USER MOD reduce.3.24.130724 H: found=0, std=0, add=1242, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1246 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 34 LYS NZ :NH3+ -125:sc= -8.48! (180deg=-8.17!) USER MOD Set 1.2: B 58 MET CE :methyl 173:sc= -1.53 (180deg=-0.00282) USER MOD Set 2.1: A 34 LYS NZ :NH3+ -126:sc= -8.24! (180deg=-7.92!) USER MOD Set 2.2: A 58 MET CE :methyl 173:sc= -1.63 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 162:sc= 0 (180deg=-0.565) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -1.1 X(o=-1.1,f=-1.3) USER MOD Single : A 18 HIS : no HE2:sc= -0.458 X(o=-0.46,f=-0.54) USER MOD Single : A 19 SER OG : rot -101:sc= 0.94! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -150:sc= -0.743 (180deg=-1.43) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -129:sc= -2.94! (180deg=-4.7!) USER MOD Single : A 31 LYS NZ :NH3+ -154:sc= -0.123 (180deg=-0.682) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 39 THR OG1 : rot 106:sc= 0.56 USER MOD Single : A 42 SER OG : rot 105:sc= 1.2 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.0329 K(o=-0.033,f=-0.65) USER MOD Single : A 49 LYS NZ :NH3+ -129:sc= -2.59 (180deg=-5.77!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -161:sc= -0.0255 (180deg=-0.381) USER MOD Single : A 64 ASN :FLIP amide:sc= -5.43 F(o=-12!,f=-5.4) USER MOD Single : A 72 GLN : amide:sc= -1.63 K(o=-1.6,f=-5.7!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.00349 USER MOD Single : A 85 CYS SG : rot -30:sc= -0.853! USER MOD Single : A 86 ASN : amide:sc= -0.462 X(o=-0.46,f=-0.83) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B 8 MET CE :methyl 163:sc= 0 (180deg=-0.45) USER MOD Single : B 10 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 16 HIS : no HD1:sc= -1.07 X(o=-1.1,f=-1.3) USER MOD Single : B 18 HIS : no HE2:sc= -0.341 X(o=-0.34,f=-0.52) USER MOD Single : B 19 SER OG : rot -113:sc= 1.03 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ -145:sc= -0.741 (180deg=-1.36) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ -129:sc= -3.14 (180deg=-4.45!) USER MOD Single : B 31 LYS NZ :NH3+ -150:sc= -0.116 (180deg=-0.835) USER MOD Single : B 38 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : B 39 THR OG1 : rot 106:sc= 0.546 USER MOD Single : B 42 SER OG : rot 98:sc= 1.15 USER MOD Single : B 43 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.0558 K(o=-0.056,f=-0.68) USER MOD Single : B 49 LYS NZ :NH3+ -130:sc= -2.46 (180deg=-5.62!) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 LYS NZ :NH3+ -160:sc= -0.0732 (180deg=-0.435) USER MOD Single : B 64 ASN :FLIP amide:sc= -5.71 F(o=-12!,f=-5.7) USER MOD Single : B 72 GLN : amide:sc= -1.59 K(o=-1.6,f=-5.5!) USER MOD Single : B 82 THR OG1 : rot 180:sc= 0.00852 USER MOD Single : B 85 CYS SG : rot -30:sc= -0.834! USER MOD Single : B 86 ASN : amide:sc= -0.454 X(o=-0.45,f=-0.8) USER MOD ----------------------------------------------------------------- ATOM 21 N GLU A 3 58.422 -0.261 -7.397 1.00 0.00 N ATOM 22 CA GLU A 3 58.815 -1.138 -6.261 1.00 0.00 C ATOM 23 C GLU A 3 60.081 -0.601 -5.582 1.00 0.00 C ATOM 24 O GLU A 3 60.135 -0.470 -4.376 1.00 0.00 O ATOM 25 CB GLU A 3 59.074 -2.556 -6.777 1.00 0.00 C ATOM 26 CG GLU A 3 57.745 -3.185 -7.194 1.00 0.00 C ATOM 27 CD GLU A 3 58.001 -4.549 -7.833 1.00 0.00 C ATOM 28 OE1 GLU A 3 58.235 -4.585 -9.030 1.00 0.00 O ATOM 29 OE2 GLU A 3 57.959 -5.534 -7.115 1.00 0.00 O ATOM 0 HA GLU A 3 58.005 -1.153 -5.532 1.00 0.00 H new ATOM 0 HB2 GLU A 3 59.760 -2.529 -7.624 1.00 0.00 H new ATOM 0 HB3 GLU A 3 59.548 -3.158 -6.002 1.00 0.00 H new ATOM 0 HG2 GLU A 3 57.095 -3.295 -6.326 1.00 0.00 H new ATOM 0 HG3 GLU A 3 57.228 -2.533 -7.899 1.00 0.00 H new ATOM 36 N LEU A 4 61.108 -0.306 -6.339 1.00 0.00 N ATOM 37 CA LEU A 4 62.366 0.206 -5.715 1.00 0.00 C ATOM 38 C LEU A 4 62.164 1.625 -5.165 1.00 0.00 C ATOM 39 O LEU A 4 62.637 1.956 -4.094 1.00 0.00 O ATOM 40 CB LEU A 4 63.499 0.218 -6.757 1.00 0.00 C ATOM 41 CG LEU A 4 63.951 -1.225 -7.094 1.00 0.00 C ATOM 42 CD1 LEU A 4 63.036 -1.843 -8.165 1.00 0.00 C ATOM 43 CD2 LEU A 4 65.392 -1.206 -7.624 1.00 0.00 C ATOM 0 H LEU A 4 61.130 -0.397 -7.355 1.00 0.00 H new ATOM 0 HA LEU A 4 62.632 -0.455 -4.890 1.00 0.00 H new ATOM 0 HB2 LEU A 4 63.160 0.719 -7.664 1.00 0.00 H new ATOM 0 HB3 LEU A 4 64.345 0.789 -6.375 1.00 0.00 H new ATOM 0 HG LEU A 4 63.894 -1.823 -6.185 1.00 0.00 H new ATOM 0 HD11 LEU A 4 63.370 -2.856 -8.388 1.00 0.00 H new ATOM 0 HD12 LEU A 4 62.011 -1.872 -7.795 1.00 0.00 H new ATOM 0 HD13 LEU A 4 63.078 -1.239 -9.072 1.00 0.00 H new ATOM 0 HD21 LEU A 4 65.706 -2.223 -7.860 1.00 0.00 H new ATOM 0 HD22 LEU A 4 65.441 -0.593 -8.524 1.00 0.00 H new ATOM 0 HD23 LEU A 4 66.053 -0.789 -6.865 1.00 0.00 H new ATOM 55 N GLU A 5 61.480 2.471 -5.883 1.00 0.00 N ATOM 56 CA GLU A 5 61.275 3.863 -5.386 1.00 0.00 C ATOM 57 C GLU A 5 60.498 3.832 -4.066 1.00 0.00 C ATOM 58 O GLU A 5 60.833 4.516 -3.118 1.00 0.00 O ATOM 59 CB GLU A 5 60.492 4.660 -6.430 1.00 0.00 C ATOM 60 CG GLU A 5 60.311 6.104 -5.951 1.00 0.00 C ATOM 61 CD GLU A 5 59.543 6.900 -7.008 1.00 0.00 C ATOM 62 OE1 GLU A 5 59.358 6.378 -8.094 1.00 0.00 O ATOM 63 OE2 GLU A 5 59.152 8.018 -6.712 1.00 0.00 O ATOM 0 H GLU A 5 61.056 2.262 -6.787 1.00 0.00 H new ATOM 0 HA GLU A 5 62.242 4.337 -5.217 1.00 0.00 H new ATOM 0 HB2 GLU A 5 61.021 4.647 -7.383 1.00 0.00 H new ATOM 0 HB3 GLU A 5 59.519 4.198 -6.599 1.00 0.00 H new ATOM 0 HG2 GLU A 5 59.770 6.119 -5.005 1.00 0.00 H new ATOM 0 HG3 GLU A 5 61.283 6.563 -5.770 1.00 0.00 H new ATOM 70 N THR A 6 59.460 3.045 -4.007 1.00 0.00 N ATOM 71 CA THR A 6 58.642 2.956 -2.764 1.00 0.00 C ATOM 72 C THR A 6 59.513 2.472 -1.603 1.00 0.00 C ATOM 73 O THR A 6 59.387 2.928 -0.482 1.00 0.00 O ATOM 74 CB THR A 6 57.494 1.969 -2.989 1.00 0.00 C ATOM 75 OG1 THR A 6 56.694 2.422 -4.071 1.00 0.00 O ATOM 76 CG2 THR A 6 56.630 1.894 -1.733 1.00 0.00 C ATOM 0 H THR A 6 59.140 2.454 -4.774 1.00 0.00 H new ATOM 0 HA THR A 6 58.240 3.940 -2.522 1.00 0.00 H new ATOM 0 HB THR A 6 57.903 0.984 -3.213 1.00 0.00 H new ATOM 0 HG1 THR A 6 55.958 1.792 -4.220 1.00 0.00 H new ATOM 0 HG21 THR A 6 55.813 1.191 -1.895 1.00 0.00 H new ATOM 0 HG22 THR A 6 57.238 1.557 -0.893 1.00 0.00 H new ATOM 0 HG23 THR A 6 56.222 2.880 -1.513 1.00 0.00 H new ATOM 84 N ALA A 7 60.380 1.534 -1.863 1.00 0.00 N ATOM 85 CA ALA A 7 61.253 0.987 -0.785 1.00 0.00 C ATOM 86 C ALA A 7 62.118 2.097 -0.182 1.00 0.00 C ATOM 87 O ALA A 7 62.325 2.140 1.007 1.00 0.00 O ATOM 88 CB ALA A 7 62.155 -0.112 -1.365 1.00 0.00 C ATOM 0 H ALA A 7 60.523 1.119 -2.784 1.00 0.00 H new ATOM 0 HA ALA A 7 60.623 0.569 0.000 1.00 0.00 H new ATOM 0 HB1 ALA A 7 62.793 -0.512 -0.577 1.00 0.00 H new ATOM 0 HB2 ALA A 7 61.537 -0.912 -1.773 1.00 0.00 H new ATOM 0 HB3 ALA A 7 62.776 0.307 -2.157 1.00 0.00 H new ATOM 94 N MET A 8 62.633 2.985 -0.984 1.00 0.00 N ATOM 95 CA MET A 8 63.494 4.075 -0.429 1.00 0.00 C ATOM 96 C MET A 8 62.701 4.922 0.579 1.00 0.00 C ATOM 97 O MET A 8 63.204 5.283 1.625 1.00 0.00 O ATOM 98 CB MET A 8 63.978 4.970 -1.595 1.00 0.00 C ATOM 99 CG MET A 8 65.360 4.509 -2.108 1.00 0.00 C ATOM 100 SD MET A 8 66.657 5.440 -1.242 1.00 0.00 S ATOM 101 CE MET A 8 67.972 4.198 -1.332 1.00 0.00 C ATOM 0 H MET A 8 62.499 3.007 -1.995 1.00 0.00 H new ATOM 0 HA MET A 8 64.349 3.635 0.085 1.00 0.00 H new ATOM 0 HB2 MET A 8 63.254 4.936 -2.409 1.00 0.00 H new ATOM 0 HB3 MET A 8 64.036 6.007 -1.263 1.00 0.00 H new ATOM 0 HG2 MET A 8 65.487 3.440 -1.937 1.00 0.00 H new ATOM 0 HG3 MET A 8 65.435 4.671 -3.183 1.00 0.00 H new ATOM 0 HE1 MET A 8 68.935 4.674 -1.149 1.00 0.00 H new ATOM 0 HE2 MET A 8 67.798 3.429 -0.579 1.00 0.00 H new ATOM 0 HE3 MET A 8 67.975 3.742 -2.322 1.00 0.00 H new ATOM 111 N GLU A 9 61.479 5.250 0.274 1.00 0.00 N ATOM 112 CA GLU A 9 60.675 6.086 1.216 1.00 0.00 C ATOM 113 C GLU A 9 60.472 5.337 2.538 1.00 0.00 C ATOM 114 O GLU A 9 60.534 5.912 3.610 1.00 0.00 O ATOM 115 CB GLU A 9 59.320 6.389 0.567 1.00 0.00 C ATOM 116 CG GLU A 9 58.470 7.259 1.499 1.00 0.00 C ATOM 117 CD GLU A 9 57.125 7.558 0.830 1.00 0.00 C ATOM 118 OE1 GLU A 9 56.971 7.205 -0.329 1.00 0.00 O ATOM 119 OE2 GLU A 9 56.272 8.128 1.488 1.00 0.00 O ATOM 0 H GLU A 9 60.999 4.978 -0.584 1.00 0.00 H new ATOM 0 HA GLU A 9 61.199 7.018 1.426 1.00 0.00 H new ATOM 0 HB2 GLU A 9 59.470 6.901 -0.384 1.00 0.00 H new ATOM 0 HB3 GLU A 9 58.797 5.458 0.349 1.00 0.00 H new ATOM 0 HG2 GLU A 9 58.311 6.747 2.448 1.00 0.00 H new ATOM 0 HG3 GLU A 9 58.992 8.189 1.723 1.00 0.00 H new ATOM 126 N THR A 10 60.228 4.059 2.466 1.00 0.00 N ATOM 127 CA THR A 10 60.013 3.259 3.708 1.00 0.00 C ATOM 128 C THR A 10 61.289 3.223 4.550 1.00 0.00 C ATOM 129 O THR A 10 61.240 3.286 5.759 1.00 0.00 O ATOM 130 CB THR A 10 59.611 1.825 3.333 1.00 0.00 C ATOM 131 OG1 THR A 10 58.410 1.856 2.575 1.00 0.00 O ATOM 132 CG2 THR A 10 59.386 0.991 4.602 1.00 0.00 C ATOM 0 H THR A 10 60.167 3.529 1.596 1.00 0.00 H new ATOM 0 HA THR A 10 59.219 3.726 4.290 1.00 0.00 H new ATOM 0 HB THR A 10 60.410 1.374 2.745 1.00 0.00 H new ATOM 0 HG1 THR A 10 58.152 0.942 2.333 1.00 0.00 H new ATOM 0 HG21 THR A 10 59.101 -0.024 4.325 1.00 0.00 H new ATOM 0 HG22 THR A 10 60.305 0.963 5.187 1.00 0.00 H new ATOM 0 HG23 THR A 10 58.591 1.441 5.197 1.00 0.00 H new ATOM 140 N LEU A 11 62.426 3.092 3.929 1.00 0.00 N ATOM 141 CA LEU A 11 63.694 3.015 4.704 1.00 0.00 C ATOM 142 C LEU A 11 63.879 4.280 5.537 1.00 0.00 C ATOM 143 O LEU A 11 64.320 4.218 6.663 1.00 0.00 O ATOM 144 CB LEU A 11 64.877 2.849 3.737 1.00 0.00 C ATOM 145 CG LEU A 11 64.829 1.459 3.078 1.00 0.00 C ATOM 146 CD1 LEU A 11 65.886 1.384 1.970 1.00 0.00 C ATOM 147 CD2 LEU A 11 65.097 0.353 4.121 1.00 0.00 C ATOM 0 H LEU A 11 62.532 3.035 2.916 1.00 0.00 H new ATOM 0 HA LEU A 11 63.651 2.157 5.375 1.00 0.00 H new ATOM 0 HB2 LEU A 11 64.843 3.624 2.972 1.00 0.00 H new ATOM 0 HB3 LEU A 11 65.817 2.973 4.275 1.00 0.00 H new ATOM 0 HG LEU A 11 63.836 1.306 2.655 1.00 0.00 H new ATOM 0 HD11 LEU A 11 65.853 0.400 1.502 1.00 0.00 H new ATOM 0 HD12 LEU A 11 65.683 2.149 1.221 1.00 0.00 H new ATOM 0 HD13 LEU A 11 66.875 1.550 2.398 1.00 0.00 H new ATOM 0 HD21 LEU A 11 65.059 -0.622 3.635 1.00 0.00 H new ATOM 0 HD22 LEU A 11 66.083 0.500 4.562 1.00 0.00 H new ATOM 0 HD23 LEU A 11 64.339 0.399 4.903 1.00 0.00 H new ATOM 159 N ILE A 12 63.559 5.422 5.007 1.00 0.00 N ATOM 160 CA ILE A 12 63.731 6.678 5.797 1.00 0.00 C ATOM 161 C ILE A 12 62.860 6.650 7.064 1.00 0.00 C ATOM 162 O ILE A 12 63.312 6.987 8.141 1.00 0.00 O ATOM 163 CB ILE A 12 63.337 7.876 4.933 1.00 0.00 C ATOM 164 CG1 ILE A 12 64.289 7.958 3.738 1.00 0.00 C ATOM 165 CG2 ILE A 12 63.432 9.159 5.760 1.00 0.00 C ATOM 166 CD1 ILE A 12 63.779 8.994 2.736 1.00 0.00 C ATOM 0 H ILE A 12 63.187 5.546 4.065 1.00 0.00 H new ATOM 0 HA ILE A 12 64.775 6.762 6.097 1.00 0.00 H new ATOM 0 HB ILE A 12 62.313 7.758 4.580 1.00 0.00 H new ATOM 0 HG12 ILE A 12 65.289 8.229 4.077 1.00 0.00 H new ATOM 0 HG13 ILE A 12 64.368 6.983 3.257 1.00 0.00 H new ATOM 0 HG21 ILE A 12 63.151 10.012 5.142 1.00 0.00 H new ATOM 0 HG22 ILE A 12 62.758 9.092 6.614 1.00 0.00 H new ATOM 0 HG23 ILE A 12 64.455 9.289 6.114 1.00 0.00 H new ATOM 0 HD11 ILE A 12 64.462 9.047 1.888 1.00 0.00 H new ATOM 0 HD12 ILE A 12 62.788 8.705 2.386 1.00 0.00 H new ATOM 0 HD13 ILE A 12 63.723 9.970 3.218 1.00 0.00 H new ATOM 178 N ASN A 13 61.616 6.271 6.945 1.00 0.00 N ATOM 179 CA ASN A 13 60.720 6.245 8.143 1.00 0.00 C ATOM 180 C ASN A 13 61.265 5.268 9.194 1.00 0.00 C ATOM 181 O ASN A 13 61.222 5.522 10.380 1.00 0.00 O ATOM 182 CB ASN A 13 59.324 5.794 7.707 1.00 0.00 C ATOM 183 CG ASN A 13 58.690 6.867 6.819 1.00 0.00 C ATOM 184 OD1 ASN A 13 58.486 6.650 5.641 1.00 0.00 O ATOM 185 ND2 ASN A 13 58.365 8.021 7.335 1.00 0.00 N ATOM 0 H ASN A 13 61.179 5.978 6.071 1.00 0.00 H new ATOM 0 HA ASN A 13 60.674 7.242 8.580 1.00 0.00 H new ATOM 0 HB2 ASN A 13 59.389 4.851 7.165 1.00 0.00 H new ATOM 0 HB3 ASN A 13 58.699 5.616 8.582 1.00 0.00 H new ATOM 0 HD21 ASN A 13 57.940 8.740 6.749 1.00 0.00 H new ATOM 0 HD22 ASN A 13 58.536 8.204 8.324 1.00 0.00 H new ATOM 192 N VAL A 14 61.764 4.148 8.759 1.00 0.00 N ATOM 193 CA VAL A 14 62.306 3.129 9.702 1.00 0.00 C ATOM 194 C VAL A 14 63.527 3.693 10.448 1.00 0.00 C ATOM 195 O VAL A 14 63.714 3.465 11.636 1.00 0.00 O ATOM 196 CB VAL A 14 62.687 1.880 8.903 1.00 0.00 C ATOM 197 CG1 VAL A 14 63.420 0.900 9.807 1.00 0.00 C ATOM 198 CG2 VAL A 14 61.413 1.219 8.362 1.00 0.00 C ATOM 0 H VAL A 14 61.821 3.889 7.774 1.00 0.00 H new ATOM 0 HA VAL A 14 61.552 2.869 10.445 1.00 0.00 H new ATOM 0 HB VAL A 14 63.336 2.161 8.074 1.00 0.00 H new ATOM 0 HG11 VAL A 14 63.691 0.011 9.237 1.00 0.00 H new ATOM 0 HG12 VAL A 14 64.323 1.370 10.197 1.00 0.00 H new ATOM 0 HG13 VAL A 14 62.772 0.616 10.636 1.00 0.00 H new ATOM 0 HG21 VAL A 14 61.679 0.329 7.792 1.00 0.00 H new ATOM 0 HG22 VAL A 14 60.768 0.938 9.194 1.00 0.00 H new ATOM 0 HG23 VAL A 14 60.886 1.920 7.715 1.00 0.00 H new ATOM 208 N PHE A 15 64.360 4.422 9.765 1.00 0.00 N ATOM 209 CA PHE A 15 65.567 4.991 10.425 1.00 0.00 C ATOM 210 C PHE A 15 65.091 5.829 11.603 1.00 0.00 C ATOM 211 O PHE A 15 65.669 5.818 12.672 1.00 0.00 O ATOM 212 CB PHE A 15 66.325 5.894 9.443 1.00 0.00 C ATOM 213 CG PHE A 15 66.780 5.150 8.187 1.00 0.00 C ATOM 214 CD1 PHE A 15 66.548 3.766 7.995 1.00 0.00 C ATOM 215 CD2 PHE A 15 67.452 5.875 7.190 1.00 0.00 C ATOM 216 CE1 PHE A 15 66.988 3.141 6.823 1.00 0.00 C ATOM 217 CE2 PHE A 15 67.889 5.238 6.024 1.00 0.00 C ATOM 218 CZ PHE A 15 67.656 3.873 5.841 1.00 0.00 C ATOM 0 H PHE A 15 64.258 4.650 8.776 1.00 0.00 H new ATOM 0 HA PHE A 15 66.232 4.192 10.752 1.00 0.00 H new ATOM 0 HB2 PHE A 15 65.685 6.728 9.154 1.00 0.00 H new ATOM 0 HB3 PHE A 15 67.195 6.319 9.944 1.00 0.00 H new ATOM 0 HD1 PHE A 15 66.032 3.194 8.752 1.00 0.00 H new ATOM 0 HD2 PHE A 15 67.633 6.931 7.324 1.00 0.00 H new ATOM 0 HE1 PHE A 15 66.809 2.086 6.678 1.00 0.00 H new ATOM 0 HE2 PHE A 15 68.408 5.803 5.264 1.00 0.00 H new ATOM 0 HZ PHE A 15 67.993 3.384 4.939 1.00 0.00 H new ATOM 228 N HIS A 16 64.024 6.543 11.411 1.00 0.00 N ATOM 229 CA HIS A 16 63.473 7.378 12.503 1.00 0.00 C ATOM 230 C HIS A 16 63.187 6.490 13.709 1.00 0.00 C ATOM 231 O HIS A 16 63.217 6.927 14.836 1.00 0.00 O ATOM 232 CB HIS A 16 62.167 8.008 12.028 1.00 0.00 C ATOM 233 CG HIS A 16 61.720 9.060 13.008 1.00 0.00 C ATOM 234 ND1 HIS A 16 62.403 10.257 13.174 1.00 0.00 N ATOM 235 CD2 HIS A 16 60.659 9.112 13.881 1.00 0.00 C ATOM 236 CE1 HIS A 16 61.752 10.971 14.112 1.00 0.00 C ATOM 237 NE2 HIS A 16 60.685 10.317 14.574 1.00 0.00 N ATOM 0 H HIS A 16 63.505 6.584 10.534 1.00 0.00 H new ATOM 0 HA HIS A 16 64.186 8.156 12.776 1.00 0.00 H new ATOM 0 HB2 HIS A 16 62.305 8.452 11.042 1.00 0.00 H new ATOM 0 HB3 HIS A 16 61.398 7.242 11.928 1.00 0.00 H new ATOM 0 HD2 HIS A 16 59.919 8.336 14.009 1.00 0.00 H new ATOM 0 HE1 HIS A 16 62.056 11.951 14.448 1.00 0.00 H new ATOM 0 HE2 HIS A 16 60.027 10.634 15.286 1.00 0.00 H new ATOM 246 N ALA A 17 62.882 5.244 13.480 1.00 0.00 N ATOM 247 CA ALA A 17 62.568 4.347 14.622 1.00 0.00 C ATOM 248 C ALA A 17 63.768 4.262 15.573 1.00 0.00 C ATOM 249 O ALA A 17 63.626 4.464 16.762 1.00 0.00 O ATOM 250 CB ALA A 17 62.227 2.951 14.096 1.00 0.00 C ATOM 0 H ALA A 17 62.837 4.811 12.557 1.00 0.00 H new ATOM 0 HA ALA A 17 61.714 4.750 15.167 1.00 0.00 H new ATOM 0 HB1 ALA A 17 61.997 2.293 14.934 1.00 0.00 H new ATOM 0 HB2 ALA A 17 61.363 3.012 13.435 1.00 0.00 H new ATOM 0 HB3 ALA A 17 63.078 2.552 13.545 1.00 0.00 H new ATOM 256 N HIS A 18 64.949 3.973 15.085 1.00 0.00 N ATOM 257 CA HIS A 18 66.119 3.896 16.025 1.00 0.00 C ATOM 258 C HIS A 18 66.625 5.301 16.379 1.00 0.00 C ATOM 259 O HIS A 18 66.998 5.567 17.505 1.00 0.00 O ATOM 260 CB HIS A 18 67.269 3.102 15.392 1.00 0.00 C ATOM 261 CG HIS A 18 66.865 1.659 15.236 1.00 0.00 C ATOM 262 ND1 HIS A 18 66.322 0.928 16.284 1.00 0.00 N ATOM 263 CD2 HIS A 18 66.931 0.794 14.171 1.00 0.00 C ATOM 264 CE1 HIS A 18 66.085 -0.317 15.831 1.00 0.00 C ATOM 265 NE2 HIS A 18 66.438 -0.449 14.552 1.00 0.00 N ATOM 0 H HIS A 18 65.155 3.791 14.103 1.00 0.00 H new ATOM 0 HA HIS A 18 65.782 3.392 16.931 1.00 0.00 H new ATOM 0 HB2 HIS A 18 67.524 3.525 14.420 1.00 0.00 H new ATOM 0 HB3 HIS A 18 68.160 3.175 16.015 1.00 0.00 H new ATOM 0 HD1 HIS A 18 66.136 1.272 17.226 1.00 0.00 H new ATOM 0 HD2 HIS A 18 67.308 1.041 13.189 1.00 0.00 H new ATOM 0 HE1 HIS A 18 65.662 -1.110 16.429 1.00 0.00 H new ATOM 274 N SER A 19 66.673 6.194 15.423 1.00 0.00 N ATOM 275 CA SER A 19 67.191 7.577 15.691 1.00 0.00 C ATOM 276 C SER A 19 66.046 8.568 15.860 1.00 0.00 C ATOM 277 O SER A 19 66.236 9.761 15.746 1.00 0.00 O ATOM 278 CB SER A 19 68.038 8.032 14.512 1.00 0.00 C ATOM 279 OG SER A 19 69.058 7.075 14.269 1.00 0.00 O ATOM 0 H SER A 19 66.375 6.027 14.462 1.00 0.00 H new ATOM 0 HA SER A 19 67.779 7.546 16.608 1.00 0.00 H new ATOM 0 HB2 SER A 19 67.415 8.149 13.626 1.00 0.00 H new ATOM 0 HB3 SER A 19 68.480 9.006 14.722 1.00 0.00 H new ATOM 0 HG SER A 19 69.903 7.394 14.650 1.00 0.00 H new ATOM 285 N GLY A 20 64.860 8.108 16.103 1.00 0.00 N ATOM 286 CA GLY A 20 63.738 9.069 16.240 1.00 0.00 C ATOM 287 C GLY A 20 64.064 10.080 17.330 1.00 0.00 C ATOM 288 O GLY A 20 63.353 11.046 17.524 1.00 0.00 O ATOM 0 H GLY A 20 64.618 7.123 16.212 1.00 0.00 H new ATOM 0 HA2 GLY A 20 63.567 9.582 15.293 1.00 0.00 H new ATOM 0 HA3 GLY A 20 62.818 8.538 16.485 1.00 0.00 H new ATOM 348 N LYS A 25 69.428 12.581 15.444 1.00 0.00 N ATOM 349 CA LYS A 25 68.576 12.002 14.355 1.00 0.00 C ATOM 350 C LYS A 25 69.445 11.105 13.467 1.00 0.00 C ATOM 351 O LYS A 25 68.962 10.196 12.818 1.00 0.00 O ATOM 352 CB LYS A 25 67.977 13.129 13.512 1.00 0.00 C ATOM 353 CG LYS A 25 66.929 13.875 14.342 1.00 0.00 C ATOM 354 CD LYS A 25 66.312 15.016 13.515 1.00 0.00 C ATOM 355 CE LYS A 25 67.222 16.252 13.550 1.00 0.00 C ATOM 356 NZ LYS A 25 66.580 17.366 12.793 1.00 0.00 N ATOM 0 HA LYS A 25 67.768 11.418 14.794 1.00 0.00 H new ATOM 0 HB2 LYS A 25 68.761 13.816 13.191 1.00 0.00 H new ATOM 0 HB3 LYS A 25 67.521 12.722 12.610 1.00 0.00 H new ATOM 0 HG2 LYS A 25 66.149 13.184 14.662 1.00 0.00 H new ATOM 0 HG3 LYS A 25 67.388 14.277 15.245 1.00 0.00 H new ATOM 0 HD2 LYS A 25 66.168 14.691 12.485 1.00 0.00 H new ATOM 0 HD3 LYS A 25 65.328 15.269 13.909 1.00 0.00 H new ATOM 0 HE2 LYS A 25 67.401 16.555 14.581 1.00 0.00 H new ATOM 0 HE3 LYS A 25 68.192 16.014 13.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 67.197 18.203 12.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 66.431 17.074 11.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 65.664 17.598 13.228 1.00 0.00 H new ATOM 370 N TYR A 26 70.730 11.354 13.439 1.00 0.00 N ATOM 371 CA TYR A 26 71.643 10.514 12.607 1.00 0.00 C ATOM 372 C TYR A 26 71.360 9.047 12.920 1.00 0.00 C ATOM 373 O TYR A 26 70.634 8.744 13.845 1.00 0.00 O ATOM 374 CB TYR A 26 73.100 10.820 12.965 1.00 0.00 C ATOM 375 CG TYR A 26 73.372 12.298 12.819 1.00 0.00 C ATOM 376 CD1 TYR A 26 73.612 12.844 11.554 1.00 0.00 C ATOM 377 CD2 TYR A 26 73.400 13.121 13.951 1.00 0.00 C ATOM 378 CE1 TYR A 26 73.879 14.210 11.417 1.00 0.00 C ATOM 379 CE2 TYR A 26 73.665 14.489 13.817 1.00 0.00 C ATOM 380 CZ TYR A 26 73.906 15.034 12.548 1.00 0.00 C ATOM 381 OH TYR A 26 74.174 16.382 12.411 1.00 0.00 O ATOM 0 H TYR A 26 71.187 12.104 13.958 1.00 0.00 H new ATOM 0 HA TYR A 26 71.479 10.725 11.550 1.00 0.00 H new ATOM 0 HB2 TYR A 26 73.305 10.504 13.988 1.00 0.00 H new ATOM 0 HB3 TYR A 26 73.768 10.254 12.316 1.00 0.00 H new ATOM 0 HD1 TYR A 26 73.591 12.209 10.681 1.00 0.00 H new ATOM 0 HD2 TYR A 26 73.217 12.700 14.929 1.00 0.00 H new ATOM 0 HE1 TYR A 26 74.064 14.629 10.439 1.00 0.00 H new ATOM 0 HE2 TYR A 26 73.684 15.124 14.690 1.00 0.00 H new ATOM 0 HH TYR A 26 74.154 16.811 13.292 1.00 0.00 H new ATOM 391 N LYS A 27 71.919 8.128 12.178 1.00 0.00 N ATOM 392 CA LYS A 27 71.643 6.700 12.489 1.00 0.00 C ATOM 393 C LYS A 27 72.045 6.445 13.933 1.00 0.00 C ATOM 394 O LYS A 27 71.223 6.435 14.817 1.00 0.00 O ATOM 395 CB LYS A 27 72.438 5.761 11.561 1.00 0.00 C ATOM 396 CG LYS A 27 72.238 4.277 11.964 1.00 0.00 C ATOM 397 CD LYS A 27 70.756 3.888 11.873 1.00 0.00 C ATOM 398 CE LYS A 27 70.616 2.366 11.948 1.00 0.00 C ATOM 399 NZ LYS A 27 70.932 1.913 13.332 1.00 0.00 N ATOM 0 H LYS A 27 72.541 8.300 11.388 1.00 0.00 H new ATOM 0 HA LYS A 27 70.583 6.499 12.337 1.00 0.00 H new ATOM 0 HB2 LYS A 27 72.118 5.907 10.529 1.00 0.00 H new ATOM 0 HB3 LYS A 27 73.498 6.013 11.604 1.00 0.00 H new ATOM 0 HG2 LYS A 27 72.829 3.634 11.311 1.00 0.00 H new ATOM 0 HG3 LYS A 27 72.600 4.118 12.980 1.00 0.00 H new ATOM 0 HD2 LYS A 27 70.197 4.355 12.684 1.00 0.00 H new ATOM 0 HD3 LYS A 27 70.330 4.256 10.940 1.00 0.00 H new ATOM 0 HE2 LYS A 27 69.603 2.068 11.677 1.00 0.00 H new ATOM 0 HE3 LYS A 27 71.289 1.891 11.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 71.333 0.954 13.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 71.622 2.562 13.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 70.062 1.906 13.902 1.00 0.00 H new ATOM 413 N LEU A 28 73.304 6.240 14.178 1.00 0.00 N ATOM 414 CA LEU A 28 73.752 5.982 15.587 1.00 0.00 C ATOM 415 C LEU A 28 75.288 5.979 15.633 1.00 0.00 C ATOM 416 O LEU A 28 75.935 5.775 14.627 1.00 0.00 O ATOM 417 CB LEU A 28 73.222 4.589 16.029 1.00 0.00 C ATOM 418 CG LEU A 28 72.469 4.608 17.384 1.00 0.00 C ATOM 419 CD1 LEU A 28 73.236 5.373 18.475 1.00 0.00 C ATOM 420 CD2 LEU A 28 71.074 5.228 17.223 1.00 0.00 C ATOM 0 H LEU A 28 74.044 6.238 13.476 1.00 0.00 H new ATOM 0 HA LEU A 28 73.368 6.755 16.252 1.00 0.00 H new ATOM 0 HB2 LEU A 28 72.555 4.203 15.258 1.00 0.00 H new ATOM 0 HB3 LEU A 28 74.061 3.897 16.100 1.00 0.00 H new ATOM 0 HG LEU A 28 72.380 3.568 17.699 1.00 0.00 H new ATOM 0 HD11 LEU A 28 72.664 5.355 19.403 1.00 0.00 H new ATOM 0 HD12 LEU A 28 74.205 4.901 18.637 1.00 0.00 H new ATOM 0 HD13 LEU A 28 73.384 6.406 18.160 1.00 0.00 H new ATOM 0 HD21 LEU A 28 70.564 5.231 18.186 1.00 0.00 H new ATOM 0 HD22 LEU A 28 71.170 6.251 16.860 1.00 0.00 H new ATOM 0 HD23 LEU A 28 70.496 4.643 16.508 1.00 0.00 H new ATOM 432 N SER A 29 75.881 6.149 16.790 1.00 0.00 N ATOM 433 CA SER A 29 77.365 6.088 16.868 1.00 0.00 C ATOM 434 C SER A 29 77.810 4.803 16.159 1.00 0.00 C ATOM 435 O SER A 29 77.087 3.825 16.151 1.00 0.00 O ATOM 436 CB SER A 29 77.801 6.047 18.329 1.00 0.00 C ATOM 437 OG SER A 29 77.194 7.126 19.027 1.00 0.00 O ATOM 0 H SER A 29 75.403 6.326 17.673 1.00 0.00 H new ATOM 0 HA SER A 29 77.813 6.963 16.397 1.00 0.00 H new ATOM 0 HB2 SER A 29 77.513 5.098 18.781 1.00 0.00 H new ATOM 0 HB3 SER A 29 78.886 6.117 18.399 1.00 0.00 H new ATOM 0 HG SER A 29 77.469 7.104 19.967 1.00 0.00 H new ATOM 443 N LYS A 30 78.957 4.782 15.543 1.00 0.00 N ATOM 444 CA LYS A 30 79.359 3.537 14.827 1.00 0.00 C ATOM 445 C LYS A 30 79.275 2.329 15.769 1.00 0.00 C ATOM 446 O LYS A 30 78.728 1.310 15.419 1.00 0.00 O ATOM 447 CB LYS A 30 80.803 3.662 14.290 1.00 0.00 C ATOM 448 CG LYS A 30 80.840 4.432 12.969 1.00 0.00 C ATOM 449 CD LYS A 30 82.293 4.456 12.478 1.00 0.00 C ATOM 450 CE LYS A 30 82.381 4.959 11.037 1.00 0.00 C ATOM 451 NZ LYS A 30 81.390 4.237 10.189 1.00 0.00 N ATOM 0 H LYS A 30 79.623 5.554 15.502 1.00 0.00 H new ATOM 0 HA LYS A 30 78.675 3.393 13.990 1.00 0.00 H new ATOM 0 HB2 LYS A 30 81.425 4.170 15.027 1.00 0.00 H new ATOM 0 HB3 LYS A 30 81.227 2.668 14.146 1.00 0.00 H new ATOM 0 HG2 LYS A 30 80.196 3.954 12.231 1.00 0.00 H new ATOM 0 HG3 LYS A 30 80.467 5.447 13.108 1.00 0.00 H new ATOM 0 HD2 LYS A 30 82.888 5.098 13.127 1.00 0.00 H new ATOM 0 HD3 LYS A 30 82.718 3.455 12.543 1.00 0.00 H new ATOM 0 HE2 LYS A 30 82.189 6.031 11.004 1.00 0.00 H new ATOM 0 HE3 LYS A 30 83.388 4.804 10.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 81.866 3.858 9.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 80.973 3.454 10.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 80.639 4.894 9.897 1.00 0.00 H new ATOM 465 N LYS A 31 79.831 2.414 16.939 1.00 0.00 N ATOM 466 CA LYS A 31 79.820 1.233 17.862 1.00 0.00 C ATOM 467 C LYS A 31 78.386 0.725 18.110 1.00 0.00 C ATOM 468 O LYS A 31 78.131 -0.467 18.090 1.00 0.00 O ATOM 469 CB LYS A 31 80.464 1.662 19.193 1.00 0.00 C ATOM 470 CG LYS A 31 80.548 0.486 20.185 1.00 0.00 C ATOM 471 CD LYS A 31 81.585 -0.538 19.706 1.00 0.00 C ATOM 472 CE LYS A 31 81.955 -1.471 20.860 1.00 0.00 C ATOM 473 NZ LYS A 31 82.713 -0.710 21.893 1.00 0.00 N ATOM 0 H LYS A 31 80.295 3.246 17.304 1.00 0.00 H new ATOM 0 HA LYS A 31 80.380 0.416 17.408 1.00 0.00 H new ATOM 0 HB2 LYS A 31 81.464 2.053 19.005 1.00 0.00 H new ATOM 0 HB3 LYS A 31 79.883 2.471 19.635 1.00 0.00 H new ATOM 0 HG2 LYS A 31 80.820 0.854 21.174 1.00 0.00 H new ATOM 0 HG3 LYS A 31 79.572 0.010 20.279 1.00 0.00 H new ATOM 0 HD2 LYS A 31 81.183 -1.115 18.873 1.00 0.00 H new ATOM 0 HD3 LYS A 31 82.475 -0.026 19.340 1.00 0.00 H new ATOM 0 HE2 LYS A 31 81.054 -1.900 21.298 1.00 0.00 H new ATOM 0 HE3 LYS A 31 82.557 -2.302 20.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 83.325 -1.361 22.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 83.298 0.015 21.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 82.046 -0.252 22.546 1.00 0.00 H new ATOM 487 N GLU A 32 77.455 1.601 18.342 1.00 0.00 N ATOM 488 CA GLU A 32 76.051 1.151 18.594 1.00 0.00 C ATOM 489 C GLU A 32 75.443 0.622 17.305 1.00 0.00 C ATOM 490 O GLU A 32 74.717 -0.338 17.304 1.00 0.00 O ATOM 491 CB GLU A 32 75.214 2.328 19.099 1.00 0.00 C ATOM 492 CG GLU A 32 73.776 1.870 19.394 1.00 0.00 C ATOM 493 CD GLU A 32 73.788 0.823 20.512 1.00 0.00 C ATOM 494 OE1 GLU A 32 74.766 0.774 21.242 1.00 0.00 O ATOM 495 OE2 GLU A 32 72.820 0.090 20.619 1.00 0.00 O ATOM 0 H GLU A 32 77.599 2.610 18.369 1.00 0.00 H new ATOM 0 HA GLU A 32 76.060 0.361 19.345 1.00 0.00 H new ATOM 0 HB2 GLU A 32 75.664 2.743 20.001 1.00 0.00 H new ATOM 0 HB3 GLU A 32 75.204 3.123 18.353 1.00 0.00 H new ATOM 0 HG2 GLU A 32 73.165 2.723 19.688 1.00 0.00 H new ATOM 0 HG3 GLU A 32 73.326 1.451 18.494 1.00 0.00 H new ATOM 502 N LEU A 33 75.717 1.275 16.220 1.00 0.00 N ATOM 503 CA LEU A 33 75.146 0.858 14.915 1.00 0.00 C ATOM 504 C LEU A 33 75.457 -0.612 14.619 1.00 0.00 C ATOM 505 O LEU A 33 74.588 -1.350 14.209 1.00 0.00 O ATOM 506 CB LEU A 33 75.779 1.752 13.828 1.00 0.00 C ATOM 507 CG LEU A 33 75.376 1.319 12.397 1.00 0.00 C ATOM 508 CD1 LEU A 33 76.098 0.023 11.954 1.00 0.00 C ATOM 509 CD2 LEU A 33 73.858 1.122 12.324 1.00 0.00 C ATOM 0 H LEU A 33 76.323 2.095 16.179 1.00 0.00 H new ATOM 0 HA LEU A 33 74.062 0.966 14.935 1.00 0.00 H new ATOM 0 HB2 LEU A 33 75.476 2.786 13.990 1.00 0.00 H new ATOM 0 HB3 LEU A 33 76.864 1.720 13.922 1.00 0.00 H new ATOM 0 HG LEU A 33 75.681 2.112 11.714 1.00 0.00 H new ATOM 0 HD11 LEU A 33 75.784 -0.242 10.944 1.00 0.00 H new ATOM 0 HD12 LEU A 33 77.176 0.184 11.968 1.00 0.00 H new ATOM 0 HD13 LEU A 33 75.843 -0.787 12.637 1.00 0.00 H new ATOM 0 HD21 LEU A 33 73.579 0.817 11.315 1.00 0.00 H new ATOM 0 HD22 LEU A 33 73.557 0.350 13.033 1.00 0.00 H new ATOM 0 HD23 LEU A 33 73.357 2.058 12.572 1.00 0.00 H new ATOM 521 N LYS A 34 76.675 -1.060 14.771 1.00 0.00 N ATOM 522 CA LYS A 34 76.938 -2.494 14.422 1.00 0.00 C ATOM 523 C LYS A 34 76.215 -3.426 15.382 1.00 0.00 C ATOM 524 O LYS A 34 75.699 -4.440 14.984 1.00 0.00 O ATOM 525 CB LYS A 34 78.438 -2.820 14.435 1.00 0.00 C ATOM 526 CG LYS A 34 78.711 -4.317 14.123 1.00 0.00 C ATOM 527 CD LYS A 34 78.240 -4.731 12.710 1.00 0.00 C ATOM 528 CE LYS A 34 78.898 -3.867 11.621 1.00 0.00 C ATOM 529 NZ LYS A 34 80.263 -3.459 12.039 1.00 0.00 N ATOM 0 H LYS A 34 77.474 -0.523 15.108 1.00 0.00 H new ATOM 0 HA LYS A 34 76.560 -2.646 13.411 1.00 0.00 H new ATOM 0 HB2 LYS A 34 78.951 -2.198 13.702 1.00 0.00 H new ATOM 0 HB3 LYS A 34 78.855 -2.571 15.411 1.00 0.00 H new ATOM 0 HG2 LYS A 34 79.779 -4.514 14.217 1.00 0.00 H new ATOM 0 HG3 LYS A 34 78.206 -4.936 14.865 1.00 0.00 H new ATOM 0 HD2 LYS A 34 78.480 -5.780 12.538 1.00 0.00 H new ATOM 0 HD3 LYS A 34 77.156 -4.637 12.645 1.00 0.00 H new ATOM 0 HE2 LYS A 34 78.949 -4.425 10.686 1.00 0.00 H new ATOM 0 HE3 LYS A 34 78.289 -2.983 11.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 80.350 -2.424 11.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 80.432 -3.764 13.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 80.965 -3.902 11.413 1.00 0.00 H new ATOM 543 N ASP A 35 76.184 -3.119 16.644 1.00 0.00 N ATOM 544 CA ASP A 35 75.501 -4.043 17.592 1.00 0.00 C ATOM 545 C ASP A 35 73.997 -4.040 17.314 1.00 0.00 C ATOM 546 O ASP A 35 73.295 -4.998 17.585 1.00 0.00 O ATOM 547 CB ASP A 35 75.754 -3.568 19.024 1.00 0.00 C ATOM 548 CG ASP A 35 77.223 -3.799 19.385 1.00 0.00 C ATOM 549 OD1 ASP A 35 77.855 -4.608 18.726 1.00 0.00 O ATOM 550 OD2 ASP A 35 77.692 -3.158 20.311 1.00 0.00 O ATOM 0 H ASP A 35 76.594 -2.282 17.059 1.00 0.00 H new ATOM 0 HA ASP A 35 75.890 -5.053 17.464 1.00 0.00 H new ATOM 0 HB2 ASP A 35 75.507 -2.510 19.117 1.00 0.00 H new ATOM 0 HB3 ASP A 35 75.109 -4.108 19.717 1.00 0.00 H new ATOM 555 N LEU A 36 73.500 -2.954 16.795 1.00 0.00 N ATOM 556 CA LEU A 36 72.044 -2.844 16.529 1.00 0.00 C ATOM 557 C LEU A 36 71.625 -3.714 15.335 1.00 0.00 C ATOM 558 O LEU A 36 70.780 -4.576 15.466 1.00 0.00 O ATOM 559 CB LEU A 36 71.720 -1.354 16.241 1.00 0.00 C ATOM 560 CG LEU A 36 70.414 -0.923 16.916 1.00 0.00 C ATOM 561 CD1 LEU A 36 70.184 0.567 16.666 1.00 0.00 C ATOM 562 CD2 LEU A 36 69.228 -1.712 16.345 1.00 0.00 C ATOM 0 H LEU A 36 74.047 -2.131 16.542 1.00 0.00 H new ATOM 0 HA LEU A 36 71.490 -3.198 17.398 1.00 0.00 H new ATOM 0 HB2 LEU A 36 72.538 -0.727 16.596 1.00 0.00 H new ATOM 0 HB3 LEU A 36 71.643 -1.199 15.165 1.00 0.00 H new ATOM 0 HG LEU A 36 70.492 -1.120 17.985 1.00 0.00 H new ATOM 0 HD11 LEU A 36 69.255 0.877 17.145 1.00 0.00 H new ATOM 0 HD12 LEU A 36 71.015 1.138 17.081 1.00 0.00 H new ATOM 0 HD13 LEU A 36 70.118 0.750 15.594 1.00 0.00 H new ATOM 0 HD21 LEU A 36 68.309 -1.393 16.836 1.00 0.00 H new ATOM 0 HD22 LEU A 36 69.150 -1.527 15.274 1.00 0.00 H new ATOM 0 HD23 LEU A 36 69.382 -2.777 16.519 1.00 0.00 H new ATOM 574 N LEU A 37 72.168 -3.484 14.162 1.00 0.00 N ATOM 575 CA LEU A 37 71.727 -4.302 12.985 1.00 0.00 C ATOM 576 C LEU A 37 72.347 -5.698 12.960 1.00 0.00 C ATOM 577 O LEU A 37 71.686 -6.659 12.622 1.00 0.00 O ATOM 578 CB LEU A 37 72.015 -3.541 11.688 1.00 0.00 C ATOM 579 CG LEU A 37 70.883 -2.537 11.429 1.00 0.00 C ATOM 580 CD1 LEU A 37 70.778 -1.569 12.606 1.00 0.00 C ATOM 581 CD2 LEU A 37 71.175 -1.749 10.156 1.00 0.00 C ATOM 0 H LEU A 37 72.882 -2.781 13.970 1.00 0.00 H new ATOM 0 HA LEU A 37 70.652 -4.458 13.080 1.00 0.00 H new ATOM 0 HB2 LEU A 37 72.969 -3.020 11.763 1.00 0.00 H new ATOM 0 HB3 LEU A 37 72.097 -4.238 10.854 1.00 0.00 H new ATOM 0 HG LEU A 37 69.944 -3.079 11.315 1.00 0.00 H new ATOM 0 HD11 LEU A 37 69.974 -0.857 12.421 1.00 0.00 H new ATOM 0 HD12 LEU A 37 70.566 -2.127 13.518 1.00 0.00 H new ATOM 0 HD13 LEU A 37 71.719 -1.032 12.720 1.00 0.00 H new ATOM 0 HD21 LEU A 37 70.369 -1.037 9.976 1.00 0.00 H new ATOM 0 HD22 LEU A 37 72.116 -1.211 10.269 1.00 0.00 H new ATOM 0 HD23 LEU A 37 71.249 -2.435 9.312 1.00 0.00 H new ATOM 593 N GLN A 38 73.589 -5.844 13.299 1.00 0.00 N ATOM 594 CA GLN A 38 74.184 -7.207 13.265 1.00 0.00 C ATOM 595 C GLN A 38 73.313 -8.124 14.113 1.00 0.00 C ATOM 596 O GLN A 38 73.166 -9.298 13.836 1.00 0.00 O ATOM 597 CB GLN A 38 75.598 -7.180 13.847 1.00 0.00 C ATOM 598 CG GLN A 38 76.129 -8.604 13.999 1.00 0.00 C ATOM 599 CD GLN A 38 77.611 -8.545 14.373 1.00 0.00 C ATOM 600 OE1 GLN A 38 78.022 -7.689 15.131 1.00 0.00 O ATOM 601 NE2 GLN A 38 78.435 -9.424 13.878 1.00 0.00 N ATOM 0 H GLN A 38 74.214 -5.094 13.595 1.00 0.00 H new ATOM 0 HA GLN A 38 74.235 -7.562 12.236 1.00 0.00 H new ATOM 0 HB2 GLN A 38 76.257 -6.605 13.196 1.00 0.00 H new ATOM 0 HB3 GLN A 38 75.592 -6.680 14.816 1.00 0.00 H new ATOM 0 HG2 GLN A 38 75.568 -9.135 14.768 1.00 0.00 H new ATOM 0 HG3 GLN A 38 75.997 -9.156 13.069 1.00 0.00 H new ATOM 0 HE21 GLN A 38 78.092 -10.143 13.242 1.00 0.00 H new ATOM 0 HE22 GLN A 38 79.424 -9.393 14.127 1.00 0.00 H new ATOM 610 N THR A 39 72.726 -7.587 15.142 1.00 0.00 N ATOM 611 CA THR A 39 71.854 -8.417 16.008 1.00 0.00 C ATOM 612 C THR A 39 70.544 -8.668 15.262 1.00 0.00 C ATOM 613 O THR A 39 69.992 -9.749 15.288 1.00 0.00 O ATOM 614 CB THR A 39 71.616 -7.679 17.327 1.00 0.00 C ATOM 615 OG1 THR A 39 72.786 -7.774 18.130 1.00 0.00 O ATOM 616 CG2 THR A 39 70.432 -8.291 18.082 1.00 0.00 C ATOM 0 H THR A 39 72.813 -6.609 15.420 1.00 0.00 H new ATOM 0 HA THR A 39 72.318 -9.376 16.238 1.00 0.00 H new ATOM 0 HB THR A 39 71.390 -6.635 17.112 1.00 0.00 H new ATOM 0 HG1 THR A 39 73.248 -6.910 18.139 1.00 0.00 H new ATOM 0 HG21 THR A 39 70.279 -7.752 19.017 1.00 0.00 H new ATOM 0 HG22 THR A 39 69.533 -8.218 17.470 1.00 0.00 H new ATOM 0 HG23 THR A 39 70.640 -9.339 18.297 1.00 0.00 H new ATOM 624 N GLU A 40 70.057 -7.668 14.587 1.00 0.00 N ATOM 625 CA GLU A 40 68.795 -7.821 13.818 1.00 0.00 C ATOM 626 C GLU A 40 69.058 -8.748 12.620 1.00 0.00 C ATOM 627 O GLU A 40 68.217 -9.529 12.225 1.00 0.00 O ATOM 628 CB GLU A 40 68.336 -6.423 13.340 1.00 0.00 C ATOM 629 CG GLU A 40 66.821 -6.259 13.530 1.00 0.00 C ATOM 630 CD GLU A 40 66.522 -5.945 14.998 1.00 0.00 C ATOM 631 OE1 GLU A 40 67.338 -6.294 15.837 1.00 0.00 O ATOM 632 OE2 GLU A 40 65.486 -5.359 15.261 1.00 0.00 O ATOM 0 H GLU A 40 70.483 -6.743 14.535 1.00 0.00 H new ATOM 0 HA GLU A 40 68.011 -8.258 14.436 1.00 0.00 H new ATOM 0 HB2 GLU A 40 68.864 -5.650 13.898 1.00 0.00 H new ATOM 0 HB3 GLU A 40 68.593 -6.289 12.289 1.00 0.00 H new ATOM 0 HG2 GLU A 40 66.448 -5.457 12.892 1.00 0.00 H new ATOM 0 HG3 GLU A 40 66.305 -7.171 13.230 1.00 0.00 H new ATOM 639 N LEU A 41 70.230 -8.656 12.039 1.00 0.00 N ATOM 640 CA LEU A 41 70.574 -9.517 10.863 1.00 0.00 C ATOM 641 C LEU A 41 71.327 -10.762 11.342 1.00 0.00 C ATOM 642 O LEU A 41 72.175 -11.287 10.657 1.00 0.00 O ATOM 643 CB LEU A 41 71.477 -8.734 9.888 1.00 0.00 C ATOM 644 CG LEU A 41 70.769 -7.466 9.371 1.00 0.00 C ATOM 645 CD1 LEU A 41 71.815 -6.462 8.865 1.00 0.00 C ATOM 646 CD2 LEU A 41 69.841 -7.822 8.200 1.00 0.00 C ATOM 0 H LEU A 41 70.969 -8.016 12.331 1.00 0.00 H new ATOM 0 HA LEU A 41 69.654 -9.810 10.357 1.00 0.00 H new ATOM 0 HB2 LEU A 41 72.404 -8.457 10.389 1.00 0.00 H new ATOM 0 HB3 LEU A 41 71.747 -9.372 9.046 1.00 0.00 H new ATOM 0 HG LEU A 41 70.190 -7.034 10.187 1.00 0.00 H new ATOM 0 HD11 LEU A 41 71.313 -5.566 8.500 1.00 0.00 H new ATOM 0 HD12 LEU A 41 72.487 -6.194 9.681 1.00 0.00 H new ATOM 0 HD13 LEU A 41 72.389 -6.912 8.055 1.00 0.00 H new ATOM 0 HD21 LEU A 41 69.345 -6.920 7.841 1.00 0.00 H new ATOM 0 HD22 LEU A 41 70.427 -8.260 7.392 1.00 0.00 H new ATOM 0 HD23 LEU A 41 69.092 -8.539 8.535 1.00 0.00 H new ATOM 658 N SER A 42 71.034 -11.231 12.517 1.00 0.00 N ATOM 659 CA SER A 42 71.747 -12.434 13.036 1.00 0.00 C ATOM 660 C SER A 42 71.520 -13.629 12.113 1.00 0.00 C ATOM 661 O SER A 42 72.414 -14.411 11.861 1.00 0.00 O ATOM 662 CB SER A 42 71.186 -12.778 14.400 1.00 0.00 C ATOM 663 OG SER A 42 71.553 -11.768 15.327 1.00 0.00 O ATOM 0 H SER A 42 70.333 -10.837 13.144 1.00 0.00 H new ATOM 0 HA SER A 42 72.814 -12.217 13.091 1.00 0.00 H new ATOM 0 HB2 SER A 42 70.101 -12.863 14.348 1.00 0.00 H new ATOM 0 HB3 SER A 42 71.566 -13.745 14.729 1.00 0.00 H new ATOM 0 HG SER A 42 70.778 -11.198 15.514 1.00 0.00 H new ATOM 669 N SER A 43 70.327 -13.781 11.618 1.00 0.00 N ATOM 670 CA SER A 43 70.037 -14.933 10.717 1.00 0.00 C ATOM 671 C SER A 43 70.914 -14.827 9.487 1.00 0.00 C ATOM 672 O SER A 43 71.340 -15.813 8.931 1.00 0.00 O ATOM 673 CB SER A 43 68.565 -14.925 10.309 1.00 0.00 C ATOM 674 OG SER A 43 67.756 -15.100 11.465 1.00 0.00 O ATOM 0 H SER A 43 69.538 -13.159 11.796 1.00 0.00 H new ATOM 0 HA SER A 43 70.246 -15.866 11.240 1.00 0.00 H new ATOM 0 HB2 SER A 43 68.317 -13.985 9.817 1.00 0.00 H new ATOM 0 HB3 SER A 43 68.370 -15.722 9.591 1.00 0.00 H new ATOM 0 HG SER A 43 66.811 -15.094 11.207 1.00 0.00 H new ATOM 680 N PHE A 44 71.212 -13.644 9.058 1.00 0.00 N ATOM 681 CA PHE A 44 72.087 -13.534 7.862 1.00 0.00 C ATOM 682 C PHE A 44 73.404 -14.214 8.202 1.00 0.00 C ATOM 683 O PHE A 44 73.974 -14.927 7.400 1.00 0.00 O ATOM 684 CB PHE A 44 72.318 -12.067 7.485 1.00 0.00 C ATOM 685 CG PHE A 44 71.153 -11.568 6.666 1.00 0.00 C ATOM 686 CD1 PHE A 44 70.018 -11.046 7.297 1.00 0.00 C ATOM 687 CD2 PHE A 44 71.209 -11.637 5.269 1.00 0.00 C ATOM 688 CE1 PHE A 44 68.939 -10.591 6.532 1.00 0.00 C ATOM 689 CE2 PHE A 44 70.131 -11.182 4.503 1.00 0.00 C ATOM 690 CZ PHE A 44 68.995 -10.659 5.133 1.00 0.00 C ATOM 0 H PHE A 44 70.899 -12.764 9.468 1.00 0.00 H new ATOM 0 HA PHE A 44 71.617 -14.013 7.003 1.00 0.00 H new ATOM 0 HB2 PHE A 44 72.429 -11.462 8.385 1.00 0.00 H new ATOM 0 HB3 PHE A 44 73.244 -11.968 6.918 1.00 0.00 H new ATOM 0 HD1 PHE A 44 69.975 -10.994 8.375 1.00 0.00 H new ATOM 0 HD2 PHE A 44 72.084 -12.042 4.783 1.00 0.00 H new ATOM 0 HE1 PHE A 44 68.063 -10.188 7.019 1.00 0.00 H new ATOM 0 HE2 PHE A 44 70.175 -11.234 3.425 1.00 0.00 H new ATOM 0 HZ PHE A 44 68.162 -10.308 4.541 1.00 0.00 H new ATOM 700 N LEU A 45 73.873 -14.032 9.399 1.00 0.00 N ATOM 701 CA LEU A 45 75.131 -14.701 9.806 1.00 0.00 C ATOM 702 C LEU A 45 74.953 -16.214 9.627 1.00 0.00 C ATOM 703 O LEU A 45 75.878 -16.980 9.811 1.00 0.00 O ATOM 704 CB LEU A 45 75.440 -14.394 11.276 1.00 0.00 C ATOM 705 CG LEU A 45 75.387 -12.881 11.517 1.00 0.00 C ATOM 706 CD1 LEU A 45 75.744 -12.592 12.975 1.00 0.00 C ATOM 707 CD2 LEU A 45 76.383 -12.167 10.596 1.00 0.00 C ATOM 0 H LEU A 45 73.439 -13.448 10.114 1.00 0.00 H new ATOM 0 HA LEU A 45 75.956 -14.339 9.193 1.00 0.00 H new ATOM 0 HB2 LEU A 45 74.721 -14.899 11.921 1.00 0.00 H new ATOM 0 HB3 LEU A 45 76.426 -14.778 11.537 1.00 0.00 H new ATOM 0 HG LEU A 45 74.382 -12.517 11.303 1.00 0.00 H new ATOM 0 HD11 LEU A 45 75.708 -11.517 13.152 1.00 0.00 H new ATOM 0 HD12 LEU A 45 75.031 -13.092 13.630 1.00 0.00 H new ATOM 0 HD13 LEU A 45 76.748 -12.961 13.184 1.00 0.00 H new ATOM 0 HD21 LEU A 45 76.338 -11.093 10.775 1.00 0.00 H new ATOM 0 HD22 LEU A 45 77.391 -12.527 10.801 1.00 0.00 H new ATOM 0 HD23 LEU A 45 76.129 -12.373 9.556 1.00 0.00 H new ATOM 719 N ASP A 46 73.766 -16.657 9.279 1.00 0.00 N ATOM 720 CA ASP A 46 73.552 -18.123 9.111 1.00 0.00 C ATOM 721 C ASP A 46 74.655 -18.686 8.199 1.00 0.00 C ATOM 722 O ASP A 46 75.104 -19.802 8.371 1.00 0.00 O ATOM 723 CB ASP A 46 72.180 -18.403 8.464 1.00 0.00 C ATOM 724 CG ASP A 46 71.063 -18.308 9.515 1.00 0.00 C ATOM 725 OD1 ASP A 46 71.353 -18.487 10.687 1.00 0.00 O ATOM 726 OD2 ASP A 46 69.935 -18.055 9.125 1.00 0.00 O ATOM 0 H ASP A 46 72.949 -16.072 9.107 1.00 0.00 H new ATOM 0 HA ASP A 46 73.583 -18.598 10.092 1.00 0.00 H new ATOM 0 HB2 ASP A 46 71.996 -17.687 7.663 1.00 0.00 H new ATOM 0 HB3 ASP A 46 72.179 -19.395 8.012 1.00 0.00 H new ATOM 731 N VAL A 47 75.089 -17.920 7.225 1.00 0.00 N ATOM 732 CA VAL A 47 76.160 -18.405 6.293 1.00 0.00 C ATOM 733 C VAL A 47 77.151 -17.270 5.975 1.00 0.00 C ATOM 734 O VAL A 47 76.899 -16.419 5.148 1.00 0.00 O ATOM 735 CB VAL A 47 75.515 -18.926 4.996 1.00 0.00 C ATOM 736 CG1 VAL A 47 74.549 -17.889 4.410 1.00 0.00 C ATOM 737 CG2 VAL A 47 76.604 -19.235 3.967 1.00 0.00 C ATOM 0 H VAL A 47 74.747 -16.978 7.034 1.00 0.00 H new ATOM 0 HA VAL A 47 76.709 -19.215 6.773 1.00 0.00 H new ATOM 0 HB VAL A 47 74.957 -19.832 5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 47 74.106 -18.281 3.494 1.00 0.00 H new ATOM 0 HG12 VAL A 47 73.761 -17.677 5.132 1.00 0.00 H new ATOM 0 HG13 VAL A 47 75.092 -16.971 4.186 1.00 0.00 H new ATOM 0 HG21 VAL A 47 76.144 -19.604 3.050 1.00 0.00 H new ATOM 0 HG22 VAL A 47 77.168 -18.328 3.751 1.00 0.00 H new ATOM 0 HG23 VAL A 47 77.277 -19.994 4.366 1.00 0.00 H new ATOM 747 N GLN A 48 78.288 -17.260 6.615 1.00 0.00 N ATOM 748 CA GLN A 48 79.286 -16.200 6.328 1.00 0.00 C ATOM 749 C GLN A 48 79.866 -16.428 4.929 1.00 0.00 C ATOM 750 O GLN A 48 80.525 -17.413 4.657 1.00 0.00 O ATOM 751 CB GLN A 48 80.396 -16.217 7.394 1.00 0.00 C ATOM 752 CG GLN A 48 81.339 -17.408 7.181 1.00 0.00 C ATOM 753 CD GLN A 48 82.134 -17.669 8.463 1.00 0.00 C ATOM 754 OE1 GLN A 48 81.578 -17.687 9.544 1.00 0.00 O ATOM 755 NE2 GLN A 48 83.421 -17.876 8.388 1.00 0.00 N ATOM 0 H GLN A 48 78.566 -17.940 7.323 1.00 0.00 H new ATOM 0 HA GLN A 48 78.807 -15.221 6.359 1.00 0.00 H new ATOM 0 HB2 GLN A 48 80.962 -15.287 7.350 1.00 0.00 H new ATOM 0 HB3 GLN A 48 79.951 -16.273 8.388 1.00 0.00 H new ATOM 0 HG2 GLN A 48 80.766 -18.295 6.910 1.00 0.00 H new ATOM 0 HG3 GLN A 48 82.019 -17.203 6.355 1.00 0.00 H new ATOM 0 HE21 GLN A 48 83.888 -17.861 7.481 1.00 0.00 H new ATOM 0 HE22 GLN A 48 83.959 -18.053 9.236 1.00 0.00 H new ATOM 764 N LYS A 49 79.610 -15.516 4.045 1.00 0.00 N ATOM 765 CA LYS A 49 80.123 -15.628 2.647 1.00 0.00 C ATOM 766 C LYS A 49 81.500 -14.957 2.550 1.00 0.00 C ATOM 767 O LYS A 49 82.519 -15.617 2.560 1.00 0.00 O ATOM 768 CB LYS A 49 79.148 -14.930 1.692 1.00 0.00 C ATOM 769 CG LYS A 49 77.802 -15.676 1.661 1.00 0.00 C ATOM 770 CD LYS A 49 77.922 -16.975 0.847 1.00 0.00 C ATOM 771 CE LYS A 49 76.525 -17.445 0.430 1.00 0.00 C ATOM 772 NZ LYS A 49 75.629 -17.471 1.618 1.00 0.00 N ATOM 0 H LYS A 49 79.057 -14.679 4.229 1.00 0.00 H new ATOM 0 HA LYS A 49 80.213 -16.680 2.375 1.00 0.00 H new ATOM 0 HB2 LYS A 49 78.993 -13.899 2.010 1.00 0.00 H new ATOM 0 HB3 LYS A 49 79.574 -14.893 0.689 1.00 0.00 H new ATOM 0 HG2 LYS A 49 77.484 -15.906 2.678 1.00 0.00 H new ATOM 0 HG3 LYS A 49 77.035 -15.036 1.224 1.00 0.00 H new ATOM 0 HD2 LYS A 49 78.540 -16.809 -0.035 1.00 0.00 H new ATOM 0 HD3 LYS A 49 78.415 -17.745 1.441 1.00 0.00 H new ATOM 0 HE2 LYS A 49 76.118 -16.778 -0.330 1.00 0.00 H new ATOM 0 HE3 LYS A 49 76.583 -18.438 -0.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 75.157 -18.396 1.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 76.190 -17.313 2.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 74.913 -16.722 1.529 1.00 0.00 H new ATOM 786 N ASP A 50 81.537 -13.647 2.448 1.00 0.00 N ATOM 787 CA ASP A 50 82.851 -12.928 2.343 1.00 0.00 C ATOM 788 C ASP A 50 83.247 -12.352 3.705 1.00 0.00 C ATOM 789 O ASP A 50 82.765 -11.320 4.136 1.00 0.00 O ATOM 790 CB ASP A 50 82.737 -11.799 1.316 1.00 0.00 C ATOM 791 CG ASP A 50 82.631 -12.395 -0.091 1.00 0.00 C ATOM 792 OD1 ASP A 50 83.037 -13.533 -0.260 1.00 0.00 O ATOM 793 OD2 ASP A 50 82.155 -11.702 -0.975 1.00 0.00 O ATOM 0 H ASP A 50 80.714 -13.044 2.433 1.00 0.00 H new ATOM 0 HA ASP A 50 83.618 -13.633 2.023 1.00 0.00 H new ATOM 0 HB2 ASP A 50 81.861 -11.186 1.530 1.00 0.00 H new ATOM 0 HB3 ASP A 50 83.607 -11.145 1.381 1.00 0.00 H new ATOM 798 N ALA A 51 84.142 -13.015 4.375 1.00 0.00 N ATOM 799 CA ALA A 51 84.602 -12.532 5.701 1.00 0.00 C ATOM 800 C ALA A 51 85.472 -11.300 5.500 1.00 0.00 C ATOM 801 O ALA A 51 85.715 -10.544 6.409 1.00 0.00 O ATOM 802 CB ALA A 51 85.420 -13.629 6.385 1.00 0.00 C ATOM 0 H ALA A 51 84.579 -13.880 4.057 1.00 0.00 H new ATOM 0 HA ALA A 51 83.744 -12.281 6.324 1.00 0.00 H new ATOM 0 HB1 ALA A 51 85.759 -13.276 7.359 1.00 0.00 H new ATOM 0 HB2 ALA A 51 84.801 -14.517 6.516 1.00 0.00 H new ATOM 0 HB3 ALA A 51 86.284 -13.877 5.768 1.00 0.00 H new ATOM 808 N ASP A 52 85.950 -11.109 4.307 1.00 0.00 N ATOM 809 CA ASP A 52 86.807 -9.932 4.010 1.00 0.00 C ATOM 810 C ASP A 52 85.952 -8.668 4.026 1.00 0.00 C ATOM 811 O ASP A 52 86.370 -7.636 4.498 1.00 0.00 O ATOM 812 CB ASP A 52 87.452 -10.091 2.632 1.00 0.00 C ATOM 813 CG ASP A 52 88.512 -9.003 2.442 1.00 0.00 C ATOM 814 OD1 ASP A 52 88.506 -8.057 3.214 1.00 0.00 O ATOM 815 OD2 ASP A 52 89.311 -9.135 1.532 1.00 0.00 O ATOM 0 H ASP A 52 85.781 -11.727 3.513 1.00 0.00 H new ATOM 0 HA ASP A 52 87.589 -9.858 4.765 1.00 0.00 H new ATOM 0 HB2 ASP A 52 87.907 -11.078 2.542 1.00 0.00 H new ATOM 0 HB3 ASP A 52 86.694 -10.017 1.852 1.00 0.00 H new ATOM 820 N ALA A 53 84.758 -8.738 3.496 1.00 0.00 N ATOM 821 CA ALA A 53 83.882 -7.524 3.477 1.00 0.00 C ATOM 822 C ALA A 53 83.521 -7.141 4.903 1.00 0.00 C ATOM 823 O ALA A 53 83.698 -6.015 5.315 1.00 0.00 O ATOM 824 CB ALA A 53 82.609 -7.824 2.691 1.00 0.00 C ATOM 0 H ALA A 53 84.352 -9.575 3.078 1.00 0.00 H new ATOM 0 HA ALA A 53 84.413 -6.699 3.001 1.00 0.00 H new ATOM 0 HB1 ALA A 53 81.972 -6.939 2.678 1.00 0.00 H new ATOM 0 HB2 ALA A 53 82.869 -8.099 1.669 1.00 0.00 H new ATOM 0 HB3 ALA A 53 82.075 -8.648 3.164 1.00 0.00 H new ATOM 830 N VAL A 54 83.043 -8.078 5.667 1.00 0.00 N ATOM 831 CA VAL A 54 82.692 -7.772 7.094 1.00 0.00 C ATOM 832 C VAL A 54 83.964 -7.296 7.794 1.00 0.00 C ATOM 833 O VAL A 54 83.930 -6.434 8.634 1.00 0.00 O ATOM 834 CB VAL A 54 82.132 -9.060 7.771 1.00 0.00 C ATOM 835 CG1 VAL A 54 82.695 -9.242 9.195 1.00 0.00 C ATOM 836 CG2 VAL A 54 80.595 -8.982 7.864 1.00 0.00 C ATOM 0 H VAL A 54 82.878 -9.041 5.375 1.00 0.00 H new ATOM 0 HA VAL A 54 81.929 -6.996 7.157 1.00 0.00 H new ATOM 0 HB VAL A 54 82.437 -9.908 7.157 1.00 0.00 H new ATOM 0 HG11 VAL A 54 82.283 -10.150 9.636 1.00 0.00 H new ATOM 0 HG12 VAL A 54 83.781 -9.322 9.149 1.00 0.00 H new ATOM 0 HG13 VAL A 54 82.419 -8.384 9.808 1.00 0.00 H new ATOM 0 HG21 VAL A 54 80.213 -9.886 8.338 1.00 0.00 H new ATOM 0 HG22 VAL A 54 80.310 -8.113 8.457 1.00 0.00 H new ATOM 0 HG23 VAL A 54 80.174 -8.892 6.863 1.00 0.00 H new ATOM 846 N ASP A 55 85.072 -7.865 7.457 1.00 0.00 N ATOM 847 CA ASP A 55 86.354 -7.471 8.109 1.00 0.00 C ATOM 848 C ASP A 55 86.636 -5.983 7.861 1.00 0.00 C ATOM 849 O ASP A 55 87.090 -5.276 8.739 1.00 0.00 O ATOM 850 CB ASP A 55 87.488 -8.324 7.524 1.00 0.00 C ATOM 851 CG ASP A 55 88.816 -7.953 8.191 1.00 0.00 C ATOM 852 OD1 ASP A 55 88.865 -6.924 8.844 1.00 0.00 O ATOM 853 OD2 ASP A 55 89.764 -8.708 8.039 1.00 0.00 O ATOM 0 H ASP A 55 85.155 -8.596 6.750 1.00 0.00 H new ATOM 0 HA ASP A 55 86.285 -7.635 9.184 1.00 0.00 H new ATOM 0 HB2 ASP A 55 87.276 -9.382 7.679 1.00 0.00 H new ATOM 0 HB3 ASP A 55 87.555 -8.167 6.448 1.00 0.00 H new ATOM 858 N LYS A 56 86.365 -5.496 6.682 1.00 0.00 N ATOM 859 CA LYS A 56 86.611 -4.052 6.390 1.00 0.00 C ATOM 860 C LYS A 56 85.632 -3.201 7.209 1.00 0.00 C ATOM 861 O LYS A 56 85.965 -2.151 7.740 1.00 0.00 O ATOM 862 CB LYS A 56 86.377 -3.804 4.897 1.00 0.00 C ATOM 863 CG LYS A 56 86.785 -2.373 4.530 1.00 0.00 C ATOM 864 CD LYS A 56 86.351 -2.064 3.092 1.00 0.00 C ATOM 865 CE LYS A 56 87.240 -2.819 2.101 1.00 0.00 C ATOM 866 NZ LYS A 56 87.074 -2.223 0.748 1.00 0.00 N ATOM 0 H LYS A 56 85.983 -6.035 5.905 1.00 0.00 H new ATOM 0 HA LYS A 56 87.634 -3.784 6.653 1.00 0.00 H new ATOM 0 HB2 LYS A 56 86.953 -4.517 4.307 1.00 0.00 H new ATOM 0 HB3 LYS A 56 85.327 -3.965 4.654 1.00 0.00 H new ATOM 0 HG2 LYS A 56 86.324 -1.665 5.219 1.00 0.00 H new ATOM 0 HG3 LYS A 56 87.864 -2.256 4.627 1.00 0.00 H new ATOM 0 HD2 LYS A 56 85.309 -2.350 2.949 1.00 0.00 H new ATOM 0 HD3 LYS A 56 86.416 -0.992 2.907 1.00 0.00 H new ATOM 0 HE2 LYS A 56 88.283 -2.762 2.412 1.00 0.00 H new ATOM 0 HE3 LYS A 56 86.970 -3.875 2.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 87.675 -2.731 0.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 86.079 -2.300 0.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 87.351 -1.221 0.774 1.00 0.00 H new ATOM 880 N ILE A 57 84.418 -3.653 7.304 1.00 0.00 N ATOM 881 CA ILE A 57 83.389 -2.901 8.064 1.00 0.00 C ATOM 882 C ILE A 57 83.833 -2.755 9.520 1.00 0.00 C ATOM 883 O ILE A 57 83.676 -1.718 10.126 1.00 0.00 O ATOM 884 CB ILE A 57 82.065 -3.672 7.988 1.00 0.00 C ATOM 885 CG1 ILE A 57 81.563 -3.688 6.536 1.00 0.00 C ATOM 886 CG2 ILE A 57 81.022 -3.000 8.876 1.00 0.00 C ATOM 887 CD1 ILE A 57 80.375 -4.657 6.378 1.00 0.00 C ATOM 0 H ILE A 57 84.091 -4.522 6.882 1.00 0.00 H new ATOM 0 HA ILE A 57 83.258 -1.906 7.639 1.00 0.00 H new ATOM 0 HB ILE A 57 82.226 -4.694 8.331 1.00 0.00 H new ATOM 0 HG12 ILE A 57 81.261 -2.684 6.240 1.00 0.00 H new ATOM 0 HG13 ILE A 57 82.373 -3.986 5.870 1.00 0.00 H new ATOM 0 HG21 ILE A 57 80.084 -3.552 8.818 1.00 0.00 H new ATOM 0 HG22 ILE A 57 81.374 -2.991 9.908 1.00 0.00 H new ATOM 0 HG23 ILE A 57 80.862 -1.976 8.538 1.00 0.00 H new ATOM 0 HD11 ILE A 57 80.036 -4.652 5.342 1.00 0.00 H new ATOM 0 HD12 ILE A 57 80.688 -5.664 6.652 1.00 0.00 H new ATOM 0 HD13 ILE A 57 79.559 -4.341 7.028 1.00 0.00 H new ATOM 899 N MET A 58 84.406 -3.784 10.074 1.00 0.00 N ATOM 900 CA MET A 58 84.877 -3.717 11.486 1.00 0.00 C ATOM 901 C MET A 58 85.926 -2.615 11.625 1.00 0.00 C ATOM 902 O MET A 58 86.084 -2.038 12.676 1.00 0.00 O ATOM 903 CB MET A 58 85.481 -5.070 11.899 1.00 0.00 C ATOM 904 CG MET A 58 84.359 -6.028 12.322 1.00 0.00 C ATOM 905 SD MET A 58 83.028 -5.986 11.094 1.00 0.00 S ATOM 906 CE MET A 58 81.625 -6.106 12.232 1.00 0.00 C ATOM 0 H MET A 58 84.570 -4.676 9.607 1.00 0.00 H new ATOM 0 HA MET A 58 84.032 -3.492 12.137 1.00 0.00 H new ATOM 0 HB2 MET A 58 86.044 -5.497 11.069 1.00 0.00 H new ATOM 0 HB3 MET A 58 86.183 -4.930 12.721 1.00 0.00 H new ATOM 0 HG2 MET A 58 84.749 -7.042 12.416 1.00 0.00 H new ATOM 0 HG3 MET A 58 83.973 -5.743 13.301 1.00 0.00 H new ATOM 0 HE1 MET A 58 80.695 -5.972 11.679 1.00 0.00 H new ATOM 0 HE2 MET A 58 81.626 -7.087 12.708 1.00 0.00 H new ATOM 0 HE3 MET A 58 81.708 -5.332 12.995 1.00 0.00 H new ATOM 916 N LYS A 59 86.658 -2.330 10.588 1.00 0.00 N ATOM 917 CA LYS A 59 87.701 -1.272 10.687 1.00 0.00 C ATOM 918 C LYS A 59 87.053 0.065 11.039 1.00 0.00 C ATOM 919 O LYS A 59 87.596 0.837 11.789 1.00 0.00 O ATOM 920 CB LYS A 59 88.462 -1.154 9.365 1.00 0.00 C ATOM 921 CG LYS A 59 89.206 -2.463 9.096 1.00 0.00 C ATOM 922 CD LYS A 59 89.972 -2.361 7.778 1.00 0.00 C ATOM 923 CE LYS A 59 90.709 -3.677 7.526 1.00 0.00 C ATOM 924 NZ LYS A 59 91.802 -3.832 8.530 1.00 0.00 N ATOM 0 H LYS A 59 86.581 -2.782 9.677 1.00 0.00 H new ATOM 0 HA LYS A 59 88.406 -1.544 11.473 1.00 0.00 H new ATOM 0 HB2 LYS A 59 87.770 -0.941 8.551 1.00 0.00 H new ATOM 0 HB3 LYS A 59 89.167 -0.324 9.410 1.00 0.00 H new ATOM 0 HG2 LYS A 59 89.896 -2.674 9.913 1.00 0.00 H new ATOM 0 HG3 LYS A 59 88.499 -3.292 9.053 1.00 0.00 H new ATOM 0 HD2 LYS A 59 89.284 -2.152 6.958 1.00 0.00 H new ATOM 0 HD3 LYS A 59 90.681 -1.534 7.818 1.00 0.00 H new ATOM 0 HE2 LYS A 59 90.015 -4.515 7.595 1.00 0.00 H new ATOM 0 HE3 LYS A 59 91.122 -3.688 6.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 92.493 -4.529 8.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 92.275 -2.917 8.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 91.401 -4.158 9.432 1.00 0.00 H new ATOM 938 N GLU A 60 85.913 0.363 10.482 1.00 0.00 N ATOM 939 CA GLU A 60 85.250 1.652 10.777 1.00 0.00 C ATOM 940 C GLU A 60 84.762 1.686 12.242 1.00 0.00 C ATOM 941 O GLU A 60 84.838 2.694 12.914 1.00 0.00 O ATOM 942 CB GLU A 60 84.056 1.784 9.830 1.00 0.00 C ATOM 943 CG GLU A 60 84.550 2.009 8.395 1.00 0.00 C ATOM 944 CD GLU A 60 85.216 3.382 8.281 1.00 0.00 C ATOM 945 OE1 GLU A 60 84.547 4.366 8.545 1.00 0.00 O ATOM 946 OE2 GLU A 60 86.382 3.424 7.922 1.00 0.00 O ATOM 0 H GLU A 60 85.412 -0.240 9.830 1.00 0.00 H new ATOM 0 HA GLU A 60 85.950 2.476 10.637 1.00 0.00 H new ATOM 0 HB2 GLU A 60 83.443 0.884 9.876 1.00 0.00 H new ATOM 0 HB3 GLU A 60 83.424 2.616 10.141 1.00 0.00 H new ATOM 0 HG2 GLU A 60 85.258 1.228 8.119 1.00 0.00 H new ATOM 0 HG3 GLU A 60 83.714 1.942 7.699 1.00 0.00 H new ATOM 953 N LEU A 61 84.242 0.593 12.719 1.00 0.00 N ATOM 954 CA LEU A 61 83.713 0.520 14.114 1.00 0.00 C ATOM 955 C LEU A 61 84.842 0.588 15.151 1.00 0.00 C ATOM 956 O LEU A 61 84.648 1.043 16.262 1.00 0.00 O ATOM 957 CB LEU A 61 82.977 -0.822 14.290 1.00 0.00 C ATOM 958 CG LEU A 61 81.621 -0.858 13.546 1.00 0.00 C ATOM 959 CD1 LEU A 61 80.534 -0.275 14.436 1.00 0.00 C ATOM 960 CD2 LEU A 61 81.649 -0.079 12.220 1.00 0.00 C ATOM 0 H LEU A 61 84.158 -0.275 12.191 1.00 0.00 H new ATOM 0 HA LEU A 61 83.046 1.368 14.271 1.00 0.00 H new ATOM 0 HB2 LEU A 61 83.610 -1.630 13.924 1.00 0.00 H new ATOM 0 HB3 LEU A 61 82.810 -1.004 15.352 1.00 0.00 H new ATOM 0 HG LEU A 61 81.415 -1.903 13.313 1.00 0.00 H new ATOM 0 HD11 LEU A 61 79.580 -0.301 13.910 1.00 0.00 H new ATOM 0 HD12 LEU A 61 80.460 -0.862 15.352 1.00 0.00 H new ATOM 0 HD13 LEU A 61 80.782 0.757 14.685 1.00 0.00 H new ATOM 0 HD21 LEU A 61 80.671 -0.139 11.742 1.00 0.00 H new ATOM 0 HD22 LEU A 61 81.894 0.965 12.416 1.00 0.00 H new ATOM 0 HD23 LEU A 61 82.402 -0.510 11.561 1.00 0.00 H new ATOM 972 N ASP A 62 86.001 0.106 14.816 1.00 0.00 N ATOM 973 CA ASP A 62 87.133 0.100 15.796 1.00 0.00 C ATOM 974 C ASP A 62 87.988 1.359 15.657 1.00 0.00 C ATOM 975 O ASP A 62 88.572 1.835 16.609 1.00 0.00 O ATOM 976 CB ASP A 62 88.010 -1.127 15.532 1.00 0.00 C ATOM 977 CG ASP A 62 89.044 -1.273 16.652 1.00 0.00 C ATOM 978 OD1 ASP A 62 89.361 -0.275 17.277 1.00 0.00 O ATOM 979 OD2 ASP A 62 89.499 -2.384 16.869 1.00 0.00 O ATOM 0 H ASP A 62 86.221 -0.288 13.901 1.00 0.00 H new ATOM 0 HA ASP A 62 86.720 0.071 16.804 1.00 0.00 H new ATOM 0 HB2 ASP A 62 87.391 -2.023 15.476 1.00 0.00 H new ATOM 0 HB3 ASP A 62 88.513 -1.026 14.570 1.00 0.00 H new ATOM 984 N GLU A 63 88.079 1.892 14.480 1.00 0.00 N ATOM 985 CA GLU A 63 88.911 3.104 14.278 1.00 0.00 C ATOM 986 C GLU A 63 88.231 4.292 14.957 1.00 0.00 C ATOM 987 O GLU A 63 88.872 5.207 15.432 1.00 0.00 O ATOM 988 CB GLU A 63 89.094 3.334 12.770 1.00 0.00 C ATOM 989 CG GLU A 63 87.836 3.935 12.150 1.00 0.00 C ATOM 990 CD GLU A 63 88.050 4.091 10.644 1.00 0.00 C ATOM 991 OE1 GLU A 63 89.175 3.915 10.207 1.00 0.00 O ATOM 992 OE2 GLU A 63 87.089 4.392 9.955 1.00 0.00 O ATOM 0 H GLU A 63 87.612 1.541 13.644 1.00 0.00 H new ATOM 0 HA GLU A 63 89.898 2.981 14.724 1.00 0.00 H new ATOM 0 HB2 GLU A 63 89.940 3.999 12.600 1.00 0.00 H new ATOM 0 HB3 GLU A 63 89.329 2.389 12.281 1.00 0.00 H new ATOM 0 HG2 GLU A 63 86.977 3.293 12.344 1.00 0.00 H new ATOM 0 HG3 GLU A 63 87.619 4.903 12.602 1.00 0.00 H new ATOM 999 N ASN A 64 86.928 4.276 15.006 1.00 0.00 N ATOM 1000 CA ASN A 64 86.189 5.391 15.655 1.00 0.00 C ATOM 1001 C ASN A 64 84.787 4.912 16.032 1.00 0.00 C ATOM 1002 O ASN A 64 83.796 5.519 15.681 1.00 0.00 O ATOM 1003 CB ASN A 64 86.101 6.586 14.697 1.00 0.00 C ATOM 1004 CG ASN A 64 85.154 6.260 13.537 1.00 0.00 C ATOM 1005 OD1 ASN A 64 85.273 5.119 12.916 1.00 0.00 O flip ATOM 1006 ND2 ASN A 64 84.296 7.051 13.195 1.00 0.00 N flip ATOM 0 H ASN A 64 86.342 3.535 14.622 1.00 0.00 H new ATOM 0 HA ASN A 64 86.717 5.705 16.555 1.00 0.00 H new ATOM 0 HB2 ASN A 64 85.744 7.466 15.232 1.00 0.00 H new ATOM 0 HB3 ASN A 64 87.092 6.827 14.312 1.00 0.00 H new ATOM 0 HD21 ASN A 64 84.202 7.943 13.680 1.00 0.00 H new ATOM 0 HD22 ASN A 64 83.670 6.822 12.423 1.00 0.00 H new ATOM 1013 N GLY A 65 84.697 3.824 16.751 1.00 0.00 N ATOM 1014 CA GLY A 65 83.361 3.307 17.154 1.00 0.00 C ATOM 1015 C GLY A 65 82.548 4.453 17.763 1.00 0.00 C ATOM 1016 O GLY A 65 81.334 4.465 17.716 1.00 0.00 O ATOM 0 H GLY A 65 85.492 3.273 17.075 1.00 0.00 H new ATOM 0 HA2 GLY A 65 82.841 2.893 16.290 1.00 0.00 H new ATOM 0 HA3 GLY A 65 83.472 2.498 17.876 1.00 0.00 H new ATOM 1020 N ASP A 66 83.218 5.420 18.335 1.00 0.00 N ATOM 1021 CA ASP A 66 82.500 6.571 18.953 1.00 0.00 C ATOM 1022 C ASP A 66 82.125 7.601 17.878 1.00 0.00 C ATOM 1023 O ASP A 66 81.475 8.589 18.159 1.00 0.00 O ATOM 1024 CB ASP A 66 83.408 7.231 19.993 1.00 0.00 C ATOM 1025 CG ASP A 66 84.692 7.724 19.321 1.00 0.00 C ATOM 1026 OD1 ASP A 66 85.011 7.223 18.256 1.00 0.00 O ATOM 1027 OD2 ASP A 66 85.335 8.593 19.885 1.00 0.00 O ATOM 0 H ASP A 66 84.235 5.461 18.400 1.00 0.00 H new ATOM 0 HA ASP A 66 81.589 6.209 19.430 1.00 0.00 H new ATOM 0 HB2 ASP A 66 82.890 8.066 20.464 1.00 0.00 H new ATOM 0 HB3 ASP A 66 83.650 6.519 20.782 1.00 0.00 H new ATOM 1032 N GLY A 67 82.518 7.379 16.651 1.00 0.00 N ATOM 1033 CA GLY A 67 82.173 8.347 15.575 1.00 0.00 C ATOM 1034 C GLY A 67 80.669 8.290 15.318 1.00 0.00 C ATOM 1035 O GLY A 67 79.883 8.083 16.224 1.00 0.00 O ATOM 0 H GLY A 67 83.062 6.570 16.350 1.00 0.00 H new ATOM 0 HA2 GLY A 67 82.467 9.355 15.867 1.00 0.00 H new ATOM 0 HA3 GLY A 67 82.720 8.107 14.663 1.00 0.00 H new ATOM 1039 N GLU A 68 80.255 8.467 14.093 1.00 0.00 N ATOM 1040 CA GLU A 68 78.793 8.416 13.798 1.00 0.00 C ATOM 1041 C GLU A 68 78.535 8.094 12.328 1.00 0.00 C ATOM 1042 O GLU A 68 79.350 8.340 11.463 1.00 0.00 O ATOM 1043 CB GLU A 68 78.156 9.758 14.165 1.00 0.00 C ATOM 1044 CG GLU A 68 78.828 10.877 13.377 1.00 0.00 C ATOM 1045 CD GLU A 68 78.185 12.212 13.754 1.00 0.00 C ATOM 1046 OE1 GLU A 68 77.115 12.186 14.338 1.00 0.00 O ATOM 1047 OE2 GLU A 68 78.777 13.237 13.458 1.00 0.00 O ATOM 0 H GLU A 68 80.859 8.643 13.290 1.00 0.00 H new ATOM 0 HA GLU A 68 78.345 7.621 14.394 1.00 0.00 H new ATOM 0 HB2 GLU A 68 77.088 9.737 13.947 1.00 0.00 H new ATOM 0 HB3 GLU A 68 78.259 9.940 15.235 1.00 0.00 H new ATOM 0 HG2 GLU A 68 79.896 10.900 13.593 1.00 0.00 H new ATOM 0 HG3 GLU A 68 78.723 10.698 12.307 1.00 0.00 H new ATOM 1054 N VAL A 69 77.381 7.540 12.060 1.00 0.00 N ATOM 1055 CA VAL A 69 76.993 7.176 10.666 1.00 0.00 C ATOM 1056 C VAL A 69 75.590 7.704 10.401 1.00 0.00 C ATOM 1057 O VAL A 69 74.819 7.917 11.322 1.00 0.00 O ATOM 1058 CB VAL A 69 76.976 5.652 10.524 1.00 0.00 C ATOM 1059 CG1 VAL A 69 78.416 5.127 10.554 1.00 0.00 C ATOM 1060 CG2 VAL A 69 76.140 5.013 11.673 1.00 0.00 C ATOM 0 H VAL A 69 76.677 7.320 12.765 1.00 0.00 H new ATOM 0 HA VAL A 69 77.705 7.604 9.960 1.00 0.00 H new ATOM 0 HB VAL A 69 76.514 5.381 9.575 1.00 0.00 H new ATOM 0 HG11 VAL A 69 78.410 4.042 10.453 1.00 0.00 H new ATOM 0 HG12 VAL A 69 78.980 5.565 9.730 1.00 0.00 H new ATOM 0 HG13 VAL A 69 78.883 5.401 11.500 1.00 0.00 H new ATOM 0 HG21 VAL A 69 76.136 3.929 11.560 1.00 0.00 H new ATOM 0 HG22 VAL A 69 76.582 5.276 12.634 1.00 0.00 H new ATOM 0 HG23 VAL A 69 75.117 5.386 11.629 1.00 0.00 H new ATOM 1070 N ASP A 70 75.243 7.900 9.151 1.00 0.00 N ATOM 1071 CA ASP A 70 73.885 8.404 8.810 1.00 0.00 C ATOM 1072 C ASP A 70 73.236 7.436 7.831 1.00 0.00 C ATOM 1073 O ASP A 70 73.556 6.272 7.787 1.00 0.00 O ATOM 1074 CB ASP A 70 73.996 9.775 8.147 1.00 0.00 C ATOM 1075 CG ASP A 70 74.841 10.698 9.021 1.00 0.00 C ATOM 1076 OD1 ASP A 70 75.092 10.336 10.158 1.00 0.00 O ATOM 1077 OD2 ASP A 70 75.219 11.752 8.541 1.00 0.00 O ATOM 0 H ASP A 70 75.851 7.729 8.350 1.00 0.00 H new ATOM 0 HA ASP A 70 73.287 8.486 9.718 1.00 0.00 H new ATOM 0 HB2 ASP A 70 74.448 9.678 7.160 1.00 0.00 H new ATOM 0 HB3 ASP A 70 73.004 10.202 8.002 1.00 0.00 H new ATOM 1082 N PHE A 71 72.308 7.910 7.062 1.00 0.00 N ATOM 1083 CA PHE A 71 71.610 7.019 6.101 1.00 0.00 C ATOM 1084 C PHE A 71 72.552 6.460 5.037 1.00 0.00 C ATOM 1085 O PHE A 71 72.495 5.303 4.719 1.00 0.00 O ATOM 1086 CB PHE A 71 70.507 7.811 5.406 1.00 0.00 C ATOM 1087 CG PHE A 71 71.092 9.094 4.862 1.00 0.00 C ATOM 1088 CD1 PHE A 71 71.694 9.106 3.600 1.00 0.00 C ATOM 1089 CD2 PHE A 71 71.041 10.267 5.621 1.00 0.00 C ATOM 1090 CE1 PHE A 71 72.240 10.287 3.094 1.00 0.00 C ATOM 1091 CE2 PHE A 71 71.587 11.453 5.115 1.00 0.00 C ATOM 1092 CZ PHE A 71 72.186 11.462 3.849 1.00 0.00 C ATOM 0 H PHE A 71 71.999 8.882 7.055 1.00 0.00 H new ATOM 0 HA PHE A 71 71.204 6.179 6.664 1.00 0.00 H new ATOM 0 HB2 PHE A 71 70.073 7.223 4.598 1.00 0.00 H new ATOM 0 HB3 PHE A 71 69.702 8.032 6.107 1.00 0.00 H new ATOM 0 HD1 PHE A 71 71.737 8.199 3.015 1.00 0.00 H new ATOM 0 HD2 PHE A 71 70.580 10.258 6.598 1.00 0.00 H new ATOM 0 HE1 PHE A 71 72.704 10.293 2.119 1.00 0.00 H new ATOM 0 HE2 PHE A 71 71.546 12.360 5.700 1.00 0.00 H new ATOM 0 HZ PHE A 71 72.606 12.376 3.456 1.00 0.00 H new ATOM 1102 N GLN A 72 73.385 7.258 4.454 1.00 0.00 N ATOM 1103 CA GLN A 72 74.280 6.721 3.388 1.00 0.00 C ATOM 1104 C GLN A 72 75.388 5.910 4.019 1.00 0.00 C ATOM 1105 O GLN A 72 75.900 4.975 3.442 1.00 0.00 O ATOM 1106 CB GLN A 72 74.892 7.887 2.593 1.00 0.00 C ATOM 1107 CG GLN A 72 75.772 7.373 1.440 1.00 0.00 C ATOM 1108 CD GLN A 72 76.668 8.514 0.946 1.00 0.00 C ATOM 1109 OE1 GLN A 72 76.755 8.770 -0.238 1.00 0.00 O ATOM 1110 NE2 GLN A 72 77.338 9.220 1.818 1.00 0.00 N ATOM 0 H GLN A 72 73.492 8.251 4.660 1.00 0.00 H new ATOM 0 HA GLN A 72 73.701 6.087 2.717 1.00 0.00 H new ATOM 0 HB2 GLN A 72 74.096 8.516 2.194 1.00 0.00 H new ATOM 0 HB3 GLN A 72 75.488 8.511 3.259 1.00 0.00 H new ATOM 0 HG2 GLN A 72 76.382 6.535 1.777 1.00 0.00 H new ATOM 0 HG3 GLN A 72 75.148 7.005 0.626 1.00 0.00 H new ATOM 0 HE21 GLN A 72 77.265 9.005 2.812 1.00 0.00 H new ATOM 0 HE22 GLN A 72 77.934 9.986 1.504 1.00 0.00 H new ATOM 1119 N GLU A 73 75.796 6.288 5.179 1.00 0.00 N ATOM 1120 CA GLU A 73 76.922 5.552 5.824 1.00 0.00 C ATOM 1121 C GLU A 73 76.444 4.245 6.439 1.00 0.00 C ATOM 1122 O GLU A 73 77.127 3.242 6.364 1.00 0.00 O ATOM 1123 CB GLU A 73 77.610 6.405 6.886 1.00 0.00 C ATOM 1124 CG GLU A 73 78.178 7.676 6.240 1.00 0.00 C ATOM 1125 CD GLU A 73 78.925 8.500 7.290 1.00 0.00 C ATOM 1126 OE1 GLU A 73 79.312 7.932 8.298 1.00 0.00 O ATOM 1127 OE2 GLU A 73 79.108 9.685 7.063 1.00 0.00 O ATOM 0 H GLU A 73 75.411 7.066 5.715 1.00 0.00 H new ATOM 0 HA GLU A 73 77.646 5.326 5.042 1.00 0.00 H new ATOM 0 HB2 GLU A 73 76.900 6.670 7.670 1.00 0.00 H new ATOM 0 HB3 GLU A 73 78.411 5.837 7.360 1.00 0.00 H new ATOM 0 HG2 GLU A 73 78.852 7.411 5.425 1.00 0.00 H new ATOM 0 HG3 GLU A 73 77.371 8.267 5.807 1.00 0.00 H new ATOM 1134 N PHE A 74 75.295 4.222 7.056 1.00 0.00 N ATOM 1135 CA PHE A 74 74.838 2.945 7.664 1.00 0.00 C ATOM 1136 C PHE A 74 74.258 2.069 6.568 1.00 0.00 C ATOM 1137 O PHE A 74 74.336 0.863 6.616 1.00 0.00 O ATOM 1138 CB PHE A 74 73.815 3.252 8.780 1.00 0.00 C ATOM 1139 CG PHE A 74 72.406 2.770 8.460 1.00 0.00 C ATOM 1140 CD1 PHE A 74 72.145 1.403 8.345 1.00 0.00 C ATOM 1141 CD2 PHE A 74 71.365 3.693 8.292 1.00 0.00 C ATOM 1142 CE1 PHE A 74 70.850 0.956 8.057 1.00 0.00 C ATOM 1143 CE2 PHE A 74 70.070 3.246 8.007 1.00 0.00 C ATOM 1144 CZ PHE A 74 69.816 1.875 7.888 1.00 0.00 C ATOM 0 H PHE A 74 74.664 5.017 7.164 1.00 0.00 H new ATOM 0 HA PHE A 74 75.666 2.405 8.123 1.00 0.00 H new ATOM 0 HB2 PHE A 74 74.149 2.785 9.707 1.00 0.00 H new ATOM 0 HB3 PHE A 74 73.792 4.328 8.955 1.00 0.00 H new ATOM 0 HD1 PHE A 74 72.944 0.689 8.479 1.00 0.00 H new ATOM 0 HD2 PHE A 74 71.563 4.751 8.383 1.00 0.00 H new ATOM 0 HE1 PHE A 74 70.652 -0.102 7.966 1.00 0.00 H new ATOM 0 HE2 PHE A 74 69.268 3.958 7.879 1.00 0.00 H new ATOM 0 HZ PHE A 74 68.818 1.529 7.665 1.00 0.00 H new ATOM 1154 N VAL A 75 73.678 2.669 5.585 1.00 0.00 N ATOM 1155 CA VAL A 75 73.089 1.849 4.485 1.00 0.00 C ATOM 1156 C VAL A 75 74.209 1.205 3.682 1.00 0.00 C ATOM 1157 O VAL A 75 74.109 0.075 3.265 1.00 0.00 O ATOM 1158 CB VAL A 75 72.225 2.713 3.562 1.00 0.00 C ATOM 1159 CG1 VAL A 75 71.815 1.908 2.321 1.00 0.00 C ATOM 1160 CG2 VAL A 75 70.970 3.142 4.316 1.00 0.00 C ATOM 0 H VAL A 75 73.581 3.679 5.485 1.00 0.00 H new ATOM 0 HA VAL A 75 72.456 1.078 4.925 1.00 0.00 H new ATOM 0 HB VAL A 75 72.795 3.588 3.249 1.00 0.00 H new ATOM 0 HG11 VAL A 75 71.201 2.530 1.670 1.00 0.00 H new ATOM 0 HG12 VAL A 75 72.708 1.590 1.782 1.00 0.00 H new ATOM 0 HG13 VAL A 75 71.245 1.031 2.628 1.00 0.00 H new ATOM 0 HG21 VAL A 75 70.348 3.758 3.667 1.00 0.00 H new ATOM 0 HG22 VAL A 75 70.410 2.259 4.623 1.00 0.00 H new ATOM 0 HG23 VAL A 75 71.254 3.716 5.198 1.00 0.00 H new ATOM 1170 N VAL A 76 75.263 1.922 3.445 1.00 0.00 N ATOM 1171 CA VAL A 76 76.383 1.360 2.653 1.00 0.00 C ATOM 1172 C VAL A 76 77.080 0.246 3.452 1.00 0.00 C ATOM 1173 O VAL A 76 77.463 -0.768 2.906 1.00 0.00 O ATOM 1174 CB VAL A 76 77.344 2.496 2.305 1.00 0.00 C ATOM 1175 CG1 VAL A 76 78.630 1.938 1.705 1.00 0.00 C ATOM 1176 CG2 VAL A 76 76.672 3.417 1.280 1.00 0.00 C ATOM 0 H VAL A 76 75.399 2.880 3.768 1.00 0.00 H new ATOM 0 HA VAL A 76 76.017 0.914 1.728 1.00 0.00 H new ATOM 0 HB VAL A 76 77.587 3.049 3.212 1.00 0.00 H new ATOM 0 HG11 VAL A 76 79.304 2.759 1.462 1.00 0.00 H new ATOM 0 HG12 VAL A 76 79.110 1.275 2.425 1.00 0.00 H new ATOM 0 HG13 VAL A 76 78.396 1.380 0.798 1.00 0.00 H new ATOM 0 HG21 VAL A 76 77.349 4.232 1.024 1.00 0.00 H new ATOM 0 HG22 VAL A 76 76.433 2.848 0.381 1.00 0.00 H new ATOM 0 HG23 VAL A 76 75.756 3.827 1.705 1.00 0.00 H new ATOM 1186 N LEU A 77 77.256 0.427 4.734 1.00 0.00 N ATOM 1187 CA LEU A 77 77.928 -0.630 5.557 1.00 0.00 C ATOM 1188 C LEU A 77 77.037 -1.868 5.635 1.00 0.00 C ATOM 1189 O LEU A 77 77.511 -2.977 5.663 1.00 0.00 O ATOM 1190 CB LEU A 77 78.179 -0.096 6.989 1.00 0.00 C ATOM 1191 CG LEU A 77 79.633 0.377 7.152 1.00 0.00 C ATOM 1192 CD1 LEU A 77 79.872 1.633 6.302 1.00 0.00 C ATOM 1193 CD2 LEU A 77 79.897 0.695 8.634 1.00 0.00 C ATOM 0 H LEU A 77 76.965 1.258 5.249 1.00 0.00 H new ATOM 0 HA LEU A 77 78.878 -0.892 5.091 1.00 0.00 H new ATOM 0 HB2 LEU A 77 77.498 0.729 7.198 1.00 0.00 H new ATOM 0 HB3 LEU A 77 77.963 -0.879 7.716 1.00 0.00 H new ATOM 0 HG LEU A 77 80.311 -0.409 6.819 1.00 0.00 H new ATOM 0 HD11 LEU A 77 80.904 1.963 6.422 1.00 0.00 H new ATOM 0 HD12 LEU A 77 79.684 1.404 5.253 1.00 0.00 H new ATOM 0 HD13 LEU A 77 79.198 2.426 6.626 1.00 0.00 H new ATOM 0 HD21 LEU A 77 80.927 1.031 8.756 1.00 0.00 H new ATOM 0 HD22 LEU A 77 79.217 1.481 8.964 1.00 0.00 H new ATOM 0 HD23 LEU A 77 79.734 -0.201 9.233 1.00 0.00 H new ATOM 1205 N VAL A 78 75.762 -1.681 5.711 1.00 0.00 N ATOM 1206 CA VAL A 78 74.847 -2.843 5.822 1.00 0.00 C ATOM 1207 C VAL A 78 74.833 -3.611 4.506 1.00 0.00 C ATOM 1208 O VAL A 78 74.851 -4.819 4.496 1.00 0.00 O ATOM 1209 CB VAL A 78 73.448 -2.355 6.187 1.00 0.00 C ATOM 1210 CG1 VAL A 78 72.452 -3.510 6.050 1.00 0.00 C ATOM 1211 CG2 VAL A 78 73.452 -1.892 7.636 1.00 0.00 C ATOM 0 H VAL A 78 75.306 -0.769 5.701 1.00 0.00 H new ATOM 0 HA VAL A 78 75.194 -3.515 6.607 1.00 0.00 H new ATOM 0 HB VAL A 78 73.162 -1.538 5.525 1.00 0.00 H new ATOM 0 HG11 VAL A 78 71.453 -3.162 6.311 1.00 0.00 H new ATOM 0 HG12 VAL A 78 72.453 -3.872 5.022 1.00 0.00 H new ATOM 0 HG13 VAL A 78 72.740 -4.320 6.720 1.00 0.00 H new ATOM 0 HG21 VAL A 78 72.457 -1.541 7.908 1.00 0.00 H new ATOM 0 HG22 VAL A 78 73.733 -2.723 8.283 1.00 0.00 H new ATOM 0 HG23 VAL A 78 74.169 -1.080 7.756 1.00 0.00 H new ATOM 1221 N ALA A 79 74.838 -2.931 3.398 1.00 0.00 N ATOM 1222 CA ALA A 79 74.874 -3.654 2.102 1.00 0.00 C ATOM 1223 C ALA A 79 76.154 -4.474 2.103 1.00 0.00 C ATOM 1224 O ALA A 79 76.190 -5.611 1.678 1.00 0.00 O ATOM 1225 CB ALA A 79 74.877 -2.652 0.942 1.00 0.00 C ATOM 0 H ALA A 79 74.819 -1.913 3.333 1.00 0.00 H new ATOM 0 HA ALA A 79 74.001 -4.294 1.977 1.00 0.00 H new ATOM 0 HB1 ALA A 79 74.904 -3.192 -0.005 1.00 0.00 H new ATOM 0 HB2 ALA A 79 73.975 -2.041 0.986 1.00 0.00 H new ATOM 0 HB3 ALA A 79 75.754 -2.010 1.018 1.00 0.00 H new ATOM 1231 N ALA A 80 77.204 -3.896 2.612 1.00 0.00 N ATOM 1232 CA ALA A 80 78.492 -4.615 2.691 1.00 0.00 C ATOM 1233 C ALA A 80 78.320 -5.841 3.601 1.00 0.00 C ATOM 1234 O ALA A 80 78.869 -6.883 3.357 1.00 0.00 O ATOM 1235 CB ALA A 80 79.546 -3.650 3.250 1.00 0.00 C ATOM 0 H ALA A 80 77.219 -2.945 2.979 1.00 0.00 H new ATOM 0 HA ALA A 80 78.815 -4.960 1.709 1.00 0.00 H new ATOM 0 HB1 ALA A 80 80.507 -4.160 3.317 1.00 0.00 H new ATOM 0 HB2 ALA A 80 79.638 -2.789 2.588 1.00 0.00 H new ATOM 0 HB3 ALA A 80 79.243 -3.315 4.242 1.00 0.00 H new ATOM 1241 N LEU A 81 77.548 -5.722 4.646 1.00 0.00 N ATOM 1242 CA LEU A 81 77.331 -6.885 5.560 1.00 0.00 C ATOM 1243 C LEU A 81 76.649 -8.018 4.793 1.00 0.00 C ATOM 1244 O LEU A 81 76.967 -9.178 4.967 1.00 0.00 O ATOM 1245 CB LEU A 81 76.443 -6.445 6.733 1.00 0.00 C ATOM 1246 CG LEU A 81 76.192 -7.622 7.693 1.00 0.00 C ATOM 1247 CD1 LEU A 81 77.528 -8.168 8.233 1.00 0.00 C ATOM 1248 CD2 LEU A 81 75.303 -7.149 8.862 1.00 0.00 C ATOM 0 H LEU A 81 77.056 -4.868 4.909 1.00 0.00 H new ATOM 0 HA LEU A 81 78.290 -7.238 5.941 1.00 0.00 H new ATOM 0 HB2 LEU A 81 76.921 -5.626 7.270 1.00 0.00 H new ATOM 0 HB3 LEU A 81 75.493 -6.068 6.355 1.00 0.00 H new ATOM 0 HG LEU A 81 75.686 -8.422 7.152 1.00 0.00 H new ATOM 0 HD11 LEU A 81 77.334 -9.000 8.910 1.00 0.00 H new ATOM 0 HD12 LEU A 81 78.143 -8.513 7.402 1.00 0.00 H new ATOM 0 HD13 LEU A 81 78.054 -7.378 8.770 1.00 0.00 H new ATOM 0 HD21 LEU A 81 75.124 -7.981 9.543 1.00 0.00 H new ATOM 0 HD22 LEU A 81 75.805 -6.343 9.398 1.00 0.00 H new ATOM 0 HD23 LEU A 81 74.351 -6.788 8.472 1.00 0.00 H new ATOM 1260 N THR A 82 75.711 -7.691 3.947 1.00 0.00 N ATOM 1261 CA THR A 82 75.004 -8.740 3.171 1.00 0.00 C ATOM 1262 C THR A 82 76.014 -9.502 2.309 1.00 0.00 C ATOM 1263 O THR A 82 75.944 -10.708 2.178 1.00 0.00 O ATOM 1264 CB THR A 82 73.939 -8.079 2.292 1.00 0.00 C ATOM 1265 OG1 THR A 82 73.232 -7.123 3.066 1.00 0.00 O ATOM 1266 CG2 THR A 82 72.962 -9.143 1.795 1.00 0.00 C ATOM 0 H THR A 82 75.405 -6.736 3.761 1.00 0.00 H new ATOM 0 HA THR A 82 74.520 -9.445 3.847 1.00 0.00 H new ATOM 0 HB THR A 82 74.413 -7.592 1.440 1.00 0.00 H new ATOM 0 HG1 THR A 82 72.549 -6.693 2.510 1.00 0.00 H new ATOM 0 HG21 THR A 82 72.202 -8.675 1.169 1.00 0.00 H new ATOM 0 HG22 THR A 82 73.502 -9.890 1.213 1.00 0.00 H new ATOM 0 HG23 THR A 82 72.483 -9.624 2.648 1.00 0.00 H new ATOM 1274 N VAL A 83 76.960 -8.811 1.727 1.00 0.00 N ATOM 1275 CA VAL A 83 77.976 -9.502 0.880 1.00 0.00 C ATOM 1276 C VAL A 83 78.712 -10.524 1.752 1.00 0.00 C ATOM 1277 O VAL A 83 79.057 -11.603 1.317 1.00 0.00 O ATOM 1278 CB VAL A 83 78.959 -8.449 0.287 1.00 0.00 C ATOM 1279 CG1 VAL A 83 80.255 -8.321 1.111 1.00 0.00 C ATOM 1280 CG2 VAL A 83 79.356 -8.842 -1.133 1.00 0.00 C ATOM 0 H VAL A 83 77.072 -7.800 1.802 1.00 0.00 H new ATOM 0 HA VAL A 83 77.502 -10.022 0.047 1.00 0.00 H new ATOM 0 HB VAL A 83 78.432 -7.495 0.304 1.00 0.00 H new ATOM 0 HG11 VAL A 83 80.904 -7.574 0.654 1.00 0.00 H new ATOM 0 HG12 VAL A 83 80.011 -8.016 2.128 1.00 0.00 H new ATOM 0 HG13 VAL A 83 80.768 -9.282 1.134 1.00 0.00 H new ATOM 0 HG21 VAL A 83 80.043 -8.099 -1.538 1.00 0.00 H new ATOM 0 HG22 VAL A 83 79.843 -9.817 -1.118 1.00 0.00 H new ATOM 0 HG23 VAL A 83 78.465 -8.891 -1.759 1.00 0.00 H new ATOM 1290 N ALA A 84 78.950 -10.173 2.982 1.00 0.00 N ATOM 1291 CA ALA A 84 79.660 -11.087 3.910 1.00 0.00 C ATOM 1292 C ALA A 84 78.768 -12.268 4.257 1.00 0.00 C ATOM 1293 O ALA A 84 79.239 -13.301 4.664 1.00 0.00 O ATOM 1294 CB ALA A 84 80.021 -10.338 5.185 1.00 0.00 C ATOM 0 H ALA A 84 78.678 -9.278 3.388 1.00 0.00 H new ATOM 0 HA ALA A 84 80.567 -11.450 3.428 1.00 0.00 H new ATOM 0 HB1 ALA A 84 80.543 -11.010 5.866 1.00 0.00 H new ATOM 0 HB2 ALA A 84 80.667 -9.495 4.941 1.00 0.00 H new ATOM 0 HB3 ALA A 84 79.112 -9.972 5.662 1.00 0.00 H new ATOM 1300 N CYS A 85 77.480 -12.129 4.116 1.00 0.00 N ATOM 1301 CA CYS A 85 76.576 -13.249 4.441 1.00 0.00 C ATOM 1302 C CYS A 85 75.364 -13.130 3.529 1.00 0.00 C ATOM 1303 O CYS A 85 74.265 -12.878 3.975 1.00 0.00 O ATOM 1304 CB CYS A 85 76.154 -13.161 5.914 1.00 0.00 C ATOM 1305 SG CYS A 85 77.557 -12.608 6.918 1.00 0.00 S ATOM 0 H CYS A 85 77.019 -11.281 3.787 1.00 0.00 H new ATOM 0 HA CYS A 85 77.069 -14.210 4.291 1.00 0.00 H new ATOM 0 HB2 CYS A 85 75.320 -12.467 6.023 1.00 0.00 H new ATOM 0 HB3 CYS A 85 75.806 -14.134 6.262 1.00 0.00 H new ATOM 0 HG CYS A 85 78.666 -13.017 6.376 1.00 0.00 H new ATOM 1311 N ASN A 86 75.569 -13.292 2.245 1.00 0.00 N ATOM 1312 CA ASN A 86 74.434 -13.182 1.287 1.00 0.00 C ATOM 1313 C ASN A 86 73.476 -14.336 1.549 1.00 0.00 C ATOM 1314 O ASN A 86 73.086 -15.065 0.658 1.00 0.00 O ATOM 1315 CB ASN A 86 74.952 -13.258 -0.149 1.00 0.00 C ATOM 1316 CG ASN A 86 73.795 -13.008 -1.120 1.00 0.00 C ATOM 1317 OD1 ASN A 86 73.291 -13.931 -1.731 1.00 0.00 O ATOM 1318 ND2 ASN A 86 73.349 -11.793 -1.296 1.00 0.00 N ATOM 0 H ASN A 86 76.475 -13.496 1.822 1.00 0.00 H new ATOM 0 HA ASN A 86 73.924 -12.228 1.421 1.00 0.00 H new ATOM 0 HB2 ASN A 86 75.738 -12.518 -0.304 1.00 0.00 H new ATOM 0 HB3 ASN A 86 75.394 -14.237 -0.337 1.00 0.00 H new ATOM 0 HD21 ASN A 86 72.580 -11.621 -1.944 1.00 0.00 H new ATOM 0 HD22 ASN A 86 73.769 -11.016 -0.785 1.00 0.00 H new ATOM 1465 N GLU B 3 61.495 -3.587 11.439 1.00 0.00 N ATOM 1466 CA GLU B 3 61.236 -2.685 10.284 1.00 0.00 C ATOM 1467 C GLU B 3 62.411 -2.726 9.295 1.00 0.00 C ATOM 1468 O GLU B 3 62.220 -2.891 8.107 1.00 0.00 O ATOM 1469 CB GLU B 3 61.047 -1.256 10.796 1.00 0.00 C ATOM 1470 CG GLU B 3 59.722 -1.161 11.554 1.00 0.00 C ATOM 1471 CD GLU B 3 59.584 0.231 12.169 1.00 0.00 C ATOM 1472 OE1 GLU B 3 60.066 0.420 13.273 1.00 0.00 O ATOM 1473 OE2 GLU B 3 59.000 1.086 11.523 1.00 0.00 O ATOM 0 HA GLU B 3 60.335 -3.018 9.768 1.00 0.00 H new ATOM 0 HB2 GLU B 3 61.874 -0.980 11.450 1.00 0.00 H new ATOM 0 HB3 GLU B 3 61.053 -0.555 9.961 1.00 0.00 H new ATOM 0 HG2 GLU B 3 58.889 -1.355 10.878 1.00 0.00 H new ATOM 0 HG3 GLU B 3 59.682 -1.921 12.335 1.00 0.00 H new ATOM 1480 N LEU B 4 63.624 -2.566 9.767 1.00 0.00 N ATOM 1481 CA LEU B 4 64.789 -2.581 8.830 1.00 0.00 C ATOM 1482 C LEU B 4 65.018 -3.996 8.278 1.00 0.00 C ATOM 1483 O LEU B 4 65.299 -4.175 7.109 1.00 0.00 O ATOM 1484 CB LEU B 4 66.059 -2.102 9.561 1.00 0.00 C ATOM 1485 CG LEU B 4 65.964 -0.590 9.875 1.00 0.00 C ATOM 1486 CD1 LEU B 4 65.168 -0.358 11.170 1.00 0.00 C ATOM 1487 CD2 LEU B 4 67.369 -0.008 10.042 1.00 0.00 C ATOM 0 H LEU B 4 63.856 -2.427 10.751 1.00 0.00 H new ATOM 0 HA LEU B 4 64.572 -1.909 8.000 1.00 0.00 H new ATOM 0 HB2 LEU B 4 66.188 -2.664 10.486 1.00 0.00 H new ATOM 0 HB3 LEU B 4 66.936 -2.297 8.944 1.00 0.00 H new ATOM 0 HG LEU B 4 65.453 -0.097 9.048 1.00 0.00 H new ATOM 0 HD11 LEU B 4 65.111 0.711 11.376 1.00 0.00 H new ATOM 0 HD12 LEU B 4 64.161 -0.759 11.055 1.00 0.00 H new ATOM 0 HD13 LEU B 4 65.667 -0.861 11.999 1.00 0.00 H new ATOM 0 HD21 LEU B 4 67.298 1.057 10.263 1.00 0.00 H new ATOM 0 HD22 LEU B 4 67.878 -0.515 10.861 1.00 0.00 H new ATOM 0 HD23 LEU B 4 67.934 -0.150 9.121 1.00 0.00 H new ATOM 1499 N GLU B 5 64.907 -5.002 9.101 1.00 0.00 N ATOM 1500 CA GLU B 5 65.131 -6.395 8.607 1.00 0.00 C ATOM 1501 C GLU B 5 64.112 -6.729 7.514 1.00 0.00 C ATOM 1502 O GLU B 5 64.447 -7.273 6.478 1.00 0.00 O ATOM 1503 CB GLU B 5 64.982 -7.379 9.771 1.00 0.00 C ATOM 1504 CG GLU B 5 65.284 -8.801 9.286 1.00 0.00 C ATOM 1505 CD GLU B 5 65.143 -9.778 10.453 1.00 0.00 C ATOM 1506 OE1 GLU B 5 65.015 -9.316 11.574 1.00 0.00 O ATOM 1507 OE2 GLU B 5 65.167 -10.973 10.206 1.00 0.00 O ATOM 0 H GLU B 5 64.672 -4.923 10.090 1.00 0.00 H new ATOM 0 HA GLU B 5 66.136 -6.473 8.192 1.00 0.00 H new ATOM 0 HB2 GLU B 5 65.662 -7.108 10.579 1.00 0.00 H new ATOM 0 HB3 GLU B 5 63.971 -7.329 10.175 1.00 0.00 H new ATOM 0 HG2 GLU B 5 64.600 -9.076 8.483 1.00 0.00 H new ATOM 0 HG3 GLU B 5 66.293 -8.850 8.876 1.00 0.00 H new ATOM 1514 N THR B 6 62.871 -6.409 7.743 1.00 0.00 N ATOM 1515 CA THR B 6 61.810 -6.697 6.739 1.00 0.00 C ATOM 1516 C THR B 6 62.126 -5.972 5.430 1.00 0.00 C ATOM 1517 O THR B 6 61.914 -6.489 4.351 1.00 0.00 O ATOM 1518 CB THR B 6 60.464 -6.214 7.281 1.00 0.00 C ATOM 1519 OG1 THR B 6 60.174 -6.888 8.497 1.00 0.00 O ATOM 1520 CG2 THR B 6 59.368 -6.515 6.263 1.00 0.00 C ATOM 0 H THR B 6 62.542 -5.954 8.594 1.00 0.00 H new ATOM 0 HA THR B 6 61.767 -7.770 6.550 1.00 0.00 H new ATOM 0 HB THR B 6 60.510 -5.140 7.461 1.00 0.00 H new ATOM 0 HG1 THR B 6 59.312 -6.578 8.846 1.00 0.00 H new ATOM 0 HG21 THR B 6 58.408 -6.171 6.649 1.00 0.00 H new ATOM 0 HG22 THR B 6 59.589 -6.000 5.328 1.00 0.00 H new ATOM 0 HG23 THR B 6 59.323 -7.589 6.084 1.00 0.00 H new ATOM 1528 N ALA B 7 62.601 -4.762 5.525 1.00 0.00 N ATOM 1529 CA ALA B 7 62.907 -3.969 4.300 1.00 0.00 C ATOM 1530 C ALA B 7 63.956 -4.689 3.445 1.00 0.00 C ATOM 1531 O ALA B 7 63.870 -4.705 2.238 1.00 0.00 O ATOM 1532 CB ALA B 7 63.449 -2.599 4.720 1.00 0.00 C ATOM 0 H ALA B 7 62.792 -4.284 6.405 1.00 0.00 H new ATOM 0 HA ALA B 7 61.997 -3.852 3.712 1.00 0.00 H new ATOM 0 HB1 ALA B 7 63.677 -2.010 3.832 1.00 0.00 H new ATOM 0 HB2 ALA B 7 62.700 -2.079 5.318 1.00 0.00 H new ATOM 0 HB3 ALA B 7 64.356 -2.732 5.309 1.00 0.00 H new ATOM 1538 N MET B 8 64.948 -5.275 4.056 1.00 0.00 N ATOM 1539 CA MET B 8 66.000 -5.982 3.262 1.00 0.00 C ATOM 1540 C MET B 8 65.371 -7.113 2.432 1.00 0.00 C ATOM 1541 O MET B 8 65.707 -7.303 1.279 1.00 0.00 O ATOM 1542 CB MET B 8 67.051 -6.566 4.239 1.00 0.00 C ATOM 1543 CG MET B 8 68.235 -5.592 4.423 1.00 0.00 C ATOM 1544 SD MET B 8 69.539 -6.003 3.227 1.00 0.00 S ATOM 1545 CE MET B 8 70.249 -4.348 3.033 1.00 0.00 C ATOM 0 H MET B 8 65.078 -5.297 5.067 1.00 0.00 H new ATOM 0 HA MET B 8 66.477 -5.279 2.579 1.00 0.00 H new ATOM 0 HB2 MET B 8 66.585 -6.764 5.204 1.00 0.00 H new ATOM 0 HB3 MET B 8 67.416 -7.520 3.859 1.00 0.00 H new ATOM 0 HG2 MET B 8 67.902 -4.564 4.277 1.00 0.00 H new ATOM 0 HG3 MET B 8 68.623 -5.660 5.439 1.00 0.00 H new ATOM 0 HE1 MET B 8 71.238 -4.427 2.582 1.00 0.00 H new ATOM 0 HE2 MET B 8 69.604 -3.748 2.391 1.00 0.00 H new ATOM 0 HE3 MET B 8 70.333 -3.871 4.010 1.00 0.00 H new ATOM 1555 N GLU B 9 64.479 -7.868 3.004 1.00 0.00 N ATOM 1556 CA GLU B 9 63.857 -8.987 2.242 1.00 0.00 C ATOM 1557 C GLU B 9 63.077 -8.440 1.041 1.00 0.00 C ATOM 1558 O GLU B 9 63.096 -9.002 -0.038 1.00 0.00 O ATOM 1559 CB GLU B 9 62.912 -9.752 3.176 1.00 0.00 C ATOM 1560 CG GLU B 9 62.296 -10.944 2.443 1.00 0.00 C ATOM 1561 CD GLU B 9 61.361 -11.689 3.396 1.00 0.00 C ATOM 1562 OE1 GLU B 9 61.360 -11.361 4.572 1.00 0.00 O ATOM 1563 OE2 GLU B 9 60.658 -12.573 2.935 1.00 0.00 O ATOM 0 H GLU B 9 64.153 -7.761 3.964 1.00 0.00 H new ATOM 0 HA GLU B 9 64.634 -9.656 1.872 1.00 0.00 H new ATOM 0 HB2 GLU B 9 63.458 -10.098 4.054 1.00 0.00 H new ATOM 0 HB3 GLU B 9 62.124 -9.088 3.532 1.00 0.00 H new ATOM 0 HG2 GLU B 9 61.745 -10.603 1.566 1.00 0.00 H new ATOM 0 HG3 GLU B 9 63.080 -11.612 2.087 1.00 0.00 H new ATOM 1570 N THR B 10 62.390 -7.350 1.228 1.00 0.00 N ATOM 1571 CA THR B 10 61.597 -6.751 0.117 1.00 0.00 C ATOM 1572 C THR B 10 62.517 -6.271 -1.005 1.00 0.00 C ATOM 1573 O THR B 10 62.204 -6.402 -2.167 1.00 0.00 O ATOM 1574 CB THR B 10 60.784 -5.565 0.651 1.00 0.00 C ATOM 1575 OG1 THR B 10 59.905 -6.014 1.672 1.00 0.00 O ATOM 1576 CG2 THR B 10 59.969 -4.942 -0.482 1.00 0.00 C ATOM 0 H THR B 10 62.343 -6.842 2.111 1.00 0.00 H new ATOM 0 HA THR B 10 60.926 -7.512 -0.282 1.00 0.00 H new ATOM 0 HB THR B 10 61.466 -4.818 1.057 1.00 0.00 H new ATOM 0 HG1 THR B 10 59.387 -5.256 2.014 1.00 0.00 H new ATOM 0 HG21 THR B 10 59.394 -4.100 -0.096 1.00 0.00 H new ATOM 0 HG22 THR B 10 60.642 -4.593 -1.265 1.00 0.00 H new ATOM 0 HG23 THR B 10 59.289 -5.688 -0.894 1.00 0.00 H new ATOM 1584 N LEU B 11 63.633 -5.693 -0.670 1.00 0.00 N ATOM 1585 CA LEU B 11 64.548 -5.172 -1.721 1.00 0.00 C ATOM 1586 C LEU B 11 64.997 -6.308 -2.637 1.00 0.00 C ATOM 1587 O LEU B 11 65.105 -6.135 -3.830 1.00 0.00 O ATOM 1588 CB LEU B 11 65.770 -4.514 -1.064 1.00 0.00 C ATOM 1589 CG LEU B 11 65.351 -3.227 -0.328 1.00 0.00 C ATOM 1590 CD1 LEU B 11 66.539 -2.702 0.492 1.00 0.00 C ATOM 1591 CD2 LEU B 11 64.894 -2.150 -1.340 1.00 0.00 C ATOM 0 H LEU B 11 63.953 -5.558 0.289 1.00 0.00 H new ATOM 0 HA LEU B 11 64.018 -4.429 -2.317 1.00 0.00 H new ATOM 0 HB2 LEU B 11 66.233 -5.208 -0.363 1.00 0.00 H new ATOM 0 HB3 LEU B 11 66.518 -4.281 -1.822 1.00 0.00 H new ATOM 0 HG LEU B 11 64.517 -3.452 0.337 1.00 0.00 H new ATOM 0 HD11 LEU B 11 66.246 -1.791 1.014 1.00 0.00 H new ATOM 0 HD12 LEU B 11 66.841 -3.456 1.219 1.00 0.00 H new ATOM 0 HD13 LEU B 11 67.374 -2.486 -0.175 1.00 0.00 H new ATOM 0 HD21 LEU B 11 64.601 -1.247 -0.803 1.00 0.00 H new ATOM 0 HD22 LEU B 11 65.714 -1.918 -2.020 1.00 0.00 H new ATOM 0 HD23 LEU B 11 64.044 -2.524 -1.911 1.00 0.00 H new ATOM 1603 N ILE B 12 65.268 -7.459 -2.101 1.00 0.00 N ATOM 1604 CA ILE B 12 65.715 -8.588 -2.965 1.00 0.00 C ATOM 1605 C ILE B 12 64.623 -8.958 -3.981 1.00 0.00 C ATOM 1606 O ILE B 12 64.895 -9.148 -5.149 1.00 0.00 O ATOM 1607 CB ILE B 12 66.029 -9.803 -2.093 1.00 0.00 C ATOM 1608 CG1 ILE B 12 67.206 -9.470 -1.171 1.00 0.00 C ATOM 1609 CG2 ILE B 12 66.399 -10.986 -2.989 1.00 0.00 C ATOM 1610 CD1 ILE B 12 67.375 -10.574 -0.127 1.00 0.00 C ATOM 0 H ILE B 12 65.201 -7.671 -1.105 1.00 0.00 H new ATOM 0 HA ILE B 12 66.608 -8.279 -3.508 1.00 0.00 H new ATOM 0 HB ILE B 12 65.157 -10.062 -1.492 1.00 0.00 H new ATOM 0 HG12 ILE B 12 68.120 -9.367 -1.756 1.00 0.00 H new ATOM 0 HG13 ILE B 12 67.034 -8.513 -0.677 1.00 0.00 H new ATOM 0 HG21 ILE B 12 66.624 -11.855 -2.370 1.00 0.00 H new ATOM 0 HG22 ILE B 12 65.563 -11.217 -3.650 1.00 0.00 H new ATOM 0 HG23 ILE B 12 67.274 -10.730 -3.587 1.00 0.00 H new ATOM 0 HD11 ILE B 12 68.214 -10.332 0.526 1.00 0.00 H new ATOM 0 HD12 ILE B 12 66.465 -10.656 0.467 1.00 0.00 H new ATOM 0 HD13 ILE B 12 67.568 -11.522 -0.628 1.00 0.00 H new ATOM 1622 N ASN B 13 63.398 -9.079 -3.548 1.00 0.00 N ATOM 1623 CA ASN B 13 62.305 -9.458 -4.495 1.00 0.00 C ATOM 1624 C ASN B 13 62.169 -8.399 -5.597 1.00 0.00 C ATOM 1625 O ASN B 13 61.947 -8.707 -6.751 1.00 0.00 O ATOM 1626 CB ASN B 13 60.987 -9.567 -3.730 1.00 0.00 C ATOM 1627 CG ASN B 13 61.051 -10.747 -2.758 1.00 0.00 C ATOM 1628 OD1 ASN B 13 61.077 -10.562 -1.559 1.00 0.00 O ATOM 1629 ND2 ASN B 13 61.074 -11.964 -3.228 1.00 0.00 N ATOM 0 H ASN B 13 63.105 -8.933 -2.582 1.00 0.00 H new ATOM 0 HA ASN B 13 62.547 -10.417 -4.952 1.00 0.00 H new ATOM 0 HB2 ASN B 13 60.795 -8.643 -3.184 1.00 0.00 H new ATOM 0 HB3 ASN B 13 60.161 -9.702 -4.428 1.00 0.00 H new ATOM 0 HD21 ASN B 13 61.114 -12.757 -2.588 1.00 0.00 H new ATOM 0 HD22 ASN B 13 61.052 -12.122 -4.235 1.00 0.00 H new ATOM 1636 N VAL B 14 62.285 -7.153 -5.238 1.00 0.00 N ATOM 1637 CA VAL B 14 62.153 -6.053 -6.232 1.00 0.00 C ATOM 1638 C VAL B 14 63.279 -6.145 -7.279 1.00 0.00 C ATOM 1639 O VAL B 14 63.073 -5.921 -8.464 1.00 0.00 O ATOM 1640 CB VAL B 14 62.219 -4.715 -5.488 1.00 0.00 C ATOM 1641 CG1 VAL B 14 62.302 -3.573 -6.496 1.00 0.00 C ATOM 1642 CG2 VAL B 14 60.964 -4.551 -4.621 1.00 0.00 C ATOM 0 H VAL B 14 62.469 -6.845 -4.283 1.00 0.00 H new ATOM 0 HA VAL B 14 61.200 -6.135 -6.755 1.00 0.00 H new ATOM 0 HB VAL B 14 63.103 -4.696 -4.851 1.00 0.00 H new ATOM 0 HG11 VAL B 14 62.349 -2.622 -5.965 1.00 0.00 H new ATOM 0 HG12 VAL B 14 63.196 -3.692 -7.108 1.00 0.00 H new ATOM 0 HG13 VAL B 14 61.420 -3.588 -7.136 1.00 0.00 H new ATOM 0 HG21 VAL B 14 61.010 -3.600 -4.091 1.00 0.00 H new ATOM 0 HG22 VAL B 14 60.078 -4.571 -5.256 1.00 0.00 H new ATOM 0 HG23 VAL B 14 60.911 -5.366 -3.899 1.00 0.00 H new ATOM 1652 N PHE B 15 64.468 -6.466 -6.852 1.00 0.00 N ATOM 1653 CA PHE B 15 65.607 -6.561 -7.809 1.00 0.00 C ATOM 1654 C PHE B 15 65.222 -7.572 -8.881 1.00 0.00 C ATOM 1655 O PHE B 15 65.477 -7.391 -10.054 1.00 0.00 O ATOM 1656 CB PHE B 15 66.862 -7.056 -7.076 1.00 0.00 C ATOM 1657 CG PHE B 15 67.284 -6.129 -5.936 1.00 0.00 C ATOM 1658 CD1 PHE B 15 66.591 -4.933 -5.628 1.00 0.00 C ATOM 1659 CD2 PHE B 15 68.401 -6.491 -5.168 1.00 0.00 C ATOM 1660 CE1 PHE B 15 67.025 -4.131 -4.566 1.00 0.00 C ATOM 1661 CE2 PHE B 15 68.826 -5.679 -4.111 1.00 0.00 C ATOM 1662 CZ PHE B 15 68.138 -4.501 -3.811 1.00 0.00 C ATOM 0 H PHE B 15 64.701 -6.667 -5.880 1.00 0.00 H new ATOM 0 HA PHE B 15 65.818 -5.586 -8.248 1.00 0.00 H new ATOM 0 HB2 PHE B 15 66.675 -8.053 -6.678 1.00 0.00 H new ATOM 0 HB3 PHE B 15 67.682 -7.146 -7.788 1.00 0.00 H new ATOM 0 HD1 PHE B 15 65.730 -4.641 -6.211 1.00 0.00 H new ATOM 0 HD2 PHE B 15 68.936 -7.402 -5.394 1.00 0.00 H new ATOM 0 HE1 PHE B 15 66.495 -3.220 -4.330 1.00 0.00 H new ATOM 0 HE2 PHE B 15 69.688 -5.964 -3.526 1.00 0.00 H new ATOM 0 HZ PHE B 15 68.468 -3.876 -2.994 1.00 0.00 H new ATOM 1672 N HIS B 16 64.593 -8.630 -8.474 1.00 0.00 N ATOM 1673 CA HIS B 16 64.156 -9.665 -9.436 1.00 0.00 C ATOM 1674 C HIS B 16 63.266 -9.014 -10.492 1.00 0.00 C ATOM 1675 O HIS B 16 63.188 -9.463 -11.614 1.00 0.00 O ATOM 1676 CB HIS B 16 63.348 -10.723 -8.691 1.00 0.00 C ATOM 1677 CG HIS B 16 63.116 -11.910 -9.585 1.00 0.00 C ATOM 1678 ND1 HIS B 16 64.143 -12.764 -9.966 1.00 0.00 N ATOM 1679 CD2 HIS B 16 61.979 -12.403 -10.178 1.00 0.00 C ATOM 1680 CE1 HIS B 16 63.608 -13.717 -10.752 1.00 0.00 C ATOM 1681 NE2 HIS B 16 62.295 -13.541 -10.912 1.00 0.00 N ATOM 0 H HIS B 16 64.360 -8.824 -7.500 1.00 0.00 H new ATOM 0 HA HIS B 16 65.023 -10.124 -9.911 1.00 0.00 H new ATOM 0 HB2 HIS B 16 63.879 -11.032 -7.791 1.00 0.00 H new ATOM 0 HB3 HIS B 16 62.394 -10.306 -8.370 1.00 0.00 H new ATOM 0 HD2 HIS B 16 60.992 -11.973 -10.088 1.00 0.00 H new ATOM 0 HE1 HIS B 16 64.171 -14.524 -11.198 1.00 0.00 H new ATOM 0 HE2 HIS B 16 61.657 -14.120 -11.458 1.00 0.00 H new ATOM 1690 N ALA B 17 62.573 -7.969 -10.138 1.00 0.00 N ATOM 1691 CA ALA B 17 61.672 -7.319 -11.129 1.00 0.00 C ATOM 1692 C ALA B 17 62.480 -6.832 -12.338 1.00 0.00 C ATOM 1693 O ALA B 17 62.144 -7.130 -13.468 1.00 0.00 O ATOM 1694 CB ALA B 17 60.959 -6.136 -10.473 1.00 0.00 C ATOM 0 H ALA B 17 62.591 -7.539 -9.213 1.00 0.00 H new ATOM 0 HA ALA B 17 60.933 -8.045 -11.469 1.00 0.00 H new ATOM 0 HB1 ALA B 17 60.300 -5.661 -11.199 1.00 0.00 H new ATOM 0 HB2 ALA B 17 60.371 -6.490 -9.626 1.00 0.00 H new ATOM 0 HB3 ALA B 17 61.697 -5.413 -10.126 1.00 0.00 H new ATOM 1700 N HIS B 18 63.539 -6.088 -12.132 1.00 0.00 N ATOM 1701 CA HIS B 18 64.333 -5.611 -13.318 1.00 0.00 C ATOM 1702 C HIS B 18 65.237 -6.730 -13.851 1.00 0.00 C ATOM 1703 O HIS B 18 65.398 -6.889 -15.044 1.00 0.00 O ATOM 1704 CB HIS B 18 65.208 -4.405 -12.943 1.00 0.00 C ATOM 1705 CG HIS B 18 64.329 -3.229 -12.625 1.00 0.00 C ATOM 1706 ND1 HIS B 18 63.306 -2.818 -13.469 1.00 0.00 N ATOM 1707 CD2 HIS B 18 64.315 -2.357 -11.565 1.00 0.00 C ATOM 1708 CE1 HIS B 18 62.725 -1.741 -12.907 1.00 0.00 C ATOM 1709 NE2 HIS B 18 63.302 -1.422 -11.748 1.00 0.00 N ATOM 0 H HIS B 18 63.886 -5.793 -11.219 1.00 0.00 H new ATOM 0 HA HIS B 18 63.622 -5.316 -14.090 1.00 0.00 H new ATOM 0 HB2 HIS B 18 65.833 -4.649 -12.084 1.00 0.00 H new ATOM 0 HB3 HIS B 18 65.879 -4.159 -13.766 1.00 0.00 H new ATOM 0 HD1 HIS B 18 63.043 -3.253 -14.353 1.00 0.00 H new ATOM 0 HD2 HIS B 18 64.987 -2.392 -10.720 1.00 0.00 H new ATOM 0 HE1 HIS B 18 61.895 -1.203 -13.341 1.00 0.00 H new ATOM 1718 N SER B 19 65.852 -7.489 -12.977 1.00 0.00 N ATOM 1719 CA SER B 19 66.778 -8.580 -13.431 1.00 0.00 C ATOM 1720 C SER B 19 66.094 -9.940 -13.365 1.00 0.00 C ATOM 1721 O SER B 19 66.747 -10.964 -13.355 1.00 0.00 O ATOM 1722 CB SER B 19 67.996 -8.617 -12.516 1.00 0.00 C ATOM 1723 OG SER B 19 68.583 -7.325 -12.471 1.00 0.00 O ATOM 0 H SER B 19 65.754 -7.402 -11.965 1.00 0.00 H new ATOM 0 HA SER B 19 67.068 -8.373 -14.461 1.00 0.00 H new ATOM 0 HB2 SER B 19 67.704 -8.932 -11.514 1.00 0.00 H new ATOM 0 HB3 SER B 19 68.719 -9.346 -12.882 1.00 0.00 H new ATOM 0 HG SER B 19 69.467 -7.352 -12.893 1.00 0.00 H new ATOM 1729 N GLY B 20 64.802 -9.981 -13.297 1.00 0.00 N ATOM 1730 CA GLY B 20 64.142 -11.307 -13.206 1.00 0.00 C ATOM 1731 C GLY B 20 64.557 -12.165 -14.393 1.00 0.00 C ATOM 1732 O GLY B 20 64.242 -13.336 -14.462 1.00 0.00 O ATOM 0 H GLY B 20 64.181 -9.172 -13.300 1.00 0.00 H new ATOM 0 HA2 GLY B 20 64.419 -11.799 -12.274 1.00 0.00 H new ATOM 0 HA3 GLY B 20 63.059 -11.186 -13.193 1.00 0.00 H new ATOM 1792 N LYS B 25 70.753 -12.327 -13.974 1.00 0.00 N ATOM 1793 CA LYS B 25 70.034 -12.066 -12.686 1.00 0.00 C ATOM 1794 C LYS B 25 70.681 -10.864 -11.990 1.00 0.00 C ATOM 1795 O LYS B 25 70.059 -10.180 -11.200 1.00 0.00 O ATOM 1796 CB LYS B 25 70.142 -13.294 -11.778 1.00 0.00 C ATOM 1797 CG LYS B 25 69.289 -14.431 -12.355 1.00 0.00 C ATOM 1798 CD LYS B 25 69.375 -15.672 -11.454 1.00 0.00 C ATOM 1799 CE LYS B 25 70.643 -16.469 -11.776 1.00 0.00 C ATOM 1800 NZ LYS B 25 70.681 -17.699 -10.939 1.00 0.00 N ATOM 0 HA LYS B 25 68.983 -11.859 -12.889 1.00 0.00 H new ATOM 0 HB2 LYS B 25 71.182 -13.610 -11.697 1.00 0.00 H new ATOM 0 HB3 LYS B 25 69.805 -13.046 -10.771 1.00 0.00 H new ATOM 0 HG2 LYS B 25 68.252 -14.108 -12.443 1.00 0.00 H new ATOM 0 HG3 LYS B 25 69.632 -14.678 -13.360 1.00 0.00 H new ATOM 0 HD2 LYS B 25 69.382 -15.371 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS B 25 68.495 -16.299 -11.600 1.00 0.00 H new ATOM 0 HE2 LYS B 25 70.660 -16.735 -12.833 1.00 0.00 H new ATOM 0 HE3 LYS B 25 71.527 -15.860 -11.586 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 71.542 -18.241 -11.157 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 70.684 -17.435 -9.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 69.844 -18.282 -11.141 1.00 0.00 H new ATOM 1814 N TYR B 26 71.928 -10.596 -12.285 1.00 0.00 N ATOM 1815 CA TYR B 26 72.617 -9.430 -11.652 1.00 0.00 C ATOM 1816 C TYR B 26 71.727 -8.197 -11.812 1.00 0.00 C ATOM 1817 O TYR B 26 70.741 -8.237 -12.519 1.00 0.00 O ATOM 1818 CB TYR B 26 73.952 -9.171 -12.356 1.00 0.00 C ATOM 1819 CG TYR B 26 74.793 -10.427 -12.353 1.00 0.00 C ATOM 1820 CD1 TYR B 26 75.516 -10.785 -11.210 1.00 0.00 C ATOM 1821 CD2 TYR B 26 74.865 -11.224 -13.501 1.00 0.00 C ATOM 1822 CE1 TYR B 26 76.310 -11.937 -11.213 1.00 0.00 C ATOM 1823 CE2 TYR B 26 75.657 -12.378 -13.505 1.00 0.00 C ATOM 1824 CZ TYR B 26 76.380 -12.735 -12.359 1.00 0.00 C ATOM 1825 OH TYR B 26 77.166 -13.868 -12.363 1.00 0.00 O ATOM 0 H TYR B 26 72.499 -11.134 -12.937 1.00 0.00 H new ATOM 0 HA TYR B 26 72.800 -9.639 -10.598 1.00 0.00 H new ATOM 0 HB2 TYR B 26 73.774 -8.845 -13.381 1.00 0.00 H new ATOM 0 HB3 TYR B 26 74.487 -8.365 -11.854 1.00 0.00 H new ATOM 0 HD1 TYR B 26 75.461 -10.171 -10.323 1.00 0.00 H new ATOM 0 HD2 TYR B 26 74.309 -10.948 -14.385 1.00 0.00 H new ATOM 0 HE1 TYR B 26 76.869 -12.210 -10.330 1.00 0.00 H new ATOM 0 HE2 TYR B 26 75.711 -12.993 -14.391 1.00 0.00 H new ATOM 0 HH TYR B 26 77.101 -14.308 -13.236 1.00 0.00 H new ATOM 1835 N LYS B 27 72.047 -7.098 -11.180 1.00 0.00 N ATOM 1836 CA LYS B 27 71.174 -5.906 -11.351 1.00 0.00 C ATOM 1837 C LYS B 27 71.093 -5.589 -12.837 1.00 0.00 C ATOM 1838 O LYS B 27 70.147 -5.942 -13.500 1.00 0.00 O ATOM 1839 CB LYS B 27 71.743 -4.690 -10.597 1.00 0.00 C ATOM 1840 CG LYS B 27 70.897 -3.417 -10.870 1.00 0.00 C ATOM 1841 CD LYS B 27 69.463 -3.598 -10.346 1.00 0.00 C ATOM 1842 CE LYS B 27 68.741 -2.248 -10.348 1.00 0.00 C ATOM 1843 NZ LYS B 27 68.505 -1.810 -11.753 1.00 0.00 N ATOM 0 H LYS B 27 72.854 -6.977 -10.568 1.00 0.00 H new ATOM 0 HA LYS B 27 70.186 -6.121 -10.944 1.00 0.00 H new ATOM 0 HB2 LYS B 27 71.759 -4.897 -9.527 1.00 0.00 H new ATOM 0 HB3 LYS B 27 72.774 -4.518 -10.904 1.00 0.00 H new ATOM 0 HG2 LYS B 27 71.360 -2.556 -10.388 1.00 0.00 H new ATOM 0 HG3 LYS B 27 70.876 -3.210 -11.940 1.00 0.00 H new ATOM 0 HD2 LYS B 27 68.924 -4.311 -10.970 1.00 0.00 H new ATOM 0 HD3 LYS B 27 69.483 -4.010 -9.337 1.00 0.00 H new ATOM 0 HE2 LYS B 27 67.792 -2.331 -9.818 1.00 0.00 H new ATOM 0 HE3 LYS B 27 69.338 -1.504 -9.820 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 68.589 -0.775 -11.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 69.210 -2.251 -12.377 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 67.551 -2.097 -12.051 1.00 0.00 H new ATOM 1857 N LEU B 28 72.075 -4.925 -13.362 1.00 0.00 N ATOM 1858 CA LEU B 28 72.038 -4.584 -14.822 1.00 0.00 C ATOM 1859 C LEU B 28 73.397 -3.998 -15.233 1.00 0.00 C ATOM 1860 O LEU B 28 74.142 -3.516 -14.403 1.00 0.00 O ATOM 1861 CB LEU B 28 70.922 -3.528 -15.060 1.00 0.00 C ATOM 1862 CG LEU B 28 69.935 -3.899 -16.198 1.00 0.00 C ATOM 1863 CD1 LEU B 28 70.652 -4.362 -17.474 1.00 0.00 C ATOM 1864 CD2 LEU B 28 68.968 -4.997 -15.739 1.00 0.00 C ATOM 0 H LEU B 28 72.900 -4.601 -12.857 1.00 0.00 H new ATOM 0 HA LEU B 28 71.833 -5.476 -15.414 1.00 0.00 H new ATOM 0 HB2 LEU B 28 70.361 -3.393 -14.136 1.00 0.00 H new ATOM 0 HB3 LEU B 28 71.386 -2.570 -15.294 1.00 0.00 H new ATOM 0 HG LEU B 28 69.383 -2.989 -16.434 1.00 0.00 H new ATOM 0 HD11 LEU B 28 69.914 -4.609 -18.237 1.00 0.00 H new ATOM 0 HD12 LEU B 28 71.298 -3.563 -17.839 1.00 0.00 H new ATOM 0 HD13 LEU B 28 71.254 -5.243 -17.253 1.00 0.00 H new ATOM 0 HD21 LEU B 28 68.284 -5.243 -16.552 1.00 0.00 H new ATOM 0 HD22 LEU B 28 69.533 -5.886 -15.459 1.00 0.00 H new ATOM 0 HD23 LEU B 28 68.398 -4.644 -14.880 1.00 0.00 H new ATOM 1876 N SER B 29 73.711 -3.986 -16.505 1.00 0.00 N ATOM 1877 CA SER B 29 74.994 -3.371 -16.942 1.00 0.00 C ATOM 1878 C SER B 29 75.071 -1.978 -16.302 1.00 0.00 C ATOM 1879 O SER B 29 74.057 -1.348 -16.078 1.00 0.00 O ATOM 1880 CB SER B 29 75.003 -3.240 -18.464 1.00 0.00 C ATOM 1881 OG SER B 29 74.734 -4.511 -19.040 1.00 0.00 O ATOM 0 H SER B 29 73.136 -4.374 -17.253 1.00 0.00 H new ATOM 0 HA SER B 29 75.844 -3.983 -16.641 1.00 0.00 H new ATOM 0 HB2 SER B 29 74.254 -2.516 -18.784 1.00 0.00 H new ATOM 0 HB3 SER B 29 75.970 -2.870 -18.804 1.00 0.00 H new ATOM 0 HG SER B 29 74.736 -4.435 -20.017 1.00 0.00 H new ATOM 1887 N LYS B 30 76.234 -1.491 -15.973 1.00 0.00 N ATOM 1888 CA LYS B 30 76.285 -0.151 -15.319 1.00 0.00 C ATOM 1889 C LYS B 30 75.522 0.884 -16.154 1.00 0.00 C ATOM 1890 O LYS B 30 74.730 1.634 -15.635 1.00 0.00 O ATOM 1891 CB LYS B 30 77.748 0.321 -15.154 1.00 0.00 C ATOM 1892 CG LYS B 30 78.397 -0.312 -13.923 1.00 0.00 C ATOM 1893 CD LYS B 30 79.819 0.252 -13.787 1.00 0.00 C ATOM 1894 CE LYS B 30 80.432 -0.121 -12.434 1.00 0.00 C ATOM 1895 NZ LYS B 30 79.472 0.206 -11.343 1.00 0.00 N ATOM 0 H LYS B 30 77.133 -1.948 -16.123 1.00 0.00 H new ATOM 0 HA LYS B 30 75.821 -0.243 -14.337 1.00 0.00 H new ATOM 0 HB2 LYS B 30 78.320 0.060 -16.045 1.00 0.00 H new ATOM 0 HB3 LYS B 30 77.775 1.407 -15.065 1.00 0.00 H new ATOM 0 HG2 LYS B 30 77.813 -0.091 -13.029 1.00 0.00 H new ATOM 0 HG3 LYS B 30 78.426 -1.397 -14.024 1.00 0.00 H new ATOM 0 HD2 LYS B 30 80.445 -0.133 -14.592 1.00 0.00 H new ATOM 0 HD3 LYS B 30 79.795 1.337 -13.893 1.00 0.00 H new ATOM 0 HE2 LYS B 30 80.673 -1.184 -12.413 1.00 0.00 H new ATOM 0 HE3 LYS B 30 81.366 0.421 -12.285 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 79.953 0.772 -10.615 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 78.675 0.749 -11.733 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 79.117 -0.674 -10.918 1.00 0.00 H new ATOM 1909 N LYS B 31 75.772 0.961 -17.427 1.00 0.00 N ATOM 1910 CA LYS B 31 75.093 2.003 -18.261 1.00 0.00 C ATOM 1911 C LYS B 31 73.562 1.915 -18.128 1.00 0.00 C ATOM 1912 O LYS B 31 72.885 2.918 -17.984 1.00 0.00 O ATOM 1913 CB LYS B 31 75.504 1.787 -19.727 1.00 0.00 C ATOM 1914 CG LYS B 31 74.897 2.861 -20.649 1.00 0.00 C ATOM 1915 CD LYS B 31 75.551 4.223 -20.381 1.00 0.00 C ATOM 1916 CE LYS B 31 75.270 5.168 -21.552 1.00 0.00 C ATOM 1917 NZ LYS B 31 75.949 4.658 -22.778 1.00 0.00 N ATOM 0 H LYS B 31 76.415 0.351 -17.932 1.00 0.00 H new ATOM 0 HA LYS B 31 75.396 2.992 -17.918 1.00 0.00 H new ATOM 0 HB2 LYS B 31 76.591 1.809 -19.808 1.00 0.00 H new ATOM 0 HB3 LYS B 31 75.180 0.799 -20.055 1.00 0.00 H new ATOM 0 HG2 LYS B 31 75.042 2.579 -21.692 1.00 0.00 H new ATOM 0 HG3 LYS B 31 73.822 2.927 -20.483 1.00 0.00 H new ATOM 0 HD2 LYS B 31 75.162 4.649 -19.456 1.00 0.00 H new ATOM 0 HD3 LYS B 31 76.626 4.102 -20.249 1.00 0.00 H new ATOM 0 HE2 LYS B 31 74.196 5.243 -21.723 1.00 0.00 H new ATOM 0 HE3 LYS B 31 75.626 6.171 -21.317 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 76.205 5.458 -23.391 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 76.809 4.140 -22.508 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 75.307 4.020 -23.291 1.00 0.00 H new ATOM 1931 N GLU B 32 73.010 0.739 -18.177 1.00 0.00 N ATOM 1932 CA GLU B 32 71.524 0.605 -18.062 1.00 0.00 C ATOM 1933 C GLU B 32 71.088 0.922 -16.641 1.00 0.00 C ATOM 1934 O GLU B 32 70.073 1.533 -16.420 1.00 0.00 O ATOM 1935 CB GLU B 32 71.105 -0.829 -18.408 1.00 0.00 C ATOM 1936 CG GLU B 32 69.575 -0.977 -18.328 1.00 0.00 C ATOM 1937 CD GLU B 32 68.916 -0.061 -19.362 1.00 0.00 C ATOM 1938 OE1 GLU B 32 69.593 0.327 -20.301 1.00 0.00 O ATOM 1939 OE2 GLU B 32 67.744 0.237 -19.199 1.00 0.00 O ATOM 0 H GLU B 32 73.518 -0.138 -18.291 1.00 0.00 H new ATOM 0 HA GLU B 32 71.051 1.302 -18.754 1.00 0.00 H new ATOM 0 HB2 GLU B 32 71.449 -1.083 -19.411 1.00 0.00 H new ATOM 0 HB3 GLU B 32 71.581 -1.529 -17.721 1.00 0.00 H new ATOM 0 HG2 GLU B 32 69.290 -2.013 -18.511 1.00 0.00 H new ATOM 0 HG3 GLU B 32 69.227 -0.722 -17.327 1.00 0.00 H new ATOM 1946 N LEU B 33 71.844 0.480 -15.685 1.00 0.00 N ATOM 1947 CA LEU B 33 71.491 0.711 -14.261 1.00 0.00 C ATOM 1948 C LEU B 33 71.274 2.198 -13.975 1.00 0.00 C ATOM 1949 O LEU B 33 70.317 2.564 -13.326 1.00 0.00 O ATOM 1950 CB LEU B 33 72.665 0.189 -13.408 1.00 0.00 C ATOM 1951 CG LEU B 33 72.482 0.498 -11.904 1.00 0.00 C ATOM 1952 CD1 LEU B 33 72.731 1.994 -11.581 1.00 0.00 C ATOM 1953 CD2 LEU B 33 71.071 0.086 -11.462 1.00 0.00 C ATOM 0 H LEU B 33 72.708 -0.042 -15.831 1.00 0.00 H new ATOM 0 HA LEU B 33 70.562 0.193 -14.024 1.00 0.00 H new ATOM 0 HB2 LEU B 33 72.761 -0.888 -13.546 1.00 0.00 H new ATOM 0 HB3 LEU B 33 73.594 0.639 -13.758 1.00 0.00 H new ATOM 0 HG LEU B 33 73.225 -0.078 -11.352 1.00 0.00 H new ATOM 0 HD11 LEU B 33 72.591 2.164 -10.513 1.00 0.00 H new ATOM 0 HD12 LEU B 33 73.750 2.262 -11.861 1.00 0.00 H new ATOM 0 HD13 LEU B 33 72.027 2.609 -12.142 1.00 0.00 H new ATOM 0 HD21 LEU B 33 70.944 0.304 -10.402 1.00 0.00 H new ATOM 0 HD22 LEU B 33 70.332 0.643 -12.039 1.00 0.00 H new ATOM 0 HD23 LEU B 33 70.934 -0.982 -11.631 1.00 0.00 H new ATOM 1965 N LYS B 34 72.147 3.071 -14.402 1.00 0.00 N ATOM 1966 CA LYS B 34 71.917 4.512 -14.054 1.00 0.00 C ATOM 1967 C LYS B 34 70.683 5.047 -14.769 1.00 0.00 C ATOM 1968 O LYS B 34 69.927 5.800 -14.208 1.00 0.00 O ATOM 1969 CB LYS B 34 73.123 5.393 -14.413 1.00 0.00 C ATOM 1970 CG LYS B 34 72.863 6.888 -14.088 1.00 0.00 C ATOM 1971 CD LYS B 34 72.618 7.140 -12.582 1.00 0.00 C ATOM 1972 CE LYS B 34 73.816 6.685 -11.728 1.00 0.00 C ATOM 1973 NZ LYS B 34 75.076 6.794 -12.506 1.00 0.00 N ATOM 0 H LYS B 34 72.979 2.866 -14.955 1.00 0.00 H new ATOM 0 HA LYS B 34 71.769 4.553 -12.975 1.00 0.00 H new ATOM 0 HB2 LYS B 34 74.000 5.049 -13.865 1.00 0.00 H new ATOM 0 HB3 LYS B 34 73.348 5.286 -15.474 1.00 0.00 H new ATOM 0 HG2 LYS B 34 73.717 7.480 -14.417 1.00 0.00 H new ATOM 0 HG3 LYS B 34 71.998 7.233 -14.655 1.00 0.00 H new ATOM 0 HD2 LYS B 34 72.434 8.201 -12.415 1.00 0.00 H new ATOM 0 HD3 LYS B 34 71.721 6.608 -12.265 1.00 0.00 H new ATOM 0 HE2 LYS B 34 73.883 7.296 -10.828 1.00 0.00 H new ATOM 0 HE3 LYS B 34 73.669 5.655 -11.403 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 75.562 5.875 -12.510 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 74.857 7.074 -13.483 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 75.692 7.510 -12.070 1.00 0.00 H new ATOM 1987 N ASP B 35 70.471 4.691 -16.000 1.00 0.00 N ATOM 1988 CA ASP B 35 69.279 5.233 -16.708 1.00 0.00 C ATOM 1989 C ASP B 35 68.009 4.665 -16.075 1.00 0.00 C ATOM 1990 O ASP B 35 66.947 5.262 -16.123 1.00 0.00 O ATOM 1991 CB ASP B 35 69.345 4.821 -18.179 1.00 0.00 C ATOM 1992 CG ASP B 35 70.481 5.578 -18.868 1.00 0.00 C ATOM 1993 OD1 ASP B 35 70.892 6.599 -18.341 1.00 0.00 O ATOM 1994 OD2 ASP B 35 70.925 5.122 -19.909 1.00 0.00 O ATOM 0 H ASP B 35 71.059 4.058 -16.542 1.00 0.00 H new ATOM 0 HA ASP B 35 69.265 6.320 -16.630 1.00 0.00 H new ATOM 0 HB2 ASP B 35 69.508 3.746 -18.260 1.00 0.00 H new ATOM 0 HB3 ASP B 35 68.397 5.038 -18.672 1.00 0.00 H new ATOM 1999 N LEU B 36 68.109 3.499 -15.507 1.00 0.00 N ATOM 2000 CA LEU B 36 66.919 2.850 -14.903 1.00 0.00 C ATOM 2001 C LEU B 36 66.492 3.551 -13.601 1.00 0.00 C ATOM 2002 O LEU B 36 65.372 4.008 -13.484 1.00 0.00 O ATOM 2003 CB LEU B 36 67.272 1.367 -14.618 1.00 0.00 C ATOM 2004 CG LEU B 36 66.110 0.439 -14.981 1.00 0.00 C ATOM 2005 CD1 LEU B 36 66.533 -1.015 -14.759 1.00 0.00 C ATOM 2006 CD2 LEU B 36 64.892 0.749 -14.104 1.00 0.00 C ATOM 0 H LEU B 36 68.974 2.963 -15.435 1.00 0.00 H new ATOM 0 HA LEU B 36 66.081 2.921 -15.597 1.00 0.00 H new ATOM 0 HB2 LEU B 36 68.157 1.085 -15.189 1.00 0.00 H new ATOM 0 HB3 LEU B 36 67.521 1.246 -13.564 1.00 0.00 H new ATOM 0 HG LEU B 36 65.846 0.594 -16.027 1.00 0.00 H new ATOM 0 HD11 LEU B 36 65.707 -1.678 -15.017 1.00 0.00 H new ATOM 0 HD12 LEU B 36 67.392 -1.244 -15.389 1.00 0.00 H new ATOM 0 HD13 LEU B 36 66.801 -1.160 -13.713 1.00 0.00 H new ATOM 0 HD21 LEU B 36 64.072 0.083 -14.371 1.00 0.00 H new ATOM 0 HD22 LEU B 36 65.152 0.602 -13.056 1.00 0.00 H new ATOM 0 HD23 LEU B 36 64.585 1.783 -14.260 1.00 0.00 H new ATOM 2018 N LEU B 37 67.347 3.611 -12.603 1.00 0.00 N ATOM 2019 CA LEU B 37 66.918 4.251 -11.314 1.00 0.00 C ATOM 2020 C LEU B 37 66.943 5.776 -11.374 1.00 0.00 C ATOM 2021 O LEU B 37 66.064 6.429 -10.850 1.00 0.00 O ATOM 2022 CB LEU B 37 67.782 3.727 -10.158 1.00 0.00 C ATOM 2023 CG LEU B 37 67.234 2.367 -9.689 1.00 0.00 C ATOM 2024 CD1 LEU B 37 67.205 1.389 -10.865 1.00 0.00 C ATOM 2025 CD2 LEU B 37 68.123 1.804 -8.577 1.00 0.00 C ATOM 0 H LEU B 37 68.302 3.253 -12.622 1.00 0.00 H new ATOM 0 HA LEU B 37 65.879 3.973 -11.140 1.00 0.00 H new ATOM 0 HB2 LEU B 37 68.818 3.623 -10.481 1.00 0.00 H new ATOM 0 HB3 LEU B 37 67.776 4.439 -9.333 1.00 0.00 H new ATOM 0 HG LEU B 37 66.222 2.503 -9.306 1.00 0.00 H new ATOM 0 HD11 LEU B 37 66.817 0.428 -10.529 1.00 0.00 H new ATOM 0 HD12 LEU B 37 66.563 1.785 -11.652 1.00 0.00 H new ATOM 0 HD13 LEU B 37 68.215 1.257 -11.253 1.00 0.00 H new ATOM 0 HD21 LEU B 37 67.730 0.842 -8.249 1.00 0.00 H new ATOM 0 HD22 LEU B 37 69.137 1.673 -8.954 1.00 0.00 H new ATOM 0 HD23 LEU B 37 68.135 2.496 -7.735 1.00 0.00 H new ATOM 2037 N GLN B 38 67.919 6.363 -11.990 1.00 0.00 N ATOM 2038 CA GLN B 38 67.938 7.850 -12.043 1.00 0.00 C ATOM 2039 C GLN B 38 66.607 8.322 -12.607 1.00 0.00 C ATOM 2040 O GLN B 38 66.094 9.361 -12.245 1.00 0.00 O ATOM 2041 CB GLN B 38 69.061 8.336 -12.962 1.00 0.00 C ATOM 2042 CG GLN B 38 68.958 9.851 -13.159 1.00 0.00 C ATOM 2043 CD GLN B 38 70.217 10.351 -13.870 1.00 0.00 C ATOM 2044 OE1 GLN B 38 70.733 9.690 -14.749 1.00 0.00 O ATOM 2045 NE2 GLN B 38 70.734 11.500 -13.530 1.00 0.00 N ATOM 0 H GLN B 38 68.695 5.892 -12.454 1.00 0.00 H new ATOM 0 HA GLN B 38 68.103 8.247 -11.042 1.00 0.00 H new ATOM 0 HB2 GLN B 38 70.030 8.082 -12.532 1.00 0.00 H new ATOM 0 HB3 GLN B 38 68.998 7.831 -13.926 1.00 0.00 H new ATOM 0 HG2 GLN B 38 68.073 10.094 -13.747 1.00 0.00 H new ATOM 0 HG3 GLN B 38 68.848 10.349 -12.196 1.00 0.00 H new ATOM 0 HE21 GLN B 38 70.301 12.056 -12.792 1.00 0.00 H new ATOM 0 HE22 GLN B 38 71.571 11.842 -14.002 1.00 0.00 H new ATOM 2054 N THR B 39 66.043 7.555 -13.492 1.00 0.00 N ATOM 2055 CA THR B 39 64.739 7.952 -14.076 1.00 0.00 C ATOM 2056 C THR B 39 63.656 7.717 -13.026 1.00 0.00 C ATOM 2057 O THR B 39 62.748 8.507 -12.859 1.00 0.00 O ATOM 2058 CB THR B 39 64.485 7.124 -15.338 1.00 0.00 C ATOM 2059 OG1 THR B 39 65.306 7.616 -16.388 1.00 0.00 O ATOM 2060 CG2 THR B 39 63.015 7.213 -15.755 1.00 0.00 C ATOM 0 H THR B 39 66.427 6.674 -13.835 1.00 0.00 H new ATOM 0 HA THR B 39 64.735 9.005 -14.357 1.00 0.00 H new ATOM 0 HB THR B 39 64.724 6.081 -15.132 1.00 0.00 H new ATOM 0 HG1 THR B 39 66.043 6.990 -16.548 1.00 0.00 H new ATOM 0 HG21 THR B 39 62.855 6.618 -16.654 1.00 0.00 H new ATOM 0 HG22 THR B 39 62.385 6.832 -14.951 1.00 0.00 H new ATOM 0 HG23 THR B 39 62.757 8.252 -15.957 1.00 0.00 H new ATOM 2068 N GLU B 40 63.761 6.635 -12.309 1.00 0.00 N ATOM 2069 CA GLU B 40 62.763 6.327 -11.250 1.00 0.00 C ATOM 2070 C GLU B 40 62.929 7.341 -10.106 1.00 0.00 C ATOM 2071 O GLU B 40 61.973 7.749 -9.475 1.00 0.00 O ATOM 2072 CB GLU B 40 63.011 4.885 -10.748 1.00 0.00 C ATOM 2073 CG GLU B 40 61.682 4.138 -10.569 1.00 0.00 C ATOM 2074 CD GLU B 40 61.172 3.676 -11.938 1.00 0.00 C ATOM 2075 OE1 GLU B 40 61.567 4.273 -12.926 1.00 0.00 O ATOM 2076 OE2 GLU B 40 60.403 2.729 -11.977 1.00 0.00 O ATOM 0 H GLU B 40 64.504 5.944 -12.413 1.00 0.00 H new ATOM 0 HA GLU B 40 61.746 6.398 -11.636 1.00 0.00 H new ATOM 0 HB2 GLU B 40 63.642 4.351 -11.458 1.00 0.00 H new ATOM 0 HB3 GLU B 40 63.550 4.912 -9.801 1.00 0.00 H new ATOM 0 HG2 GLU B 40 61.820 3.280 -9.911 1.00 0.00 H new ATOM 0 HG3 GLU B 40 60.947 4.789 -10.095 1.00 0.00 H new ATOM 2083 N LEU B 41 64.145 7.742 -9.837 1.00 0.00 N ATOM 2084 CA LEU B 41 64.406 8.723 -8.737 1.00 0.00 C ATOM 2085 C LEU B 41 64.487 10.135 -9.324 1.00 0.00 C ATOM 2086 O LEU B 41 65.213 10.975 -8.838 1.00 0.00 O ATOM 2087 CB LEU B 41 65.749 8.388 -8.065 1.00 0.00 C ATOM 2088 CG LEU B 41 65.715 6.976 -7.445 1.00 0.00 C ATOM 2089 CD1 LEU B 41 67.147 6.450 -7.260 1.00 0.00 C ATOM 2090 CD2 LEU B 41 65.040 7.027 -6.069 1.00 0.00 C ATOM 0 H LEU B 41 64.977 7.429 -10.337 1.00 0.00 H new ATOM 0 HA LEU B 41 63.600 8.670 -8.006 1.00 0.00 H new ATOM 0 HB2 LEU B 41 66.553 8.448 -8.799 1.00 0.00 H new ATOM 0 HB3 LEU B 41 65.967 9.124 -7.292 1.00 0.00 H new ATOM 0 HG LEU B 41 65.158 6.319 -8.113 1.00 0.00 H new ATOM 0 HD11 LEU B 41 67.114 5.453 -6.822 1.00 0.00 H new ATOM 0 HD12 LEU B 41 67.646 6.405 -8.228 1.00 0.00 H new ATOM 0 HD13 LEU B 41 67.698 7.119 -6.599 1.00 0.00 H new ATOM 0 HD21 LEU B 41 65.019 6.027 -5.637 1.00 0.00 H new ATOM 0 HD22 LEU B 41 65.600 7.694 -5.414 1.00 0.00 H new ATOM 0 HD23 LEU B 41 64.020 7.397 -6.177 1.00 0.00 H new ATOM 2102 N SER B 42 63.767 10.402 -10.373 1.00 0.00 N ATOM 2103 CA SER B 42 63.827 11.759 -10.986 1.00 0.00 C ATOM 2104 C SER B 42 63.390 12.818 -9.976 1.00 0.00 C ATOM 2105 O SER B 42 63.953 13.890 -9.900 1.00 0.00 O ATOM 2106 CB SER B 42 62.871 11.810 -12.161 1.00 0.00 C ATOM 2107 OG SER B 42 63.332 10.941 -13.187 1.00 0.00 O ATOM 0 H SER B 42 63.140 9.743 -10.834 1.00 0.00 H new ATOM 0 HA SER B 42 64.851 11.955 -11.304 1.00 0.00 H new ATOM 0 HB2 SER B 42 61.871 11.515 -11.843 1.00 0.00 H new ATOM 0 HB3 SER B 42 62.798 12.830 -12.539 1.00 0.00 H new ATOM 0 HG SER B 42 62.850 10.089 -13.135 1.00 0.00 H new ATOM 2113 N SER B 43 62.381 12.523 -9.208 1.00 0.00 N ATOM 2114 CA SER B 43 61.887 13.511 -8.201 1.00 0.00 C ATOM 2115 C SER B 43 63.003 13.814 -7.224 1.00 0.00 C ATOM 2116 O SER B 43 63.131 14.914 -6.736 1.00 0.00 O ATOM 2117 CB SER B 43 60.679 12.942 -7.451 1.00 0.00 C ATOM 2118 OG SER B 43 59.592 12.788 -8.355 1.00 0.00 O ATOM 0 H SER B 43 61.873 11.639 -9.231 1.00 0.00 H new ATOM 0 HA SER B 43 61.580 14.426 -8.708 1.00 0.00 H new ATOM 0 HB2 SER B 43 60.934 11.981 -7.004 1.00 0.00 H new ATOM 0 HB3 SER B 43 60.397 13.608 -6.635 1.00 0.00 H new ATOM 0 HG SER B 43 58.818 12.422 -7.877 1.00 0.00 H new ATOM 2124 N PHE B 44 63.827 12.862 -6.940 1.00 0.00 N ATOM 2125 CA PHE B 44 64.938 13.152 -5.998 1.00 0.00 C ATOM 2126 C PHE B 44 65.771 14.268 -6.608 1.00 0.00 C ATOM 2127 O PHE B 44 66.202 15.177 -5.932 1.00 0.00 O ATOM 2128 CB PHE B 44 65.794 11.902 -5.754 1.00 0.00 C ATOM 2129 CG PHE B 44 65.139 11.036 -4.703 1.00 0.00 C ATOM 2130 CD1 PHE B 44 64.166 10.099 -5.065 1.00 0.00 C ATOM 2131 CD2 PHE B 44 65.506 11.184 -3.361 1.00 0.00 C ATOM 2132 CE1 PHE B 44 63.559 9.307 -4.084 1.00 0.00 C ATOM 2133 CE2 PHE B 44 64.898 10.391 -2.379 1.00 0.00 C ATOM 2134 CZ PHE B 44 63.926 9.453 -2.742 1.00 0.00 C ATOM 0 H PHE B 44 63.788 11.911 -7.307 1.00 0.00 H new ATOM 0 HA PHE B 44 64.543 13.457 -5.029 1.00 0.00 H new ATOM 0 HB2 PHE B 44 65.909 11.341 -6.682 1.00 0.00 H new ATOM 0 HB3 PHE B 44 66.794 12.191 -5.430 1.00 0.00 H new ATOM 0 HD1 PHE B 44 63.883 9.987 -6.101 1.00 0.00 H new ATOM 0 HD2 PHE B 44 66.257 11.909 -3.082 1.00 0.00 H new ATOM 0 HE1 PHE B 44 62.807 8.583 -4.363 1.00 0.00 H new ATOM 0 HE2 PHE B 44 65.180 10.504 -1.342 1.00 0.00 H new ATOM 0 HZ PHE B 44 63.458 8.841 -1.985 1.00 0.00 H new ATOM 2144 N LEU B 45 65.970 14.224 -7.890 1.00 0.00 N ATOM 2145 CA LEU B 45 66.741 15.302 -8.547 1.00 0.00 C ATOM 2146 C LEU B 45 66.043 16.634 -8.259 1.00 0.00 C ATOM 2147 O LEU B 45 66.528 17.686 -8.621 1.00 0.00 O ATOM 2148 CB LEU B 45 66.789 15.065 -10.059 1.00 0.00 C ATOM 2149 CG LEU B 45 67.267 13.636 -10.353 1.00 0.00 C ATOM 2150 CD1 LEU B 45 67.347 13.427 -11.871 1.00 0.00 C ATOM 2151 CD2 LEU B 45 68.653 13.408 -9.729 1.00 0.00 C ATOM 0 H LEU B 45 65.632 13.488 -8.510 1.00 0.00 H new ATOM 0 HA LEU B 45 67.761 15.317 -8.164 1.00 0.00 H new ATOM 0 HB2 LEU B 45 65.801 15.223 -10.491 1.00 0.00 H new ATOM 0 HB3 LEU B 45 67.460 15.785 -10.527 1.00 0.00 H new ATOM 0 HG LEU B 45 66.561 12.926 -9.922 1.00 0.00 H new ATOM 0 HD11 LEU B 45 67.686 12.413 -12.081 1.00 0.00 H new ATOM 0 HD12 LEU B 45 66.362 13.579 -12.312 1.00 0.00 H new ATOM 0 HD13 LEU B 45 68.050 14.141 -12.300 1.00 0.00 H new ATOM 0 HD21 LEU B 45 68.985 12.392 -9.942 1.00 0.00 H new ATOM 0 HD22 LEU B 45 69.364 14.118 -10.152 1.00 0.00 H new ATOM 0 HD23 LEU B 45 68.594 13.552 -8.650 1.00 0.00 H new ATOM 2163 N ASP B 46 64.895 16.603 -7.618 1.00 0.00 N ATOM 2164 CA ASP B 46 64.182 17.883 -7.335 1.00 0.00 C ATOM 2165 C ASP B 46 65.169 18.869 -6.690 1.00 0.00 C ATOM 2166 O ASP B 46 65.099 20.062 -6.911 1.00 0.00 O ATOM 2167 CB ASP B 46 63.007 17.649 -6.366 1.00 0.00 C ATOM 2168 CG ASP B 46 61.793 17.081 -7.117 1.00 0.00 C ATOM 2169 OD1 ASP B 46 61.698 17.303 -8.313 1.00 0.00 O ATOM 2170 OD2 ASP B 46 60.979 16.434 -6.480 1.00 0.00 O ATOM 0 H ASP B 46 64.431 15.758 -7.285 1.00 0.00 H new ATOM 0 HA ASP B 46 63.793 18.284 -8.271 1.00 0.00 H new ATOM 0 HB2 ASP B 46 63.310 16.959 -5.578 1.00 0.00 H new ATOM 0 HB3 ASP B 46 62.736 18.587 -5.881 1.00 0.00 H new ATOM 2175 N VAL B 47 66.086 18.378 -5.884 1.00 0.00 N ATOM 2176 CA VAL B 47 67.077 19.285 -5.216 1.00 0.00 C ATOM 2177 C VAL B 47 68.474 18.636 -5.197 1.00 0.00 C ATOM 2178 O VAL B 47 68.772 17.799 -4.371 1.00 0.00 O ATOM 2179 CB VAL B 47 66.610 19.585 -3.779 1.00 0.00 C ATOM 2180 CG1 VAL B 47 66.277 18.289 -3.029 1.00 0.00 C ATOM 2181 CG2 VAL B 47 67.712 20.335 -3.030 1.00 0.00 C ATOM 0 H VAL B 47 66.190 17.388 -5.661 1.00 0.00 H new ATOM 0 HA VAL B 47 67.141 20.217 -5.777 1.00 0.00 H new ATOM 0 HB VAL B 47 65.710 20.198 -3.830 1.00 0.00 H new ATOM 0 HG11 VAL B 47 65.950 18.528 -2.017 1.00 0.00 H new ATOM 0 HG12 VAL B 47 65.481 17.760 -3.552 1.00 0.00 H new ATOM 0 HG13 VAL B 47 67.164 17.657 -2.984 1.00 0.00 H new ATOM 0 HG21 VAL B 47 67.381 20.547 -2.013 1.00 0.00 H new ATOM 0 HG22 VAL B 47 68.613 19.722 -2.998 1.00 0.00 H new ATOM 0 HG23 VAL B 47 67.929 21.271 -3.544 1.00 0.00 H new ATOM 2191 N GLN B 48 69.340 19.025 -6.095 1.00 0.00 N ATOM 2192 CA GLN B 48 70.702 18.439 -6.105 1.00 0.00 C ATOM 2193 C GLN B 48 71.469 18.941 -4.877 1.00 0.00 C ATOM 2194 O GLN B 48 71.745 20.115 -4.723 1.00 0.00 O ATOM 2195 CB GLN B 48 71.424 18.827 -7.407 1.00 0.00 C ATOM 2196 CG GLN B 48 71.870 20.292 -7.362 1.00 0.00 C ATOM 2197 CD GLN B 48 72.172 20.781 -8.782 1.00 0.00 C ATOM 2198 OE1 GLN B 48 71.407 20.541 -9.695 1.00 0.00 O ATOM 2199 NE2 GLN B 48 73.262 21.463 -9.005 1.00 0.00 N ATOM 0 H GLN B 48 69.159 19.721 -6.818 1.00 0.00 H new ATOM 0 HA GLN B 48 70.645 17.351 -6.062 1.00 0.00 H new ATOM 0 HB2 GLN B 48 72.290 18.182 -7.555 1.00 0.00 H new ATOM 0 HB3 GLN B 48 70.761 18.669 -8.258 1.00 0.00 H new ATOM 0 HG2 GLN B 48 71.090 20.907 -6.913 1.00 0.00 H new ATOM 0 HG3 GLN B 48 72.756 20.394 -6.735 1.00 0.00 H new ATOM 0 HE21 GLN B 48 73.904 21.664 -8.238 1.00 0.00 H new ATOM 0 HE22 GLN B 48 73.472 21.795 -9.946 1.00 0.00 H new ATOM 2208 N LYS B 49 71.801 18.046 -4.002 1.00 0.00 N ATOM 2209 CA LYS B 49 72.550 18.413 -2.763 1.00 0.00 C ATOM 2210 C LYS B 49 74.057 18.327 -3.032 1.00 0.00 C ATOM 2211 O LYS B 49 74.709 19.327 -3.260 1.00 0.00 O ATOM 2212 CB LYS B 49 72.182 17.436 -1.640 1.00 0.00 C ATOM 2213 CG LYS B 49 70.706 17.612 -1.244 1.00 0.00 C ATOM 2214 CD LYS B 49 70.516 18.902 -0.424 1.00 0.00 C ATOM 2215 CE LYS B 49 69.185 18.838 0.327 1.00 0.00 C ATOM 2216 NZ LYS B 49 68.102 18.431 -0.612 1.00 0.00 N ATOM 0 H LYS B 49 71.584 17.053 -4.088 1.00 0.00 H new ATOM 0 HA LYS B 49 72.289 19.429 -2.468 1.00 0.00 H new ATOM 0 HB2 LYS B 49 72.358 16.411 -1.967 1.00 0.00 H new ATOM 0 HB3 LYS B 49 72.821 17.609 -0.774 1.00 0.00 H new ATOM 0 HG2 LYS B 49 70.085 17.649 -2.139 1.00 0.00 H new ATOM 0 HG3 LYS B 49 70.375 16.752 -0.662 1.00 0.00 H new ATOM 0 HD2 LYS B 49 71.338 19.022 0.281 1.00 0.00 H new ATOM 0 HD3 LYS B 49 70.533 19.770 -1.083 1.00 0.00 H new ATOM 0 HE2 LYS B 49 69.254 18.126 1.150 1.00 0.00 H new ATOM 0 HE3 LYS B 49 68.955 19.810 0.764 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 67.303 19.091 -0.527 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 68.463 18.449 -1.587 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 67.783 17.469 -0.378 1.00 0.00 H new ATOM 2230 N ASP B 50 74.616 17.139 -3.003 1.00 0.00 N ATOM 2231 CA ASP B 50 76.089 16.981 -3.250 1.00 0.00 C ATOM 2232 C ASP B 50 76.341 16.537 -4.694 1.00 0.00 C ATOM 2233 O ASP B 50 76.208 15.379 -5.049 1.00 0.00 O ATOM 2234 CB ASP B 50 76.663 15.942 -2.280 1.00 0.00 C ATOM 2235 CG ASP B 50 76.687 16.526 -0.866 1.00 0.00 C ATOM 2236 OD1 ASP B 50 76.656 17.740 -0.747 1.00 0.00 O ATOM 2237 OD2 ASP B 50 76.740 15.751 0.075 1.00 0.00 O ATOM 0 H ASP B 50 74.116 16.270 -2.819 1.00 0.00 H new ATOM 0 HA ASP B 50 76.580 17.940 -3.088 1.00 0.00 H new ATOM 0 HB2 ASP B 50 76.058 15.036 -2.301 1.00 0.00 H new ATOM 0 HB3 ASP B 50 77.670 15.660 -2.586 1.00 0.00 H new ATOM 2242 N ALA B 51 76.728 17.459 -5.525 1.00 0.00 N ATOM 2243 CA ALA B 51 77.012 17.128 -6.945 1.00 0.00 C ATOM 2244 C ALA B 51 78.309 16.337 -7.019 1.00 0.00 C ATOM 2245 O ALA B 51 78.598 15.692 -7.998 1.00 0.00 O ATOM 2246 CB ALA B 51 77.155 18.421 -7.743 1.00 0.00 C ATOM 0 H ALA B 51 76.861 18.440 -5.278 1.00 0.00 H new ATOM 0 HA ALA B 51 76.197 16.535 -7.360 1.00 0.00 H new ATOM 0 HB1 ALA B 51 77.364 18.184 -8.786 1.00 0.00 H new ATOM 0 HB2 ALA B 51 76.229 18.992 -7.679 1.00 0.00 H new ATOM 0 HB3 ALA B 51 77.975 19.012 -7.334 1.00 0.00 H new ATOM 2252 N ASP B 52 79.092 16.397 -5.986 1.00 0.00 N ATOM 2253 CA ASP B 52 80.375 15.655 -5.960 1.00 0.00 C ATOM 2254 C ASP B 52 80.093 14.160 -5.831 1.00 0.00 C ATOM 2255 O ASP B 52 80.752 13.347 -6.436 1.00 0.00 O ATOM 2256 CB ASP B 52 81.214 16.110 -4.768 1.00 0.00 C ATOM 2257 CG ASP B 52 82.620 15.524 -4.898 1.00 0.00 C ATOM 2258 OD1 ASP B 52 82.785 14.615 -5.695 1.00 0.00 O ATOM 2259 OD2 ASP B 52 83.506 15.994 -4.205 1.00 0.00 O ATOM 0 H ASP B 52 78.894 16.938 -5.144 1.00 0.00 H new ATOM 0 HA ASP B 52 80.920 15.852 -6.883 1.00 0.00 H new ATOM 0 HB2 ASP B 52 81.261 17.198 -4.734 1.00 0.00 H new ATOM 0 HB3 ASP B 52 80.754 15.782 -3.836 1.00 0.00 H new ATOM 2264 N ALA B 53 79.126 13.793 -5.027 1.00 0.00 N ATOM 2265 CA ALA B 53 78.813 12.336 -4.852 1.00 0.00 C ATOM 2266 C ALA B 53 78.294 11.773 -6.169 1.00 0.00 C ATOM 2267 O ALA B 53 78.780 10.777 -6.661 1.00 0.00 O ATOM 2268 CB ALA B 53 77.752 12.169 -3.766 1.00 0.00 C ATOM 0 H ALA B 53 78.542 14.432 -4.487 1.00 0.00 H new ATOM 0 HA ALA B 53 79.715 11.799 -4.557 1.00 0.00 H new ATOM 0 HB1 ALA B 53 77.525 11.111 -3.639 1.00 0.00 H new ATOM 0 HB2 ALA B 53 78.126 12.575 -2.826 1.00 0.00 H new ATOM 0 HB3 ALA B 53 76.847 12.702 -4.057 1.00 0.00 H new ATOM 2274 N VAL B 54 77.325 12.419 -6.750 1.00 0.00 N ATOM 2275 CA VAL B 54 76.789 11.932 -8.064 1.00 0.00 C ATOM 2276 C VAL B 54 77.937 11.942 -9.071 1.00 0.00 C ATOM 2277 O VAL B 54 78.034 11.096 -9.921 1.00 0.00 O ATOM 2278 CB VAL B 54 75.632 12.868 -8.531 1.00 0.00 C ATOM 2279 CG1 VAL B 54 75.723 13.187 -10.041 1.00 0.00 C ATOM 2280 CG2 VAL B 54 74.264 12.205 -8.254 1.00 0.00 C ATOM 0 H VAL B 54 76.879 13.258 -6.381 1.00 0.00 H new ATOM 0 HA VAL B 54 76.391 10.921 -7.974 1.00 0.00 H new ATOM 0 HB VAL B 54 75.728 13.797 -7.969 1.00 0.00 H new ATOM 0 HG11 VAL B 54 74.899 13.841 -10.325 1.00 0.00 H new ATOM 0 HG12 VAL B 54 76.670 13.684 -10.251 1.00 0.00 H new ATOM 0 HG13 VAL B 54 75.664 12.261 -10.613 1.00 0.00 H new ATOM 0 HG21 VAL B 54 73.465 12.868 -8.584 1.00 0.00 H new ATOM 0 HG22 VAL B 54 74.200 11.262 -8.796 1.00 0.00 H new ATOM 0 HG23 VAL B 54 74.161 12.017 -7.185 1.00 0.00 H new ATOM 2290 N ASP B 55 78.784 12.914 -8.988 1.00 0.00 N ATOM 2291 CA ASP B 55 79.919 13.014 -9.950 1.00 0.00 C ATOM 2292 C ASP B 55 80.798 11.758 -9.848 1.00 0.00 C ATOM 2293 O ASP B 55 81.258 11.233 -10.841 1.00 0.00 O ATOM 2294 CB ASP B 55 80.740 14.269 -9.621 1.00 0.00 C ATOM 2295 CG ASP B 55 81.915 14.401 -10.597 1.00 0.00 C ATOM 2296 OD1 ASP B 55 82.197 13.439 -11.292 1.00 0.00 O ATOM 2297 OD2 ASP B 55 82.511 15.467 -10.634 1.00 0.00 O ATOM 0 H ASP B 55 78.745 13.656 -8.290 1.00 0.00 H new ATOM 0 HA ASP B 55 79.539 13.088 -10.969 1.00 0.00 H new ATOM 0 HB2 ASP B 55 80.106 15.154 -9.681 1.00 0.00 H new ATOM 0 HB3 ASP B 55 81.112 14.212 -8.598 1.00 0.00 H new ATOM 2302 N LYS B 56 81.030 11.268 -8.662 1.00 0.00 N ATOM 2303 CA LYS B 56 81.869 10.041 -8.509 1.00 0.00 C ATOM 2304 C LYS B 56 81.128 8.840 -9.109 1.00 0.00 C ATOM 2305 O LYS B 56 81.704 7.972 -9.751 1.00 0.00 O ATOM 2306 CB LYS B 56 82.120 9.802 -7.016 1.00 0.00 C ATOM 2307 CG LYS B 56 83.101 8.643 -6.827 1.00 0.00 C ATOM 2308 CD LYS B 56 83.186 8.276 -5.340 1.00 0.00 C ATOM 2309 CE LYS B 56 83.959 9.351 -4.567 1.00 0.00 C ATOM 2310 NZ LYS B 56 84.374 8.802 -3.244 1.00 0.00 N ATOM 0 H LYS B 56 80.676 11.662 -7.791 1.00 0.00 H new ATOM 0 HA LYS B 56 82.819 10.168 -9.027 1.00 0.00 H new ATOM 0 HB2 LYS B 56 82.520 10.706 -6.557 1.00 0.00 H new ATOM 0 HB3 LYS B 56 81.180 9.579 -6.512 1.00 0.00 H new ATOM 0 HG2 LYS B 56 82.775 7.779 -7.407 1.00 0.00 H new ATOM 0 HG3 LYS B 56 84.086 8.923 -7.199 1.00 0.00 H new ATOM 0 HD2 LYS B 56 82.183 8.173 -4.927 1.00 0.00 H new ATOM 0 HD3 LYS B 56 83.679 7.311 -5.225 1.00 0.00 H new ATOM 0 HE2 LYS B 56 84.835 9.665 -5.135 1.00 0.00 H new ATOM 0 HE3 LYS B 56 83.336 10.235 -4.428 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 84.899 9.528 -2.716 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 83.530 8.523 -2.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 84.983 7.971 -3.388 1.00 0.00 H new ATOM 2324 N ILE B 57 79.850 8.784 -8.892 1.00 0.00 N ATOM 2325 CA ILE B 57 79.044 7.658 -9.419 1.00 0.00 C ATOM 2326 C ILE B 57 79.151 7.626 -10.946 1.00 0.00 C ATOM 2327 O ILE B 57 79.261 6.582 -11.549 1.00 0.00 O ATOM 2328 CB ILE B 57 77.588 7.866 -8.994 1.00 0.00 C ATOM 2329 CG1 ILE B 57 77.457 7.711 -7.470 1.00 0.00 C ATOM 2330 CG2 ILE B 57 76.703 6.827 -9.673 1.00 0.00 C ATOM 2331 CD1 ILE B 57 76.066 8.179 -6.993 1.00 0.00 C ATOM 0 H ILE B 57 79.323 9.480 -8.365 1.00 0.00 H new ATOM 0 HA ILE B 57 79.409 6.710 -9.024 1.00 0.00 H new ATOM 0 HB ILE B 57 77.277 8.869 -9.287 1.00 0.00 H new ATOM 0 HG12 ILE B 57 77.611 6.669 -7.191 1.00 0.00 H new ATOM 0 HG13 ILE B 57 78.233 8.293 -6.972 1.00 0.00 H new ATOM 0 HG21 ILE B 57 75.667 6.977 -9.369 1.00 0.00 H new ATOM 0 HG22 ILE B 57 76.783 6.932 -10.755 1.00 0.00 H new ATOM 0 HG23 ILE B 57 77.026 5.828 -9.381 1.00 0.00 H new ATOM 0 HD11 ILE B 57 75.993 8.061 -5.912 1.00 0.00 H new ATOM 0 HD12 ILE B 57 75.926 9.228 -7.254 1.00 0.00 H new ATOM 0 HD13 ILE B 57 75.295 7.579 -7.476 1.00 0.00 H new ATOM 2343 N MET B 58 79.131 8.768 -11.569 1.00 0.00 N ATOM 2344 CA MET B 58 79.236 8.819 -13.053 1.00 0.00 C ATOM 2345 C MET B 58 80.556 8.195 -13.495 1.00 0.00 C ATOM 2346 O MET B 58 80.661 7.662 -14.574 1.00 0.00 O ATOM 2347 CB MET B 58 79.157 10.281 -13.528 1.00 0.00 C ATOM 2348 CG MET B 58 77.692 10.723 -13.618 1.00 0.00 C ATOM 2349 SD MET B 58 76.814 10.222 -12.113 1.00 0.00 S ATOM 2350 CE MET B 58 75.239 9.762 -12.873 1.00 0.00 C ATOM 0 H MET B 58 79.046 9.676 -11.112 1.00 0.00 H new ATOM 0 HA MET B 58 78.412 8.258 -13.495 1.00 0.00 H new ATOM 0 HB2 MET B 58 79.699 10.927 -12.837 1.00 0.00 H new ATOM 0 HB3 MET B 58 79.637 10.382 -14.501 1.00 0.00 H new ATOM 0 HG2 MET B 58 77.635 11.804 -13.742 1.00 0.00 H new ATOM 0 HG3 MET B 58 77.220 10.276 -14.493 1.00 0.00 H new ATOM 0 HE1 MET B 58 74.593 9.305 -12.123 1.00 0.00 H new ATOM 0 HE2 MET B 58 74.755 10.652 -13.275 1.00 0.00 H new ATOM 0 HE3 MET B 58 75.418 9.051 -13.680 1.00 0.00 H new ATOM 2360 N LYS B 59 81.567 8.273 -12.681 1.00 0.00 N ATOM 2361 CA LYS B 59 82.880 7.692 -13.074 1.00 0.00 C ATOM 2362 C LYS B 59 82.732 6.192 -13.325 1.00 0.00 C ATOM 2363 O LYS B 59 83.332 5.655 -14.220 1.00 0.00 O ATOM 2364 CB LYS B 59 83.920 7.936 -11.980 1.00 0.00 C ATOM 2365 CG LYS B 59 84.152 9.443 -11.828 1.00 0.00 C ATOM 2366 CD LYS B 59 85.192 9.694 -10.736 1.00 0.00 C ATOM 2367 CE LYS B 59 85.423 11.200 -10.582 1.00 0.00 C ATOM 2368 NZ LYS B 59 86.027 11.739 -11.832 1.00 0.00 N ATOM 0 H LYS B 59 81.543 8.713 -11.761 1.00 0.00 H new ATOM 0 HA LYS B 59 83.216 8.177 -13.990 1.00 0.00 H new ATOM 0 HB2 LYS B 59 83.578 7.512 -11.036 1.00 0.00 H new ATOM 0 HB3 LYS B 59 84.855 7.436 -12.233 1.00 0.00 H new ATOM 0 HG2 LYS B 59 84.493 9.866 -12.773 1.00 0.00 H new ATOM 0 HG3 LYS B 59 83.216 9.942 -11.575 1.00 0.00 H new ATOM 0 HD2 LYS B 59 84.852 9.270 -9.791 1.00 0.00 H new ATOM 0 HD3 LYS B 59 86.128 9.197 -10.990 1.00 0.00 H new ATOM 0 HE2 LYS B 59 84.479 11.704 -10.374 1.00 0.00 H new ATOM 0 HE3 LYS B 59 86.081 11.393 -9.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 86.490 12.648 -11.630 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 86.731 11.065 -12.196 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 85.283 11.880 -12.544 1.00 0.00 H new ATOM 2382 N GLU B 60 81.965 5.507 -12.526 1.00 0.00 N ATOM 2383 CA GLU B 60 81.798 4.047 -12.717 1.00 0.00 C ATOM 2384 C GLU B 60 81.027 3.755 -14.021 1.00 0.00 C ATOM 2385 O GLU B 60 81.322 2.822 -14.740 1.00 0.00 O ATOM 2386 CB GLU B 60 81.008 3.512 -11.521 1.00 0.00 C ATOM 2387 CG GLU B 60 81.872 3.563 -10.257 1.00 0.00 C ATOM 2388 CD GLU B 60 83.020 2.559 -10.368 1.00 0.00 C ATOM 2389 OE1 GLU B 60 82.740 1.379 -10.508 1.00 0.00 O ATOM 2390 OE2 GLU B 60 84.162 2.985 -10.304 1.00 0.00 O ATOM 0 H GLU B 60 81.444 5.902 -11.743 1.00 0.00 H new ATOM 0 HA GLU B 60 82.773 3.565 -12.788 1.00 0.00 H new ATOM 0 HB2 GLU B 60 80.104 4.104 -11.378 1.00 0.00 H new ATOM 0 HB3 GLU B 60 80.691 2.487 -11.713 1.00 0.00 H new ATOM 0 HG2 GLU B 60 82.269 4.568 -10.118 1.00 0.00 H new ATOM 0 HG3 GLU B 60 81.264 3.337 -9.381 1.00 0.00 H new ATOM 2397 N LEU B 61 80.027 4.540 -14.307 1.00 0.00 N ATOM 2398 CA LEU B 61 79.191 4.337 -15.530 1.00 0.00 C ATOM 2399 C LEU B 61 79.979 4.655 -16.807 1.00 0.00 C ATOM 2400 O LEU B 61 79.720 4.104 -17.857 1.00 0.00 O ATOM 2401 CB LEU B 61 77.978 5.288 -15.457 1.00 0.00 C ATOM 2402 CG LEU B 61 76.931 4.840 -14.408 1.00 0.00 C ATOM 2403 CD1 LEU B 61 75.965 3.847 -15.041 1.00 0.00 C ATOM 2404 CD2 LEU B 61 77.579 4.193 -13.171 1.00 0.00 C ATOM 0 H LEU B 61 79.745 5.334 -13.732 1.00 0.00 H new ATOM 0 HA LEU B 61 78.879 3.293 -15.566 1.00 0.00 H new ATOM 0 HB2 LEU B 61 78.323 6.293 -15.214 1.00 0.00 H new ATOM 0 HB3 LEU B 61 77.504 5.342 -16.437 1.00 0.00 H new ATOM 0 HG LEU B 61 76.402 5.734 -14.078 1.00 0.00 H new ATOM 0 HD11 LEU B 61 75.229 3.533 -14.301 1.00 0.00 H new ATOM 0 HD12 LEU B 61 75.456 4.320 -15.881 1.00 0.00 H new ATOM 0 HD13 LEU B 61 76.518 2.977 -15.395 1.00 0.00 H new ATOM 0 HD21 LEU B 61 76.802 3.897 -12.466 1.00 0.00 H new ATOM 0 HD22 LEU B 61 78.147 3.314 -13.476 1.00 0.00 H new ATOM 0 HD23 LEU B 61 78.248 4.910 -12.694 1.00 0.00 H new ATOM 2416 N ASP B 62 80.906 5.563 -16.737 1.00 0.00 N ATOM 2417 CA ASP B 62 81.678 5.950 -17.959 1.00 0.00 C ATOM 2418 C ASP B 62 82.954 5.121 -18.088 1.00 0.00 C ATOM 2419 O ASP B 62 83.426 4.855 -19.176 1.00 0.00 O ATOM 2420 CB ASP B 62 82.058 7.429 -17.853 1.00 0.00 C ATOM 2421 CG ASP B 62 82.650 7.907 -19.179 1.00 0.00 C ATOM 2422 OD1 ASP B 62 83.165 7.077 -19.911 1.00 0.00 O ATOM 2423 OD2 ASP B 62 82.577 9.095 -19.444 1.00 0.00 O ATOM 0 H ASP B 62 81.168 6.060 -15.885 1.00 0.00 H new ATOM 0 HA ASP B 62 81.056 5.770 -18.836 1.00 0.00 H new ATOM 0 HB2 ASP B 62 81.179 8.023 -17.601 1.00 0.00 H new ATOM 0 HB3 ASP B 62 82.780 7.572 -17.049 1.00 0.00 H new ATOM 2428 N GLU B 63 83.525 4.723 -16.994 1.00 0.00 N ATOM 2429 CA GLU B 63 84.777 3.934 -17.058 1.00 0.00 C ATOM 2430 C GLU B 63 84.464 2.545 -17.609 1.00 0.00 C ATOM 2431 O GLU B 63 85.271 1.928 -18.274 1.00 0.00 O ATOM 2432 CB GLU B 63 85.391 3.870 -15.651 1.00 0.00 C ATOM 2433 CG GLU B 63 84.651 2.864 -14.771 1.00 0.00 C ATOM 2434 CD GLU B 63 85.259 2.876 -13.368 1.00 0.00 C ATOM 2435 OE1 GLU B 63 86.299 3.491 -13.200 1.00 0.00 O ATOM 2436 OE2 GLU B 63 84.682 2.258 -12.491 1.00 0.00 O ATOM 0 H GLU B 63 83.177 4.911 -16.054 1.00 0.00 H new ATOM 0 HA GLU B 63 85.502 4.401 -17.725 1.00 0.00 H new ATOM 0 HB2 GLU B 63 86.442 3.591 -15.722 1.00 0.00 H new ATOM 0 HB3 GLU B 63 85.354 4.857 -15.190 1.00 0.00 H new ATOM 0 HG2 GLU B 63 83.592 3.116 -14.723 1.00 0.00 H new ATOM 0 HG3 GLU B 63 84.722 1.865 -15.202 1.00 0.00 H new ATOM 2443 N ASN B 64 83.288 2.056 -17.338 1.00 0.00 N ATOM 2444 CA ASN B 64 82.901 0.714 -17.847 1.00 0.00 C ATOM 2445 C ASN B 64 81.375 0.602 -17.855 1.00 0.00 C ATOM 2446 O ASN B 64 80.808 -0.319 -17.302 1.00 0.00 O ATOM 2447 CB ASN B 64 83.507 -0.376 -16.955 1.00 0.00 C ATOM 2448 CG ASN B 64 82.816 -0.380 -15.588 1.00 0.00 C ATOM 2449 OD1 ASN B 64 82.648 0.744 -14.945 1.00 0.00 O flip ATOM 2450 ND2 ASN B 64 82.424 -1.420 -15.098 1.00 0.00 N flip ATOM 0 H ASN B 64 82.575 2.531 -16.783 1.00 0.00 H new ATOM 0 HA ASN B 64 83.278 0.583 -18.861 1.00 0.00 H new ATOM 0 HB2 ASN B 64 83.395 -1.350 -17.431 1.00 0.00 H new ATOM 0 HB3 ASN B 64 84.576 -0.203 -16.831 1.00 0.00 H new ATOM 0 HD21 ASN B 64 82.554 -2.300 -15.598 1.00 0.00 H new ATOM 0 HD22 ASN B 64 81.965 -1.413 -14.187 1.00 0.00 H new ATOM 2457 N GLY B 65 80.706 1.532 -18.482 1.00 0.00 N ATOM 2458 CA GLY B 65 79.216 1.480 -18.526 1.00 0.00 C ATOM 2459 C GLY B 65 78.783 0.083 -18.974 1.00 0.00 C ATOM 2460 O GLY B 65 77.715 -0.389 -18.635 1.00 0.00 O ATOM 0 H GLY B 65 81.127 2.325 -18.966 1.00 0.00 H new ATOM 0 HA2 GLY B 65 78.802 1.706 -17.544 1.00 0.00 H new ATOM 0 HA3 GLY B 65 78.833 2.233 -19.215 1.00 0.00 H new ATOM 2464 N ASP B 66 79.609 -0.580 -19.738 1.00 0.00 N ATOM 2465 CA ASP B 66 79.260 -1.949 -20.218 1.00 0.00 C ATOM 2466 C ASP B 66 79.578 -2.988 -19.138 1.00 0.00 C ATOM 2467 O ASP B 66 79.316 -4.163 -19.304 1.00 0.00 O ATOM 2468 CB ASP B 66 80.072 -2.266 -21.479 1.00 0.00 C ATOM 2469 CG ASP B 66 81.568 -2.188 -21.162 1.00 0.00 C ATOM 2470 OD1 ASP B 66 81.915 -1.549 -20.182 1.00 0.00 O ATOM 2471 OD2 ASP B 66 82.341 -2.772 -21.904 1.00 0.00 O ATOM 0 H ASP B 66 80.515 -0.231 -20.052 1.00 0.00 H new ATOM 0 HA ASP B 66 78.194 -1.985 -20.442 1.00 0.00 H new ATOM 0 HB2 ASP B 66 79.819 -3.261 -21.845 1.00 0.00 H new ATOM 0 HB3 ASP B 66 79.821 -1.561 -22.272 1.00 0.00 H new ATOM 2476 N GLY B 67 80.135 -2.574 -18.031 1.00 0.00 N ATOM 2477 CA GLY B 67 80.456 -3.550 -16.955 1.00 0.00 C ATOM 2478 C GLY B 67 79.156 -4.056 -16.338 1.00 0.00 C ATOM 2479 O GLY B 67 78.156 -4.205 -17.012 1.00 0.00 O ATOM 0 H GLY B 67 80.380 -1.605 -17.828 1.00 0.00 H new ATOM 0 HA2 GLY B 67 81.029 -4.383 -17.362 1.00 0.00 H new ATOM 0 HA3 GLY B 67 81.076 -3.079 -16.192 1.00 0.00 H new ATOM 2483 N GLU B 68 79.152 -4.319 -15.060 1.00 0.00 N ATOM 2484 CA GLU B 68 77.899 -4.812 -14.417 1.00 0.00 C ATOM 2485 C GLU B 68 77.897 -4.540 -12.914 1.00 0.00 C ATOM 2486 O GLU B 68 78.926 -4.410 -12.281 1.00 0.00 O ATOM 2487 CB GLU B 68 77.747 -6.314 -14.670 1.00 0.00 C ATOM 2488 CG GLU B 68 78.986 -7.055 -14.162 1.00 0.00 C ATOM 2489 CD GLU B 68 78.830 -8.555 -14.418 1.00 0.00 C ATOM 2490 OE1 GLU B 68 77.723 -8.976 -14.713 1.00 0.00 O ATOM 2491 OE2 GLU B 68 79.821 -9.260 -14.314 1.00 0.00 O ATOM 0 H GLU B 68 79.953 -4.216 -14.437 1.00 0.00 H new ATOM 0 HA GLU B 68 77.059 -4.275 -14.858 1.00 0.00 H new ATOM 0 HB2 GLU B 68 76.856 -6.688 -14.166 1.00 0.00 H new ATOM 0 HB3 GLU B 68 77.612 -6.501 -15.735 1.00 0.00 H new ATOM 0 HG2 GLU B 68 79.877 -6.681 -14.666 1.00 0.00 H new ATOM 0 HG3 GLU B 68 79.121 -6.870 -13.096 1.00 0.00 H new ATOM 2498 N VAL B 69 76.718 -4.465 -12.349 1.00 0.00 N ATOM 2499 CA VAL B 69 76.571 -4.213 -10.887 1.00 0.00 C ATOM 2500 C VAL B 69 75.584 -5.222 -10.321 1.00 0.00 C ATOM 2501 O VAL B 69 74.752 -5.752 -11.039 1.00 0.00 O ATOM 2502 CB VAL B 69 76.013 -2.803 -10.669 1.00 0.00 C ATOM 2503 CG1 VAL B 69 77.098 -1.776 -11.022 1.00 0.00 C ATOM 2504 CG2 VAL B 69 74.752 -2.589 -11.558 1.00 0.00 C ATOM 0 H VAL B 69 75.836 -4.570 -12.851 1.00 0.00 H new ATOM 0 HA VAL B 69 77.539 -4.306 -10.394 1.00 0.00 H new ATOM 0 HB VAL B 69 75.724 -2.677 -9.626 1.00 0.00 H new ATOM 0 HG11 VAL B 69 76.709 -0.769 -10.870 1.00 0.00 H new ATOM 0 HG12 VAL B 69 77.967 -1.930 -10.382 1.00 0.00 H new ATOM 0 HG13 VAL B 69 77.389 -1.898 -12.065 1.00 0.00 H new ATOM 0 HG21 VAL B 69 74.360 -1.584 -11.398 1.00 0.00 H new ATOM 0 HG22 VAL B 69 75.022 -2.711 -12.607 1.00 0.00 H new ATOM 0 HG23 VAL B 69 73.990 -3.322 -11.292 1.00 0.00 H new ATOM 2514 N ASP B 70 75.654 -5.480 -9.038 1.00 0.00 N ATOM 2515 CA ASP B 70 74.713 -6.445 -8.409 1.00 0.00 C ATOM 2516 C ASP B 70 74.001 -5.753 -7.256 1.00 0.00 C ATOM 2517 O ASP B 70 73.850 -4.553 -7.238 1.00 0.00 O ATOM 2518 CB ASP B 70 75.487 -7.647 -7.864 1.00 0.00 C ATOM 2519 CG ASP B 70 76.396 -8.210 -8.955 1.00 0.00 C ATOM 2520 OD1 ASP B 70 76.216 -7.833 -10.100 1.00 0.00 O ATOM 2521 OD2 ASP B 70 77.253 -9.014 -8.626 1.00 0.00 O ATOM 0 H ASP B 70 76.329 -5.058 -8.399 1.00 0.00 H new ATOM 0 HA ASP B 70 73.992 -6.787 -9.152 1.00 0.00 H new ATOM 0 HB2 ASP B 70 76.081 -7.348 -7.000 1.00 0.00 H new ATOM 0 HB3 ASP B 70 74.793 -8.415 -7.523 1.00 0.00 H new ATOM 2526 N PHE B 71 73.545 -6.505 -6.305 1.00 0.00 N ATOM 2527 CA PHE B 71 72.810 -5.903 -5.160 1.00 0.00 C ATOM 2528 C PHE B 71 73.691 -4.976 -4.328 1.00 0.00 C ATOM 2529 O PHE B 71 73.271 -3.916 -3.944 1.00 0.00 O ATOM 2530 CB PHE B 71 72.294 -7.026 -4.261 1.00 0.00 C ATOM 2531 CG PHE B 71 73.434 -7.961 -3.936 1.00 0.00 C ATOM 2532 CD1 PHE B 71 74.287 -7.675 -2.866 1.00 0.00 C ATOM 2533 CD2 PHE B 71 73.644 -9.107 -4.709 1.00 0.00 C ATOM 2534 CE1 PHE B 71 75.349 -8.534 -2.567 1.00 0.00 C ATOM 2535 CE2 PHE B 71 74.708 -9.968 -4.409 1.00 0.00 C ATOM 2536 CZ PHE B 71 75.559 -9.681 -3.336 1.00 0.00 C ATOM 0 H PHE B 71 73.648 -7.519 -6.267 1.00 0.00 H new ATOM 0 HA PHE B 71 71.991 -5.309 -5.566 1.00 0.00 H new ATOM 0 HB2 PHE B 71 71.875 -6.611 -3.344 1.00 0.00 H new ATOM 0 HB3 PHE B 71 71.492 -7.570 -4.761 1.00 0.00 H new ATOM 0 HD1 PHE B 71 74.125 -6.789 -2.269 1.00 0.00 H new ATOM 0 HD2 PHE B 71 72.987 -9.328 -5.537 1.00 0.00 H new ATOM 0 HE1 PHE B 71 76.008 -8.310 -1.741 1.00 0.00 H new ATOM 0 HE2 PHE B 71 74.871 -10.853 -5.006 1.00 0.00 H new ATOM 0 HZ PHE B 71 76.378 -10.346 -3.103 1.00 0.00 H new ATOM 2546 N GLN B 72 74.882 -5.362 -4.009 1.00 0.00 N ATOM 2547 CA GLN B 72 75.732 -4.474 -3.166 1.00 0.00 C ATOM 2548 C GLN B 72 76.258 -3.328 -4.001 1.00 0.00 C ATOM 2549 O GLN B 72 76.492 -2.241 -3.515 1.00 0.00 O ATOM 2550 CB GLN B 72 76.916 -5.274 -2.609 1.00 0.00 C ATOM 2551 CG GLN B 72 77.770 -4.413 -1.661 1.00 0.00 C ATOM 2552 CD GLN B 72 79.129 -5.090 -1.455 1.00 0.00 C ATOM 2553 OE1 GLN B 72 79.589 -5.236 -0.341 1.00 0.00 O ATOM 2554 NE2 GLN B 72 79.796 -5.516 -2.494 1.00 0.00 N ATOM 0 H GLN B 72 75.309 -6.245 -4.289 1.00 0.00 H new ATOM 0 HA GLN B 72 75.133 -4.082 -2.344 1.00 0.00 H new ATOM 0 HB2 GLN B 72 76.548 -6.151 -2.076 1.00 0.00 H new ATOM 0 HB3 GLN B 72 77.533 -5.636 -3.431 1.00 0.00 H new ATOM 0 HG2 GLN B 72 77.906 -3.416 -2.079 1.00 0.00 H new ATOM 0 HG3 GLN B 72 77.262 -4.291 -0.704 1.00 0.00 H new ATOM 0 HE21 GLN B 72 79.412 -5.395 -3.431 1.00 0.00 H new ATOM 0 HE22 GLN B 72 80.701 -5.970 -2.368 1.00 0.00 H new ATOM 2563 N GLU B 73 76.489 -3.576 -5.242 1.00 0.00 N ATOM 2564 CA GLU B 73 77.054 -2.498 -6.103 1.00 0.00 C ATOM 2565 C GLU B 73 75.977 -1.506 -6.518 1.00 0.00 C ATOM 2566 O GLU B 73 76.219 -0.316 -6.564 1.00 0.00 O ATOM 2567 CB GLU B 73 77.736 -3.073 -7.341 1.00 0.00 C ATOM 2568 CG GLU B 73 78.905 -3.965 -6.911 1.00 0.00 C ATOM 2569 CD GLU B 73 79.612 -4.521 -8.149 1.00 0.00 C ATOM 2570 OE1 GLU B 73 79.492 -3.910 -9.197 1.00 0.00 O ATOM 2571 OE2 GLU B 73 80.276 -5.537 -8.022 1.00 0.00 O ATOM 0 H GLU B 73 76.317 -4.468 -5.707 1.00 0.00 H new ATOM 0 HA GLU B 73 77.803 -1.973 -5.510 1.00 0.00 H new ATOM 0 HB2 GLU B 73 77.021 -3.650 -7.928 1.00 0.00 H new ATOM 0 HB3 GLU B 73 78.096 -2.266 -7.979 1.00 0.00 H new ATOM 0 HG2 GLU B 73 79.608 -3.393 -6.305 1.00 0.00 H new ATOM 0 HG3 GLU B 73 78.541 -4.783 -6.290 1.00 0.00 H new ATOM 2578 N PHE B 74 74.793 -1.958 -6.836 1.00 0.00 N ATOM 2579 CA PHE B 74 73.746 -0.984 -7.255 1.00 0.00 C ATOM 2580 C PHE B 74 73.155 -0.347 -6.013 1.00 0.00 C ATOM 2581 O PHE B 74 72.749 0.789 -6.018 1.00 0.00 O ATOM 2582 CB PHE B 74 72.682 -1.715 -8.110 1.00 0.00 C ATOM 2583 CG PHE B 74 71.319 -1.801 -7.438 1.00 0.00 C ATOM 2584 CD1 PHE B 74 70.593 -0.634 -7.196 1.00 0.00 C ATOM 2585 CD2 PHE B 74 70.785 -3.044 -7.072 1.00 0.00 C ATOM 2586 CE1 PHE B 74 69.337 -0.703 -6.586 1.00 0.00 C ATOM 2587 CE2 PHE B 74 69.527 -3.112 -6.463 1.00 0.00 C ATOM 2588 CZ PHE B 74 68.806 -1.938 -6.220 1.00 0.00 C ATOM 0 H PHE B 74 74.510 -2.938 -6.825 1.00 0.00 H new ATOM 0 HA PHE B 74 74.167 -0.190 -7.872 1.00 0.00 H new ATOM 0 HB2 PHE B 74 72.576 -1.198 -9.064 1.00 0.00 H new ATOM 0 HB3 PHE B 74 73.034 -2.723 -8.331 1.00 0.00 H new ATOM 0 HD1 PHE B 74 71.002 0.324 -7.480 1.00 0.00 H new ATOM 0 HD2 PHE B 74 71.344 -3.949 -7.260 1.00 0.00 H new ATOM 0 HE1 PHE B 74 68.778 0.202 -6.398 1.00 0.00 H new ATOM 0 HE2 PHE B 74 69.113 -4.069 -6.181 1.00 0.00 H new ATOM 0 HZ PHE B 74 67.836 -1.989 -5.748 1.00 0.00 H new ATOM 2598 N VAL B 75 73.105 -1.072 -4.950 1.00 0.00 N ATOM 2599 CA VAL B 75 72.529 -0.488 -3.704 1.00 0.00 C ATOM 2600 C VAL B 75 73.477 0.573 -3.162 1.00 0.00 C ATOM 2601 O VAL B 75 73.058 1.599 -2.681 1.00 0.00 O ATOM 2602 CB VAL B 75 72.310 -1.569 -2.644 1.00 0.00 C ATOM 2603 CG1 VAL B 75 71.924 -0.920 -1.310 1.00 0.00 C ATOM 2604 CG2 VAL B 75 71.184 -2.498 -3.096 1.00 0.00 C ATOM 0 H VAL B 75 73.431 -2.036 -4.877 1.00 0.00 H new ATOM 0 HA VAL B 75 71.564 -0.041 -3.942 1.00 0.00 H new ATOM 0 HB VAL B 75 73.231 -2.138 -2.515 1.00 0.00 H new ATOM 0 HG11 VAL B 75 71.769 -1.695 -0.559 1.00 0.00 H new ATOM 0 HG12 VAL B 75 72.723 -0.254 -0.985 1.00 0.00 H new ATOM 0 HG13 VAL B 75 71.004 -0.349 -1.436 1.00 0.00 H new ATOM 0 HG21 VAL B 75 71.025 -3.270 -2.343 1.00 0.00 H new ATOM 0 HG22 VAL B 75 70.267 -1.923 -3.225 1.00 0.00 H new ATOM 0 HG23 VAL B 75 71.456 -2.965 -4.043 1.00 0.00 H new ATOM 2614 N VAL B 76 74.749 0.322 -3.217 1.00 0.00 N ATOM 2615 CA VAL B 76 75.723 1.308 -2.692 1.00 0.00 C ATOM 2616 C VAL B 76 75.729 2.564 -3.578 1.00 0.00 C ATOM 2617 O VAL B 76 75.808 3.671 -3.091 1.00 0.00 O ATOM 2618 CB VAL B 76 77.099 0.646 -2.640 1.00 0.00 C ATOM 2619 CG1 VAL B 76 78.171 1.688 -2.345 1.00 0.00 C ATOM 2620 CG2 VAL B 76 77.103 -0.414 -1.529 1.00 0.00 C ATOM 0 H VAL B 76 75.158 -0.528 -3.605 1.00 0.00 H new ATOM 0 HA VAL B 76 75.446 1.624 -1.686 1.00 0.00 H new ATOM 0 HB VAL B 76 77.311 0.181 -3.603 1.00 0.00 H new ATOM 0 HG11 VAL B 76 79.148 1.205 -2.310 1.00 0.00 H new ATOM 0 HG12 VAL B 76 78.168 2.445 -3.129 1.00 0.00 H new ATOM 0 HG13 VAL B 76 77.965 2.160 -1.384 1.00 0.00 H new ATOM 0 HG21 VAL B 76 78.082 -0.891 -1.485 1.00 0.00 H new ATOM 0 HG22 VAL B 76 76.888 0.061 -0.572 1.00 0.00 H new ATOM 0 HG23 VAL B 76 76.342 -1.165 -1.740 1.00 0.00 H new ATOM 2630 N LEU B 77 75.646 2.403 -4.870 1.00 0.00 N ATOM 2631 CA LEU B 77 75.642 3.594 -5.778 1.00 0.00 C ATOM 2632 C LEU B 77 74.353 4.393 -5.581 1.00 0.00 C ATOM 2633 O LEU B 77 74.348 5.595 -5.661 1.00 0.00 O ATOM 2634 CB LEU B 77 75.734 3.130 -7.254 1.00 0.00 C ATOM 2635 CG LEU B 77 77.170 3.260 -7.779 1.00 0.00 C ATOM 2636 CD1 LEU B 77 78.079 2.247 -7.068 1.00 0.00 C ATOM 2637 CD2 LEU B 77 77.180 2.996 -9.294 1.00 0.00 C ATOM 0 H LEU B 77 75.581 1.500 -5.340 1.00 0.00 H new ATOM 0 HA LEU B 77 76.500 4.223 -5.539 1.00 0.00 H new ATOM 0 HB2 LEU B 77 75.405 2.094 -7.335 1.00 0.00 H new ATOM 0 HB3 LEU B 77 75.062 3.727 -7.870 1.00 0.00 H new ATOM 0 HG LEU B 77 77.540 4.266 -7.581 1.00 0.00 H new ATOM 0 HD11 LEU B 77 79.097 2.344 -7.445 1.00 0.00 H new ATOM 0 HD12 LEU B 77 78.069 2.440 -5.995 1.00 0.00 H new ATOM 0 HD13 LEU B 77 77.717 1.237 -7.258 1.00 0.00 H new ATOM 0 HD21 LEU B 77 78.198 3.087 -9.672 1.00 0.00 H new ATOM 0 HD22 LEU B 77 76.808 1.990 -9.491 1.00 0.00 H new ATOM 0 HD23 LEU B 77 76.541 3.723 -9.794 1.00 0.00 H new ATOM 2649 N VAL B 78 73.266 3.729 -5.365 1.00 0.00 N ATOM 2650 CA VAL B 78 71.978 4.448 -5.196 1.00 0.00 C ATOM 2651 C VAL B 78 71.992 5.214 -3.880 1.00 0.00 C ATOM 2652 O VAL B 78 71.551 6.335 -3.811 1.00 0.00 O ATOM 2653 CB VAL B 78 70.832 3.439 -5.228 1.00 0.00 C ATOM 2654 CG1 VAL B 78 69.518 4.112 -4.811 1.00 0.00 C ATOM 2655 CG2 VAL B 78 70.671 2.931 -6.653 1.00 0.00 C ATOM 0 H VAL B 78 73.208 2.713 -5.297 1.00 0.00 H new ATOM 0 HA VAL B 78 71.837 5.162 -6.007 1.00 0.00 H new ATOM 0 HB VAL B 78 71.058 2.623 -4.542 1.00 0.00 H new ATOM 0 HG11 VAL B 78 68.710 3.381 -4.838 1.00 0.00 H new ATOM 0 HG12 VAL B 78 69.616 4.506 -3.800 1.00 0.00 H new ATOM 0 HG13 VAL B 78 69.293 4.928 -5.498 1.00 0.00 H new ATOM 0 HG21 VAL B 78 69.856 2.209 -6.692 1.00 0.00 H new ATOM 0 HG22 VAL B 78 70.446 3.768 -7.314 1.00 0.00 H new ATOM 0 HG23 VAL B 78 71.596 2.452 -6.975 1.00 0.00 H new ATOM 2665 N ALA B 79 72.525 4.641 -2.844 1.00 0.00 N ATOM 2666 CA ALA B 79 72.592 5.378 -1.559 1.00 0.00 C ATOM 2667 C ALA B 79 73.419 6.625 -1.821 1.00 0.00 C ATOM 2668 O ALA B 79 73.117 7.708 -1.363 1.00 0.00 O ATOM 2669 CB ALA B 79 73.265 4.502 -0.497 1.00 0.00 C ATOM 0 H ALA B 79 72.916 3.699 -2.831 1.00 0.00 H new ATOM 0 HA ALA B 79 71.599 5.640 -1.193 1.00 0.00 H new ATOM 0 HB1 ALA B 79 73.313 5.046 0.446 1.00 0.00 H new ATOM 0 HB2 ALA B 79 72.687 3.588 -0.360 1.00 0.00 H new ATOM 0 HB3 ALA B 79 74.274 4.248 -0.821 1.00 0.00 H new ATOM 2675 N ALA B 80 74.452 6.472 -2.594 1.00 0.00 N ATOM 2676 CA ALA B 80 75.306 7.623 -2.943 1.00 0.00 C ATOM 2677 C ALA B 80 74.464 8.640 -3.729 1.00 0.00 C ATOM 2678 O ALA B 80 74.615 9.824 -3.582 1.00 0.00 O ATOM 2679 CB ALA B 80 76.481 7.109 -3.783 1.00 0.00 C ATOM 0 H ALA B 80 74.741 5.583 -3.002 1.00 0.00 H new ATOM 0 HA ALA B 80 75.696 8.114 -2.052 1.00 0.00 H new ATOM 0 HB1 ALA B 80 77.128 7.944 -4.054 1.00 0.00 H new ATOM 0 HB2 ALA B 80 77.051 6.381 -3.205 1.00 0.00 H new ATOM 0 HB3 ALA B 80 76.101 6.636 -4.689 1.00 0.00 H new ATOM 2685 N LEU B 81 73.570 8.183 -4.558 1.00 0.00 N ATOM 2686 CA LEU B 81 72.723 9.130 -5.338 1.00 0.00 C ATOM 2687 C LEU B 81 71.864 9.959 -4.378 1.00 0.00 C ATOM 2688 O LEU B 81 71.671 11.144 -4.565 1.00 0.00 O ATOM 2689 CB LEU B 81 71.821 8.331 -6.293 1.00 0.00 C ATOM 2690 CG LEU B 81 70.894 9.269 -7.089 1.00 0.00 C ATOM 2691 CD1 LEU B 81 71.717 10.285 -7.895 1.00 0.00 C ATOM 2692 CD2 LEU B 81 70.030 8.433 -8.051 1.00 0.00 C ATOM 0 H LEU B 81 73.388 7.194 -4.731 1.00 0.00 H new ATOM 0 HA LEU B 81 73.357 9.802 -5.917 1.00 0.00 H new ATOM 0 HB2 LEU B 81 72.437 7.752 -6.981 1.00 0.00 H new ATOM 0 HB3 LEU B 81 71.223 7.619 -5.724 1.00 0.00 H new ATOM 0 HG LEU B 81 70.257 9.811 -6.390 1.00 0.00 H new ATOM 0 HD11 LEU B 81 71.045 10.939 -8.451 1.00 0.00 H new ATOM 0 HD12 LEU B 81 72.324 10.882 -7.215 1.00 0.00 H new ATOM 0 HD13 LEU B 81 72.367 9.756 -8.592 1.00 0.00 H new ATOM 0 HD21 LEU B 81 69.372 9.093 -8.616 1.00 0.00 H new ATOM 0 HD22 LEU B 81 70.676 7.888 -8.739 1.00 0.00 H new ATOM 0 HD23 LEU B 81 69.430 7.725 -7.479 1.00 0.00 H new ATOM 2704 N THR B 82 71.346 9.339 -3.353 1.00 0.00 N ATOM 2705 CA THR B 82 70.497 10.073 -2.381 1.00 0.00 C ATOM 2706 C THR B 82 71.310 11.205 -1.745 1.00 0.00 C ATOM 2707 O THR B 82 70.815 12.297 -1.539 1.00 0.00 O ATOM 2708 CB THR B 82 70.010 9.095 -1.309 1.00 0.00 C ATOM 2709 OG1 THR B 82 69.569 7.901 -1.942 1.00 0.00 O ATOM 2710 CG2 THR B 82 68.841 9.717 -0.543 1.00 0.00 C ATOM 0 H THR B 82 71.477 8.348 -3.149 1.00 0.00 H new ATOM 0 HA THR B 82 69.635 10.507 -2.888 1.00 0.00 H new ATOM 0 HB THR B 82 70.822 8.874 -0.616 1.00 0.00 H new ATOM 0 HG1 THR B 82 69.256 7.267 -1.263 1.00 0.00 H new ATOM 0 HG21 THR B 82 68.494 9.020 0.220 1.00 0.00 H new ATOM 0 HG22 THR B 82 69.168 10.642 -0.068 1.00 0.00 H new ATOM 0 HG23 THR B 82 68.026 9.932 -1.234 1.00 0.00 H new ATOM 2718 N VAL B 83 72.558 10.959 -1.441 1.00 0.00 N ATOM 2719 CA VAL B 83 73.402 12.026 -0.824 1.00 0.00 C ATOM 2720 C VAL B 83 73.462 13.206 -1.799 1.00 0.00 C ATOM 2721 O VAL B 83 73.467 14.357 -1.411 1.00 0.00 O ATOM 2722 CB VAL B 83 74.822 11.454 -0.535 1.00 0.00 C ATOM 2723 CG1 VAL B 83 75.833 11.788 -1.647 1.00 0.00 C ATOM 2724 CG2 VAL B 83 75.363 12.025 0.773 1.00 0.00 C ATOM 0 H VAL B 83 73.029 10.067 -1.593 1.00 0.00 H new ATOM 0 HA VAL B 83 72.980 12.366 0.122 1.00 0.00 H new ATOM 0 HB VAL B 83 74.709 10.371 -0.478 1.00 0.00 H new ATOM 0 HG11 VAL B 83 76.805 11.365 -1.394 1.00 0.00 H new ATOM 0 HG12 VAL B 83 75.488 11.366 -2.591 1.00 0.00 H new ATOM 0 HG13 VAL B 83 75.922 12.870 -1.745 1.00 0.00 H new ATOM 0 HG21 VAL B 83 76.356 11.618 0.965 1.00 0.00 H new ATOM 0 HG22 VAL B 83 75.424 13.111 0.698 1.00 0.00 H new ATOM 0 HG23 VAL B 83 74.696 11.755 1.592 1.00 0.00 H new ATOM 2734 N ALA B 84 73.514 12.909 -3.064 1.00 0.00 N ATOM 2735 CA ALA B 84 73.580 13.974 -4.095 1.00 0.00 C ATOM 2736 C ALA B 84 72.249 14.712 -4.166 1.00 0.00 C ATOM 2737 O ALA B 84 72.182 15.825 -4.630 1.00 0.00 O ATOM 2738 CB ALA B 84 73.896 13.347 -5.448 1.00 0.00 C ATOM 0 H ALA B 84 73.513 11.958 -3.432 1.00 0.00 H new ATOM 0 HA ALA B 84 74.363 14.685 -3.831 1.00 0.00 H new ATOM 0 HB1 ALA B 84 73.945 14.127 -6.208 1.00 0.00 H new ATOM 0 HB2 ALA B 84 74.855 12.831 -5.395 1.00 0.00 H new ATOM 0 HB3 ALA B 84 73.114 12.634 -5.710 1.00 0.00 H new ATOM 2744 N CYS B 85 71.186 14.102 -3.723 1.00 0.00 N ATOM 2745 CA CYS B 85 69.871 14.771 -3.770 1.00 0.00 C ATOM 2746 C CYS B 85 69.054 14.243 -2.599 1.00 0.00 C ATOM 2747 O CYS B 85 68.063 13.567 -2.780 1.00 0.00 O ATOM 2748 CB CYS B 85 69.177 14.441 -5.099 1.00 0.00 C ATOM 2749 SG CYS B 85 70.394 14.444 -6.440 1.00 0.00 S ATOM 0 H CYS B 85 71.179 13.161 -3.329 1.00 0.00 H new ATOM 0 HA CYS B 85 69.975 15.854 -3.701 1.00 0.00 H new ATOM 0 HB2 CYS B 85 68.694 13.466 -5.036 1.00 0.00 H new ATOM 0 HB3 CYS B 85 68.395 15.172 -5.303 1.00 0.00 H new ATOM 0 HG CYS B 85 71.342 15.290 -6.164 1.00 0.00 H new ATOM 2755 N ASN B 86 69.481 14.535 -1.394 1.00 0.00 N ATOM 2756 CA ASN B 86 68.741 14.048 -0.195 1.00 0.00 C ATOM 2757 C ASN B 86 67.378 14.727 -0.167 1.00 0.00 C ATOM 2758 O ASN B 86 66.957 15.284 0.827 1.00 0.00 O ATOM 2759 CB ASN B 86 69.517 14.395 1.077 1.00 0.00 C ATOM 2760 CG ASN B 86 68.813 13.769 2.281 1.00 0.00 C ATOM 2761 OD1 ASN B 86 68.157 14.455 3.040 1.00 0.00 O ATOM 2762 ND2 ASN B 86 68.920 12.485 2.490 1.00 0.00 N ATOM 0 H ASN B 86 70.312 15.091 -1.192 1.00 0.00 H new ATOM 0 HA ASN B 86 68.623 12.965 -0.244 1.00 0.00 H new ATOM 0 HB2 ASN B 86 70.540 14.025 1.006 1.00 0.00 H new ATOM 0 HB3 ASN B 86 69.577 15.477 1.197 1.00 0.00 H new ATOM 0 HD21 ASN B 86 68.453 12.058 3.290 1.00 0.00 H new ATOM 0 HD22 ASN B 86 69.470 11.909 1.853 1.00 0.00 H new