 86 4.623 -23.479 2.138 1.00 0.00 C ATOM 1227 O ALA A 86 3.864 -22.787 2.790 1.00 0.00 O ATOM 1228 CB ALA A 86 4.072 -25.763 1.235 1.00 0.00 C ATOM 0 H ALA A 86 5.458 -25.024 -0.590 1.00 0.00 H new ATOM 0 HA ALA A 86 3.156 -23.874 0.646 1.00 0.00 H new ATOM 0 HB1 ALA A 86 3.362 -25.933 2.044 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.750 -26.310 0.349 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.059 -26.112 1.538 1.00 0.00 H new ATOM 1234 N MET A 87 5.894 -23.567 2.428 1.00 0.00 N ATOM 1235 CA MET A 87 6.463 -22.815 3.582 1.00 0.00 C ATOM 1236 C MET A 87 6.422 -21.312 3.292 1.00 0.00 C ATOM 1237 O MET A 87 6.207 -20.502 4.174 1.00 0.00 O ATOM 1238 CB MET A 87 7.911 -23.297 3.701 1.00 0.00 C ATOM 1239 CG MET A 87 8.566 -22.657 4.927 1.00 0.00 C ATOM 1240 SD MET A 87 7.883 -23.398 6.431 1.00 0.00 S ATOM 1241 CE MET A 87 8.902 -22.485 7.616 1.00 0.00 C ATOM 0 H MET A 87 6.567 -24.132 1.910 1.00 0.00 H new ATOM 0 HA MET A 87 5.905 -22.983 4.503 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.937 -24.383 3.788 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.467 -23.035 2.801 1.00 0.00 H new ATOM 0 HG2 MET A 87 9.646 -22.804 4.894 1.00 0.00 H new ATOM 0 HG3 MET A 87 8.390 -21.581 4.927 1.00 0.00 H new ATOM 0 HE1 MET A 87 8.643 -22.791 8.630 1.00 0.00 H new ATOM 0 HE2 MET A 87 9.955 -22.698 7.430 1.00 0.00 H new ATOM 0 HE3 MET A 87 8.722 -21.416 7.502 1.00 0.00 H new ATOM 1251 N ASP A 88 6.639 -20.941 2.056 1.00 0.00 N ATOM 1252 CA ASP A 88 6.627 -19.491 1.682 1.00 0.00 C ATOM 1253 C ASP A 88 5.230 -18.891 1.869 1.00 0.00 C ATOM 1254 O ASP A 88 5.083 -17.696 2.041 1.00 0.00 O ATOM 1255 CB ASP A 88 7.035 -19.450 0.208 1.00 0.00 C ATOM 1256 CG ASP A 88 8.476 -19.949 0.054 1.00 0.00 C ATOM 1257 OD1 ASP A 88 9.241 -19.803 0.995 1.00 0.00 O ATOM 1258 OD2 ASP A 88 8.790 -20.470 -1.003 1.00 0.00 O ATOM 0 H ASP A 88 6.825 -21.582 1.285 1.00 0.00 H new ATOM 0 HA ASP A 88 7.302 -18.908 2.309 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.361 -20.070 -0.383 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.950 -18.433 -0.174 1.00 0.00 H new ATOM 1263 N THR A 89 4.199 -19.707 1.843 1.00 0.00 N ATOM 1264 CA THR A 89 2.814 -19.190 2.024 1.00 0.00 C ATOM 1265 C THR A 89 2.730 -18.369 3.306 1.00 0.00 C ATOM 1266 O THR A 89 3.320 -18.716 4.313 1.00 0.00 O ATOM 1267 CB THR A 89 1.934 -20.419 2.125 1.00 0.00 C ATOM 1268 OG1 THR A 89 2.134 -21.242 0.986 1.00 0.00 O ATOM 1269 CG2 THR A 89 0.467 -20.001 2.209 1.00 0.00 C ATOM 0 H THR A 89 4.265 -20.715 1.703 1.00 0.00 H new ATOM 0 HA THR A 89 2.507 -18.542 1.203 1.00 0.00 H new ATOM 0 HB THR A 89 2.197 -20.977 3.024 1.00 0.00 H new ATOM 0 HG1 THR A 89 2.814 -21.918 1.186 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.161 -20.889 2.281 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.316 -19.377 3.090 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.197 -19.438 1.315 1.00 0.00 H new ATOM 1277 N GLY A 90 2.018 -17.281 3.270 1.00 0.00 N ATOM 1278 CA GLY A 90 1.918 -16.428 4.494 1.00 0.00 C ATOM 1279 C GLY A 90 1.289 -15.070 4.167 1.00 0.00 C ATOM 1280 O GLY A 90 0.427 -14.957 3.319 1.00 0.00 O ATOM 0 H GLY A 90 1.503 -16.943 2.457 1.00 0.00 H new ATOM 0 HA2 GLY A 90 1.319 -16.938 5.249 1.00 0.00 H new ATOM 0 HA3 GLY A 90 2.910 -16.280 4.921 1.00 0.00 H new ATOM 1284 N LEU A 91 1.715 -14.043 4.862 1.00 0.00 N ATOM 1285 CA LEU A 91 1.152 -12.677 4.637 1.00 0.00 C ATOM 1286 C LEU A 91 2.165 -11.785 3.914 1.00 0.00 C ATOM 1287 O LEU A 91 3.320 -11.696 4.293 1.00 0.00 O ATOM 1288 CB LEU A 91 0.892 -12.140 6.061 1.00 0.00 C ATOM 1289 CG LEU A 91 0.025 -10.853 6.067 1.00 0.00 C ATOM 1290 CD1 LEU A 91 0.694 -9.719 5.291 1.00 0.00 C ATOM 1291 CD2 LEU A 91 -1.360 -11.139 5.469 1.00 0.00 C ATOM 0 H LEU A 91 2.436 -14.095 5.582 1.00 0.00 H new ATOM 0 HA LEU A 91 0.255 -12.694 4.018 1.00 0.00 H new ATOM 0 HB2 LEU A 91 0.395 -12.911 6.650 1.00 0.00 H new ATOM 0 HB3 LEU A 91 1.846 -11.933 6.546 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.084 -10.538 7.105 1.00 0.00 H new ATOM 0 HD11 LEU A 91 0.057 -8.835 5.318 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.657 -9.486 5.745 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.845 -10.026 4.256 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -1.957 -10.227 5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.248 -11.487 4.442 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -1.860 -11.907 6.060 1.00 0.00 H new ATOM 1303 N TYR A 92 1.704 -11.066 2.923 1.00 0.00 N ATOM 1304 CA TYR A 92 2.580 -10.099 2.201 1.00 0.00 C ATOM 1305 C TYR A 92 1.952 -8.706 2.330 1.00 0.00 C ATOM 1306 O TYR A 92 0.789 -8.521 2.028 1.00 0.00 O ATOM 1307 CB TYR A 92 2.627 -10.583 0.753 1.00 0.00 C ATOM 1308 CG TYR A 92 3.567 -11.761 0.675 1.00 0.00 C ATOM 1309 CD1 TYR A 92 3.085 -13.078 0.903 1.00 0.00 C ATOM 1310 CD2 TYR A 92 4.943 -11.548 0.388 1.00 0.00 C ATOM 1311 CE1 TYR A 92 3.980 -14.182 0.843 1.00 0.00 C ATOM 1312 CE2 TYR A 92 5.837 -12.650 0.327 1.00 0.00 C ATOM 1313 CZ TYR A 92 5.355 -13.968 0.554 1.00 0.00 C ATOM 1314 OH TYR A 92 6.223 -15.039 0.496 1.00 0.00 O ATOM 0 H TYR A 92 0.744 -11.110 2.580 1.00 0.00 H new ATOM 0 HA TYR A 92 3.593 -10.039 2.599 1.00 0.00 H new ATOM 0 HB2 TYR A 92 1.631 -10.870 0.416 1.00 0.00 H new ATOM 0 HB3 TYR A 92 2.967 -9.782 0.096 1.00 0.00 H new ATOM 0 HD1 TYR A 92 2.040 -13.241 1.122 1.00 0.00 H new ATOM 0 HD2 TYR A 92 5.309 -10.547 0.216 1.00 0.00 H new ATOM 0 HE1 TYR A 92 3.615 -15.183 1.017 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.882 -12.487 0.108 1.00 0.00 H new ATOM 0 HH TYR A 92 5.835 -15.801 0.974 1.00 0.00 H new ATOM 1324 N ILE A 93 2.693 -7.740 2.822 1.00 0.00 N ATOM 1325 CA ILE A 93 2.110 -6.374 3.028 1.00 0.00 C ATOM 1326 C ILE A 93 2.457 -5.413 1.897 1.00 0.00 C ATOM 1327 O ILE A 93 3.609 -5.138 1.648 1.00 0.00 O ATOM 1328 CB ILE A 93 2.727 -5.865 4.345 1.00 0.00 C ATOM 1329 CG1 ILE A 93 2.142 -6.648 5.514 1.00 0.00 C ATOM 1330 CG2 ILE A 93 2.411 -4.368 4.555 1.00 0.00 C ATOM 1331 CD1 ILE A 93 3.014 -7.854 5.856 1.00 0.00 C ATOM 0 H ILE A 93 3.673 -7.838 3.089 1.00 0.00 H new ATOM 0 HA ILE A 93 1.022 -6.427 3.054 1.00 0.00 H new ATOM 0 HB ILE A 93 3.807 -6.002 4.292 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.056 -5.998 6.385 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.135 -6.982 5.265 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.856 -4.030 5.491 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.822 -3.790 3.728 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.331 -4.226 4.595 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.574 -8.395 6.694 1.00 0.00 H new ATOM 0 HD12 ILE A 93 3.078 -8.514 4.991 1.00 0.00 H new ATOM 0 HD13 ILE A 93 4.013 -7.515 6.128 1.00 0.00 H new ATOM 1343 N CYS A 94 1.463 -4.835 1.279 1.00 0.00 N ATOM 1344 CA CYS A 94 1.734 -3.816 0.230 1.00 0.00 C ATOM 1345 C CYS A 94 1.918 -2.476 0.943 1.00 0.00 C ATOM 1346 O CYS A 94 0.983 -1.938 1.504 1.00 0.00 O ATOM 1347 CB CYS A 94 0.489 -3.800 -0.654 1.00 0.00 C ATOM 1348 SG CYS A 94 -0.907 -3.120 0.279 1.00 0.00 S ATOM 0 H CYS A 94 0.477 -5.025 1.456 1.00 0.00 H new ATOM 0 HA CYS A 94 2.621 -4.020 -0.369 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.671 -3.200 -1.546 1.00 0.00 H new ATOM 0 HB3 CYS A 94 0.257 -4.810 -0.992 1.00 0.00 H new ATOM 1353 N LYS A 95 3.110 -1.947 0.944 1.00 0.00 N ATOM 1354 CA LYS A 95 3.357 -0.655 1.642 1.00 0.00 C ATOM 1355 C LYS A 95 3.457 0.458 0.608 1.00 0.00 C ATOM 1356 O LYS A 95 4.004 0.266 -0.458 1.00 0.00 O ATOM 1357 CB LYS A 95 4.676 -0.860 2.386 1.00 0.00 C ATOM 1358 CG LYS A 95 5.059 0.417 3.143 1.00 0.00 C ATOM 1359 CD LYS A 95 5.235 0.083 4.620 1.00 0.00 C ATOM 1360 CE LYS A 95 5.559 1.358 5.404 1.00 0.00 C ATOM 1361 NZ LYS A 95 5.642 0.925 6.827 1.00 0.00 N ATOM 0 H LYS A 95 3.927 -2.356 0.490 1.00 0.00 H new ATOM 0 HA LYS A 95 2.561 -0.373 2.331 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.583 -1.692 3.084 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.463 -1.123 1.680 1.00 0.00 H new ATOM 0 HG2 LYS A 95 5.982 0.832 2.738 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.286 1.175 3.018 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.325 -0.374 5.010 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.036 -0.645 4.745 1.00 0.00 H new ATOM 0 HE2 LYS A 95 6.498 1.799 5.070 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.786 2.114 5.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.438 1.734 7.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 4.948 0.170 7.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 6.598 0.568 7.026 1.00 0.00 H new ATOM 1375 N VAL A 96 2.898 1.606 0.894 1.00 0.00 N ATOM 1376 CA VAL A 96 2.938 2.721 -0.099 1.00 0.00 C ATOM 1377 C VAL A 96 3.185 4.042 0.630 1.00 0.00 C ATOM 1378 O VAL A 96 2.302 4.562 1.297 1.00 0.00 O ATOM 1379 CB VAL A 96 1.550 2.717 -0.754 1.00 0.00 C ATOM 1380 CG1 VAL A 96 1.537 3.684 -1.939 1.00 0.00 C ATOM 1381 CG2 VAL A 96 1.198 1.300 -1.242 1.00 0.00 C ATOM 0 H VAL A 96 2.418 1.819 1.768 1.00 0.00 H new ATOM 0 HA VAL A 96 3.732 2.602 -0.836 1.00 0.00 H new ATOM 0 HB VAL A 96 0.811 3.033 -0.018 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.550 3.679 -2.402 1.00 0.00 H new ATOM 0 HG12 VAL A 96 1.769 4.690 -1.590 1.00 0.00 H new ATOM 0 HG13 VAL A 96 2.283 3.373 -2.671 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.211 1.309 -1.705 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.938 0.972 -1.972 1.00 0.00 H new ATOM 0 HG23 VAL A 96 1.195 0.614 -0.395 1.00 0.00 H new ATOM 1391 N GLU A 97 4.376 4.584 0.529 1.00 0.00 N ATOM 1392 CA GLU A 97 4.666 5.864 1.243 1.00 0.00 C ATOM 1393 C GLU A 97 5.342 6.892 0.336 1.00 0.00 C ATOM 1394 O GLU A 97 6.349 6.620 -0.282 1.00 0.00 O ATOM 1395 CB GLU A 97 5.642 5.491 2.360 1.00 0.00 C ATOM 1396 CG GLU A 97 4.973 4.509 3.325 1.00 0.00 C ATOM 1397 CD GLU A 97 5.795 4.413 4.611 1.00 0.00 C ATOM 1398 OE1 GLU A 97 6.905 3.911 4.542 1.00 0.00 O ATOM 1399 OE2 GLU A 97 5.300 4.839 5.640 1.00 0.00 O ATOM 0 H GLU A 97 5.151 4.199 -0.011 1.00 0.00 H new ATOM 0 HA GLU A 97 3.739 6.312 1.600 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.541 5.043 1.936 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.955 6.387 2.897 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.960 4.841 3.553 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.890 3.526 2.860 1.00 0.00 H new ATOM 1406 N LEU A 98 4.839 8.096 0.320 1.00 0.00 N ATOM 1407 CA LEU A 98 5.497 9.167 -0.461 1.00 0.00 C ATOM 1408 C LEU A 98 6.568 9.696 0.476 1.00 0.00 C ATOM 1409 O LEU A 98 6.378 10.671 1.189 1.00 0.00 O ATOM 1410 CB LEU A 98 4.417 10.234 -0.724 1.00 0.00 C ATOM 1411 CG LEU A 98 3.107 9.587 -1.216 1.00 0.00 C ATOM 1412 CD1 LEU A 98 2.164 10.678 -1.720 1.00 0.00 C ATOM 1413 CD2 LEU A 98 3.382 8.587 -2.347 1.00 0.00 C ATOM 0 H LEU A 98 3.996 8.380 0.819 1.00 0.00 H new ATOM 0 HA LEU A 98 5.927 8.857 -1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.227 10.797 0.190 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.777 10.945 -1.468 1.00 0.00 H new ATOM 0 HG LEU A 98 2.649 9.051 -0.385 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.236 10.224 -2.069 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.946 11.373 -0.909 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.636 11.216 -2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.443 8.144 -2.677 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.853 9.104 -3.183 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.046 7.802 -1.985 1.00 0.00 H new ATOM 1425 N MET A 99 7.658 8.990 0.575 1.00 0.00 N ATOM 1426 CA MET A 99 8.712 9.372 1.565 1.00 0.00 C ATOM 1427 C MET A 99 9.600 10.511 1.080 1.00 0.00 C ATOM 1428 O MET A 99 9.944 11.395 1.830 1.00 0.00 O ATOM 1429 CB MET A 99 9.553 8.099 1.729 1.00 0.00 C ATOM 1430 CG MET A 99 8.737 7.038 2.468 1.00 0.00 C ATOM 1431 SD MET A 99 7.321 7.820 3.277 1.00 0.00 S ATOM 1432 CE MET A 99 7.427 6.917 4.842 1.00 0.00 C ATOM 0 H MET A 99 7.868 8.164 0.015 1.00 0.00 H new ATOM 0 HA MET A 99 8.260 9.729 2.490 1.00 0.00 H new ATOM 0 HB2 MET A 99 9.857 7.723 0.752 1.00 0.00 H new ATOM 0 HB3 MET A 99 10.465 8.322 2.283 1.00 0.00 H new ATOM 0 HG2 MET A 99 8.394 6.275 1.769 1.00 0.00 H new ATOM 0 HG3 MET A 99 9.360 6.535 3.208 1.00 0.00 H new ATOM 0 HE1 MET A 99 6.423 6.706 5.209 1.00 0.00 H new ATOM 0 HE2 MET A 99 7.960 5.979 4.686 1.00 0.00 H new ATOM 0 HE3 MET A 99 7.962 7.521 5.575 1.00 0.00 H new ATOM 1442 N TYR A 100 9.995 10.498 -0.174 1.00 0.00 N ATOM 1443 CA TYR A 100 10.878 11.590 -0.684 1.00 0.00 C ATOM 1444 C TYR A 100 10.192 12.974 -0.687 1.00 0.00 C ATOM 1445 O TYR A 100 10.821 13.931 -0.247 1.00 0.00 O ATOM 1446 CB TYR A 100 11.286 11.160 -2.093 1.00 0.00 C ATOM 1447 CG TYR A 100 12.322 10.054 -1.999 1.00 0.00 C ATOM 1448 CD1 TYR A 100 11.918 8.705 -1.807 1.00 0.00 C ATOM 1449 CD2 TYR A 100 13.705 10.367 -2.095 1.00 0.00 C ATOM 1450 CE1 TYR A 100 12.889 7.671 -1.710 1.00 0.00 C ATOM 1451 CE2 TYR A 100 14.676 9.333 -1.998 1.00 0.00 C ATOM 1452 CZ TYR A 100 14.268 7.984 -1.804 1.00 0.00 C ATOM 1453 OH TYR A 100 15.217 6.983 -1.707 1.00 0.00 O ATOM 0 H TYR A 100 9.745 9.784 -0.858 1.00 0.00 H new ATOM 0 HA TYR A 100 11.740 11.720 -0.030 1.00 0.00 H new ATOM 0 HB2 TYR A 100 10.414 10.811 -2.646 1.00 0.00 H new ATOM 0 HB3 TYR A 100 11.693 12.010 -2.642 1.00 0.00 H new ATOM 0 HD1 TYR A 100 10.868 8.464 -1.734 1.00 0.00 H new ATOM 0 HD2 TYR A 100 14.018 11.390 -2.242 1.00 0.00 H new ATOM 0 HE1 TYR A 100 12.576 6.648 -1.565 1.00 0.00 H new ATOM 0 HE2 TYR A 100 15.727 9.572 -2.072 1.00 0.00 H new ATOM 0 HH TYR A 100 16.112 7.372 -1.794 1.00 0.00 H new ATOM 1463 N PRO A 101 8.982 13.075 -1.175 1.00 0.00 N ATOM 1464 CA PRO A 101 8.277 14.387 -1.183 1.00 0.00 C ATOM 1465 C PRO A 101 7.736 14.741 0.214 1.00 0.00 C ATOM 1466 O PRO A 101 6.786 14.166 0.665 1.00 0.00 O ATOM 1467 CB PRO A 101 7.146 14.173 -2.226 1.00 0.00 C ATOM 1468 CG PRO A 101 6.868 12.705 -2.194 1.00 0.00 C ATOM 1469 CD PRO A 101 8.138 12.016 -1.737 1.00 0.00 C ATOM 0 HA PRO A 101 8.923 15.227 -1.440 1.00 0.00 H new ATOM 0 HB2 PRO A 101 6.257 14.749 -1.969 1.00 0.00 H new ATOM 0 HB3 PRO A 101 7.458 14.495 -3.220 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.045 12.484 -1.514 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.571 12.349 -3.180 1.00 0.00 H new ATOM 0 HD2 PRO A 101 7.922 11.250 -0.992 1.00 0.00 H new ATOM 0 HD3 PRO A 101 8.636 11.519 -2.570 1.00 0.00 H new ATOM 1477 N PRO A 102 8.336 15.744 0.845 1.00 0.00 N ATOM 1478 CA PRO A 102 7.882 16.180 2.234 1.00 0.00 C ATOM 1479 C PRO A 102 6.738 17.291 2.124 1.00 0.00 C ATOM 1480 O PRO A 102 6.913 18.011 1.102 1.00 0.00 O ATOM 1481 CB PRO A 102 9.156 16.858 2.806 1.00 0.00 C ATOM 1482 CG PRO A 102 9.942 17.300 1.609 1.00 0.00 C ATOM 1483 CD PRO A 102 9.468 16.559 0.379 1.00 0.00 C ATOM 0 HA PRO A 102 7.490 15.356 2.830 1.00 0.00 H new ATOM 0 HB2 PRO A 102 8.899 17.705 3.442 1.00 0.00 H new ATOM 0 HB3 PRO A 102 9.730 16.163 3.418 1.00 0.00 H new ATOM 0 HG2 PRO A 102 9.827 18.374 1.464 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.003 17.112 1.771 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.161 17.250 -0.406 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.260 15.936 -0.037 1.00 0.00 H new ATOM 1491 N PRO A 103 5.609 17.513 2.982 1.00 0.00 N ATOM 1492 CA PRO A 103 6.019 16.270 3.952 1.00 0.00 C ATOM 1493 C PRO A 103 5.389 14.884 3.448 1.00 0.00 C ATOM 1494 O PRO A 103 4.907 14.743 2.308 1.00 0.00 O ATOM 1495 CB PRO A 103 5.592 16.639 5.409 1.00 0.00 C ATOM 1496 CG PRO A 103 4.555 17.617 5.201 1.00 0.00 C ATOM 1497 CD PRO A 103 4.261 17.375 3.761 1.00 0.00 C ATOM 0 HA PRO A 103 7.097 16.112 3.925 1.00 0.00 H new ATOM 0 HB2 PRO A 103 5.225 15.770 5.955 1.00 0.00 H new ATOM 0 HB3 PRO A 103 6.424 17.048 5.983 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.687 17.447 5.838 1.00 0.00 H new ATOM 0 HG3 PRO A 103 4.896 18.634 5.392 1.00 0.00 H new ATOM 0 HD2 PRO A 103 3.834 16.382 3.617 1.00 0.00 H new ATOM 0 HD3 PRO A 103 3.529 18.093 3.392 1.00 0.00 H new ATOM 1505 N TYR A 104 5.457 13.876 4.269 1.00 0.00 N ATOM 1506 CA TYR A 104 4.867 12.564 3.902 1.00 0.00 C ATOM 1507 C TYR A 104 3.393 12.417 4.283 1.00 0.00 C ATOM 1508 O TYR A 104 2.979 12.802 5.350 1.00 0.00 O ATOM 1509 CB TYR A 104 5.763 11.516 4.620 1.00 0.00 C ATOM 1510 CG TYR A 104 5.097 10.178 4.665 1.00 0.00 C ATOM 1511 CD1 TYR A 104 4.567 9.609 3.483 1.00 0.00 C ATOM 1512 CD2 TYR A 104 4.976 9.514 5.903 1.00 0.00 C ATOM 1513 CE1 TYR A 104 3.906 8.350 3.541 1.00 0.00 C ATOM 1514 CE2 TYR A 104 4.319 8.253 5.965 1.00 0.00 C ATOM 1515 CZ TYR A 104 3.782 7.672 4.789 1.00 0.00 C ATOM 1516 OH TYR A 104 3.147 6.458 4.856 1.00 0.00 O ATOM 0 H TYR A 104 5.901 13.907 5.187 1.00 0.00 H new ATOM 0 HA TYR A 104 4.856 12.436 2.820 1.00 0.00 H new ATOM 0 HB2 TYR A 104 6.718 11.433 4.101 1.00 0.00 H new ATOM 0 HB3 TYR A 104 5.980 11.852 5.634 1.00 0.00 H new ATOM 0 HD1 TYR A 104 4.664 10.128 2.541 1.00 0.00 H new ATOM 0 HD2 TYR A 104 5.380 9.960 6.800 1.00 0.00 H new ATOM 0 HE1 TYR A 104 3.500 7.910 2.643 1.00 0.00 H new ATOM 0 HE2 TYR A 104 4.229 7.738 6.910 1.00 0.00 H new ATOM 0 HH TYR A 104 3.741 5.801 5.275 1.00 0.00 H new ATOM 1526 N TYR A 105 2.583 11.837 3.385 1.00 0.00 N ATOM 1527 CA TYR A 105 1.118 11.626 3.667 1.00 0.00 C ATOM 1528 C TYR A 105 0.549 10.444 2.878 1.00 0.00 C ATOM 1529 O TYR A 105 0.102 10.603 1.760 1.00 0.00 O ATOM 1530 CB TYR A 105 0.383 12.900 3.277 1.00 0.00 C ATOM 1531 CG TYR A 105 0.814 13.398 1.924 1.00 0.00 C ATOM 1532 CD1 TYR A 105 1.986 14.177 1.806 1.00 0.00 C ATOM 1533 CD2 TYR A 105 0.034 13.105 0.780 1.00 0.00 C ATOM 1534 CE1 TYR A 105 2.390 14.667 0.531 1.00 0.00 C ATOM 1535 CE2 TYR A 105 0.432 13.591 -0.492 1.00 0.00 C ATOM 1536 CZ TYR A 105 1.614 14.371 -0.614 1.00 0.00 C ATOM 1537 OH TYR A 105 1.991 14.847 -1.841 1.00 0.00 O ATOM 0 H TYR A 105 2.889 11.505 2.471 1.00 0.00 H new ATOM 0 HA TYR A 105 0.988 11.400 4.725 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -0.691 12.714 3.271 1.00 0.00 H new ATOM 0 HB3 TYR A 105 0.569 13.671 4.025 1.00 0.00 H new ATOM 0 HD1 TYR A 105 2.576 14.401 2.682 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.864 12.512 0.875 1.00 0.00 H new ATOM 0 HE1 TYR A 105 3.286 15.263 0.439 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -0.162 13.369 -1.366 1.00 0.00 H new ATOM 0 HH TYR A 105 1.348 14.550 -2.519 1.00 0.00 H new ATOM 1547 N LEU A 106 0.544 9.272 3.458 1.00 0.00 N ATOM 1548 CA LEU A 106 0.007 8.079 2.731 1.00 0.00 C ATOM 1549 C LEU A 106 -0.357 6.963 3.725 1.00 0.00 C ATOM 1550 O LEU A 106 -0.745 7.243 4.850 1.00 0.00 O ATOM 1551 CB LEU A 106 1.133 7.653 1.778 1.00 0.00 C ATOM 1552 CG LEU A 106 0.532 7.377 0.400 1.00 0.00 C ATOM 1553 CD1 LEU A 106 0.000 8.688 -0.191 1.00 0.00 C ATOM 1554 CD2 LEU A 106 1.595 6.798 -0.538 1.00 0.00 C ATOM 0 H LEU A 106 0.887 9.088 4.401 1.00 0.00 H new ATOM 0 HA LEU A 106 -0.909 8.300 2.183 1.00 0.00 H new ATOM 0 HB2 LEU A 106 1.888 8.437 1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 106 1.632 6.762 2.158 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.279 6.657 0.506 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.430 8.496 -1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -0.767 9.099 0.466 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.818 9.403 -0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.152 6.607 -1.515 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.414 7.510 -0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 106 1.977 5.865 -0.124 1.00 0.00 H new ATOM 1566 N GLY A 108 -0.259 5.715 3.328 1.00 0.00 N ATOM 1567 CA GLY A 108 -0.627 4.608 4.264 1.00 0.00 C ATOM 1568 C GLY A 108 -0.074 3.277 3.756 1.00 0.00 C ATOM 1569 O GLY A 108 0.519 3.194 2.699 1.00 0.00 O ATOM 0 H GLY A 108 0.057 5.419 2.405 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.233 4.817 5.258 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.711 4.547 4.357 1.00 0.00 H new ATOM 1573 N ILE A 109 -0.262 2.235 4.522 1.00 0.00 N ATOM 1574 CA ILE A 109 0.240 0.890 4.134 1.00 0.00 C ATOM 1575 C ILE A 109 -0.949 -0.068 3.967 1.00 0.00 C ATOM 1576 O ILE A 109 -2.012 0.144 4.526 1.00 0.00 O ATOM 1577 CB ILE A 109 1.124 0.454 5.316 1.00 0.00 C ATOM 1578 CG1 ILE A 109 2.402 1.291 5.362 1.00 0.00 C ATOM 1579 CG2 ILE A 109 1.507 -1.017 5.176 1.00 0.00 C ATOM 1580 CD1 ILE A 109 2.105 2.695 5.887 1.00 0.00 C ATOM 0 H ILE A 109 -0.752 2.263 5.416 1.00 0.00 H new ATOM 0 HA ILE A 109 0.790 0.893 3.193 1.00 0.00 H new ATOM 0 HB ILE A 109 0.556 0.601 6.235 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.139 0.805 6.002 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.838 1.354 4.365 1.00 0.00 H new ATOM 0 HG21 ILE A 109 2.132 -1.312 6.019 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.605 -1.628 5.162 1.00 0.00 H new ATOM 0 HG23 ILE A 109 2.058 -1.163 4.247 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.027 3.276 5.913 1.00 0.00 H new ATOM 0 HD12 ILE A 109 1.386 3.184 5.230 1.00 0.00 H new ATOM 0 HD13 ILE A 109 1.691 2.627 6.893 1.00 0.00 H new ATOM 1592 N GLY A 110 -0.765 -1.130 3.227 1.00 0.00 N ATOM 1593 CA GLY A 110 -1.865 -2.121 3.046 1.00 0.00 C ATOM 1594 C GLY A 110 -1.794 -3.136 4.188 1.00 0.00 C ATOM 1595 O GLY A 110 -0.722 -3.449 4.675 1.00 0.00 O ATOM 0 H GLY A 110 0.102 -1.354 2.739 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -2.832 -1.618 3.045 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -1.767 -2.625 2.084 1.00 0.00 H new ATOM 1599 N ASN A 111 -2.918 -3.643 4.628 1.00 0.00 N ATOM 1600 CA ASN A 111 -2.901 -4.634 5.746 1.00 0.00 C ATOM 1601 C ASN A 111 -2.076 -5.861 5.350 1.00 0.00 C ATOM 1602 O ASN A 111 -1.357 -6.420 6.156 1.00 0.00 O ATOM 1603 CB ASN A 111 -4.365 -5.014 5.993 1.00 0.00 C ATOM 1604 CG ASN A 111 -4.494 -5.844 7.285 1.00 0.00 C ATOM 1605 OD1 ASN A 111 -5.526 -6.424 7.552 1.00 0.00 O ATOM 1606 ND2 ASN A 111 -3.456 -5.912 8.090 1.00 0.00 N ATOM 0 H ASN A 111 -3.843 -3.415 4.263 1.00 0.00 H new ATOM 0 HA ASN A 111 -2.446 -4.223 6.647 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -4.973 -4.113 6.070 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -4.747 -5.585 5.147 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -2.594 -5.420 7.854 1.00 0.00 H new ATOM 1612 N GLY A 112 -2.161 -6.264 4.109 1.00 0.00 N ATOM 1613 CA GLY A 112 -1.368 -7.435 3.644 1.00 0.00 C ATOM 1614 C GLY A 112 -2.276 -8.530 3.096 1.00 0.00 C ATOM 1615 O GLY A 112 -3.222 -8.953 3.735 1.00 0.00 O ATOM 0 H GLY A 112 -2.748 -5.830 3.397 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -0.667 -7.120 2.872 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -0.776 -7.829 4.470 1.00 0.00 H new ATOM 1619 N THR A 113 -1.964 -9.010 1.921 1.00 0.00 N ATOM 1620 CA THR A 113 -2.766 -10.106 1.312 1.00 0.00 C ATOM 1621 C THR A 113 -2.112 -11.442 1.638 1.00 0.00 C ATOM 1622 O THR A 113 -0.928 -11.622 1.415 1.00 0.00 O ATOM 1623 CB THR A 113 -2.707 -9.869 -0.201 1.00 0.00 C ATOM 1624 OG1 THR A 113 -3.260 -8.597 -0.507 1.00 0.00 O ATOM 1625 CG2 THR A 113 -3.486 -10.973 -0.933 1.00 0.00 C ATOM 0 H THR A 113 -1.181 -8.685 1.354 1.00 0.00 H new ATOM 0 HA THR A 113 -3.791 -10.120 1.683 1.00 0.00 H new ATOM 0 HB THR A 113 -1.668 -9.894 -0.529 1.00 0.00 H new ATOM 0 HG1 THR A 113 -3.948 -8.372 0.154 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.440 -10.799 -2.008 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.045 -11.943 -0.703 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.526 -10.961 -0.607 1.00 0.00 H new ATOM 1633 N GLN A 114 -2.866 -12.384 2.130 1.00 0.00 N ATOM 1634 CA GLN A 114 -2.262 -13.714 2.422 1.00 0.00 C ATOM 1635 C GLN A 114 -2.163 -14.488 1.108 1.00 0.00 C ATOM 1636 O GLN A 114 -3.109 -14.544 0.350 1.00 0.00 O ATOM 1637 CB GLN A 114 -3.214 -14.414 3.403 1.00 0.00 C ATOM 1638 CG GLN A 114 -2.565 -15.704 3.909 1.00 0.00 C ATOM 1639 CD GLN A 114 -1.638 -15.397 5.089 1.00 0.00 C ATOM 1640 OE1 GLN A 114 -1.583 -14.281 5.569 1.00 0.00 O ATOM 1641 NE2 GLN A 114 -0.899 -16.351 5.579 1.00 0.00 N ATOM 0 H GLN A 114 -3.860 -12.294 2.340 1.00 0.00 H new ATOM 0 HA GLN A 114 -1.264 -13.642 2.855 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.440 -13.755 4.241 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.160 -14.639 2.911 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -3.335 -16.412 4.216 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.000 -16.176 3.105 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -0.944 -17.288 5.178 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -0.276 -16.161 6.364 1.00 0.00 H new ATOM 1650 N ILE A 115 -1.033 -15.074 0.814 1.00 0.00 N ATOM 1651 CA ILE A 115 -0.922 -15.839 -0.458 1.00 0.00 C ATOM 1652 C ILE A 115 -1.113 -17.331 -0.155 1.00 0.00 C ATOM 1653 O ILE A 115 -0.428 -17.893 0.686 1.00 0.00 O ATOM 1654 CB ILE A 115 0.479 -15.548 -1.009 1.00 0.00 C ATOM 1655 CG1 ILE A 115 0.587 -14.057 -1.346 1.00 0.00 C ATOM 1656 CG2 ILE A 115 0.719 -16.374 -2.276 1.00 0.00 C ATOM 1657 CD1 ILE A 115 2.008 -13.733 -1.811 1.00 0.00 C ATOM 0 H ILE A 115 -0.193 -15.056 1.392 1.00 0.00 H new ATOM 0 HA ILE A 115 -1.678 -15.555 -1.190 1.00 0.00 H new ATOM 0 HB ILE A 115 1.226 -15.813 -0.261 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.129 -13.798 -2.126 1.00 0.00 H new ATOM 0 HG13 ILE A 115 0.335 -13.458 -0.471 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.716 -16.164 -2.664 1.00 0.00 H new ATOM 0 HG22 ILE A 115 0.638 -17.435 -2.039 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -0.026 -16.112 -3.028 1.00 0.00 H new ATOM 0 HD11 ILE A 115 2.080 -12.672 -2.049 1.00 0.00 H new ATOM 0 HD12 ILE A 115 2.715 -13.975 -1.017 1.00 0.00 H new ATOM 0 HD13 ILE A 115 2.243 -14.321 -2.698 1.00 0.00 H new ATOM 1669 N TYR A 116 -2.047 -17.961 -0.825 1.00 0.00 N ATOM 1670 CA TYR A 116 -2.319 -19.414 -0.589 1.00 0.00 C ATOM 1671 C TYR A 116 -1.733 -20.273 -1.709 1.00 0.00 C ATOM 1672 O TYR A 116 -1.658 -19.854 -2.849 1.00 0.00 O ATOM 1673 CB TYR A 116 -3.851 -19.560 -0.639 1.00 0.00 C ATOM 1674 CG TYR A 116 -4.552 -19.022 0.606 1.00 0.00 C ATOM 1675 CD1 TYR A 116 -3.862 -18.859 1.848 1.00 0.00 C ATOM 1676 CD2 TYR A 116 -5.943 -18.713 0.532 1.00 0.00 C ATOM 1677 CE1 TYR A 116 -4.561 -18.385 2.991 1.00 0.00 C ATOM 1678 CE2 TYR A 116 -6.635 -18.256 1.676 1.00 0.00 C ATOM 1679 CZ TYR A 116 -5.946 -18.088 2.907 1.00 0.00 C ATOM 1680 OH TYR A 116 -6.624 -17.641 4.022 1.00 0.00 O ATOM 0 H TYR A 116 -2.639 -17.526 -1.533 1.00 0.00 H new ATOM 0 HA TYR A 116 -1.879 -19.735 0.355 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -4.230 -19.035 -1.516 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -4.104 -20.613 -0.763 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -2.811 -19.096 1.917 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -6.470 -18.829 -0.404 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -4.037 -18.251 3.926 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -7.690 -18.034 1.614 1.00 0.00 H new ATOM 0 HH TYR A 116 -7.564 -17.483 3.792 1.00 0.00 H new ATOM 1690 N VAL A 117 -1.373 -21.494 -1.398 1.00 0.00 N ATOM 1691 CA VAL A 117 -0.854 -22.408 -2.452 1.00 0.00 C ATOM 1692 C VAL A 117 -1.989 -23.341 -2.871 1.00 0.00 C ATOM 1693 O VAL A 117 -3.013 -23.420 -2.218 1.00 0.00 O ATOM 1694 CB VAL A 117 0.297 -23.203 -1.827 1.00 0.00 C ATOM 1695 CG1 VAL A 117 0.811 -24.240 -2.841 1.00 0.00 C ATOM 1696 CG2 VAL A 117 1.433 -22.246 -1.462 1.00 0.00 C ATOM 0 H VAL A 117 -1.417 -21.893 -0.460 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.499 -21.870 -3.331 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.055 -23.713 -0.930 1.00 0.00 H new ATOM 0 HG11 VAL A 117 1.630 -24.807 -2.398 1.00 0.00 H new ATOM 0 HG12 VAL A 117 0.002 -24.920 -3.108 1.00 0.00 H new ATOM 0 HG13 VAL A 117 1.166 -23.729 -3.736 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.254 -22.808 -1.017 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.785 -21.740 -2.361 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.071 -21.507 -0.748 1.00 0.00 H new ATOM 1706 N ILE A 118 -1.817 -24.025 -3.960 1.00 0.00 N ATOM 1707 CA ILE A 118 -2.879 -24.941 -4.452 1.00 0.00 C ATOM 1708 C ILE A 118 -2.548 -26.399 -4.114 1.00 0.00 C ATOM 1709 O ILE A 118 -1.538 -26.930 -4.536 1.00 0.00 O ATOM 1710 CB ILE A 118 -2.866 -24.710 -5.959 1.00 0.00 C ATOM 1711 CG1 ILE A 118 -3.158 -23.234 -6.274 1.00 0.00 C ATOM 1712 CG2 ILE A 118 -3.911 -25.597 -6.641 1.00 0.00 C ATOM 1713 CD1 ILE A 118 -4.486 -22.820 -5.645 1.00 0.00 C ATOM 0 H ILE A 118 -0.978 -23.990 -4.538 1.00 0.00 H new ATOM 0 HA ILE A 118 -3.852 -24.751 -3.999 1.00 0.00 H new ATOM 0 HB ILE A 118 -1.877 -24.967 -6.338 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -2.353 -22.606 -5.892 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -3.195 -23.084 -7.353 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -3.891 -25.422 -7.717 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.686 -26.644 -6.440 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.901 -25.357 -6.253 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -4.686 -21.773 -5.873 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -5.288 -23.438 -6.048 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -4.434 -22.953 -4.564 1.00 0.00 H new ATOM 1725 N ASP A 119 -3.403 -27.045 -3.364 1.00 0.00 N ATOM 1726 CA ASP A 119 -3.164 -28.473 -2.998 1.00 0.00 C ATOM 1727 C ASP A 119 -4.319 -29.345 -3.518 1.00 0.00 C ATOM 1728 O ASP A 119 -5.441 -28.886 -3.594 1.00 0.00 O ATOM 1729 CB ASP A 119 -3.123 -28.490 -1.469 1.00 0.00 C ATOM 1730 CG ASP A 119 -1.850 -27.794 -0.975 1.00 0.00 C ATOM 1731 OD1 ASP A 119 -0.866 -27.809 -1.698 1.00 0.00 O ATOM 1732 OD2 ASP A 119 -1.880 -27.260 0.121 1.00 0.00 O ATOM 0 H ASP A 119 -4.261 -26.642 -2.987 1.00 0.00 H new ATOM 0 HA ASP A 119 -2.244 -28.866 -3.431 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -4.003 -27.987 -1.067 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -3.150 -29.518 -1.107 1.00 0.00 H new ATOM 1737 N PRO A 120 -4.017 -30.578 -3.864 1.00 0.00 N ATOM 1738 CA PRO A 120 -5.072 -31.490 -4.377 1.00 0.00 C ATOM 1739 C PRO A 120 -6.039 -31.874 -3.254 1.00 0.00 C ATOM 1740 O PRO A 120 -5.657 -31.969 -2.102 1.00 0.00 O ATOM 1741 CB PRO A 120 -4.290 -32.707 -4.868 1.00 0.00 C ATOM 1742 CG PRO A 120 -3.016 -32.686 -4.087 1.00 0.00 C ATOM 1743 CD PRO A 120 -2.702 -31.239 -3.810 1.00 0.00 C ATOM 0 HA PRO A 120 -5.683 -31.041 -5.161 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -4.845 -33.629 -4.695 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -4.098 -32.647 -5.939 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -3.123 -33.244 -3.157 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -2.209 -33.156 -4.649 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -2.230 -31.111 -2.836 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -2.017 -30.829 -4.552 1.00 0.00 H new ATOM 1751 N GLU A 121 -7.288 -32.093 -3.581 1.00 0.00 N ATOM 1752 CA GLU A 121 -8.287 -32.471 -2.536 1.00 0.00 C ATOM 1753 C GLU A 121 -9.075 -33.718 -2.974 1.00 0.00 C ATOM 1754 O GLU A 121 -9.363 -33.876 -4.144 1.00 0.00 O ATOM 1755 CB GLU A 121 -9.216 -31.262 -2.426 1.00 0.00 C ATOM 1756 CG GLU A 121 -8.426 -30.053 -1.919 1.00 0.00 C ATOM 1757 CD GLU A 121 -9.329 -28.817 -1.902 1.00 0.00 C ATOM 1758 OE1 GLU A 121 -10.204 -28.732 -2.749 1.00 0.00 O ATOM 1759 OE2 GLU A 121 -9.130 -27.975 -1.041 1.00 0.00 O ATOM 0 H GLU A 121 -7.659 -32.026 -4.529 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.816 -32.715 -1.584 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.657 -31.040 -3.398 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -10.039 -31.483 -1.746 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -8.044 -30.250 -0.917 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -7.563 -29.876 -2.560 1.00 0.00 H new ATOM 1766 N PRO A 122 -9.408 -34.569 -2.025 1.00 0.00 N ATOM 1767 CA PRO A 122 -10.174 -35.799 -2.354 1.00 0.00 C ATOM 1768 C PRO A 122 -11.612 -35.443 -2.745 1.00 0.00 C ATOM 1769 O PRO A 122 -12.104 -34.378 -2.423 1.00 0.00 O ATOM 1770 CB PRO A 122 -10.143 -36.604 -1.057 1.00 0.00 C ATOM 1771 CG PRO A 122 -9.936 -35.590 0.020 1.00 0.00 C ATOM 1772 CD PRO A 122 -9.119 -34.478 -0.582 1.00 0.00 C ATOM 0 HA PRO A 122 -9.758 -36.350 -3.197 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -11.074 -37.152 -0.910 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -9.338 -37.339 -1.067 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -10.891 -35.214 0.386 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -9.420 -36.031 0.873 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -9.405 -33.507 -0.177 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -8.056 -34.607 -0.378 1.00 0.00 H new ATOM 1780 N CYS A 123 -12.288 -36.330 -3.433 1.00 0.00 N ATOM 1781 CA CYS A 123 -13.698 -36.048 -3.845 1.00 0.00 C ATOM 1782 C CYS A 123 -14.655 -36.339 -2.674 1.00 0.00 C ATOM 1783 O CYS A 123 -14.469 -37.305 -1.962 1.00 0.00 O ATOM 1784 CB CYS A 123 -13.967 -37.002 -5.009 1.00 0.00 C ATOM 1785 SG CYS A 123 -12.878 -36.586 -6.393 1.00 0.00 S ATOM 0 H CYS A 123 -11.925 -37.237 -3.727 1.00 0.00 H new ATOM 0 HA CYS A 123 -13.849 -35.007 -4.130 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -13.797 -38.032 -4.696 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -15.010 -36.930 -5.318 1.00 0.00 H new ATOM 0 HG CYS A 123 -13.104 -37.398 -7.383 1.00 0.00 H new ATOM 1791 N PRO A 124 -15.652 -35.493 -2.499 1.00 0.00 N ATOM 1792 CA PRO A 124 -16.619 -35.695 -1.387 1.00 0.00 C ATOM 1793 C PRO A 124 -17.508 -36.916 -1.648 1.00 0.00 C ATOM 1794 O PRO A 124 -17.868 -37.634 -0.734 1.00 0.00 O ATOM 1795 CB PRO A 124 -17.444 -34.410 -1.387 1.00 0.00 C ATOM 1796 CG PRO A 124 -17.330 -33.877 -2.778 1.00 0.00 C ATOM 1797 CD PRO A 124 -15.980 -34.297 -3.295 1.00 0.00 C ATOM 0 HA PRO A 124 -16.130 -35.883 -0.431 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -18.483 -34.608 -1.124 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -17.062 -33.696 -0.658 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -18.126 -34.272 -3.410 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -17.426 -32.791 -2.785 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -16.013 -34.523 -4.361 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -15.238 -33.511 -3.159 1.00 0.00 H new ATOM 1805 N ASP A 125 -17.867 -37.153 -2.885 1.00 0.00 N ATOM 1806 CA ASP A 125 -18.738 -38.328 -3.203 1.00 0.00 C ATOM 1807 C ASP A 125 -17.992 -39.640 -2.940 1.00 0.00 C ATOM 1808 O ASP A 125 -18.557 -40.594 -2.438 1.00 0.00 O ATOM 1809 CB ASP A 125 -19.089 -38.187 -4.690 1.00 0.00 C ATOM 1810 CG ASP A 125 -17.811 -38.183 -5.534 1.00 0.00 C ATOM 1811 OD1 ASP A 125 -17.194 -37.136 -5.630 1.00 0.00 O ATOM 1812 OD2 ASP A 125 -17.474 -39.226 -6.068 1.00 0.00 O ATOM 0 H ASP A 125 -17.596 -36.585 -3.688 1.00 0.00 H new ATOM 0 HA ASP A 125 -19.632 -38.350 -2.580 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.735 -39.009 -4.999 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.646 -37.264 -4.854 1.00 0.00 H new ATOM 1817 N SER A 126 -16.728 -39.692 -3.277 1.00 0.00 N ATOM 1818 CA SER A 126 -15.938 -40.943 -3.052 1.00 0.00 C ATOM 1819 C SER A 126 -15.812 -41.233 -1.554 1.00 0.00 C ATOM 1820 O SER A 126 -15.749 -42.376 -1.140 1.00 0.00 O ATOM 1821 CB SER A 126 -14.562 -40.666 -3.660 1.00 0.00 C ATOM 1822 OG SER A 126 -13.936 -39.610 -2.943 1.00 0.00 O ATOM 0 H SER A 126 -16.208 -38.922 -3.698 1.00 0.00 H new ATOM 0 HA SER A 126 -16.415 -41.812 -3.504 1.00 0.00 H new ATOM 0 HB2 SER A 126 -13.946 -41.564 -3.619 1.00 0.00 H new ATOM 0 HB3 SER A 126 -14.664 -40.397 -4.711 1.00 0.00 H new ATOM 0 HG SER A 126 -14.588 -38.899 -2.773 1.00 0.00 H new ATOM 1828 N ASP A 127 -15.769 -40.207 -0.742 1.00 0.00 N ATOM 1829 CA ASP A 127 -15.640 -40.417 0.731 1.00 0.00 C ATOM 1830 C ASP A 127 -16.959 -40.087 1.436 1.00 0.00 C ATOM 1831 O ASP A 127 -17.483 -38.996 1.310 1.00 0.00 O ATOM 1832 CB ASP A 127 -14.541 -39.450 1.173 1.00 0.00 C ATOM 1833 CG ASP A 127 -14.150 -39.750 2.621 1.00 0.00 C ATOM 1834 OD1 ASP A 127 -13.786 -40.882 2.893 1.00 0.00 O ATOM 1835 OD2 ASP A 127 -14.219 -38.842 3.433 1.00 0.00 O ATOM 0 H ASP A 127 -15.818 -39.232 -1.037 1.00 0.00 H new ATOM 0 HA ASP A 127 -15.401 -41.451 0.979 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.672 -39.549 0.523 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -14.890 -38.421 1.085 1.00 0.00 H new ATOM 1840 N GLN A 128 -17.492 -41.022 2.182 1.00 0.00 N ATOM 1841 CA GLN A 128 -18.777 -40.768 2.904 1.00 0.00 C ATOM 1842 C GLN A 128 -18.531 -39.837 4.094 1.00 0.00 C ATOM 1843 O GLN A 128 -17.434 -39.756 4.612 1.00 0.00 O ATOM 1844 CB GLN A 128 -19.247 -42.143 3.386 1.00 0.00 C ATOM 1845 CG GLN A 128 -19.552 -43.032 2.179 1.00 0.00 C ATOM 1846 CD GLN A 128 -19.927 -44.436 2.658 1.00 0.00 C ATOM 1847 OE1 GLN A 128 -19.547 -44.845 3.738 1.00 0.00 O ATOM 1848 NE2 GLN A 128 -20.665 -45.196 1.896 1.00 0.00 N ATOM 0 H GLN A 128 -17.093 -41.950 2.322 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.521 -40.288 2.268 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -18.478 -42.605 4.006 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -20.137 -42.038 4.007 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -20.369 -42.605 1.597 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -18.684 -43.081 1.522 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -20.984 -44.853 0.990 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -20.923 -46.133 2.207 1.00 0.00 H new ATOM 1857 N GLU A 129 -19.546 -39.125 4.525 1.00 0.00 N ATOM 1858 CA GLU A 129 -19.388 -38.181 5.682 1.00 0.00 C ATOM 1859 C GLU A 129 -18.217 -37.206 5.436 1.00 0.00 C ATOM 1860 O GLU A 129 -17.363 -37.050 6.287 1.00 0.00 O ATOM 1861 CB GLU A 129 -19.105 -39.070 6.899 1.00 0.00 C ATOM 1862 CG GLU A 129 -20.320 -39.957 7.176 1.00 0.00 C ATOM 1863 CD GLU A 129 -20.003 -40.913 8.328 1.00 0.00 C ATOM 1864 OE1 GLU A 129 -19.071 -41.688 8.189 1.00 0.00 O ATOM 1865 OE2 GLU A 129 -20.698 -40.854 9.329 1.00 0.00 O ATOM 0 H GLU A 129 -20.483 -39.156 4.124 1.00 0.00 H new ATOM 0 HA GLU A 129 -20.278 -37.569 5.827 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -18.225 -39.687 6.715 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -18.886 -38.453 7.770 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -21.183 -39.341 7.428 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -20.582 -40.523 6.282 1.00 0.00 H new ATOM 1872 N PRO A 130 -18.206 -36.578 4.276 1.00 0.00 N ATOM 1873 CA PRO A 130 -17.114 -35.625 3.948 1.00 0.00 C ATOM 1874 C PRO A 130 -17.229 -34.361 4.804 1.00 0.00 C ATOM 1875 O PRO A 130 -18.232 -34.130 5.452 1.00 0.00 O ATOM 1876 CB PRO A 130 -17.340 -35.308 2.471 1.00 0.00 C ATOM 1877 CG PRO A 130 -18.792 -35.571 2.240 1.00 0.00 C ATOM 1878 CD PRO A 130 -19.185 -36.680 3.178 1.00 0.00 C ATOM 0 HA PRO A 130 -16.121 -36.031 4.142 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -17.085 -34.272 2.246 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -16.718 -35.936 1.832 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -19.383 -34.675 2.431 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -18.973 -35.858 1.204 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -20.206 -36.555 3.540 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -19.137 -37.653 2.689 1.00 0.00 H new ATOM 1886 N LYS A 131 -16.206 -33.543 4.809 1.00 0.00 N ATOM 1887 CA LYS A 131 -16.242 -32.285 5.624 1.00 0.00 C ATOM 1888 C LYS A 131 -17.453 -31.429 5.239 1.00 0.00 C ATOM 1889 O LYS A 131 -18.349 -31.210 6.031 1.00 0.00 O ATOM 1890 CB LYS A 131 -14.943 -31.547 5.287 1.00 0.00 C ATOM 1891 CG LYS A 131 -13.741 -32.375 5.751 1.00 0.00 C ATOM 1892 CD LYS A 131 -12.445 -31.608 5.465 1.00 0.00 C ATOM 1893 CE LYS A 131 -11.779 -32.170 4.204 1.00 0.00 C ATOM 1894 NZ LYS A 131 -12.740 -31.884 3.101 1.00 0.00 N ATOM 0 H LYS A 131 -15.345 -33.691 4.283 1.00 0.00 H new ATOM 0 HA LYS A 131 -16.328 -32.497 6.690 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -14.882 -31.371 4.213 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -14.932 -30.571 5.771 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -13.822 -32.586 6.817 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -13.728 -33.335 5.236 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -12.660 -30.548 5.332 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -11.767 -31.692 6.314 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -10.815 -31.695 4.021 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -11.594 -33.240 4.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -12.245 -31.935 2.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -13.508 -32.585 3.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -13.138 -30.931 3.226 1.00 0.00 H new TER 1908 LYS A 131 HETATM 1909 C1 NAG A 132 -3.532 -5.395 9.444 1.00 0.00 C HETATM 1910 C2 NAG A 132 -3.164 -3.915 9.460 1.00 0.00 C HETATM 1911 C3 NAG A 132 -3.245 -3.368 10.881 1.00 0.00 C HETATM 1912 C4 NAG A 132 -4.603 -3.689 11.510 1.00 0.00 C HETATM 1913 C5 NAG A 132 -4.927 -5.178 11.366 1.00 0.00 C HETATM 1914 C6 NAG A 132 -6.329 -5.513 11.842 1.00 0.00 C HETATM 1915 C7 NAG A 132 -1.510 -2.619 8.320 1.00 0.00 C HETATM 1916 C8 NAG A 132 -0.032 -2.309 8.130 1.00 0.00 C HETATM 1917 N2 NAG A 132 -1.823 -3.729 8.938 1.00 0.00 N HETATM 1918 O3 NAG A 132 -3.049 -1.962 10.859 1.00 0.00 O HETATM 1919 O4 NAG A 132 -4.580 -3.340 12.909 1.00 0.00 O HETATM 1920 O5 NAG A 132 -4.839 -5.584 9.987 1.00 0.00 O HETATM 1921 O6 NAG A 132 -6.856 -6.623 11.078 1.00 0.00 O HETATM 1922 O7 NAG A 132 -2.371 -1.866 7.912 1.00 0.00 O HETATM 0 HO3 NAG A 132 -3.788 -1.521 11.328 1.00 0.00 H new HETATM 0 HN2 NAG A 132 -1.124 -4.463 9.053 1.00 0.00 H new HETATM 0 H83 NAG A 132 0.454 -2.241 9.103 1.00 0.00 H new HETATM 0 H82 NAG A 132 0.434 -3.103 7.546 1.00 0.00 H new HETATM 0 H81 NAG A 132 0.076 -1.361 7.604 1.00 0.00 H new HETATM 0 H62 NAG A 132 -6.312 -5.765 12.902 1.00 0.00 H new HETATM 0 H61 NAG A 132 -6.977 -4.644 11.732 1.00 0.00 H new HETATM 0 H5 NAG A 132 -4.198 -5.705 11.982 1.00 0.00 H new HETATM 0 H4 NAG A 132 -5.370 -3.111 10.994 1.00 0.00 H new HETATM 0 H3 NAG A 132 -2.467 -3.840 11.481 1.00 0.00 H new HETATM 0 H2 NAG A 132 -3.870 -3.373 8.830 1.00 0.00 H new HETATM 1935 C1 NAG A 133 -5.261 -2.189 13.277 1.00 0.00 C HETATM 1936 C2 NAG A 133 -5.211 -2.035 14.797 1.00 0.00 C HETATM 1937 C3 NAG A 133 -5.815 -0.697 15.228 1.00 0.00 C HETATM 1938 C4 NAG A 133 -5.196 0.452 14.441 1.00 0.00 C HETATM 1939 C5 NAG A 133 -5.258 0.171 12.944 1.00 0.00 C HETATM 1940 C6 NAG A 133 -4.543 1.239 12.141 1.00 0.00 C HETATM 1941 C7 NAG A 133 -7.225 -3.179 15.439 1.00 0.00 C HETATM 1942 C8 NAG A 133 -7.896 -4.221 14.560 1.00 0.00 C HETATM 1943 N2 NAG A 133 -5.915 -3.135 15.436 1.00 0.00 N HETATM 1944 O3 NAG A 133 -5.591 -0.497 16.615 1.00 0.00 O HETATM 1945 O4 NAG A 133 -5.904 1.673 14.730 1.00 0.00 O HETATM 1946 O5 NAG A 133 -4.617 -1.081 12.645 1.00 0.00 O HETATM 1947 O6 NAG A 133 -5.374 1.751 11.111 1.00 0.00 O HETATM 1948 O7 NAG A 133 -7.876 -2.414 16.121 1.00 0.00 O HETATM 0 HO6 NAG A 133 -4.888 2.439 10.610 1.00 0.00 H new HETATM 0 HO3 NAG A 133 -6.244 -1.016 17.130 1.00 0.00 H new HETATM 0 HN2 NAG A 133 -5.384 -3.880 15.887 1.00 0.00 H new HETATM 0 H83 NAG A 133 -7.617 -4.054 13.520 1.00 0.00 H new HETATM 0 H82 NAG A 133 -7.575 -5.217 14.866 1.00 0.00 H new HETATM 0 H81 NAG A 133 -8.978 -4.141 14.663 1.00 0.00 H new HETATM 0 H62 NAG A 133 -4.237 2.050 12.802 1.00 0.00 H new HETATM 0 H61 NAG A 133 -3.635 0.823 11.705 1.00 0.00 H new HETATM 0 H5 NAG A 133 -6.314 0.151 12.675 1.00 0.00 H new HETATM 0 H4 NAG A 133 -4.152 0.553 14.736 1.00 0.00 H new HETATM 0 H3 NAG A 133 -6.886 -0.720 15.028 1.00 0.00 H new HETATM 0 H2 NAG A 133 -4.167 -2.055 15.110 1.00 0.00 H new HETATM 1962 C1 FUL A 134 -7.376 -7.635 11.891 1.00 0.00 C HETATM 1963 C2 FUL A 134 -8.598 -7.093 12.637 1.00 0.00 C HETATM 1964 O2 FUL A 134 -9.620 -6.728 11.719 1.00 0.00 O HETATM 1965 C3 FUL A 134 -9.136 -8.143 13.604 1.00 0.00 C HETATM 1966 O3 FUL A 134 -10.196 -7.586 14.367 1.00 0.00 O HETATM 1967 C4 FUL A 134 -8.024 -8.608 14.538 1.00 0.00 C HETATM 1968 O4 FUL A 134 -7.660 -7.541 15.401 1.00 0.00 O HETATM 1969 C5 FUL A 134 -6.801 -9.054 13.741 1.00 0.00 C HETATM 1970 C6 FUL A 134 -5.617 -9.365 14.635 1.00 0.00 C HETATM 1971 O5 FUL A 134 -6.390 -8.010 12.843 1.00 0.00 O HETATM 0 HO4 FUL A 134 -7.347 -7.904 16.256 1.00 0.00 H new HETATM 0 HO3 FUL A 134 -9.837 -7.200 15.193 1.00 0.00 H new HETATM 0 HO2 FUL A 134 -9.216 -6.478 10.862 1.00 0.00 H new HETATM 0 H63 FUL A 134 -5.345 -8.474 15.202 1.00 0.00 H new HETATM 0 H62 FUL A 134 -5.882 -10.167 15.324 1.00 0.00 H new HETATM 0 H61 FUL A 134 -4.771 -9.678 14.023 1.00 0.00 H new HETATM 0 H5 FUL A 134 -7.095 -9.954 13.202 1.00 0.00 H new HETATM 0 H4 FUL A 134 -8.387 -9.454 15.121 1.00 0.00 H new HETATM 0 H3 FUL A 134 -9.505 -8.997 13.036 1.00 0.00 H new HETATM 0 H2 FUL A 134 -8.291 -6.210 13.198 1.00 0.00 H new HETATM 1983 C1 BMA A 135 -5.376 2.466 15.736 1.00 0.00 C HETATM 1984 C2 BMA A 135 -4.730 3.703 15.123 1.00 0.00 C HETATM 1985 C3 BMA A 135 -4.242 4.645 16.218 1.00 0.00 C HETATM 1986 C4 BMA A 135 -5.374 4.950 17.193 1.00 0.00 C HETATM 1987 C5 BMA A 135 -6.004 3.656 17.705 1.00 0.00 C HETATM 1988 C6 BMA A 135 -7.214 3.915 18.581 1.00 0.00 C HETATM 1989 O2 BMA A 135 -5.671 4.376 14.299 1.00 0.00 O HETATM 1990 O3 BMA A 135 -3.775 5.853 15.637 1.00 0.00 O HETATM 1991 O4 BMA A 135 -4.867 5.695 18.290 1.00 0.00 O HETATM 1992 O5 BMA A 135 -6.448 2.844 16.602 1.00 0.00 O HETATM 1993 O6 BMA A 135 -6.826 4.349 19.876 1.00 0.00 O HETATM 0 HO6 BMA A 135 -7.625 4.511 20.420 1.00 0.00 H new HETATM 0 HO4 BMA A 135 -5.286 5.383 19.119 1.00 0.00 H new HETATM 0 HO3 BMA A 135 -3.464 6.457 16.343 1.00 0.00 H new HETATM 0 HO2 BMA A 135 -5.530 5.344 14.365 1.00 0.00 H new HETATM 0 H62 BMA A 135 -7.848 4.670 18.116 1.00 0.00 H new HETATM 0 H61 BMA A 135 -7.809 3.005 18.662 1.00 0.00 H new HETATM 0 H5 BMA A 135 -5.233 3.151 18.287 1.00 0.00 H new HETATM 0 H4 BMA A 135 -6.137 5.530 16.673 1.00 0.00 H new HETATM 0 H3 BMA A 135 -3.428 4.164 16.760 1.00 0.00 H new HETATM 0 H2 BMA A 135 -3.876 3.391 14.521 1.00 0.00 H new HETATM 2005 C1 NAG A 136 0.944 -7.381 -12.988 1.00 0.00 C HETATM 2006 C2 NAG A 136 -0.451 -7.982 -13.078 1.00 0.00 C HETATM 2007 C3 NAG A 136 -0.408 -9.323 -13.795 1.00 0.00 C HETATM 2008 C4 NAG A 136 0.310 -9.209 -15.137 1.00 0.00 C HETATM 2009 C5 NAG A 136 1.672 -8.505 -14.971 1.00 0.00 C HETATM 2010 C6 NAG A 136 2.333 -8.201 -16.310 1.00 0.00 C HETATM 2011 C7 NAG A 136 -2.287 -8.176 -11.565 1.00 0.00 C HETATM 2012 C8 NAG A 136 -2.822 -9.026 -10.423 1.00 0.00 C HETATM 2013 N2 NAG A 136 -0.995 -8.160 -11.746 1.00 0.00 N HETATM 2014 O3 NAG A 136 -1.731 -9.792 -14.005 1.00 0.00 O HETATM 2015 O4 NAG A 136 0.432 -10.536 -15.713 1.00 0.00 O HETATM 2016 O5 NAG A 136 1.510 -7.244 -14.292 1.00 0.00 O HETATM 2017 O6 NAG A 136 3.002 -6.919 -16.264 1.00 0.00 O HETATM 2018 O7 NAG A 136 -3.031 -7.537 -12.282 1.00 0.00 O HETATM 0 HO3 NAG A 136 -1.702 -10.655 -14.468 1.00 0.00 H new HETATM 0 HN2 NAG A 136 -0.367 -8.273 -10.950 1.00 0.00 H new HETATM 0 H83 NAG A 136 -2.539 -10.067 -10.581 1.00 0.00 H new HETATM 0 H82 NAG A 136 -2.402 -8.675 -9.480 1.00 0.00 H new HETATM 0 H81 NAG A 136 -3.909 -8.947 -10.388 1.00 0.00 H new HETATM 0 H62 NAG A 136 3.051 -8.984 -16.554 1.00 0.00 H new HETATM 0 H61 NAG A 136 1.583 -8.198 -17.101 1.00 0.00 H new HETATM 0 H5 NAG A 136 2.296 -9.191 -14.399 1.00 0.00 H new HETATM 0 H4 NAG A 136 -0.268 -8.590 -15.823 1.00 0.00 H new HETATM 0 H3 NAG A 136 0.143 -10.026 -13.170 1.00 0.00 H new HETATM 0 H2 NAG A 136 -1.087 -7.302 -13.644 1.00 0.00 H new HETATM 2031 C1 NAG A 137 1.622 -10.959 -16.286 1.00 0.00 C HETATM 2032 C2 NAG A 137 1.678 -12.481 -16.276 1.00 0.00 C HETATM 2033 C3 NAG A 137 2.942 -12.964 -16.979 1.00 0.00 C HETATM 2034 C4 NAG A 137 3.056 -12.337 -18.366 1.00 0.00 C HETATM 2035 C5 NAG A 137 2.898 -10.819 -18.291 1.00 0.00 C HETATM 2036 C6 NAG A 137 2.858 -10.178 -19.664 1.00 0.00 C HETATM 2037 C7 NAG A 137 1.347 -14.210 -14.664 1.00 0.00 C HETATM 2038 C8 NAG A 137 1.673 -14.750 -13.281 1.00 0.00 C HETATM 2039 N2 NAG A 137 1.659 -12.967 -14.910 1.00 0.00 N HETATM 2040 O3 NAG A 137 2.910 -14.378 -17.098 1.00 0.00 O HETATM 2041 O4 NAG A 137 4.340 -12.658 -18.932 1.00 0.00 O HETATM 2042 O5 NAG A 137 1.668 -10.471 -17.627 1.00 0.00 O HETATM 2043 O6 NAG A 137 1.905 -10.817 -20.501 1.00 0.00 O HETATM 2044 O7 NAG A 137 0.816 -14.905 -15.507 1.00 0.00 O HETATM 0 HO6 NAG A 137 1.898 -10.383 -21.380 1.00 0.00 H new HETATM 0 HO3 NAG A 137 2.011 -14.704 -16.884 1.00 0.00 H new HETATM 0 HN2 NAG A 137 1.890 -12.337 -14.141 1.00 0.00 H new HETATM 0 H83 NAG A 137 2.747 -14.681 -13.107 1.00 0.00 H new HETATM 0 H82 NAG A 137 1.145 -14.164 -12.528 1.00 0.00 H new HETATM 0 H81 NAG A 137 1.361 -15.792 -13.214 1.00 0.00 H new HETATM 0 H62 NAG A 137 2.611 -9.121 -19.568 1.00 0.00 H new HETATM 0 H61 NAG A 137 3.845 -10.234 -20.123 1.00 0.00 H new HETATM 0 H5 NAG A 137 3.764 -10.452 -17.740 1.00 0.00 H new HETATM 0 H4 NAG A 137 2.261 -12.738 -18.995 1.00 0.00 H new HETATM 0 H3 NAG A 137 3.807 -12.665 -16.387 1.00 0.00 H new HETATM 0 H2 NAG A 137 0.808 -12.869 -16.806 1.00 0.00 H new HETATM 2058 C1 FUC A 138 3.056 -6.254 -17.504 1.00 0.00 C HETATM 2059 C2 FUC A 138 1.764 -5.478 -17.694 1.00 0.00 C HETATM 2060 C3 FUC A 138 1.584 -4.618 -16.443 1.00 0.00 C HETATM 2061 C4 FUC A 138 2.817 -3.718 -16.231 1.00 0.00 C HETATM 2062 C5 FUC A 138 4.143 -4.493 -16.350 1.00 0.00 C HETATM 2063 C6 FUC A 138 5.346 -3.578 -16.474 1.00 0.00 C HETATM 2064 O2 FUC A 138 0.665 -6.363 -17.854 1.00 0.00 O HETATM 2065 O3 FUC A 138 0.427 -3.808 -16.587 1.00 0.00 O HETATM 2066 O4 FUC A 138 2.803 -2.682 -17.202 1.00 0.00 O HETATM 2067 O5 FUC A 138 4.114 -5.319 -17.527 1.00 0.00 O HETATM 0 HO4 FUC A 138 3.234 -1.883 -16.834 1.00 0.00 H new HETATM 0 HO3 FUC A 138 0.686 -2.923 -16.918 1.00 0.00 H new HETATM 0 HO2 FUC A 138 0.279 -6.567 -16.977 1.00 0.00 H new HETATM 0 H63 FUC A 138 5.241 -2.958 -17.364 1.00 0.00 H new HETATM 0 H62 FUC A 138 5.410 -2.940 -15.593 1.00 0.00 H new HETATM 0 H61 FUC A 138 6.253 -4.178 -16.555 1.00 0.00 H new HETATM 0 H5 FUC A 138 4.240 -5.083 -15.438 1.00 0.00 H new HETATM 0 H4 FUC A 138 2.760 -3.316 -15.220 1.00 0.00 H new HETATM 0 H3 FUC A 138 1.470 -5.272 -15.579 1.00 0.00 H new HETATM 0 H2 FUC A 138 1.808 -4.861 -18.591 1.00 0.00 H new HETATM 2079 C1 BMA A 139 4.359 -12.933 -20.289 1.00 0.00 C HETATM 2080 C2 BMA A 139 5.794 -12.876 -20.801 1.00 0.00 C HETATM 2081 C3 BMA A 139 5.850 -13.282 -22.269 1.00 0.00 C HETATM 2082 C4 BMA A 139 5.165 -14.630 -22.471 1.00 0.00 C HETATM 2083 C5 BMA A 139 3.762 -14.615 -21.868 1.00 0.00 C HETATM 2084 C6 BMA A 139 3.094 -15.974 -21.937 1.00 0.00 C HETATM 2085 O2 BMA A 139 6.610 -13.749 -20.033 1.00 0.00 O HETATM 2086 O3 BMA A 139 7.203 -13.367 -22.690 1.00 0.00 O HETATM 2087 O4 BMA A 139 5.081 -14.917 -23.859 1.00 0.00 O HETATM 2088 O5 BMA A 139 3.818 -14.242 -20.479 1.00 0.00 O HETATM 2089 O6 BMA A 139 3.706 -16.893 -21.045 1.00 0.00 O HETATM 0 HO6 BMA A 139 4.112 -16.404 -20.299 1.00 0.00 H new HETATM 0 HO4 BMA A 139 5.109 -15.887 -23.995 1.00 0.00 H new HETATM 0 HO3 BMA A 139 7.236 -13.630 -23.634 1.00 0.00 H new HETATM 0 HO2 BMA A 139 7.318 -14.119 -20.601 1.00 0.00 H new HETATM 0 H62 BMA A 139 2.036 -15.875 -21.692 1.00 0.00 H new HETATM 0 H61 BMA A 139 3.151 -16.359 -22.955 1.00 0.00 H new HETATM 0 H5 BMA A 139 3.187 -13.896 -22.451 1.00 0.00 H new HETATM 0 H4 BMA A 139 5.753 -15.399 -21.970 1.00 0.00 H new HETATM 0 H3 BMA A 139 5.331 -12.530 -22.863 1.00 0.00 H new HETATM 0 H2 BMA A 139 6.161 -11.854 -20.705 1.00 0.00 H new