USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1170 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 56 LYS NZ :NH3+ 155:sc= -0.26 (180deg=-1.13) USER MOD Set 1.2: B 59 LYS NZ :NH3+ -178:sc= -0.0718 (180deg=-0.08) USER MOD Set 2.1: A 82 THR OG1 : rot 85:sc= 1.01 USER MOD Set 2.2: B 8 MET CE :methyl -155:sc= -0.319 (180deg=-1.54!) USER MOD Set 3.1: A 56 LYS NZ :NH3+ 160:sc= -0.231 (180deg=-1.25) USER MOD Set 3.2: A 59 LYS NZ :NH3+ -178:sc= -0.077 (180deg=-0.0802) USER MOD Set 4.1: A 8 MET CE :methyl -147:sc= -0.226 (180deg=-1.56!) USER MOD Set 4.2: B 82 THR OG1 : rot 97:sc= 1.08 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 69:sc= 0.00427 USER MOD Single : A 13 ASN : amide:sc= -2.35! C(o=-2.4!,f=-5!) USER MOD Single : A 16 HIS : no HD1:sc=-0.00925 X(o=-0.0092,f=-0.0092) USER MOD Single : A 18 HIS : no HD1:sc= -4.6! C(o=-4.6!,f=-4.1!) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -141:sc= -9.63! (180deg=-14.1!) USER MOD Single : A 31 LYS NZ :NH3+ -166:sc= -0.0108 (180deg=-0.214) USER MOD Single : A 32 GLN : amide:sc= -0.13 K(o=-0.13,f=-1.3!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 GLN : amide:sc= -1.66 K(o=-1.7,f=-0.89) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -3.25 K(o=-3.3,f=-4.1!) USER MOD Single : A 49 LYS NZ :NH3+ 159:sc= -0.346 (180deg=-1.53!) USER MOD Single : A 58 MET CE :methyl -173:sc= -0.349 (180deg=-0.467) USER MOD Single : A 64 ASN : amide:sc= -0.0299 K(o=-0.03,f=1.2) USER MOD Single : A 72 GLN : amide:sc= -0.0991 X(o=-0.099,f=0) USER MOD Single : A 74 TYR OH : rot 159:sc= 0.95 USER MOD Single : A 85 CYS SG : rot 69:sc= 0.949 USER MOD Single : A 86 ASN : amide:sc= -0.0261 X(o=-0.026,f=0.059) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B 10 THR OG1 : rot 69:sc= 0.00557 USER MOD Single : B 13 ASN : amide:sc= -2.35! C(o=-2.4!,f=-5.1!) USER MOD Single : B 16 HIS : no HD1:sc=-0.00791 X(o=-0.0079,f=-0.0079) USER MOD Single : B 18 HIS : no HD1:sc= -4.58! C(o=-4.6!,f=-4.3!) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ -138:sc= -9.71! (180deg=-14!) USER MOD Single : B 31 LYS NZ :NH3+ -168:sc= -0.0116 (180deg=-0.219) USER MOD Single : B 32 GLN : amide:sc= -0.152 K(o=-0.15,f=-1.4!) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 GLN : amide:sc= -1.66 K(o=-1.7,f=-0.9) USER MOD Single : B 39 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -3.15 K(o=-3.1,f=-3.9!) USER MOD Single : B 49 LYS NZ :NH3+ 155:sc= -0.344 (180deg=-1.61!) USER MOD Single : B 58 MET CE :methyl -171:sc= -0.358 (180deg=-0.452) USER MOD Single : B 64 ASN : amide:sc= -0.0333 K(o=-0.033,f=1.1) USER MOD Single : B 72 GLN : amide:sc= -0.0929 X(o=-0.093,f=0) USER MOD Single : B 74 TYR OH : rot 159:sc= 0.974 USER MOD Single : B 85 CYS SG : rot 69:sc= 0.942 USER MOD Single : B 86 ASN : amide:sc= -0.0211 X(o=-0.021,f=0.12) USER MOD ----------------------------------------------------------------- ATOM 19 N GLU A 3 153.407 -0.132 -12.079 1.00 0.00 N ATOM 20 CA GLU A 3 151.967 0.076 -12.171 1.00 0.00 C ATOM 21 C GLU A 3 151.398 0.479 -10.815 1.00 0.00 C ATOM 22 O GLU A 3 150.439 1.248 -10.737 1.00 0.00 O ATOM 23 CB GLU A 3 151.285 -1.205 -12.654 1.00 0.00 C ATOM 24 CG GLU A 3 151.741 -1.521 -14.080 1.00 0.00 C ATOM 25 CD GLU A 3 151.289 -0.417 -15.030 1.00 0.00 C ATOM 26 OE1 GLU A 3 150.397 0.327 -14.660 1.00 0.00 O ATOM 27 OE2 GLU A 3 151.843 -0.331 -16.113 1.00 0.00 O ATOM 0 HA GLU A 3 151.778 0.878 -12.884 1.00 0.00 H new ATOM 0 HB2 GLU A 3 151.532 -2.033 -11.990 1.00 0.00 H new ATOM 0 HB3 GLU A 3 150.202 -1.086 -12.625 1.00 0.00 H new ATOM 0 HG2 GLU A 3 152.826 -1.616 -14.111 1.00 0.00 H new ATOM 0 HG3 GLU A 3 151.328 -2.478 -14.399 1.00 0.00 H new ATOM 34 N LEU A 4 151.995 -0.043 -9.749 1.00 0.00 N ATOM 35 CA LEU A 4 151.538 0.269 -8.399 1.00 0.00 C ATOM 36 C LEU A 4 151.345 1.774 -8.238 1.00 0.00 C ATOM 37 O LEU A 4 150.233 2.245 -7.997 1.00 0.00 O ATOM 38 CB LEU A 4 152.562 -0.231 -7.376 1.00 0.00 C ATOM 39 CG LEU A 4 152.030 -0.004 -5.958 1.00 0.00 C ATOM 40 CD1 LEU A 4 150.806 -0.891 -5.716 1.00 0.00 C ATOM 41 CD2 LEU A 4 153.123 -0.357 -4.946 1.00 0.00 C ATOM 0 H LEU A 4 152.791 -0.680 -9.792 1.00 0.00 H new ATOM 0 HA LEU A 4 150.583 -0.229 -8.230 1.00 0.00 H new ATOM 0 HB2 LEU A 4 152.761 -1.291 -7.535 1.00 0.00 H new ATOM 0 HB3 LEU A 4 153.508 0.294 -7.508 1.00 0.00 H new ATOM 0 HG LEU A 4 151.744 1.041 -5.842 1.00 0.00 H new ATOM 0 HD11 LEU A 4 150.431 -0.726 -4.706 1.00 0.00 H new ATOM 0 HD12 LEU A 4 150.028 -0.642 -6.437 1.00 0.00 H new ATOM 0 HD13 LEU A 4 151.087 -1.938 -5.832 1.00 0.00 H new ATOM 0 HD21 LEU A 4 152.748 -0.197 -3.935 1.00 0.00 H new ATOM 0 HD22 LEU A 4 153.406 -1.403 -5.066 1.00 0.00 H new ATOM 0 HD23 LEU A 4 153.994 0.277 -5.115 1.00 0.00 H new ATOM 53 N GLU A 5 152.434 2.524 -8.371 1.00 0.00 N ATOM 54 CA GLU A 5 152.373 3.975 -8.239 1.00 0.00 C ATOM 55 C GLU A 5 151.254 4.546 -9.105 1.00 0.00 C ATOM 56 O GLU A 5 150.589 5.507 -8.720 1.00 0.00 O ATOM 57 CB GLU A 5 153.709 4.592 -8.656 1.00 0.00 C ATOM 58 CG GLU A 5 154.830 4.023 -7.784 1.00 0.00 C ATOM 59 CD GLU A 5 156.173 4.595 -8.223 1.00 0.00 C ATOM 60 OE1 GLU A 5 156.624 4.238 -9.299 1.00 0.00 O ATOM 61 OE2 GLU A 5 156.732 5.382 -7.476 1.00 0.00 O ATOM 0 H GLU A 5 153.364 2.154 -8.569 1.00 0.00 H new ATOM 0 HA GLU A 5 152.169 4.219 -7.196 1.00 0.00 H new ATOM 0 HB2 GLU A 5 153.908 4.379 -9.706 1.00 0.00 H new ATOM 0 HB3 GLU A 5 153.669 5.676 -8.553 1.00 0.00 H new ATOM 0 HG2 GLU A 5 154.647 4.266 -6.737 1.00 0.00 H new ATOM 0 HG3 GLU A 5 154.846 2.936 -7.861 1.00 0.00 H new ATOM 68 N THR A 6 151.053 3.948 -10.275 1.00 0.00 N ATOM 69 CA THR A 6 150.011 4.407 -11.187 1.00 0.00 C ATOM 70 C THR A 6 148.628 4.119 -10.613 1.00 0.00 C ATOM 71 O THR A 6 147.696 4.904 -10.791 1.00 0.00 O ATOM 72 CB THR A 6 150.160 3.711 -12.542 1.00 0.00 C ATOM 73 OG1 THR A 6 151.516 3.778 -12.960 1.00 0.00 O ATOM 74 CG2 THR A 6 149.269 4.404 -13.574 1.00 0.00 C ATOM 0 H THR A 6 151.593 3.151 -10.612 1.00 0.00 H new ATOM 0 HA THR A 6 150.118 5.484 -11.318 1.00 0.00 H new ATOM 0 HB THR A 6 149.860 2.667 -12.450 1.00 0.00 H new ATOM 0 HG1 THR A 6 151.614 3.331 -13.827 1.00 0.00 H new ATOM 0 HG21 THR A 6 149.376 3.908 -14.539 1.00 0.00 H new ATOM 0 HG22 THR A 6 148.229 4.350 -13.251 1.00 0.00 H new ATOM 0 HG23 THR A 6 149.566 5.448 -13.668 1.00 0.00 H new ATOM 82 N ALA A 7 148.500 2.988 -9.926 1.00 0.00 N ATOM 83 CA ALA A 7 147.224 2.605 -9.333 1.00 0.00 C ATOM 84 C ALA A 7 146.822 3.588 -8.238 1.00 0.00 C ATOM 85 O ALA A 7 145.707 4.110 -8.238 1.00 0.00 O ATOM 86 CB ALA A 7 147.325 1.196 -8.744 1.00 0.00 C ATOM 0 H ALA A 7 149.259 2.325 -9.767 1.00 0.00 H new ATOM 0 HA ALA A 7 146.464 2.620 -10.114 1.00 0.00 H new ATOM 0 HB1 ALA A 7 146.368 0.917 -8.303 1.00 0.00 H new ATOM 0 HB2 ALA A 7 147.581 0.489 -9.533 1.00 0.00 H new ATOM 0 HB3 ALA A 7 148.098 1.177 -7.976 1.00 0.00 H new ATOM 92 N MET A 8 147.734 3.834 -7.305 1.00 0.00 N ATOM 93 CA MET A 8 147.461 4.755 -6.208 1.00 0.00 C ATOM 94 C MET A 8 146.971 6.097 -6.741 1.00 0.00 C ATOM 95 O MET A 8 146.126 6.749 -6.127 1.00 0.00 O ATOM 96 CB MET A 8 148.728 4.967 -5.376 1.00 0.00 C ATOM 97 CG MET A 8 149.351 3.612 -5.036 1.00 0.00 C ATOM 98 SD MET A 8 148.105 2.550 -4.264 1.00 0.00 S ATOM 99 CE MET A 8 147.720 3.631 -2.865 1.00 0.00 C ATOM 0 H MET A 8 148.662 3.412 -7.285 1.00 0.00 H new ATOM 0 HA MET A 8 146.682 4.321 -5.581 1.00 0.00 H new ATOM 0 HB2 MET A 8 149.441 5.578 -5.930 1.00 0.00 H new ATOM 0 HB3 MET A 8 148.488 5.508 -4.461 1.00 0.00 H new ATOM 0 HG2 MET A 8 149.737 3.140 -5.940 1.00 0.00 H new ATOM 0 HG3 MET A 8 150.197 3.748 -4.362 1.00 0.00 H new ATOM 0 HE1 MET A 8 147.468 3.024 -1.995 1.00 0.00 H new ATOM 0 HE2 MET A 8 148.586 4.252 -2.636 1.00 0.00 H new ATOM 0 HE3 MET A 8 146.874 4.269 -3.120 1.00 0.00 H new ATOM 109 N GLU A 9 147.506 6.505 -7.887 1.00 0.00 N ATOM 110 CA GLU A 9 147.114 7.774 -8.491 1.00 0.00 C ATOM 111 C GLU A 9 145.661 7.721 -8.954 1.00 0.00 C ATOM 112 O GLU A 9 144.946 8.722 -8.903 1.00 0.00 O ATOM 113 CB GLU A 9 148.020 8.085 -9.684 1.00 0.00 C ATOM 114 CG GLU A 9 149.421 8.443 -9.183 1.00 0.00 C ATOM 115 CD GLU A 9 149.378 9.752 -8.401 1.00 0.00 C ATOM 116 OE1 GLU A 9 148.715 10.669 -8.857 1.00 0.00 O ATOM 117 OE2 GLU A 9 150.008 9.818 -7.359 1.00 0.00 O ATOM 0 H GLU A 9 148.206 5.981 -8.412 1.00 0.00 H new ATOM 0 HA GLU A 9 147.216 8.559 -7.742 1.00 0.00 H new ATOM 0 HB2 GLU A 9 148.070 7.224 -10.350 1.00 0.00 H new ATOM 0 HB3 GLU A 9 147.607 8.912 -10.262 1.00 0.00 H new ATOM 0 HG2 GLU A 9 149.804 7.644 -8.549 1.00 0.00 H new ATOM 0 HG3 GLU A 9 150.105 8.536 -10.027 1.00 0.00 H new ATOM 124 N THR A 10 145.230 6.547 -9.406 1.00 0.00 N ATOM 125 CA THR A 10 143.859 6.377 -9.875 1.00 0.00 C ATOM 126 C THR A 10 142.872 6.564 -8.728 1.00 0.00 C ATOM 127 O THR A 10 141.826 7.191 -8.893 1.00 0.00 O ATOM 128 CB THR A 10 143.683 4.982 -10.480 1.00 0.00 C ATOM 129 OG1 THR A 10 144.466 4.878 -11.661 1.00 0.00 O ATOM 130 CG2 THR A 10 142.210 4.753 -10.822 1.00 0.00 C ATOM 0 H THR A 10 145.805 5.706 -9.457 1.00 0.00 H new ATOM 0 HA THR A 10 143.660 7.131 -10.636 1.00 0.00 H new ATOM 0 HB THR A 10 144.007 4.231 -9.760 1.00 0.00 H new ATOM 0 HG1 THR A 10 145.417 4.886 -11.425 1.00 0.00 H new ATOM 0 HG21 THR A 10 142.087 3.759 -11.253 1.00 0.00 H new ATOM 0 HG22 THR A 10 141.609 4.833 -9.916 1.00 0.00 H new ATOM 0 HG23 THR A 10 141.883 5.503 -11.542 1.00 0.00 H new ATOM 138 N LEU A 11 143.211 6.015 -7.566 1.00 0.00 N ATOM 139 CA LEU A 11 142.344 6.126 -6.397 1.00 0.00 C ATOM 140 C LEU A 11 142.155 7.588 -6.004 1.00 0.00 C ATOM 141 O LEU A 11 141.065 7.998 -5.610 1.00 0.00 O ATOM 142 CB LEU A 11 142.951 5.353 -5.223 1.00 0.00 C ATOM 143 CG LEU A 11 142.776 3.847 -5.451 1.00 0.00 C ATOM 144 CD1 LEU A 11 143.894 3.085 -4.735 1.00 0.00 C ATOM 145 CD2 LEU A 11 141.422 3.397 -4.894 1.00 0.00 C ATOM 0 H LEU A 11 144.073 5.493 -7.408 1.00 0.00 H new ATOM 0 HA LEU A 11 141.371 5.702 -6.648 1.00 0.00 H new ATOM 0 HB2 LEU A 11 144.009 5.595 -5.124 1.00 0.00 H new ATOM 0 HB3 LEU A 11 142.468 5.648 -4.292 1.00 0.00 H new ATOM 0 HG LEU A 11 142.819 3.639 -6.520 1.00 0.00 H new ATOM 0 HD11 LEU A 11 143.767 2.015 -4.898 1.00 0.00 H new ATOM 0 HD12 LEU A 11 144.860 3.401 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 11 143.852 3.296 -3.666 1.00 0.00 H new ATOM 0 HD21 LEU A 11 141.299 2.326 -5.057 1.00 0.00 H new ATOM 0 HD22 LEU A 11 141.380 3.609 -3.826 1.00 0.00 H new ATOM 0 HD23 LEU A 11 140.622 3.935 -5.403 1.00 0.00 H new ATOM 157 N ILE A 12 143.226 8.369 -6.114 1.00 0.00 N ATOM 158 CA ILE A 12 143.165 9.784 -5.765 1.00 0.00 C ATOM 159 C ILE A 12 142.363 10.561 -6.805 1.00 0.00 C ATOM 160 O ILE A 12 141.675 11.528 -6.477 1.00 0.00 O ATOM 161 CB ILE A 12 144.578 10.361 -5.674 1.00 0.00 C ATOM 162 CG1 ILE A 12 145.381 9.580 -4.629 1.00 0.00 C ATOM 163 CG2 ILE A 12 144.505 11.832 -5.263 1.00 0.00 C ATOM 164 CD1 ILE A 12 146.855 9.983 -4.713 1.00 0.00 C ATOM 0 H ILE A 12 144.138 8.049 -6.439 1.00 0.00 H new ATOM 0 HA ILE A 12 142.671 9.878 -4.798 1.00 0.00 H new ATOM 0 HB ILE A 12 145.066 10.279 -6.645 1.00 0.00 H new ATOM 0 HG12 ILE A 12 144.994 9.783 -3.631 1.00 0.00 H new ATOM 0 HG13 ILE A 12 145.275 8.509 -4.800 1.00 0.00 H new ATOM 0 HG21 ILE A 12 145.513 12.242 -5.198 1.00 0.00 H new ATOM 0 HG22 ILE A 12 143.933 12.389 -6.005 1.00 0.00 H new ATOM 0 HG23 ILE A 12 144.017 11.915 -4.292 1.00 0.00 H new ATOM 0 HD11 ILE A 12 147.427 9.428 -3.970 1.00 0.00 H new ATOM 0 HD12 ILE A 12 147.238 9.757 -5.708 1.00 0.00 H new ATOM 0 HD13 ILE A 12 146.952 11.052 -4.521 1.00 0.00 H new ATOM 176 N ASN A 13 142.460 10.135 -8.060 1.00 0.00 N ATOM 177 CA ASN A 13 141.741 10.803 -9.141 1.00 0.00 C ATOM 178 C ASN A 13 140.239 10.790 -8.875 1.00 0.00 C ATOM 179 O ASN A 13 139.578 11.827 -8.950 1.00 0.00 O ATOM 180 CB ASN A 13 142.031 10.104 -10.470 1.00 0.00 C ATOM 181 CG ASN A 13 143.433 10.457 -10.951 1.00 0.00 C ATOM 182 OD1 ASN A 13 144.354 10.583 -10.144 1.00 0.00 O ATOM 183 ND2 ASN A 13 143.654 10.625 -12.227 1.00 0.00 N ATOM 0 H ASN A 13 143.024 9.337 -8.353 1.00 0.00 H new ATOM 0 HA ASN A 13 142.080 11.838 -9.192 1.00 0.00 H new ATOM 0 HB2 ASN A 13 141.940 9.024 -10.350 1.00 0.00 H new ATOM 0 HB3 ASN A 13 141.295 10.404 -11.216 1.00 0.00 H new ATOM 0 HD21 ASN A 13 144.590 10.861 -12.556 1.00 0.00 H new ATOM 0 HD22 ASN A 13 142.890 10.520 -12.895 1.00 0.00 H new ATOM 190 N VAL A 14 139.707 9.612 -8.568 1.00 0.00 N ATOM 191 CA VAL A 14 138.279 9.478 -8.296 1.00 0.00 C ATOM 192 C VAL A 14 137.908 10.201 -7.005 1.00 0.00 C ATOM 193 O VAL A 14 136.883 10.879 -6.935 1.00 0.00 O ATOM 194 CB VAL A 14 137.906 8.000 -8.180 1.00 0.00 C ATOM 195 CG1 VAL A 14 136.416 7.872 -7.863 1.00 0.00 C ATOM 196 CG2 VAL A 14 138.208 7.292 -9.503 1.00 0.00 C ATOM 0 H VAL A 14 140.237 8.743 -8.501 1.00 0.00 H new ATOM 0 HA VAL A 14 137.728 9.928 -9.122 1.00 0.00 H new ATOM 0 HB VAL A 14 138.488 7.541 -7.381 1.00 0.00 H new ATOM 0 HG11 VAL A 14 136.151 6.818 -7.780 1.00 0.00 H new ATOM 0 HG12 VAL A 14 136.200 8.375 -6.921 1.00 0.00 H new ATOM 0 HG13 VAL A 14 135.833 8.331 -8.662 1.00 0.00 H new ATOM 0 HG21 VAL A 14 137.942 6.238 -9.421 1.00 0.00 H new ATOM 0 HG22 VAL A 14 137.627 7.751 -10.302 1.00 0.00 H new ATOM 0 HG23 VAL A 14 139.270 7.382 -9.729 1.00 0.00 H new ATOM 206 N PHE A 15 138.746 10.049 -5.985 1.00 0.00 N ATOM 207 CA PHE A 15 138.494 10.689 -4.699 1.00 0.00 C ATOM 208 C PHE A 15 138.403 12.204 -4.860 1.00 0.00 C ATOM 209 O PHE A 15 137.537 12.849 -4.270 1.00 0.00 O ATOM 210 CB PHE A 15 139.615 10.344 -3.717 1.00 0.00 C ATOM 211 CG PHE A 15 139.306 10.944 -2.367 1.00 0.00 C ATOM 212 CD1 PHE A 15 138.243 10.444 -1.605 1.00 0.00 C ATOM 213 CD2 PHE A 15 140.083 12.000 -1.875 1.00 0.00 C ATOM 214 CE1 PHE A 15 137.957 11.000 -0.352 1.00 0.00 C ATOM 215 CE2 PHE A 15 139.797 12.556 -0.623 1.00 0.00 C ATOM 216 CZ PHE A 15 138.734 12.056 0.139 1.00 0.00 C ATOM 0 H PHE A 15 139.600 9.492 -6.023 1.00 0.00 H new ATOM 0 HA PHE A 15 137.544 10.320 -4.311 1.00 0.00 H new ATOM 0 HB2 PHE A 15 139.717 9.262 -3.631 1.00 0.00 H new ATOM 0 HB3 PHE A 15 140.567 10.725 -4.087 1.00 0.00 H new ATOM 0 HD1 PHE A 15 137.644 9.629 -1.984 1.00 0.00 H new ATOM 0 HD2 PHE A 15 140.903 12.386 -2.462 1.00 0.00 H new ATOM 0 HE1 PHE A 15 137.137 10.614 0.236 1.00 0.00 H new ATOM 0 HE2 PHE A 15 140.396 13.371 -0.244 1.00 0.00 H new ATOM 0 HZ PHE A 15 138.514 12.485 1.105 1.00 0.00 H new ATOM 226 N HIS A 16 139.304 12.763 -5.661 1.00 0.00 N ATOM 227 CA HIS A 16 139.318 14.204 -5.890 1.00 0.00 C ATOM 228 C HIS A 16 138.037 14.650 -6.589 1.00 0.00 C ATOM 229 O HIS A 16 137.626 15.804 -6.477 1.00 0.00 O ATOM 230 CB HIS A 16 140.528 14.586 -6.745 1.00 0.00 C ATOM 231 CG HIS A 16 140.604 16.083 -6.865 1.00 0.00 C ATOM 232 ND1 HIS A 16 140.454 16.735 -8.079 1.00 0.00 N ATOM 233 CD2 HIS A 16 140.813 17.069 -5.933 1.00 0.00 C ATOM 234 CE1 HIS A 16 140.574 18.055 -7.847 1.00 0.00 C ATOM 235 NE2 HIS A 16 140.793 18.313 -6.555 1.00 0.00 N ATOM 0 H HIS A 16 140.029 12.246 -6.159 1.00 0.00 H new ATOM 0 HA HIS A 16 139.383 14.705 -4.924 1.00 0.00 H new ATOM 0 HB2 HIS A 16 141.442 14.200 -6.294 1.00 0.00 H new ATOM 0 HB3 HIS A 16 140.445 14.135 -7.734 1.00 0.00 H new ATOM 0 HD2 HIS A 16 140.969 16.904 -4.877 1.00 0.00 H new ATOM 0 HE1 HIS A 16 140.502 18.814 -8.612 1.00 0.00 H new ATOM 0 HE2 HIS A 16 140.919 19.226 -6.118 1.00 0.00 H new ATOM 244 N ALA A 17 137.412 13.727 -7.313 1.00 0.00 N ATOM 245 CA ALA A 17 136.179 14.037 -8.029 1.00 0.00 C ATOM 246 C ALA A 17 135.050 14.351 -7.052 1.00 0.00 C ATOM 247 O ALA A 17 134.332 15.338 -7.216 1.00 0.00 O ATOM 248 CB ALA A 17 135.777 12.854 -8.912 1.00 0.00 C ATOM 0 H ALA A 17 137.735 12.766 -7.419 1.00 0.00 H new ATOM 0 HA ALA A 17 136.356 14.914 -8.652 1.00 0.00 H new ATOM 0 HB1 ALA A 17 134.856 13.093 -9.443 1.00 0.00 H new ATOM 0 HB2 ALA A 17 136.569 12.652 -9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 17 135.619 11.973 -8.290 1.00 0.00 H new ATOM 254 N HIS A 18 134.897 13.506 -6.037 1.00 0.00 N ATOM 255 CA HIS A 18 133.849 13.705 -5.043 1.00 0.00 C ATOM 256 C HIS A 18 134.298 14.698 -3.975 1.00 0.00 C ATOM 257 O HIS A 18 133.491 15.460 -3.443 1.00 0.00 O ATOM 258 CB HIS A 18 133.493 12.371 -4.384 1.00 0.00 C ATOM 259 CG HIS A 18 132.708 11.530 -5.353 1.00 0.00 C ATOM 260 ND1 HIS A 18 131.323 11.542 -5.387 1.00 0.00 N ATOM 261 CD2 HIS A 18 133.100 10.650 -6.331 1.00 0.00 C ATOM 262 CE1 HIS A 18 130.934 10.693 -6.356 1.00 0.00 C ATOM 263 NE2 HIS A 18 131.978 10.123 -6.964 1.00 0.00 N ATOM 0 H HIS A 18 135.480 12.684 -5.882 1.00 0.00 H new ATOM 0 HA HIS A 18 132.971 14.107 -5.548 1.00 0.00 H new ATOM 0 HB2 HIS A 18 134.401 11.848 -4.083 1.00 0.00 H new ATOM 0 HB3 HIS A 18 132.910 12.544 -3.479 1.00 0.00 H new ATOM 0 HD2 HIS A 18 134.123 10.404 -6.573 1.00 0.00 H new ATOM 0 HE1 HIS A 18 129.903 10.496 -6.611 1.00 0.00 H new ATOM 0 HE2 HIS A 18 131.957 9.447 -7.728 1.00 0.00 H new ATOM 272 N SER A 19 135.590 14.685 -3.668 1.00 0.00 N ATOM 273 CA SER A 19 136.133 15.591 -2.662 1.00 0.00 C ATOM 274 C SER A 19 135.869 17.041 -3.051 1.00 0.00 C ATOM 275 O SER A 19 135.812 17.924 -2.195 1.00 0.00 O ATOM 276 CB SER A 19 137.638 15.366 -2.514 1.00 0.00 C ATOM 277 OG SER A 19 138.084 15.967 -1.305 1.00 0.00 O ATOM 0 H SER A 19 136.276 14.063 -4.096 1.00 0.00 H new ATOM 0 HA SER A 19 135.641 15.386 -1.711 1.00 0.00 H new ATOM 0 HB2 SER A 19 137.859 14.299 -2.507 1.00 0.00 H new ATOM 0 HB3 SER A 19 138.167 15.796 -3.365 1.00 0.00 H new ATOM 0 HG SER A 19 139.048 15.824 -1.205 1.00 0.00 H new ATOM 411 N LEU A 28 135.806 14.019 3.554 1.00 0.00 N ATOM 412 CA LEU A 28 134.645 13.371 2.955 1.00 0.00 C ATOM 413 C LEU A 28 133.644 12.970 4.037 1.00 0.00 C ATOM 414 O LEU A 28 133.942 12.140 4.895 1.00 0.00 O ATOM 415 CB LEU A 28 135.091 12.130 2.173 1.00 0.00 C ATOM 416 CG LEU A 28 134.121 11.860 1.015 1.00 0.00 C ATOM 417 CD1 LEU A 28 132.690 11.792 1.552 1.00 0.00 C ATOM 418 CD2 LEU A 28 134.228 12.980 -0.034 1.00 0.00 C ATOM 0 HA LEU A 28 134.162 14.072 2.274 1.00 0.00 H new ATOM 0 HB2 LEU A 28 136.099 12.277 1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 28 135.127 11.266 2.836 1.00 0.00 H new ATOM 0 HG LEU A 28 134.379 10.910 0.547 1.00 0.00 H new ATOM 0 HD11 LEU A 28 132.001 11.600 0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 28 132.614 10.988 2.284 1.00 0.00 H new ATOM 0 HD13 LEU A 28 132.434 12.739 2.026 1.00 0.00 H new ATOM 0 HD21 LEU A 28 133.536 12.780 -0.852 1.00 0.00 H new ATOM 0 HD22 LEU A 28 133.978 13.935 0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 28 135.246 13.020 -0.422 1.00 0.00 H new ATOM 430 N SER A 29 132.458 13.571 3.992 1.00 0.00 N ATOM 431 CA SER A 29 131.422 13.273 4.976 1.00 0.00 C ATOM 432 C SER A 29 131.035 11.799 4.929 1.00 0.00 C ATOM 433 O SER A 29 130.859 11.226 3.853 1.00 0.00 O ATOM 434 CB SER A 29 130.188 14.135 4.708 1.00 0.00 C ATOM 435 OG SER A 29 129.152 13.765 5.609 1.00 0.00 O ATOM 0 H SER A 29 132.192 14.262 3.290 1.00 0.00 H new ATOM 0 HA SER A 29 131.817 13.497 5.967 1.00 0.00 H new ATOM 0 HB2 SER A 29 130.433 15.190 4.831 1.00 0.00 H new ATOM 0 HB3 SER A 29 129.855 14.003 3.679 1.00 0.00 H new ATOM 0 HG SER A 29 128.360 14.317 5.441 1.00 0.00 H new ATOM 441 N LYS A 30 130.900 11.190 6.103 1.00 0.00 N ATOM 442 CA LYS A 30 130.531 9.781 6.186 1.00 0.00 C ATOM 443 C LYS A 30 129.211 9.528 5.466 1.00 0.00 C ATOM 444 O LYS A 30 129.082 8.570 4.704 1.00 0.00 O ATOM 445 CB LYS A 30 130.403 9.358 7.651 1.00 0.00 C ATOM 446 CG LYS A 30 131.794 9.278 8.284 1.00 0.00 C ATOM 447 CD LYS A 30 131.677 8.722 9.705 1.00 0.00 C ATOM 448 CE LYS A 30 133.076 8.538 10.297 1.00 0.00 C ATOM 449 NZ LYS A 30 133.727 9.869 10.456 1.00 0.00 N ATOM 0 H LYS A 30 131.040 11.646 7.004 1.00 0.00 H new ATOM 0 HA LYS A 30 131.313 9.193 5.705 1.00 0.00 H new ATOM 0 HB2 LYS A 30 129.785 10.073 8.194 1.00 0.00 H new ATOM 0 HB3 LYS A 30 129.905 8.391 7.719 1.00 0.00 H new ATOM 0 HG2 LYS A 30 132.442 8.639 7.684 1.00 0.00 H new ATOM 0 HG3 LYS A 30 132.253 10.266 8.305 1.00 0.00 H new ATOM 0 HD2 LYS A 30 131.094 9.402 10.326 1.00 0.00 H new ATOM 0 HD3 LYS A 30 131.148 7.769 9.692 1.00 0.00 H new ATOM 0 HE2 LYS A 30 133.011 8.035 11.262 1.00 0.00 H new ATOM 0 HE3 LYS A 30 133.677 7.903 9.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 134.734 9.795 10.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 133.266 10.558 9.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 133.636 10.184 11.443 1.00 0.00 H new ATOM 463 N LYS A 31 128.232 10.393 5.711 1.00 0.00 N ATOM 464 CA LYS A 31 126.927 10.250 5.078 1.00 0.00 C ATOM 465 C LYS A 31 127.074 10.191 3.561 1.00 0.00 C ATOM 466 O LYS A 31 126.477 9.341 2.902 1.00 0.00 O ATOM 467 CB LYS A 31 126.028 11.429 5.460 1.00 0.00 C ATOM 468 CG LYS A 31 124.602 11.160 4.978 1.00 0.00 C ATOM 469 CD LYS A 31 123.716 12.362 5.309 1.00 0.00 C ATOM 470 CE LYS A 31 122.262 12.036 4.964 1.00 0.00 C ATOM 471 NZ LYS A 31 122.123 11.890 3.488 1.00 0.00 N ATOM 0 H LYS A 31 128.316 11.193 6.338 1.00 0.00 H new ATOM 0 HA LYS A 31 126.474 9.322 5.426 1.00 0.00 H new ATOM 0 HB2 LYS A 31 126.037 11.572 6.541 1.00 0.00 H new ATOM 0 HB3 LYS A 31 126.407 12.348 5.014 1.00 0.00 H new ATOM 0 HG2 LYS A 31 124.598 10.977 3.903 1.00 0.00 H new ATOM 0 HG3 LYS A 31 124.209 10.262 5.455 1.00 0.00 H new ATOM 0 HD2 LYS A 31 123.803 12.611 6.367 1.00 0.00 H new ATOM 0 HD3 LYS A 31 124.047 13.236 4.748 1.00 0.00 H new ATOM 0 HE2 LYS A 31 121.956 11.116 5.462 1.00 0.00 H new ATOM 0 HE3 LYS A 31 121.605 12.827 5.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 121.115 11.906 3.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 122.613 12.675 3.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 122.543 10.987 3.187 1.00 0.00 H new ATOM 485 N GLN A 32 127.877 11.098 3.015 1.00 0.00 N ATOM 486 CA GLN A 32 128.101 11.137 1.575 1.00 0.00 C ATOM 487 C GLN A 32 128.969 9.961 1.139 1.00 0.00 C ATOM 488 O GLN A 32 128.837 9.460 0.023 1.00 0.00 O ATOM 489 CB GLN A 32 128.783 12.450 1.188 1.00 0.00 C ATOM 490 CG GLN A 32 127.877 13.626 1.558 1.00 0.00 C ATOM 491 CD GLN A 32 126.657 13.650 0.643 1.00 0.00 C ATOM 492 OE1 GLN A 32 126.743 13.259 -0.520 1.00 0.00 O ATOM 493 NE2 GLN A 32 125.518 14.090 1.104 1.00 0.00 N ATOM 0 H GLN A 32 128.380 11.811 3.543 1.00 0.00 H new ATOM 0 HA GLN A 32 127.136 11.069 1.072 1.00 0.00 H new ATOM 0 HB2 GLN A 32 129.740 12.540 1.701 1.00 0.00 H new ATOM 0 HB3 GLN A 32 128.993 12.461 0.118 1.00 0.00 H new ATOM 0 HG2 GLN A 32 127.561 13.540 2.598 1.00 0.00 H new ATOM 0 HG3 GLN A 32 128.428 14.562 1.469 1.00 0.00 H new ATOM 0 HE21 GLN A 32 125.449 14.414 2.069 1.00 0.00 H new ATOM 0 HE22 GLN A 32 124.697 14.110 0.499 1.00 0.00 H new ATOM 502 N LEU A 33 129.856 9.527 2.028 1.00 0.00 N ATOM 503 CA LEU A 33 130.742 8.410 1.726 1.00 0.00 C ATOM 504 C LEU A 33 129.933 7.165 1.368 1.00 0.00 C ATOM 505 O LEU A 33 130.372 6.337 0.571 1.00 0.00 O ATOM 506 CB LEU A 33 131.637 8.111 2.933 1.00 0.00 C ATOM 507 CG LEU A 33 132.636 7.007 2.577 1.00 0.00 C ATOM 508 CD1 LEU A 33 133.609 7.514 1.507 1.00 0.00 C ATOM 509 CD2 LEU A 33 133.419 6.609 3.831 1.00 0.00 C ATOM 0 H LEU A 33 129.980 9.929 2.957 1.00 0.00 H new ATOM 0 HA LEU A 33 131.363 8.684 0.873 1.00 0.00 H new ATOM 0 HB2 LEU A 33 132.170 9.013 3.234 1.00 0.00 H new ATOM 0 HB3 LEU A 33 131.027 7.802 3.782 1.00 0.00 H new ATOM 0 HG LEU A 33 132.097 6.142 2.191 1.00 0.00 H new ATOM 0 HD11 LEU A 33 134.318 6.725 1.257 1.00 0.00 H new ATOM 0 HD12 LEU A 33 133.052 7.798 0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 33 134.150 8.380 1.888 1.00 0.00 H new ATOM 0 HD21 LEU A 33 134.131 5.823 3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 33 133.956 7.476 4.215 1.00 0.00 H new ATOM 0 HD23 LEU A 33 132.728 6.244 4.591 1.00 0.00 H new ATOM 521 N LYS A 34 128.753 7.042 1.965 1.00 0.00 N ATOM 522 CA LYS A 34 127.890 5.895 1.707 1.00 0.00 C ATOM 523 C LYS A 34 127.506 5.828 0.231 1.00 0.00 C ATOM 524 O LYS A 34 127.502 4.755 -0.370 1.00 0.00 O ATOM 525 CB LYS A 34 126.628 5.996 2.566 1.00 0.00 C ATOM 526 CG LYS A 34 125.605 4.957 2.102 1.00 0.00 C ATOM 527 CD LYS A 34 124.471 4.866 3.123 1.00 0.00 C ATOM 528 CE LYS A 34 123.600 3.647 2.812 1.00 0.00 C ATOM 529 NZ LYS A 34 122.645 3.419 3.934 1.00 0.00 N ATOM 0 H LYS A 34 128.373 7.718 2.627 1.00 0.00 H new ATOM 0 HA LYS A 34 128.435 4.986 1.964 1.00 0.00 H new ATOM 0 HB2 LYS A 34 126.876 5.833 3.615 1.00 0.00 H new ATOM 0 HB3 LYS A 34 126.204 6.997 2.490 1.00 0.00 H new ATOM 0 HG2 LYS A 34 125.208 5.233 1.125 1.00 0.00 H new ATOM 0 HG3 LYS A 34 126.085 3.985 1.988 1.00 0.00 H new ATOM 0 HD2 LYS A 34 124.880 4.786 4.130 1.00 0.00 H new ATOM 0 HD3 LYS A 34 123.868 5.774 3.094 1.00 0.00 H new ATOM 0 HE2 LYS A 34 123.054 3.805 1.882 1.00 0.00 H new ATOM 0 HE3 LYS A 34 124.226 2.766 2.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 122.053 2.591 3.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 123.175 3.251 4.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 122.040 4.257 4.050 1.00 0.00 H new ATOM 543 N GLU A 35 127.179 6.980 -0.345 1.00 0.00 N ATOM 544 CA GLU A 35 126.789 7.039 -1.749 1.00 0.00 C ATOM 545 C GLU A 35 128.012 6.923 -2.657 1.00 0.00 C ATOM 546 O GLU A 35 127.903 6.505 -3.810 1.00 0.00 O ATOM 547 CB GLU A 35 126.064 8.355 -2.033 1.00 0.00 C ATOM 548 CG GLU A 35 124.715 8.362 -1.309 1.00 0.00 C ATOM 549 CD GLU A 35 124.926 8.604 0.182 1.00 0.00 C ATOM 550 OE1 GLU A 35 126.002 9.050 0.543 1.00 0.00 O ATOM 551 OE2 GLU A 35 124.007 8.342 0.939 1.00 0.00 O ATOM 0 H GLU A 35 127.176 7.880 0.135 1.00 0.00 H new ATOM 0 HA GLU A 35 126.121 6.202 -1.954 1.00 0.00 H new ATOM 0 HB2 GLU A 35 126.672 9.196 -1.700 1.00 0.00 H new ATOM 0 HB3 GLU A 35 125.914 8.475 -3.106 1.00 0.00 H new ATOM 0 HG2 GLU A 35 124.073 9.139 -1.725 1.00 0.00 H new ATOM 0 HG3 GLU A 35 124.205 7.411 -1.463 1.00 0.00 H new ATOM 558 N LEU A 36 129.171 7.301 -2.131 1.00 0.00 N ATOM 559 CA LEU A 36 130.408 7.244 -2.905 1.00 0.00 C ATOM 560 C LEU A 36 130.953 5.819 -2.959 1.00 0.00 C ATOM 561 O LEU A 36 131.568 5.417 -3.946 1.00 0.00 O ATOM 562 CB LEU A 36 131.454 8.166 -2.273 1.00 0.00 C ATOM 563 CG LEU A 36 132.791 8.019 -3.003 1.00 0.00 C ATOM 564 CD1 LEU A 36 132.589 8.268 -4.498 1.00 0.00 C ATOM 565 CD2 LEU A 36 133.785 9.041 -2.449 1.00 0.00 C ATOM 0 H LEU A 36 129.282 7.648 -1.178 1.00 0.00 H new ATOM 0 HA LEU A 36 130.192 7.571 -3.922 1.00 0.00 H new ATOM 0 HB2 LEU A 36 131.115 9.201 -2.322 1.00 0.00 H new ATOM 0 HB3 LEU A 36 131.577 7.920 -1.218 1.00 0.00 H new ATOM 0 HG LEU A 36 133.178 7.011 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 36 133.542 8.163 -5.016 1.00 0.00 H new ATOM 0 HD12 LEU A 36 131.878 7.543 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 36 132.202 9.276 -4.650 1.00 0.00 H new ATOM 0 HD21 LEU A 36 134.739 8.939 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 36 133.395 10.047 -2.602 1.00 0.00 H new ATOM 0 HD23 LEU A 36 133.931 8.866 -1.383 1.00 0.00 H new ATOM 577 N LEU A 37 130.735 5.063 -1.888 1.00 0.00 N ATOM 578 CA LEU A 37 131.224 3.691 -1.825 1.00 0.00 C ATOM 579 C LEU A 37 130.342 2.752 -2.646 1.00 0.00 C ATOM 580 O LEU A 37 130.842 1.857 -3.327 1.00 0.00 O ATOM 581 CB LEU A 37 131.260 3.219 -0.366 1.00 0.00 C ATOM 582 CG LEU A 37 132.365 2.173 -0.188 1.00 0.00 C ATOM 583 CD1 LEU A 37 133.694 2.875 0.097 1.00 0.00 C ATOM 584 CD2 LEU A 37 132.015 1.254 0.985 1.00 0.00 C ATOM 0 H LEU A 37 130.228 5.373 -1.059 1.00 0.00 H new ATOM 0 HA LEU A 37 132.230 3.670 -2.244 1.00 0.00 H new ATOM 0 HB2 LEU A 37 131.438 4.066 0.296 1.00 0.00 H new ATOM 0 HB3 LEU A 37 130.296 2.794 -0.087 1.00 0.00 H new ATOM 0 HG LEU A 37 132.454 1.583 -1.100 1.00 0.00 H new ATOM 0 HD11 LEU A 37 134.479 2.130 0.223 1.00 0.00 H new ATOM 0 HD12 LEU A 37 133.946 3.530 -0.737 1.00 0.00 H new ATOM 0 HD13 LEU A 37 133.605 3.466 1.008 1.00 0.00 H new ATOM 0 HD21 LEU A 37 132.801 0.510 1.111 1.00 0.00 H new ATOM 0 HD22 LEU A 37 131.925 1.845 1.896 1.00 0.00 H new ATOM 0 HD23 LEU A 37 131.069 0.751 0.784 1.00 0.00 H new ATOM 596 N GLN A 38 129.031 2.954 -2.571 1.00 0.00 N ATOM 597 CA GLN A 38 128.096 2.108 -3.307 1.00 0.00 C ATOM 598 C GLN A 38 128.120 2.430 -4.799 1.00 0.00 C ATOM 599 O GLN A 38 128.137 1.529 -5.636 1.00 0.00 O ATOM 600 CB GLN A 38 126.678 2.300 -2.763 1.00 0.00 C ATOM 601 CG GLN A 38 126.120 3.639 -3.250 1.00 0.00 C ATOM 602 CD GLN A 38 124.872 4.003 -2.451 1.00 0.00 C ATOM 603 OE1 GLN A 38 123.896 4.497 -3.015 1.00 0.00 O ATOM 604 NE2 GLN A 38 124.846 3.788 -1.164 1.00 0.00 N ATOM 0 H GLN A 38 128.594 3.688 -2.014 1.00 0.00 H new ATOM 0 HA GLN A 38 128.402 1.070 -3.173 1.00 0.00 H new ATOM 0 HB2 GLN A 38 126.036 1.484 -3.096 1.00 0.00 H new ATOM 0 HB3 GLN A 38 126.689 2.273 -1.673 1.00 0.00 H new ATOM 0 HG2 GLN A 38 126.874 4.419 -3.139 1.00 0.00 H new ATOM 0 HG3 GLN A 38 125.878 3.578 -4.311 1.00 0.00 H new ATOM 0 HE21 GLN A 38 125.656 3.378 -0.699 1.00 0.00 H new ATOM 0 HE22 GLN A 38 124.016 4.029 -0.623 1.00 0.00 H new ATOM 613 N THR A 39 128.113 3.718 -5.126 1.00 0.00 N ATOM 614 CA THR A 39 128.127 4.139 -6.523 1.00 0.00 C ATOM 615 C THR A 39 129.385 3.640 -7.228 1.00 0.00 C ATOM 616 O THR A 39 129.324 3.165 -8.363 1.00 0.00 O ATOM 617 CB THR A 39 128.061 5.665 -6.612 1.00 0.00 C ATOM 618 OG1 THR A 39 127.793 6.049 -7.954 1.00 0.00 O ATOM 619 CG2 THR A 39 129.396 6.263 -6.165 1.00 0.00 C ATOM 0 H THR A 39 128.098 4.482 -4.450 1.00 0.00 H new ATOM 0 HA THR A 39 127.256 3.708 -7.017 1.00 0.00 H new ATOM 0 HB THR A 39 127.266 6.032 -5.963 1.00 0.00 H new ATOM 0 HG1 THR A 39 127.749 7.026 -8.012 1.00 0.00 H new ATOM 0 HG21 THR A 39 129.347 7.350 -6.229 1.00 0.00 H new ATOM 0 HG22 THR A 39 129.600 5.969 -5.135 1.00 0.00 H new ATOM 0 HG23 THR A 39 130.193 5.897 -6.812 1.00 0.00 H new ATOM 627 N GLU A 40 130.522 3.751 -6.551 1.00 0.00 N ATOM 628 CA GLU A 40 131.788 3.309 -7.128 1.00 0.00 C ATOM 629 C GLU A 40 131.816 1.790 -7.269 1.00 0.00 C ATOM 630 O GLU A 40 132.133 1.262 -8.334 1.00 0.00 O ATOM 631 CB GLU A 40 132.952 3.765 -6.243 1.00 0.00 C ATOM 632 CG GLU A 40 133.332 5.205 -6.596 1.00 0.00 C ATOM 633 CD GLU A 40 134.287 5.764 -5.547 1.00 0.00 C ATOM 634 OE1 GLU A 40 134.452 5.121 -4.522 1.00 0.00 O ATOM 635 OE2 GLU A 40 134.839 6.825 -5.782 1.00 0.00 O ATOM 0 H GLU A 40 130.595 4.139 -5.611 1.00 0.00 H new ATOM 0 HA GLU A 40 131.888 3.753 -8.118 1.00 0.00 H new ATOM 0 HB2 GLU A 40 132.670 3.700 -5.192 1.00 0.00 H new ATOM 0 HB3 GLU A 40 133.809 3.107 -6.385 1.00 0.00 H new ATOM 0 HG2 GLU A 40 133.801 5.236 -7.580 1.00 0.00 H new ATOM 0 HG3 GLU A 40 132.436 5.823 -6.651 1.00 0.00 H new ATOM 642 N LEU A 41 131.485 1.094 -6.186 1.00 0.00 N ATOM 643 CA LEU A 41 131.478 -0.366 -6.200 1.00 0.00 C ATOM 644 C LEU A 41 130.068 -0.896 -6.439 1.00 0.00 C ATOM 645 O LEU A 41 129.681 -1.928 -5.892 1.00 0.00 O ATOM 646 CB LEU A 41 132.009 -0.903 -4.868 1.00 0.00 C ATOM 647 CG LEU A 41 133.535 -0.770 -4.831 1.00 0.00 C ATOM 648 CD1 LEU A 41 134.005 -0.672 -3.378 1.00 0.00 C ATOM 649 CD2 LEU A 41 134.175 -1.998 -5.487 1.00 0.00 C ATOM 0 H LEU A 41 131.220 1.512 -5.294 1.00 0.00 H new ATOM 0 HA LEU A 41 132.122 -0.705 -7.012 1.00 0.00 H new ATOM 0 HB2 LEU A 41 131.566 -0.351 -4.039 1.00 0.00 H new ATOM 0 HB3 LEU A 41 131.722 -1.947 -4.745 1.00 0.00 H new ATOM 0 HG LEU A 41 133.831 0.128 -5.373 1.00 0.00 H new ATOM 0 HD11 LEU A 41 135.091 -0.577 -3.352 1.00 0.00 H new ATOM 0 HD12 LEU A 41 133.553 0.201 -2.908 1.00 0.00 H new ATOM 0 HD13 LEU A 41 133.706 -1.570 -2.838 1.00 0.00 H new ATOM 0 HD21 LEU A 41 135.260 -1.901 -5.459 1.00 0.00 H new ATOM 0 HD22 LEU A 41 133.877 -2.896 -4.946 1.00 0.00 H new ATOM 0 HD23 LEU A 41 133.843 -2.071 -6.523 1.00 0.00 H new ATOM 661 N SER A 42 129.304 -0.181 -7.259 1.00 0.00 N ATOM 662 CA SER A 42 127.939 -0.590 -7.565 1.00 0.00 C ATOM 663 C SER A 42 127.929 -1.946 -8.264 1.00 0.00 C ATOM 664 O SER A 42 127.124 -2.818 -7.938 1.00 0.00 O ATOM 665 CB SER A 42 127.269 0.452 -8.461 1.00 0.00 C ATOM 666 OG SER A 42 125.893 0.128 -8.610 1.00 0.00 O ATOM 0 H SER A 42 129.604 0.678 -7.720 1.00 0.00 H new ATOM 0 HA SER A 42 127.387 -0.672 -6.629 1.00 0.00 H new ATOM 0 HB2 SER A 42 127.375 1.445 -8.025 1.00 0.00 H new ATOM 0 HB3 SER A 42 127.756 0.478 -9.436 1.00 0.00 H new ATOM 0 HG SER A 42 125.460 0.795 -9.183 1.00 0.00 H new ATOM 672 N GLY A 43 128.828 -2.115 -9.227 1.00 0.00 N ATOM 673 CA GLY A 43 128.914 -3.369 -9.967 1.00 0.00 C ATOM 674 C GLY A 43 129.391 -4.504 -9.067 1.00 0.00 C ATOM 675 O GLY A 43 128.848 -5.608 -9.103 1.00 0.00 O ATOM 0 H GLY A 43 129.503 -1.406 -9.512 1.00 0.00 H new ATOM 0 HA2 GLY A 43 127.938 -3.617 -10.384 1.00 0.00 H new ATOM 0 HA3 GLY A 43 129.599 -3.253 -10.807 1.00 0.00 H new ATOM 679 N PHE A 44 130.409 -4.224 -8.259 1.00 0.00 N ATOM 680 CA PHE A 44 130.951 -5.231 -7.353 1.00 0.00 C ATOM 681 C PHE A 44 129.858 -5.754 -6.426 1.00 0.00 C ATOM 682 O PHE A 44 129.810 -6.945 -6.116 1.00 0.00 O ATOM 683 CB PHE A 44 132.092 -4.628 -6.523 1.00 0.00 C ATOM 684 CG PHE A 44 133.404 -4.774 -7.262 1.00 0.00 C ATOM 685 CD1 PHE A 44 133.440 -4.677 -8.660 1.00 0.00 C ATOM 686 CD2 PHE A 44 134.584 -5.008 -6.547 1.00 0.00 C ATOM 687 CE1 PHE A 44 134.657 -4.813 -9.339 1.00 0.00 C ATOM 688 CE2 PHE A 44 135.800 -5.144 -7.227 1.00 0.00 C ATOM 689 CZ PHE A 44 135.836 -5.047 -8.623 1.00 0.00 C ATOM 0 H PHE A 44 130.872 -3.316 -8.213 1.00 0.00 H new ATOM 0 HA PHE A 44 131.337 -6.061 -7.945 1.00 0.00 H new ATOM 0 HB2 PHE A 44 131.892 -3.575 -6.326 1.00 0.00 H new ATOM 0 HB3 PHE A 44 132.152 -5.128 -5.556 1.00 0.00 H new ATOM 0 HD1 PHE A 44 132.530 -4.498 -9.213 1.00 0.00 H new ATOM 0 HD2 PHE A 44 134.556 -5.084 -5.470 1.00 0.00 H new ATOM 0 HE1 PHE A 44 134.686 -4.737 -10.416 1.00 0.00 H new ATOM 0 HE2 PHE A 44 136.710 -5.324 -6.675 1.00 0.00 H new ATOM 0 HZ PHE A 44 136.774 -5.153 -9.147 1.00 0.00 H new ATOM 699 N LEU A 45 128.981 -4.857 -5.986 1.00 0.00 N ATOM 700 CA LEU A 45 127.893 -5.241 -5.094 1.00 0.00 C ATOM 701 C LEU A 45 127.012 -6.298 -5.750 1.00 0.00 C ATOM 702 O LEU A 45 126.494 -7.191 -5.080 1.00 0.00 O ATOM 703 CB LEU A 45 127.047 -4.014 -4.742 1.00 0.00 C ATOM 704 CG LEU A 45 127.755 -3.193 -3.659 1.00 0.00 C ATOM 705 CD1 LEU A 45 127.320 -1.729 -3.761 1.00 0.00 C ATOM 706 CD2 LEU A 45 127.383 -3.738 -2.277 1.00 0.00 C ATOM 0 H LEU A 45 129.002 -3.867 -6.230 1.00 0.00 H new ATOM 0 HA LEU A 45 128.324 -5.657 -4.183 1.00 0.00 H new ATOM 0 HB2 LEU A 45 126.888 -3.402 -5.630 1.00 0.00 H new ATOM 0 HB3 LEU A 45 126.064 -4.327 -4.391 1.00 0.00 H new ATOM 0 HG LEU A 45 128.834 -3.264 -3.800 1.00 0.00 H new ATOM 0 HD11 LEU A 45 127.824 -1.145 -2.991 1.00 0.00 H new ATOM 0 HD12 LEU A 45 127.585 -1.338 -4.744 1.00 0.00 H new ATOM 0 HD13 LEU A 45 126.241 -1.659 -3.622 1.00 0.00 H new ATOM 0 HD21 LEU A 45 127.887 -3.153 -1.508 1.00 0.00 H new ATOM 0 HD22 LEU A 45 126.304 -3.669 -2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 45 127.692 -4.780 -2.202 1.00 0.00 H new ATOM 718 N ASP A 46 126.848 -6.193 -7.066 1.00 0.00 N ATOM 719 CA ASP A 46 126.029 -7.147 -7.802 1.00 0.00 C ATOM 720 C ASP A 46 126.727 -8.502 -7.876 1.00 0.00 C ATOM 721 O ASP A 46 126.243 -9.426 -8.529 1.00 0.00 O ATOM 722 CB ASP A 46 125.766 -6.629 -9.217 1.00 0.00 C ATOM 723 CG ASP A 46 124.836 -5.421 -9.164 1.00 0.00 C ATOM 724 OD1 ASP A 46 124.213 -5.223 -8.134 1.00 0.00 O ATOM 725 OD2 ASP A 46 124.761 -4.713 -10.155 1.00 0.00 O ATOM 0 H ASP A 46 127.269 -5.462 -7.640 1.00 0.00 H new ATOM 0 HA ASP A 46 125.081 -7.265 -7.278 1.00 0.00 H new ATOM 0 HB2 ASP A 46 126.707 -6.354 -9.693 1.00 0.00 H new ATOM 0 HB3 ASP A 46 125.319 -7.416 -9.825 1.00 0.00 H new ATOM 730 N ALA A 47 127.867 -8.609 -7.201 1.00 0.00 N ATOM 731 CA ALA A 47 128.626 -9.854 -7.194 1.00 0.00 C ATOM 732 C ALA A 47 129.440 -9.976 -5.910 1.00 0.00 C ATOM 733 O ALA A 47 130.591 -9.544 -5.851 1.00 0.00 O ATOM 734 CB ALA A 47 129.564 -9.900 -8.402 1.00 0.00 C ATOM 0 H ALA A 47 128.283 -7.854 -6.655 1.00 0.00 H new ATOM 0 HA ALA A 47 127.925 -10.687 -7.247 1.00 0.00 H new ATOM 0 HB1 ALA A 47 130.128 -10.833 -8.390 1.00 0.00 H new ATOM 0 HB2 ALA A 47 128.979 -9.842 -9.320 1.00 0.00 H new ATOM 0 HB3 ALA A 47 130.255 -9.058 -8.358 1.00 0.00 H new ATOM 740 N GLN A 48 128.833 -10.565 -4.884 1.00 0.00 N ATOM 741 CA GLN A 48 129.510 -10.739 -3.602 1.00 0.00 C ATOM 742 C GLN A 48 129.235 -12.128 -3.036 1.00 0.00 C ATOM 743 O GLN A 48 128.402 -12.868 -3.559 1.00 0.00 O ATOM 744 CB GLN A 48 129.028 -9.678 -2.611 1.00 0.00 C ATOM 745 CG GLN A 48 129.303 -8.285 -3.179 1.00 0.00 C ATOM 746 CD GLN A 48 128.930 -7.220 -2.153 1.00 0.00 C ATOM 747 OE1 GLN A 48 129.693 -6.280 -1.927 1.00 0.00 O ATOM 748 NE2 GLN A 48 127.796 -7.312 -1.514 1.00 0.00 N ATOM 0 H GLN A 48 127.880 -10.928 -4.914 1.00 0.00 H new ATOM 0 HA GLN A 48 130.583 -10.629 -3.760 1.00 0.00 H new ATOM 0 HB2 GLN A 48 127.962 -9.801 -2.421 1.00 0.00 H new ATOM 0 HB3 GLN A 48 129.538 -9.800 -1.655 1.00 0.00 H new ATOM 0 HG2 GLN A 48 130.356 -8.193 -3.444 1.00 0.00 H new ATOM 0 HG3 GLN A 48 128.730 -8.137 -4.094 1.00 0.00 H new ATOM 0 HE21 GLN A 48 127.166 -8.091 -1.703 1.00 0.00 H new ATOM 0 HE22 GLN A 48 127.540 -6.604 -0.826 1.00 0.00 H new ATOM 757 N LYS A 49 129.942 -12.477 -1.965 1.00 0.00 N ATOM 758 CA LYS A 49 129.769 -13.782 -1.334 1.00 0.00 C ATOM 759 C LYS A 49 129.752 -13.645 0.185 1.00 0.00 C ATOM 760 O LYS A 49 129.508 -14.614 0.903 1.00 0.00 O ATOM 761 CB LYS A 49 130.907 -14.716 -1.749 1.00 0.00 C ATOM 762 CG LYS A 49 130.930 -14.849 -3.272 1.00 0.00 C ATOM 763 CD LYS A 49 132.062 -15.791 -3.683 1.00 0.00 C ATOM 764 CE LYS A 49 132.254 -15.735 -5.200 1.00 0.00 C ATOM 765 NZ LYS A 49 132.388 -14.315 -5.632 1.00 0.00 N ATOM 0 H LYS A 49 130.636 -11.878 -1.518 1.00 0.00 H new ATOM 0 HA LYS A 49 128.817 -14.199 -1.661 1.00 0.00 H new ATOM 0 HB2 LYS A 49 131.860 -14.325 -1.393 1.00 0.00 H new ATOM 0 HB3 LYS A 49 130.773 -15.696 -1.290 1.00 0.00 H new ATOM 0 HG2 LYS A 49 129.975 -15.234 -3.629 1.00 0.00 H new ATOM 0 HG3 LYS A 49 131.071 -13.871 -3.731 1.00 0.00 H new ATOM 0 HD2 LYS A 49 132.986 -15.507 -3.179 1.00 0.00 H new ATOM 0 HD3 LYS A 49 131.831 -16.810 -3.373 1.00 0.00 H new ATOM 0 HE2 LYS A 49 133.142 -16.299 -5.486 1.00 0.00 H new ATOM 0 HE3 LYS A 49 131.406 -16.200 -5.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 132.860 -14.277 -6.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 131.444 -13.884 -5.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 132.953 -13.792 -4.933 1.00 0.00 H new ATOM 779 N ASP A 50 130.016 -12.434 0.669 1.00 0.00 N ATOM 780 CA ASP A 50 130.029 -12.179 2.106 1.00 0.00 C ATOM 781 C ASP A 50 129.392 -10.830 2.417 1.00 0.00 C ATOM 782 O ASP A 50 130.083 -9.869 2.758 1.00 0.00 O ATOM 783 CB ASP A 50 131.468 -12.198 2.626 1.00 0.00 C ATOM 784 CG ASP A 50 132.119 -13.541 2.314 1.00 0.00 C ATOM 785 OD1 ASP A 50 131.590 -14.550 2.753 1.00 0.00 O ATOM 786 OD2 ASP A 50 133.136 -13.543 1.640 1.00 0.00 O ATOM 0 H ASP A 50 130.222 -11.619 0.091 1.00 0.00 H new ATOM 0 HA ASP A 50 129.453 -12.962 2.600 1.00 0.00 H new ATOM 0 HB2 ASP A 50 132.040 -11.392 2.166 1.00 0.00 H new ATOM 0 HB3 ASP A 50 131.477 -12.022 3.702 1.00 0.00 H new ATOM 791 N VAL A 51 128.071 -10.764 2.296 1.00 0.00 N ATOM 792 CA VAL A 51 127.348 -9.526 2.567 1.00 0.00 C ATOM 793 C VAL A 51 127.458 -9.154 4.042 1.00 0.00 C ATOM 794 O VAL A 51 127.224 -8.006 4.422 1.00 0.00 O ATOM 795 CB VAL A 51 125.875 -9.689 2.189 1.00 0.00 C ATOM 796 CG1 VAL A 51 125.240 -10.772 3.062 1.00 0.00 C ATOM 797 CG2 VAL A 51 125.143 -8.363 2.411 1.00 0.00 C ATOM 0 H VAL A 51 127.482 -11.547 2.014 1.00 0.00 H new ATOM 0 HA VAL A 51 127.791 -8.730 1.969 1.00 0.00 H new ATOM 0 HB VAL A 51 125.799 -9.977 1.140 1.00 0.00 H new ATOM 0 HG11 VAL A 51 124.190 -10.888 2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 51 125.761 -11.717 2.906 1.00 0.00 H new ATOM 0 HG13 VAL A 51 125.315 -10.485 4.111 1.00 0.00 H new ATOM 0 HG21 VAL A 51 124.093 -8.478 2.142 1.00 0.00 H new ATOM 0 HG22 VAL A 51 125.220 -8.076 3.460 1.00 0.00 H new ATOM 0 HG23 VAL A 51 125.594 -7.590 1.789 1.00 0.00 H new ATOM 807 N ASP A 52 127.817 -10.131 4.868 1.00 0.00 N ATOM 808 CA ASP A 52 127.955 -9.895 6.300 1.00 0.00 C ATOM 809 C ASP A 52 128.918 -8.741 6.563 1.00 0.00 C ATOM 810 O ASP A 52 128.681 -7.910 7.440 1.00 0.00 O ATOM 811 CB ASP A 52 128.470 -11.159 6.991 1.00 0.00 C ATOM 812 CG ASP A 52 129.885 -11.474 6.515 1.00 0.00 C ATOM 813 OD1 ASP A 52 130.773 -10.690 6.803 1.00 0.00 O ATOM 814 OD2 ASP A 52 130.058 -12.494 5.868 1.00 0.00 O ATOM 0 H ASP A 52 128.016 -11.087 4.573 1.00 0.00 H new ATOM 0 HA ASP A 52 126.976 -9.635 6.702 1.00 0.00 H new ATOM 0 HB2 ASP A 52 128.463 -11.021 8.072 1.00 0.00 H new ATOM 0 HB3 ASP A 52 127.809 -11.998 6.773 1.00 0.00 H new ATOM 819 N ALA A 53 130.003 -8.696 5.797 1.00 0.00 N ATOM 820 CA ALA A 53 130.994 -7.639 5.957 1.00 0.00 C ATOM 821 C ALA A 53 130.542 -6.369 5.241 1.00 0.00 C ATOM 822 O ALA A 53 130.631 -5.271 5.790 1.00 0.00 O ATOM 823 CB ALA A 53 132.341 -8.094 5.393 1.00 0.00 C ATOM 0 H ALA A 53 130.217 -9.373 5.065 1.00 0.00 H new ATOM 0 HA ALA A 53 131.101 -7.425 7.020 1.00 0.00 H new ATOM 0 HB1 ALA A 53 133.075 -7.298 5.517 1.00 0.00 H new ATOM 0 HB2 ALA A 53 132.677 -8.983 5.926 1.00 0.00 H new ATOM 0 HB3 ALA A 53 132.232 -8.325 4.333 1.00 0.00 H new ATOM 829 N VAL A 54 130.057 -6.527 4.013 1.00 0.00 N ATOM 830 CA VAL A 54 129.594 -5.386 3.234 1.00 0.00 C ATOM 831 C VAL A 54 128.525 -4.615 4.001 1.00 0.00 C ATOM 832 O VAL A 54 128.592 -3.392 4.118 1.00 0.00 O ATOM 833 CB VAL A 54 129.022 -5.862 1.898 1.00 0.00 C ATOM 834 CG1 VAL A 54 128.622 -4.652 1.053 1.00 0.00 C ATOM 835 CG2 VAL A 54 130.082 -6.675 1.152 1.00 0.00 C ATOM 0 H VAL A 54 129.975 -7.427 3.540 1.00 0.00 H new ATOM 0 HA VAL A 54 130.442 -4.727 3.050 1.00 0.00 H new ATOM 0 HB VAL A 54 128.145 -6.484 2.079 1.00 0.00 H new ATOM 0 HG11 VAL A 54 128.214 -4.992 0.101 1.00 0.00 H new ATOM 0 HG12 VAL A 54 127.868 -4.071 1.584 1.00 0.00 H new ATOM 0 HG13 VAL A 54 129.498 -4.030 0.871 1.00 0.00 H new ATOM 0 HG21 VAL A 54 129.676 -7.015 0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 54 130.958 -6.052 0.971 1.00 0.00 H new ATOM 0 HG23 VAL A 54 130.368 -7.538 1.753 1.00 0.00 H new ATOM 845 N ASP A 55 127.541 -5.340 4.524 1.00 0.00 N ATOM 846 CA ASP A 55 126.465 -4.714 5.281 1.00 0.00 C ATOM 847 C ASP A 55 127.010 -4.071 6.552 1.00 0.00 C ATOM 848 O ASP A 55 126.546 -3.010 6.971 1.00 0.00 O ATOM 849 CB ASP A 55 125.408 -5.756 5.647 1.00 0.00 C ATOM 850 CG ASP A 55 124.194 -5.073 6.267 1.00 0.00 C ATOM 851 OD1 ASP A 55 124.171 -3.853 6.287 1.00 0.00 O ATOM 852 OD2 ASP A 55 123.304 -5.779 6.713 1.00 0.00 O ATOM 0 H ASP A 55 127.467 -6.354 4.438 1.00 0.00 H new ATOM 0 HA ASP A 55 126.012 -3.941 4.661 1.00 0.00 H new ATOM 0 HB2 ASP A 55 125.109 -6.310 4.757 1.00 0.00 H new ATOM 0 HB3 ASP A 55 125.826 -6.479 6.347 1.00 0.00 H new ATOM 857 N LYS A 56 127.998 -4.719 7.159 1.00 0.00 N ATOM 858 CA LYS A 56 128.601 -4.201 8.382 1.00 0.00 C ATOM 859 C LYS A 56 129.215 -2.827 8.135 1.00 0.00 C ATOM 860 O LYS A 56 129.154 -1.946 8.994 1.00 0.00 O ATOM 861 CB LYS A 56 129.681 -5.164 8.879 1.00 0.00 C ATOM 862 CG LYS A 56 130.433 -4.525 10.048 1.00 0.00 C ATOM 863 CD LYS A 56 131.323 -5.573 10.720 1.00 0.00 C ATOM 864 CE LYS A 56 132.012 -4.953 11.937 1.00 0.00 C ATOM 865 NZ LYS A 56 131.018 -4.177 12.730 1.00 0.00 N ATOM 0 H LYS A 56 128.396 -5.598 6.828 1.00 0.00 H new ATOM 0 HA LYS A 56 127.822 -4.107 9.139 1.00 0.00 H new ATOM 0 HB2 LYS A 56 129.228 -6.104 9.194 1.00 0.00 H new ATOM 0 HB3 LYS A 56 130.374 -5.399 8.071 1.00 0.00 H new ATOM 0 HG2 LYS A 56 131.040 -3.692 9.692 1.00 0.00 H new ATOM 0 HG3 LYS A 56 129.725 -4.118 10.770 1.00 0.00 H new ATOM 0 HD2 LYS A 56 130.725 -6.431 11.026 1.00 0.00 H new ATOM 0 HD3 LYS A 56 132.068 -5.939 10.014 1.00 0.00 H new ATOM 0 HE2 LYS A 56 132.455 -5.734 12.554 1.00 0.00 H new ATOM 0 HE3 LYS A 56 132.825 -4.302 11.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 131.374 -4.044 13.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 130.868 -3.249 12.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 130.117 -4.696 12.760 1.00 0.00 H new ATOM 879 N VAL A 57 129.806 -2.651 6.958 1.00 0.00 N ATOM 880 CA VAL A 57 130.428 -1.379 6.610 1.00 0.00 C ATOM 881 C VAL A 57 129.366 -0.343 6.256 1.00 0.00 C ATOM 882 O VAL A 57 129.521 0.844 6.543 1.00 0.00 O ATOM 883 CB VAL A 57 131.374 -1.569 5.423 1.00 0.00 C ATOM 884 CG1 VAL A 57 131.935 -0.212 4.993 1.00 0.00 C ATOM 885 CG2 VAL A 57 132.526 -2.489 5.832 1.00 0.00 C ATOM 0 H VAL A 57 129.867 -3.367 6.234 1.00 0.00 H new ATOM 0 HA VAL A 57 130.993 -1.024 7.472 1.00 0.00 H new ATOM 0 HB VAL A 57 130.828 -2.016 4.592 1.00 0.00 H new ATOM 0 HG11 VAL A 57 132.609 -0.348 4.147 1.00 0.00 H new ATOM 0 HG12 VAL A 57 131.115 0.445 4.702 1.00 0.00 H new ATOM 0 HG13 VAL A 57 132.481 0.236 5.823 1.00 0.00 H new ATOM 0 HG21 VAL A 57 133.201 -2.625 4.987 1.00 0.00 H new ATOM 0 HG22 VAL A 57 133.071 -2.042 6.663 1.00 0.00 H new ATOM 0 HG23 VAL A 57 132.128 -3.457 6.138 1.00 0.00 H new ATOM 895 N MET A 58 128.286 -0.801 5.629 1.00 0.00 N ATOM 896 CA MET A 58 127.203 0.094 5.239 1.00 0.00 C ATOM 897 C MET A 58 126.461 0.615 6.466 1.00 0.00 C ATOM 898 O MET A 58 126.247 1.818 6.610 1.00 0.00 O ATOM 899 CB MET A 58 126.223 -0.643 4.324 1.00 0.00 C ATOM 900 CG MET A 58 126.913 -0.985 3.002 1.00 0.00 C ATOM 901 SD MET A 58 127.028 0.504 1.979 1.00 0.00 S ATOM 902 CE MET A 58 128.491 0.014 1.032 1.00 0.00 C ATOM 0 H MET A 58 128.139 -1.780 5.382 1.00 0.00 H new ATOM 0 HA MET A 58 127.635 0.941 4.707 1.00 0.00 H new ATOM 0 HB2 MET A 58 125.872 -1.554 4.809 1.00 0.00 H new ATOM 0 HB3 MET A 58 125.346 -0.023 4.138 1.00 0.00 H new ATOM 0 HG2 MET A 58 127.908 -1.386 3.192 1.00 0.00 H new ATOM 0 HG3 MET A 58 126.353 -1.758 2.476 1.00 0.00 H new ATOM 0 HE1 MET A 58 128.821 0.849 0.414 1.00 0.00 H new ATOM 0 HE2 MET A 58 129.290 -0.268 1.717 1.00 0.00 H new ATOM 0 HE3 MET A 58 128.244 -0.834 0.394 1.00 0.00 H new ATOM 912 N LYS A 59 126.069 -0.300 7.349 1.00 0.00 N ATOM 913 CA LYS A 59 125.351 0.081 8.559 1.00 0.00 C ATOM 914 C LYS A 59 126.242 0.915 9.474 1.00 0.00 C ATOM 915 O LYS A 59 125.752 1.694 10.292 1.00 0.00 O ATOM 916 CB LYS A 59 124.872 -1.173 9.302 1.00 0.00 C ATOM 917 CG LYS A 59 126.047 -1.827 10.050 1.00 0.00 C ATOM 918 CD LYS A 59 126.028 -1.410 11.526 1.00 0.00 C ATOM 919 CE LYS A 59 127.418 -1.608 12.131 1.00 0.00 C ATOM 920 NZ LYS A 59 127.735 -3.063 12.182 1.00 0.00 N ATOM 0 H LYS A 59 126.235 -1.301 7.250 1.00 0.00 H new ATOM 0 HA LYS A 59 124.488 0.682 8.272 1.00 0.00 H new ATOM 0 HB2 LYS A 59 124.084 -0.908 10.007 1.00 0.00 H new ATOM 0 HB3 LYS A 59 124.442 -1.882 8.595 1.00 0.00 H new ATOM 0 HG2 LYS A 59 125.981 -2.912 9.969 1.00 0.00 H new ATOM 0 HG3 LYS A 59 126.991 -1.530 9.592 1.00 0.00 H new ATOM 0 HD2 LYS A 59 125.726 -0.367 11.616 1.00 0.00 H new ATOM 0 HD3 LYS A 59 125.294 -2.002 12.073 1.00 0.00 H new ATOM 0 HE2 LYS A 59 128.164 -1.083 11.534 1.00 0.00 H new ATOM 0 HE3 LYS A 59 127.454 -1.182 13.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 128.666 -3.200 12.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 127.010 -3.557 12.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 127.750 -3.449 11.216 1.00 0.00 H new ATOM 934 N GLU A 60 127.552 0.749 9.329 1.00 0.00 N ATOM 935 CA GLU A 60 128.500 1.495 10.149 1.00 0.00 C ATOM 936 C GLU A 60 128.356 2.993 9.902 1.00 0.00 C ATOM 937 O GLU A 60 128.442 3.797 10.831 1.00 0.00 O ATOM 938 CB GLU A 60 129.930 1.059 9.824 1.00 0.00 C ATOM 939 CG GLU A 60 130.901 1.720 10.804 1.00 0.00 C ATOM 940 CD GLU A 60 132.339 1.441 10.382 1.00 0.00 C ATOM 941 OE1 GLU A 60 132.524 0.872 9.318 1.00 0.00 O ATOM 942 OE2 GLU A 60 133.236 1.799 11.128 1.00 0.00 O ATOM 0 H GLU A 60 127.979 0.111 8.658 1.00 0.00 H new ATOM 0 HA GLU A 60 128.287 1.287 11.198 1.00 0.00 H new ATOM 0 HB2 GLU A 60 130.014 -0.026 9.888 1.00 0.00 H new ATOM 0 HB3 GLU A 60 130.183 1.338 8.801 1.00 0.00 H new ATOM 0 HG2 GLU A 60 130.724 2.795 10.834 1.00 0.00 H new ATOM 0 HG3 GLU A 60 130.729 1.340 11.811 1.00 0.00 H new ATOM 949 N LEU A 61 128.136 3.360 8.645 1.00 0.00 N ATOM 950 CA LEU A 61 127.981 4.765 8.284 1.00 0.00 C ATOM 951 C LEU A 61 126.591 5.266 8.664 1.00 0.00 C ATOM 952 O LEU A 61 126.413 6.436 9.002 1.00 0.00 O ATOM 953 CB LEU A 61 128.197 4.945 6.780 1.00 0.00 C ATOM 954 CG LEU A 61 129.503 4.267 6.367 1.00 0.00 C ATOM 955 CD1 LEU A 61 129.726 4.459 4.865 1.00 0.00 C ATOM 956 CD2 LEU A 61 130.668 4.892 7.137 1.00 0.00 C ATOM 0 H LEU A 61 128.061 2.710 7.863 1.00 0.00 H new ATOM 0 HA LEU A 61 128.725 5.345 8.830 1.00 0.00 H new ATOM 0 HB2 LEU A 61 127.361 4.515 6.228 1.00 0.00 H new ATOM 0 HB3 LEU A 61 128.231 6.006 6.531 1.00 0.00 H new ATOM 0 HG LEU A 61 129.446 3.202 6.593 1.00 0.00 H new ATOM 0 HD11 LEU A 61 130.657 3.975 4.571 1.00 0.00 H new ATOM 0 HD12 LEU A 61 128.897 4.015 4.314 1.00 0.00 H new ATOM 0 HD13 LEU A 61 129.783 5.524 4.639 1.00 0.00 H new ATOM 0 HD21 LEU A 61 131.600 4.409 6.843 1.00 0.00 H new ATOM 0 HD22 LEU A 61 130.724 5.957 6.911 1.00 0.00 H new ATOM 0 HD23 LEU A 61 130.511 4.756 8.207 1.00 0.00 H new ATOM 968 N ASP A 62 125.608 4.373 8.602 1.00 0.00 N ATOM 969 CA ASP A 62 124.237 4.736 8.939 1.00 0.00 C ATOM 970 C ASP A 62 124.156 5.268 10.367 1.00 0.00 C ATOM 971 O ASP A 62 123.562 6.318 10.614 1.00 0.00 O ATOM 972 CB ASP A 62 123.324 3.516 8.796 1.00 0.00 C ATOM 973 CG ASP A 62 121.868 3.929 8.983 1.00 0.00 C ATOM 974 OD1 ASP A 62 121.627 5.111 9.165 1.00 0.00 O ATOM 975 OD2 ASP A 62 121.016 3.056 8.945 1.00 0.00 O ATOM 0 H ASP A 62 125.734 3.400 8.324 1.00 0.00 H new ATOM 0 HA ASP A 62 123.911 5.518 8.254 1.00 0.00 H new ATOM 0 HB2 ASP A 62 123.459 3.064 7.813 1.00 0.00 H new ATOM 0 HB3 ASP A 62 123.594 2.761 9.534 1.00 0.00 H new ATOM 980 N GLU A 63 124.756 4.539 11.301 1.00 0.00 N ATOM 981 CA GLU A 63 124.745 4.950 12.700 1.00 0.00 C ATOM 982 C GLU A 63 125.516 6.253 12.883 1.00 0.00 C ATOM 983 O GLU A 63 125.183 7.067 13.744 1.00 0.00 O ATOM 984 CB GLU A 63 125.370 3.857 13.571 1.00 0.00 C ATOM 985 CG GLU A 63 124.505 2.597 13.504 1.00 0.00 C ATOM 986 CD GLU A 63 125.070 1.527 14.431 1.00 0.00 C ATOM 987 OE1 GLU A 63 126.180 1.706 14.904 1.00 0.00 O ATOM 988 OE2 GLU A 63 124.384 0.543 14.655 1.00 0.00 O ATOM 0 H GLU A 63 125.253 3.667 11.117 1.00 0.00 H new ATOM 0 HA GLU A 63 123.710 5.109 13.004 1.00 0.00 H new ATOM 0 HB2 GLU A 63 126.381 3.636 13.227 1.00 0.00 H new ATOM 0 HB3 GLU A 63 125.452 4.201 14.602 1.00 0.00 H new ATOM 0 HG2 GLU A 63 123.480 2.834 13.790 1.00 0.00 H new ATOM 0 HG3 GLU A 63 124.472 2.223 12.481 1.00 0.00 H new ATOM 995 N ASN A 64 126.547 6.443 12.065 1.00 0.00 N ATOM 996 CA ASN A 64 127.361 7.653 12.142 1.00 0.00 C ATOM 997 C ASN A 64 126.923 8.661 11.083 1.00 0.00 C ATOM 998 O ASN A 64 125.947 8.438 10.367 1.00 0.00 O ATOM 999 CB ASN A 64 128.836 7.304 11.936 1.00 0.00 C ATOM 1000 CG ASN A 64 129.333 6.444 13.092 1.00 0.00 C ATOM 1001 OD1 ASN A 64 129.399 5.220 12.974 1.00 0.00 O ATOM 1002 ND2 ASN A 64 129.689 7.013 14.211 1.00 0.00 N ATOM 0 H ASN A 64 126.838 5.780 11.346 1.00 0.00 H new ATOM 0 HA ASN A 64 127.227 8.097 13.129 1.00 0.00 H new ATOM 0 HB2 ASN A 64 128.964 6.771 10.994 1.00 0.00 H new ATOM 0 HB3 ASN A 64 129.429 8.216 11.869 1.00 0.00 H new ATOM 0 HD21 ASN A 64 130.022 6.444 14.989 1.00 0.00 H new ATOM 0 HD22 ASN A 64 129.634 8.027 14.308 1.00 0.00 H new ATOM 1009 N GLY A 65 127.650 9.770 10.992 1.00 0.00 N ATOM 1010 CA GLY A 65 127.327 10.805 10.017 1.00 0.00 C ATOM 1011 C GLY A 65 128.024 12.115 10.363 1.00 0.00 C ATOM 1012 O GLY A 65 128.616 12.763 9.499 1.00 0.00 O ATOM 0 H GLY A 65 128.461 9.974 11.577 1.00 0.00 H new ATOM 0 HA2 GLY A 65 127.629 10.480 9.022 1.00 0.00 H new ATOM 0 HA3 GLY A 65 126.248 10.959 9.988 1.00 0.00 H new ATOM 1016 N ASP A 66 127.952 12.502 11.633 1.00 0.00 N ATOM 1017 CA ASP A 66 128.581 13.738 12.082 1.00 0.00 C ATOM 1018 C ASP A 66 130.096 13.653 11.929 1.00 0.00 C ATOM 1019 O ASP A 66 130.776 14.674 11.814 1.00 0.00 O ATOM 1020 CB ASP A 66 128.227 14.002 13.546 1.00 0.00 C ATOM 1021 CG ASP A 66 126.734 14.283 13.680 1.00 0.00 C ATOM 1022 OD1 ASP A 66 126.333 15.400 13.394 1.00 0.00 O ATOM 1023 OD2 ASP A 66 126.013 13.377 14.066 1.00 0.00 O ATOM 0 H ASP A 66 127.468 11.981 12.364 1.00 0.00 H new ATOM 0 HA ASP A 66 128.211 14.558 11.466 1.00 0.00 H new ATOM 0 HB2 ASP A 66 128.499 13.140 14.155 1.00 0.00 H new ATOM 0 HB3 ASP A 66 128.800 14.851 13.920 1.00 0.00 H new ATOM 1028 N GLY A 67 130.618 12.432 11.930 1.00 0.00 N ATOM 1029 CA GLY A 67 132.055 12.226 11.792 1.00 0.00 C ATOM 1030 C GLY A 67 132.489 12.358 10.336 1.00 0.00 C ATOM 1031 O GLY A 67 131.658 12.529 9.445 1.00 0.00 O ATOM 0 H GLY A 67 130.073 11.575 12.024 1.00 0.00 H new ATOM 0 HA2 GLY A 67 132.590 12.953 12.402 1.00 0.00 H new ATOM 0 HA3 GLY A 67 132.322 11.238 12.167 1.00 0.00 H new ATOM 1035 N GLU A 68 133.796 12.278 10.103 1.00 0.00 N ATOM 1036 CA GLU A 68 134.332 12.392 8.751 1.00 0.00 C ATOM 1037 C GLU A 68 135.508 11.438 8.558 1.00 0.00 C ATOM 1038 O GLU A 68 135.948 10.783 9.503 1.00 0.00 O ATOM 1039 CB GLU A 68 134.788 13.828 8.492 1.00 0.00 C ATOM 1040 CG GLU A 68 133.679 14.797 8.905 1.00 0.00 C ATOM 1041 CD GLU A 68 133.698 14.998 10.416 1.00 0.00 C ATOM 1042 OE1 GLU A 68 134.587 14.459 11.055 1.00 0.00 O ATOM 1043 OE2 GLU A 68 132.823 15.687 10.913 1.00 0.00 O ATOM 0 H GLU A 68 134.499 12.136 10.828 1.00 0.00 H new ATOM 0 HA GLU A 68 133.546 12.127 8.044 1.00 0.00 H new ATOM 0 HB2 GLU A 68 135.698 14.039 9.054 1.00 0.00 H new ATOM 0 HB3 GLU A 68 135.027 13.960 7.437 1.00 0.00 H new ATOM 0 HG2 GLU A 68 133.815 15.754 8.401 1.00 0.00 H new ATOM 0 HG3 GLU A 68 132.710 14.407 8.594 1.00 0.00 H new ATOM 1050 N VAL A 69 136.010 11.363 7.329 1.00 0.00 N ATOM 1051 CA VAL A 69 137.134 10.483 7.023 1.00 0.00 C ATOM 1052 C VAL A 69 138.110 11.167 6.070 1.00 0.00 C ATOM 1053 O VAL A 69 137.816 12.229 5.521 1.00 0.00 O ATOM 1054 CB VAL A 69 136.626 9.188 6.388 1.00 0.00 C ATOM 1055 CG1 VAL A 69 136.014 8.293 7.467 1.00 0.00 C ATOM 1056 CG2 VAL A 69 135.563 9.520 5.337 1.00 0.00 C ATOM 0 H VAL A 69 135.660 11.897 6.534 1.00 0.00 H new ATOM 0 HA VAL A 69 137.653 10.254 7.954 1.00 0.00 H new ATOM 0 HB VAL A 69 137.457 8.666 5.914 1.00 0.00 H new ATOM 0 HG11 VAL A 69 135.652 7.371 7.013 1.00 0.00 H new ATOM 0 HG12 VAL A 69 136.770 8.057 8.216 1.00 0.00 H new ATOM 0 HG13 VAL A 69 135.183 8.813 7.943 1.00 0.00 H new ATOM 0 HG21 VAL A 69 135.200 8.598 4.883 1.00 0.00 H new ATOM 0 HG22 VAL A 69 134.733 10.043 5.812 1.00 0.00 H new ATOM 0 HG23 VAL A 69 135.999 10.156 4.567 1.00 0.00 H new ATOM 1066 N ASP A 70 139.272 10.549 5.879 1.00 0.00 N ATOM 1067 CA ASP A 70 140.292 11.100 4.988 1.00 0.00 C ATOM 1068 C ASP A 70 140.469 10.209 3.763 1.00 0.00 C ATOM 1069 O ASP A 70 139.728 9.245 3.572 1.00 0.00 O ATOM 1070 CB ASP A 70 141.624 11.217 5.732 1.00 0.00 C ATOM 1071 CG ASP A 70 142.590 12.092 4.939 1.00 0.00 C ATOM 1072 OD1 ASP A 70 142.147 12.719 3.991 1.00 0.00 O ATOM 1073 OD2 ASP A 70 143.757 12.122 5.293 1.00 0.00 O ATOM 0 H ASP A 70 139.532 9.670 6.327 1.00 0.00 H new ATOM 0 HA ASP A 70 139.969 12.088 4.661 1.00 0.00 H new ATOM 0 HB2 ASP A 70 141.461 11.645 6.721 1.00 0.00 H new ATOM 0 HB3 ASP A 70 142.055 10.227 5.880 1.00 0.00 H new ATOM 1078 N PHE A 71 141.456 10.537 2.936 1.00 0.00 N ATOM 1079 CA PHE A 71 141.722 9.760 1.731 1.00 0.00 C ATOM 1080 C PHE A 71 142.190 8.353 2.089 1.00 0.00 C ATOM 1081 O PHE A 71 141.622 7.363 1.629 1.00 0.00 O ATOM 1082 CB PHE A 71 142.790 10.453 0.884 1.00 0.00 C ATOM 1083 CG PHE A 71 143.198 9.547 -0.252 1.00 0.00 C ATOM 1084 CD1 PHE A 71 142.290 9.256 -1.277 1.00 0.00 C ATOM 1085 CD2 PHE A 71 144.486 8.998 -0.280 1.00 0.00 C ATOM 1086 CE1 PHE A 71 142.669 8.416 -2.331 1.00 0.00 C ATOM 1087 CE2 PHE A 71 144.865 8.157 -1.334 1.00 0.00 C ATOM 1088 CZ PHE A 71 143.957 7.867 -2.359 1.00 0.00 C ATOM 0 H PHE A 71 142.081 11.330 3.077 1.00 0.00 H new ATOM 0 HA PHE A 71 140.796 9.688 1.160 1.00 0.00 H new ATOM 0 HB2 PHE A 71 142.404 11.394 0.492 1.00 0.00 H new ATOM 0 HB3 PHE A 71 143.657 10.695 1.499 1.00 0.00 H new ATOM 0 HD1 PHE A 71 141.297 9.680 -1.255 1.00 0.00 H new ATOM 0 HD2 PHE A 71 145.187 9.223 0.511 1.00 0.00 H new ATOM 0 HE1 PHE A 71 141.969 8.192 -3.122 1.00 0.00 H new ATOM 0 HE2 PHE A 71 145.858 7.732 -1.356 1.00 0.00 H new ATOM 0 HZ PHE A 71 144.250 7.219 -3.172 1.00 0.00 H new ATOM 1098 N GLN A 72 143.230 8.271 2.911 1.00 0.00 N ATOM 1099 CA GLN A 72 143.766 6.978 3.321 1.00 0.00 C ATOM 1100 C GLN A 72 142.646 6.067 3.814 1.00 0.00 C ATOM 1101 O GLN A 72 142.659 4.862 3.566 1.00 0.00 O ATOM 1102 CB GLN A 72 144.800 7.167 4.433 1.00 0.00 C ATOM 1103 CG GLN A 72 144.263 8.159 5.467 1.00 0.00 C ATOM 1104 CD GLN A 72 145.266 8.322 6.603 1.00 0.00 C ATOM 1105 OE1 GLN A 72 145.638 9.443 6.949 1.00 0.00 O ATOM 1106 NE2 GLN A 72 145.729 7.263 7.210 1.00 0.00 N ATOM 0 H GLN A 72 143.716 9.077 3.304 1.00 0.00 H new ATOM 0 HA GLN A 72 144.244 6.515 2.458 1.00 0.00 H new ATOM 0 HB2 GLN A 72 145.016 6.211 4.909 1.00 0.00 H new ATOM 0 HB3 GLN A 72 145.737 7.534 4.014 1.00 0.00 H new ATOM 0 HG2 GLN A 72 144.076 9.123 4.995 1.00 0.00 H new ATOM 0 HG3 GLN A 72 143.310 7.806 5.860 1.00 0.00 H new ATOM 0 HE21 GLN A 72 145.420 6.334 6.922 1.00 0.00 H new ATOM 0 HE22 GLN A 72 146.400 7.364 7.972 1.00 0.00 H new ATOM 1115 N GLU A 73 141.677 6.652 4.510 1.00 0.00 N ATOM 1116 CA GLU A 73 140.552 5.883 5.033 1.00 0.00 C ATOM 1117 C GLU A 73 139.721 5.305 3.892 1.00 0.00 C ATOM 1118 O GLU A 73 139.247 4.171 3.970 1.00 0.00 O ATOM 1119 CB GLU A 73 139.675 6.777 5.910 1.00 0.00 C ATOM 1120 CG GLU A 73 140.434 7.139 7.190 1.00 0.00 C ATOM 1121 CD GLU A 73 139.469 7.699 8.229 1.00 0.00 C ATOM 1122 OE1 GLU A 73 138.755 6.913 8.830 1.00 0.00 O ATOM 1123 OE2 GLU A 73 139.460 8.905 8.412 1.00 0.00 O ATOM 0 H GLU A 73 141.647 7.649 4.724 1.00 0.00 H new ATOM 0 HA GLU A 73 140.943 5.060 5.631 1.00 0.00 H new ATOM 0 HB2 GLU A 73 139.403 7.682 5.367 1.00 0.00 H new ATOM 0 HB3 GLU A 73 138.746 6.263 6.158 1.00 0.00 H new ATOM 0 HG2 GLU A 73 140.936 6.257 7.587 1.00 0.00 H new ATOM 0 HG3 GLU A 73 141.208 7.873 6.968 1.00 0.00 H new ATOM 1130 N TYR A 74 139.550 6.089 2.832 1.00 0.00 N ATOM 1131 CA TYR A 74 138.776 5.639 1.679 1.00 0.00 C ATOM 1132 C TYR A 74 139.446 4.431 1.029 1.00 0.00 C ATOM 1133 O TYR A 74 138.784 3.601 0.406 1.00 0.00 O ATOM 1134 CB TYR A 74 138.651 6.778 0.660 1.00 0.00 C ATOM 1135 CG TYR A 74 138.164 6.232 -0.663 1.00 0.00 C ATOM 1136 CD1 TYR A 74 139.081 5.702 -1.578 1.00 0.00 C ATOM 1137 CD2 TYR A 74 136.799 6.258 -0.974 1.00 0.00 C ATOM 1138 CE1 TYR A 74 138.633 5.197 -2.805 1.00 0.00 C ATOM 1139 CE2 TYR A 74 136.351 5.752 -2.200 1.00 0.00 C ATOM 1140 CZ TYR A 74 137.269 5.222 -3.116 1.00 0.00 C ATOM 1141 OH TYR A 74 136.827 4.723 -4.325 1.00 0.00 O ATOM 0 H TYR A 74 139.933 7.031 2.747 1.00 0.00 H new ATOM 0 HA TYR A 74 137.781 5.348 2.016 1.00 0.00 H new ATOM 0 HB2 TYR A 74 137.958 7.534 1.029 1.00 0.00 H new ATOM 0 HB3 TYR A 74 139.616 7.268 0.528 1.00 0.00 H new ATOM 0 HD1 TYR A 74 140.134 5.682 -1.338 1.00 0.00 H new ATOM 0 HD2 TYR A 74 136.092 6.668 -0.268 1.00 0.00 H new ATOM 0 HE1 TYR A 74 139.340 4.788 -3.511 1.00 0.00 H new ATOM 0 HE2 TYR A 74 135.298 5.770 -2.440 1.00 0.00 H new ATOM 0 HH TYR A 74 135.873 4.510 -4.262 1.00 0.00 H new ATOM 1151 N VAL A 75 140.764 4.341 1.180 1.00 0.00 N ATOM 1152 CA VAL A 75 141.516 3.232 0.603 1.00 0.00 C ATOM 1153 C VAL A 75 141.335 1.967 1.440 1.00 0.00 C ATOM 1154 O VAL A 75 141.469 0.853 0.934 1.00 0.00 O ATOM 1155 CB VAL A 75 143.001 3.596 0.529 1.00 0.00 C ATOM 1156 CG1 VAL A 75 143.826 2.341 0.233 1.00 0.00 C ATOM 1157 CG2 VAL A 75 143.214 4.618 -0.589 1.00 0.00 C ATOM 0 H VAL A 75 141.330 5.017 1.693 1.00 0.00 H new ATOM 0 HA VAL A 75 141.139 3.041 -0.402 1.00 0.00 H new ATOM 0 HB VAL A 75 143.319 4.020 1.482 1.00 0.00 H new ATOM 0 HG11 VAL A 75 144.883 2.604 0.181 1.00 0.00 H new ATOM 0 HG12 VAL A 75 143.673 1.609 1.026 1.00 0.00 H new ATOM 0 HG13 VAL A 75 143.511 1.915 -0.719 1.00 0.00 H new ATOM 0 HG21 VAL A 75 144.270 4.880 -0.646 1.00 0.00 H new ATOM 0 HG22 VAL A 75 142.895 4.190 -1.539 1.00 0.00 H new ATOM 0 HG23 VAL A 75 142.628 5.513 -0.380 1.00 0.00 H new ATOM 1167 N VAL A 76 141.035 2.147 2.721 1.00 0.00 N ATOM 1168 CA VAL A 76 140.842 1.012 3.618 1.00 0.00 C ATOM 1169 C VAL A 76 139.529 0.297 3.312 1.00 0.00 C ATOM 1170 O VAL A 76 139.501 -0.922 3.136 1.00 0.00 O ATOM 1171 CB VAL A 76 140.834 1.493 5.071 1.00 0.00 C ATOM 1172 CG1 VAL A 76 140.707 0.289 6.006 1.00 0.00 C ATOM 1173 CG2 VAL A 76 142.138 2.237 5.370 1.00 0.00 C ATOM 0 H VAL A 76 140.921 3.060 3.160 1.00 0.00 H new ATOM 0 HA VAL A 76 141.665 0.313 3.467 1.00 0.00 H new ATOM 0 HB VAL A 76 139.990 2.164 5.227 1.00 0.00 H new ATOM 0 HG11 VAL A 76 140.701 0.631 7.041 1.00 0.00 H new ATOM 0 HG12 VAL A 76 139.778 -0.240 5.794 1.00 0.00 H new ATOM 0 HG13 VAL A 76 141.551 -0.383 5.851 1.00 0.00 H new ATOM 0 HG21 VAL A 76 142.132 2.580 6.405 1.00 0.00 H new ATOM 0 HG22 VAL A 76 142.983 1.567 5.214 1.00 0.00 H new ATOM 0 HG23 VAL A 76 142.228 3.095 4.704 1.00 0.00 H new ATOM 1183 N LEU A 77 138.443 1.060 3.256 1.00 0.00 N ATOM 1184 CA LEU A 77 137.130 0.490 2.978 1.00 0.00 C ATOM 1185 C LEU A 77 137.144 -0.300 1.672 1.00 0.00 C ATOM 1186 O LEU A 77 136.863 -1.499 1.659 1.00 0.00 O ATOM 1187 CB LEU A 77 136.087 1.605 2.889 1.00 0.00 C ATOM 1188 CG LEU A 77 136.125 2.445 4.166 1.00 0.00 C ATOM 1189 CD1 LEU A 77 135.057 3.537 4.091 1.00 0.00 C ATOM 1190 CD2 LEU A 77 135.852 1.547 5.376 1.00 0.00 C ATOM 0 H LEU A 77 138.445 2.070 3.399 1.00 0.00 H new ATOM 0 HA LEU A 77 136.874 -0.188 3.792 1.00 0.00 H new ATOM 0 HB2 LEU A 77 136.286 2.234 2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 77 135.094 1.178 2.752 1.00 0.00 H new ATOM 0 HG LEU A 77 137.108 2.905 4.269 1.00 0.00 H new ATOM 0 HD11 LEU A 77 135.084 4.136 5.001 1.00 0.00 H new ATOM 0 HD12 LEU A 77 135.251 4.177 3.230 1.00 0.00 H new ATOM 0 HD13 LEU A 77 134.074 3.078 3.988 1.00 0.00 H new ATOM 0 HD21 LEU A 77 135.879 2.145 6.287 1.00 0.00 H new ATOM 0 HD22 LEU A 77 134.869 1.087 5.273 1.00 0.00 H new ATOM 0 HD23 LEU A 77 136.613 0.769 5.431 1.00 0.00 H new ATOM 1202 N VAL A 78 137.470 0.378 0.577 1.00 0.00 N ATOM 1203 CA VAL A 78 137.512 -0.273 -0.729 1.00 0.00 C ATOM 1204 C VAL A 78 138.243 -1.609 -0.642 1.00 0.00 C ATOM 1205 O VAL A 78 137.883 -2.569 -1.325 1.00 0.00 O ATOM 1206 CB VAL A 78 138.218 0.630 -1.742 1.00 0.00 C ATOM 1207 CG1 VAL A 78 137.385 1.893 -1.970 1.00 0.00 C ATOM 1208 CG2 VAL A 78 139.595 1.021 -1.201 1.00 0.00 C ATOM 0 H VAL A 78 137.707 1.370 0.566 1.00 0.00 H new ATOM 0 HA VAL A 78 136.487 -0.453 -1.054 1.00 0.00 H new ATOM 0 HB VAL A 78 138.333 0.096 -2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 78 137.889 2.536 -2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 78 136.403 1.617 -2.354 1.00 0.00 H new ATOM 0 HG13 VAL A 78 137.269 2.428 -1.027 1.00 0.00 H new ATOM 0 HG21 VAL A 78 140.100 1.665 -1.922 1.00 0.00 H new ATOM 0 HG22 VAL A 78 139.477 1.555 -0.258 1.00 0.00 H new ATOM 0 HG23 VAL A 78 140.190 0.123 -1.038 1.00 0.00 H new ATOM 1218 N ALA A 79 139.270 -1.664 0.199 1.00 0.00 N ATOM 1219 CA ALA A 79 140.044 -2.889 0.364 1.00 0.00 C ATOM 1220 C ALA A 79 139.208 -3.970 1.043 1.00 0.00 C ATOM 1221 O ALA A 79 139.331 -5.153 0.724 1.00 0.00 O ATOM 1222 CB ALA A 79 141.294 -2.607 1.200 1.00 0.00 C ATOM 0 H ALA A 79 139.584 -0.881 0.773 1.00 0.00 H new ATOM 0 HA ALA A 79 140.338 -3.244 -0.624 1.00 0.00 H new ATOM 0 HB1 ALA A 79 141.867 -3.526 1.319 1.00 0.00 H new ATOM 0 HB2 ALA A 79 141.907 -1.860 0.697 1.00 0.00 H new ATOM 0 HB3 ALA A 79 140.999 -2.234 2.181 1.00 0.00 H new ATOM 1228 N ALA A 80 138.363 -3.558 1.981 1.00 0.00 N ATOM 1229 CA ALA A 80 137.515 -4.504 2.700 1.00 0.00 C ATOM 1230 C ALA A 80 136.513 -5.158 1.754 1.00 0.00 C ATOM 1231 O ALA A 80 136.376 -6.382 1.730 1.00 0.00 O ATOM 1232 CB ALA A 80 136.763 -3.783 3.821 1.00 0.00 C ATOM 0 H ALA A 80 138.246 -2.584 2.260 1.00 0.00 H new ATOM 0 HA ALA A 80 138.152 -5.279 3.127 1.00 0.00 H new ATOM 0 HB1 ALA A 80 136.132 -4.495 4.353 1.00 0.00 H new ATOM 0 HB2 ALA A 80 137.479 -3.343 4.515 1.00 0.00 H new ATOM 0 HB3 ALA A 80 136.141 -2.996 3.394 1.00 0.00 H new ATOM 1238 N LEU A 81 135.814 -4.338 0.977 1.00 0.00 N ATOM 1239 CA LEU A 81 134.825 -4.851 0.036 1.00 0.00 C ATOM 1240 C LEU A 81 135.489 -5.730 -1.018 1.00 0.00 C ATOM 1241 O LEU A 81 134.913 -6.723 -1.464 1.00 0.00 O ATOM 1242 CB LEU A 81 134.104 -3.688 -0.650 1.00 0.00 C ATOM 1243 CG LEU A 81 133.006 -3.152 0.271 1.00 0.00 C ATOM 1244 CD1 LEU A 81 133.642 -2.536 1.518 1.00 0.00 C ATOM 1245 CD2 LEU A 81 132.197 -2.086 -0.470 1.00 0.00 C ATOM 0 H LEU A 81 135.912 -3.323 0.979 1.00 0.00 H new ATOM 0 HA LEU A 81 134.104 -5.451 0.591 1.00 0.00 H new ATOM 0 HB2 LEU A 81 134.814 -2.895 -0.887 1.00 0.00 H new ATOM 0 HB3 LEU A 81 133.671 -4.021 -1.594 1.00 0.00 H new ATOM 0 HG LEU A 81 132.347 -3.969 0.566 1.00 0.00 H new ATOM 0 HD11 LEU A 81 132.860 -2.154 2.174 1.00 0.00 H new ATOM 0 HD12 LEU A 81 134.219 -3.296 2.045 1.00 0.00 H new ATOM 0 HD13 LEU A 81 134.301 -1.719 1.225 1.00 0.00 H new ATOM 0 HD21 LEU A 81 131.414 -1.703 0.185 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.856 -1.269 -0.765 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.744 -2.525 -1.359 1.00 0.00 H new ATOM 1257 N THR A 82 136.703 -5.362 -1.412 1.00 0.00 N ATOM 1258 CA THR A 82 137.433 -6.127 -2.416 1.00 0.00 C ATOM 1259 C THR A 82 137.565 -7.585 -1.988 1.00 0.00 C ATOM 1260 O THR A 82 137.392 -8.498 -2.796 1.00 0.00 O ATOM 1261 CB THR A 82 138.826 -5.527 -2.623 1.00 0.00 C ATOM 1262 OG1 THR A 82 138.700 -4.160 -2.988 1.00 0.00 O ATOM 1263 CG2 THR A 82 139.552 -6.291 -3.730 1.00 0.00 C ATOM 0 H THR A 82 137.199 -4.545 -1.055 1.00 0.00 H new ATOM 0 HA THR A 82 136.876 -6.083 -3.352 1.00 0.00 H new ATOM 0 HB THR A 82 139.398 -5.604 -1.699 1.00 0.00 H new ATOM 0 HG1 THR A 82 138.613 -3.612 -2.180 1.00 0.00 H new ATOM 0 HG21 THR A 82 140.544 -5.863 -3.877 1.00 0.00 H new ATOM 0 HG22 THR A 82 139.647 -7.339 -3.447 1.00 0.00 H new ATOM 0 HG23 THR A 82 138.984 -6.216 -4.657 1.00 0.00 H new ATOM 1271 N VAL A 83 137.872 -7.798 -0.713 1.00 0.00 N ATOM 1272 CA VAL A 83 138.025 -9.149 -0.189 1.00 0.00 C ATOM 1273 C VAL A 83 136.696 -9.896 -0.236 1.00 0.00 C ATOM 1274 O VAL A 83 136.648 -11.079 -0.576 1.00 0.00 O ATOM 1275 CB VAL A 83 138.532 -9.097 1.252 1.00 0.00 C ATOM 1276 CG1 VAL A 83 138.660 -10.519 1.801 1.00 0.00 C ATOM 1277 CG2 VAL A 83 139.901 -8.414 1.286 1.00 0.00 C ATOM 0 H VAL A 83 138.019 -7.057 -0.027 1.00 0.00 H new ATOM 0 HA VAL A 83 138.749 -9.678 -0.809 1.00 0.00 H new ATOM 0 HB VAL A 83 137.828 -8.533 1.864 1.00 0.00 H new ATOM 0 HG11 VAL A 83 139.022 -10.481 2.829 1.00 0.00 H new ATOM 0 HG12 VAL A 83 137.686 -11.007 1.777 1.00 0.00 H new ATOM 0 HG13 VAL A 83 139.364 -11.083 1.189 1.00 0.00 H new ATOM 0 HG21 VAL A 83 140.263 -8.376 2.313 1.00 0.00 H new ATOM 0 HG22 VAL A 83 140.604 -8.978 0.673 1.00 0.00 H new ATOM 0 HG23 VAL A 83 139.812 -7.400 0.895 1.00 0.00 H new ATOM 1287 N ALA A 84 135.618 -9.200 0.110 1.00 0.00 N ATOM 1288 CA ALA A 84 134.293 -9.808 0.104 1.00 0.00 C ATOM 1289 C ALA A 84 133.966 -10.365 -1.277 1.00 0.00 C ATOM 1290 O ALA A 84 133.446 -11.474 -1.403 1.00 0.00 O ATOM 1291 CB ALA A 84 133.241 -8.771 0.501 1.00 0.00 C ATOM 0 H ALA A 84 135.635 -8.221 0.396 1.00 0.00 H new ATOM 0 HA ALA A 84 134.286 -10.626 0.824 1.00 0.00 H new ATOM 0 HB1 ALA A 84 132.254 -9.233 0.494 1.00 0.00 H new ATOM 0 HB2 ALA A 84 133.459 -8.396 1.501 1.00 0.00 H new ATOM 0 HB3 ALA A 84 133.259 -7.944 -0.209 1.00 0.00 H new ATOM 1297 N CYS A 85 134.274 -9.588 -2.311 1.00 0.00 N ATOM 1298 CA CYS A 85 134.009 -10.014 -3.680 1.00 0.00 C ATOM 1299 C CYS A 85 134.960 -11.137 -4.086 1.00 0.00 C ATOM 1300 O CYS A 85 134.633 -11.961 -4.939 1.00 0.00 O ATOM 1301 CB CYS A 85 134.174 -8.831 -4.636 1.00 0.00 C ATOM 1302 SG CYS A 85 133.229 -7.418 -4.015 1.00 0.00 S ATOM 0 H CYS A 85 134.704 -8.667 -2.228 1.00 0.00 H new ATOM 0 HA CYS A 85 132.985 -10.384 -3.734 1.00 0.00 H new ATOM 0 HB2 CYS A 85 135.228 -8.566 -4.726 1.00 0.00 H new ATOM 0 HB3 CYS A 85 133.828 -9.104 -5.633 1.00 0.00 H new ATOM 0 HG CYS A 85 133.781 -6.972 -2.926 1.00 0.00 H new ATOM 1308 N ASN A 86 136.137 -11.160 -3.469 1.00 0.00 N ATOM 1309 CA ASN A 86 137.128 -12.186 -3.774 1.00 0.00 C ATOM 1310 C ASN A 86 136.941 -13.399 -2.869 1.00 0.00 C ATOM 1311 O ASN A 86 136.591 -13.261 -1.696 1.00 0.00 O ATOM 1312 CB ASN A 86 138.537 -11.621 -3.592 1.00 0.00 C ATOM 1313 CG ASN A 86 138.917 -10.767 -4.796 1.00 0.00 C ATOM 1314 OD1 ASN A 86 138.263 -9.762 -5.077 1.00 0.00 O ATOM 1315 ND2 ASN A 86 139.942 -11.107 -5.530 1.00 0.00 N ATOM 0 H ASN A 86 136.427 -10.486 -2.760 1.00 0.00 H new ATOM 0 HA ASN A 86 136.994 -12.498 -4.810 1.00 0.00 H new ATOM 0 HB2 ASN A 86 138.583 -11.022 -2.682 1.00 0.00 H new ATOM 0 HB3 ASN A 86 139.252 -12.435 -3.474 1.00 0.00 H new ATOM 0 HD21 ASN A 86 140.202 -10.540 -6.337 1.00 0.00 H new ATOM 0 HD22 ASN A 86 140.483 -11.940 -5.296 1.00 0.00 H new ATOM 1460 N GLU B 3 137.749 3.127 -13.837 1.00 0.00 N ATOM 1461 CA GLU B 3 139.171 2.912 -13.597 1.00 0.00 C ATOM 1462 C GLU B 3 139.397 2.353 -12.196 1.00 0.00 C ATOM 1463 O GLU B 3 140.319 1.568 -11.973 1.00 0.00 O ATOM 1464 CB GLU B 3 139.932 4.230 -13.754 1.00 0.00 C ATOM 1465 CG GLU B 3 139.833 4.708 -15.204 1.00 0.00 C ATOM 1466 CD GLU B 3 140.519 3.710 -16.131 1.00 0.00 C ATOM 1467 OE1 GLU B 3 141.306 2.919 -15.638 1.00 0.00 O ATOM 1468 OE2 GLU B 3 140.247 3.752 -17.320 1.00 0.00 O ATOM 0 HA GLU B 3 139.541 2.192 -14.327 1.00 0.00 H new ATOM 0 HB2 GLU B 3 139.519 4.983 -13.083 1.00 0.00 H new ATOM 0 HB3 GLU B 3 140.977 4.094 -13.475 1.00 0.00 H new ATOM 0 HG2 GLU B 3 138.787 4.820 -15.488 1.00 0.00 H new ATOM 0 HG3 GLU B 3 140.298 5.689 -15.305 1.00 0.00 H new ATOM 1475 N LEU B 4 138.551 2.762 -11.257 1.00 0.00 N ATOM 1476 CA LEU B 4 138.668 2.295 -9.881 1.00 0.00 C ATOM 1477 C LEU B 4 138.838 0.779 -9.844 1.00 0.00 C ATOM 1478 O LEU B 4 139.864 0.271 -9.393 1.00 0.00 O ATOM 1479 CB LEU B 4 137.419 2.692 -9.088 1.00 0.00 C ATOM 1480 CG LEU B 4 137.593 2.301 -7.619 1.00 0.00 C ATOM 1481 CD1 LEU B 4 138.708 3.140 -6.988 1.00 0.00 C ATOM 1482 CD2 LEU B 4 136.281 2.554 -6.870 1.00 0.00 C ATOM 0 H LEU B 4 137.782 3.411 -11.422 1.00 0.00 H new ATOM 0 HA LEU B 4 139.546 2.758 -9.431 1.00 0.00 H new ATOM 0 HB2 LEU B 4 137.250 3.766 -9.171 1.00 0.00 H new ATOM 0 HB3 LEU B 4 136.541 2.198 -9.504 1.00 0.00 H new ATOM 0 HG LEU B 4 137.857 1.245 -7.555 1.00 0.00 H new ATOM 0 HD11 LEU B 4 138.828 2.858 -5.942 1.00 0.00 H new ATOM 0 HD12 LEU B 4 139.642 2.963 -7.521 1.00 0.00 H new ATOM 0 HD13 LEU B 4 138.448 4.197 -7.051 1.00 0.00 H new ATOM 0 HD21 LEU B 4 136.401 2.277 -5.823 1.00 0.00 H new ATOM 0 HD22 LEU B 4 136.021 3.610 -6.938 1.00 0.00 H new ATOM 0 HD23 LEU B 4 135.486 1.955 -7.315 1.00 0.00 H new ATOM 1494 N GLU B 5 137.826 0.064 -10.324 1.00 0.00 N ATOM 1495 CA GLU B 5 137.873 -1.393 -10.341 1.00 0.00 C ATOM 1496 C GLU B 5 139.178 -1.879 -10.965 1.00 0.00 C ATOM 1497 O GLU B 5 139.743 -2.887 -10.538 1.00 0.00 O ATOM 1498 CB GLU B 5 136.689 -1.943 -11.137 1.00 0.00 C ATOM 1499 CG GLU B 5 135.381 -1.460 -10.507 1.00 0.00 C ATOM 1500 CD GLU B 5 134.193 -1.962 -11.321 1.00 0.00 C ATOM 1501 OE1 GLU B 5 134.013 -1.482 -12.428 1.00 0.00 O ATOM 1502 OE2 GLU B 5 133.481 -2.819 -10.826 1.00 0.00 O ATOM 0 H GLU B 5 136.969 0.466 -10.704 1.00 0.00 H new ATOM 0 HA GLU B 5 137.819 -1.753 -9.313 1.00 0.00 H new ATOM 0 HB2 GLU B 5 136.749 -1.612 -12.174 1.00 0.00 H new ATOM 0 HB3 GLU B 5 136.719 -3.033 -11.148 1.00 0.00 H new ATOM 0 HG2 GLU B 5 135.307 -1.820 -9.481 1.00 0.00 H new ATOM 0 HG3 GLU B 5 135.369 -0.371 -10.464 1.00 0.00 H new ATOM 1509 N THR B 6 139.650 -1.158 -11.977 1.00 0.00 N ATOM 1510 CA THR B 6 140.889 -1.527 -12.653 1.00 0.00 C ATOM 1511 C THR B 6 142.087 -1.323 -11.729 1.00 0.00 C ATOM 1512 O THR B 6 143.045 -2.095 -11.760 1.00 0.00 O ATOM 1513 CB THR B 6 141.067 -0.683 -13.917 1.00 0.00 C ATOM 1514 OG1 THR B 6 139.855 -0.684 -14.659 1.00 0.00 O ATOM 1515 CG2 THR B 6 142.192 -1.270 -14.770 1.00 0.00 C ATOM 0 H THR B 6 139.198 -0.321 -12.345 1.00 0.00 H new ATOM 0 HA THR B 6 140.831 -2.581 -12.926 1.00 0.00 H new ATOM 0 HB THR B 6 141.322 0.340 -13.639 1.00 0.00 H new ATOM 0 HG1 THR B 6 139.966 -0.143 -15.468 1.00 0.00 H new ATOM 0 HG21 THR B 6 142.318 -0.668 -15.670 1.00 0.00 H new ATOM 0 HG22 THR B 6 143.121 -1.268 -14.199 1.00 0.00 H new ATOM 0 HG23 THR B 6 141.941 -2.293 -15.050 1.00 0.00 H new ATOM 1523 N ALA B 7 142.026 -0.277 -10.911 1.00 0.00 N ATOM 1524 CA ALA B 7 143.114 0.021 -9.986 1.00 0.00 C ATOM 1525 C ALA B 7 143.251 -1.083 -8.942 1.00 0.00 C ATOM 1526 O ALA B 7 144.339 -1.617 -8.728 1.00 0.00 O ATOM 1527 CB ALA B 7 142.853 1.356 -9.286 1.00 0.00 C ATOM 0 H ALA B 7 141.242 0.374 -10.869 1.00 0.00 H new ATOM 0 HA ALA B 7 144.041 0.083 -10.556 1.00 0.00 H new ATOM 0 HB1 ALA B 7 143.670 1.571 -8.597 1.00 0.00 H new ATOM 0 HB2 ALA B 7 142.787 2.150 -10.030 1.00 0.00 H new ATOM 0 HB3 ALA B 7 141.916 1.299 -8.732 1.00 0.00 H new ATOM 1533 N MET B 8 142.142 -1.419 -8.293 1.00 0.00 N ATOM 1534 CA MET B 8 142.152 -2.461 -7.271 1.00 0.00 C ATOM 1535 C MET B 8 142.777 -3.741 -7.814 1.00 0.00 C ATOM 1536 O MET B 8 143.456 -4.468 -7.089 1.00 0.00 O ATOM 1537 CB MET B 8 140.724 -2.748 -6.804 1.00 0.00 C ATOM 1538 CG MET B 8 140.017 -1.430 -6.477 1.00 0.00 C ATOM 1539 SD MET B 8 141.022 -0.476 -5.312 1.00 0.00 S ATOM 1540 CE MET B 8 141.069 -1.711 -3.989 1.00 0.00 C ATOM 0 H MET B 8 141.231 -0.989 -8.454 1.00 0.00 H new ATOM 0 HA MET B 8 142.747 -2.109 -6.428 1.00 0.00 H new ATOM 0 HB2 MET B 8 140.177 -3.283 -7.580 1.00 0.00 H new ATOM 0 HB3 MET B 8 140.740 -3.392 -5.925 1.00 0.00 H new ATOM 0 HG2 MET B 8 139.856 -0.856 -7.389 1.00 0.00 H new ATOM 0 HG3 MET B 8 139.035 -1.629 -6.048 1.00 0.00 H new ATOM 0 HE1 MET B 8 141.236 -1.214 -3.033 1.00 0.00 H new ATOM 0 HE2 MET B 8 140.121 -2.248 -3.958 1.00 0.00 H new ATOM 0 HE3 MET B 8 141.879 -2.416 -4.178 1.00 0.00 H new ATOM 1550 N GLU B 9 142.543 -4.013 -9.094 1.00 0.00 N ATOM 1551 CA GLU B 9 143.089 -5.210 -9.722 1.00 0.00 C ATOM 1552 C GLU B 9 144.611 -5.126 -9.806 1.00 0.00 C ATOM 1553 O GLU B 9 145.305 -6.137 -9.693 1.00 0.00 O ATOM 1554 CB GLU B 9 142.505 -5.376 -11.126 1.00 0.00 C ATOM 1555 CG GLU B 9 141.030 -5.769 -11.025 1.00 0.00 C ATOM 1556 CD GLU B 9 140.901 -7.157 -10.407 1.00 0.00 C ATOM 1557 OE1 GLU B 9 141.668 -8.026 -10.786 1.00 0.00 O ATOM 1558 OE2 GLU B 9 140.036 -7.330 -9.563 1.00 0.00 O ATOM 0 H GLU B 9 141.983 -3.426 -9.712 1.00 0.00 H new ATOM 0 HA GLU B 9 142.819 -6.073 -9.113 1.00 0.00 H new ATOM 0 HB2 GLU B 9 142.607 -4.446 -11.685 1.00 0.00 H new ATOM 0 HB3 GLU B 9 143.058 -6.139 -11.673 1.00 0.00 H new ATOM 0 HG2 GLU B 9 140.492 -5.041 -10.419 1.00 0.00 H new ATOM 0 HG3 GLU B 9 140.574 -5.759 -12.015 1.00 0.00 H new ATOM 1565 N THR B 10 145.122 -3.915 -10.006 1.00 0.00 N ATOM 1566 CA THR B 10 146.563 -3.713 -10.104 1.00 0.00 C ATOM 1567 C THR B 10 147.243 -4.039 -8.779 1.00 0.00 C ATOM 1568 O THR B 10 148.307 -4.657 -8.751 1.00 0.00 O ATOM 1569 CB THR B 10 146.862 -2.261 -10.490 1.00 0.00 C ATOM 1570 OG1 THR B 10 146.387 -2.016 -11.807 1.00 0.00 O ATOM 1571 CG2 THR B 10 148.371 -2.016 -10.434 1.00 0.00 C ATOM 0 H THR B 10 144.565 -3.066 -10.103 1.00 0.00 H new ATOM 0 HA THR B 10 146.952 -4.381 -10.872 1.00 0.00 H new ATOM 0 HB THR B 10 146.362 -1.588 -9.793 1.00 0.00 H new ATOM 0 HG1 THR B 10 145.407 -2.038 -11.811 1.00 0.00 H new ATOM 0 HG21 THR B 10 148.582 -0.983 -10.709 1.00 0.00 H new ATOM 0 HG22 THR B 10 148.733 -2.204 -9.423 1.00 0.00 H new ATOM 0 HG23 THR B 10 148.875 -2.687 -11.130 1.00 0.00 H new ATOM 1579 N LEU B 11 146.623 -3.618 -7.681 1.00 0.00 N ATOM 1580 CA LEU B 11 147.179 -3.870 -6.357 1.00 0.00 C ATOM 1581 C LEU B 11 147.288 -5.369 -6.095 1.00 0.00 C ATOM 1582 O LEU B 11 148.255 -5.835 -5.494 1.00 0.00 O ATOM 1583 CB LEU B 11 146.293 -3.224 -5.288 1.00 0.00 C ATOM 1584 CG LEU B 11 146.496 -1.704 -5.297 1.00 0.00 C ATOM 1585 CD1 LEU B 11 145.228 -1.013 -4.796 1.00 0.00 C ATOM 1586 CD2 LEU B 11 147.667 -1.338 -4.380 1.00 0.00 C ATOM 0 H LEU B 11 145.742 -3.104 -7.681 1.00 0.00 H new ATOM 0 HA LEU B 11 148.177 -3.434 -6.314 1.00 0.00 H new ATOM 0 HB2 LEU B 11 145.246 -3.462 -5.477 1.00 0.00 H new ATOM 0 HB3 LEU B 11 146.539 -3.628 -4.306 1.00 0.00 H new ATOM 0 HG LEU B 11 146.711 -1.377 -6.314 1.00 0.00 H new ATOM 0 HD11 LEU B 11 145.375 0.067 -4.803 1.00 0.00 H new ATOM 0 HD12 LEU B 11 144.392 -1.270 -5.447 1.00 0.00 H new ATOM 0 HD13 LEU B 11 145.011 -1.343 -3.780 1.00 0.00 H new ATOM 0 HD21 LEU B 11 147.811 -0.258 -4.387 1.00 0.00 H new ATOM 0 HD22 LEU B 11 147.451 -1.669 -3.364 1.00 0.00 H new ATOM 0 HD23 LEU B 11 148.574 -1.827 -4.735 1.00 0.00 H new ATOM 1598 N ILE B 12 146.287 -6.119 -6.548 1.00 0.00 N ATOM 1599 CA ILE B 12 146.282 -7.565 -6.354 1.00 0.00 C ATOM 1600 C ILE B 12 147.323 -8.232 -7.246 1.00 0.00 C ATOM 1601 O ILE B 12 147.926 -9.237 -6.869 1.00 0.00 O ATOM 1602 CB ILE B 12 144.897 -8.128 -6.675 1.00 0.00 C ATOM 1603 CG1 ILE B 12 143.854 -7.459 -5.779 1.00 0.00 C ATOM 1604 CG2 ILE B 12 144.889 -9.638 -6.426 1.00 0.00 C ATOM 1605 CD1 ILE B 12 142.451 -7.831 -6.263 1.00 0.00 C ATOM 0 H ILE B 12 145.476 -5.753 -7.047 1.00 0.00 H new ATOM 0 HA ILE B 12 146.528 -7.773 -5.313 1.00 0.00 H new ATOM 0 HB ILE B 12 144.659 -7.931 -7.720 1.00 0.00 H new ATOM 0 HG12 ILE B 12 143.990 -7.777 -4.745 1.00 0.00 H new ATOM 0 HG13 ILE B 12 143.982 -6.377 -5.799 1.00 0.00 H new ATOM 0 HG21 ILE B 12 143.902 -10.039 -6.655 1.00 0.00 H new ATOM 0 HG22 ILE B 12 145.632 -10.116 -7.065 1.00 0.00 H new ATOM 0 HG23 ILE B 12 145.128 -9.836 -5.381 1.00 0.00 H new ATOM 0 HD11 ILE B 12 141.707 -7.354 -5.624 1.00 0.00 H new ATOM 0 HD12 ILE B 12 142.318 -7.491 -7.290 1.00 0.00 H new ATOM 0 HD13 ILE B 12 142.326 -8.913 -6.220 1.00 0.00 H new ATOM 1617 N ASN B 13 147.530 -7.668 -8.433 1.00 0.00 N ATOM 1618 CA ASN B 13 148.501 -8.220 -9.371 1.00 0.00 C ATOM 1619 C ASN B 13 149.892 -8.258 -8.748 1.00 0.00 C ATOM 1620 O ASN B 13 150.566 -9.287 -8.773 1.00 0.00 O ATOM 1621 CB ASN B 13 148.535 -7.374 -10.645 1.00 0.00 C ATOM 1622 CG ASN B 13 147.296 -7.653 -11.490 1.00 0.00 C ATOM 1623 OD1 ASN B 13 146.208 -7.856 -10.952 1.00 0.00 O ATOM 1624 ND2 ASN B 13 147.397 -7.675 -12.791 1.00 0.00 N ATOM 0 H ASN B 13 147.043 -6.836 -8.766 1.00 0.00 H new ATOM 0 HA ASN B 13 148.199 -9.238 -9.617 1.00 0.00 H new ATOM 0 HB2 ASN B 13 148.579 -6.316 -10.388 1.00 0.00 H new ATOM 0 HB3 ASN B 13 149.434 -7.600 -11.218 1.00 0.00 H new ATOM 0 HD21 ASN B 13 146.573 -7.861 -13.363 1.00 0.00 H new ATOM 0 HD22 ASN B 13 148.300 -7.507 -13.235 1.00 0.00 H new ATOM 1631 N VAL B 14 150.318 -7.128 -8.191 1.00 0.00 N ATOM 1632 CA VAL B 14 151.632 -7.043 -7.566 1.00 0.00 C ATOM 1633 C VAL B 14 151.688 -7.910 -6.311 1.00 0.00 C ATOM 1634 O VAL B 14 152.674 -8.606 -6.070 1.00 0.00 O ATOM 1635 CB VAL B 14 151.944 -5.592 -7.199 1.00 0.00 C ATOM 1636 CG1 VAL B 14 153.311 -5.520 -6.516 1.00 0.00 C ATOM 1637 CG2 VAL B 14 151.965 -4.739 -8.468 1.00 0.00 C ATOM 0 H VAL B 14 149.776 -6.265 -8.160 1.00 0.00 H new ATOM 0 HA VAL B 14 152.374 -7.405 -8.277 1.00 0.00 H new ATOM 0 HB VAL B 14 151.178 -5.217 -6.520 1.00 0.00 H new ATOM 0 HG11 VAL B 14 153.533 -4.485 -6.255 1.00 0.00 H new ATOM 0 HG12 VAL B 14 153.298 -6.128 -5.612 1.00 0.00 H new ATOM 0 HG13 VAL B 14 154.077 -5.895 -7.195 1.00 0.00 H new ATOM 0 HG21 VAL B 14 152.187 -3.704 -8.207 1.00 0.00 H new ATOM 0 HG22 VAL B 14 152.731 -5.115 -9.146 1.00 0.00 H new ATOM 0 HG23 VAL B 14 150.992 -4.789 -8.956 1.00 0.00 H new ATOM 1647 N PHE B 15 150.624 -7.860 -5.516 1.00 0.00 N ATOM 1648 CA PHE B 15 150.564 -8.644 -4.287 1.00 0.00 C ATOM 1649 C PHE B 15 150.712 -10.132 -4.589 1.00 0.00 C ATOM 1650 O PHE B 15 151.417 -10.851 -3.880 1.00 0.00 O ATOM 1651 CB PHE B 15 149.233 -8.395 -3.576 1.00 0.00 C ATOM 1652 CG PHE B 15 149.211 -9.146 -2.266 1.00 0.00 C ATOM 1653 CD1 PHE B 15 150.049 -8.748 -1.217 1.00 0.00 C ATOM 1654 CD2 PHE B 15 148.352 -10.239 -2.101 1.00 0.00 C ATOM 1655 CE1 PHE B 15 150.028 -9.443 -0.003 1.00 0.00 C ATOM 1656 CE2 PHE B 15 148.332 -10.934 -0.885 1.00 0.00 C ATOM 1657 CZ PHE B 15 149.169 -10.537 0.163 1.00 0.00 C ATOM 0 H PHE B 15 149.798 -7.290 -5.698 1.00 0.00 H new ATOM 0 HA PHE B 15 151.386 -8.335 -3.641 1.00 0.00 H new ATOM 0 HB2 PHE B 15 149.098 -7.328 -3.398 1.00 0.00 H new ATOM 0 HB3 PHE B 15 148.406 -8.720 -4.207 1.00 0.00 H new ATOM 0 HD1 PHE B 15 150.711 -7.905 -1.345 1.00 0.00 H new ATOM 0 HD2 PHE B 15 147.706 -10.546 -2.910 1.00 0.00 H new ATOM 0 HE1 PHE B 15 150.674 -9.136 0.806 1.00 0.00 H new ATOM 0 HE2 PHE B 15 147.670 -11.777 -0.756 1.00 0.00 H new ATOM 0 HZ PHE B 15 149.153 -11.074 1.100 1.00 0.00 H new ATOM 1667 N HIS B 16 150.042 -10.588 -5.642 1.00 0.00 N ATOM 1668 CA HIS B 16 150.107 -11.993 -6.026 1.00 0.00 C ATOM 1669 C HIS B 16 151.525 -12.376 -6.436 1.00 0.00 C ATOM 1670 O HIS B 16 151.912 -13.542 -6.356 1.00 0.00 O ATOM 1671 CB HIS B 16 149.147 -12.262 -7.187 1.00 0.00 C ATOM 1672 CG HIS B 16 149.124 -13.736 -7.487 1.00 0.00 C ATOM 1673 ND1 HIS B 16 149.576 -14.250 -8.692 1.00 0.00 N ATOM 1674 CD2 HIS B 16 148.708 -14.816 -6.750 1.00 0.00 C ATOM 1675 CE1 HIS B 16 149.422 -15.587 -8.645 1.00 0.00 C ATOM 1676 NE2 HIS B 16 148.897 -15.984 -7.483 1.00 0.00 N ATOM 0 H HIS B 16 149.452 -10.010 -6.241 1.00 0.00 H new ATOM 0 HA HIS B 16 149.817 -12.597 -5.166 1.00 0.00 H new ATOM 0 HB2 HIS B 16 148.145 -11.916 -6.932 1.00 0.00 H new ATOM 0 HB3 HIS B 16 149.462 -11.705 -8.070 1.00 0.00 H new ATOM 0 HD2 HIS B 16 148.296 -14.767 -5.753 1.00 0.00 H new ATOM 0 HE1 HIS B 16 149.690 -16.256 -9.449 1.00 0.00 H new ATOM 0 HE2 HIS B 16 148.681 -16.938 -7.195 1.00 0.00 H new ATOM 1685 N ALA B 17 152.295 -11.387 -6.878 1.00 0.00 N ATOM 1686 CA ALA B 17 153.669 -11.632 -7.301 1.00 0.00 C ATOM 1687 C ALA B 17 154.530 -12.068 -6.119 1.00 0.00 C ATOM 1688 O ALA B 17 155.280 -13.040 -6.212 1.00 0.00 O ATOM 1689 CB ALA B 17 154.258 -10.363 -7.922 1.00 0.00 C ATOM 0 H ALA B 17 151.994 -10.415 -6.952 1.00 0.00 H new ATOM 0 HA ALA B 17 153.661 -12.432 -8.042 1.00 0.00 H new ATOM 0 HB1 ALA B 17 155.284 -10.554 -8.235 1.00 0.00 H new ATOM 0 HB2 ALA B 17 153.663 -10.071 -8.787 1.00 0.00 H new ATOM 0 HB3 ALA B 17 154.247 -9.559 -7.186 1.00 0.00 H new ATOM 1695 N HIS B 18 154.419 -11.343 -5.011 1.00 0.00 N ATOM 1696 CA HIS B 18 155.196 -11.665 -3.819 1.00 0.00 C ATOM 1697 C HIS B 18 154.513 -12.765 -3.011 1.00 0.00 C ATOM 1698 O HIS B 18 155.178 -13.591 -2.386 1.00 0.00 O ATOM 1699 CB HIS B 18 155.360 -10.417 -2.950 1.00 0.00 C ATOM 1700 CG HIS B 18 156.346 -9.484 -3.598 1.00 0.00 C ATOM 1701 ND1 HIS B 18 157.698 -9.510 -3.293 1.00 0.00 N ATOM 1702 CD2 HIS B 18 156.192 -8.495 -4.538 1.00 0.00 C ATOM 1703 CE1 HIS B 18 158.300 -8.565 -4.038 1.00 0.00 C ATOM 1704 NE2 HIS B 18 157.427 -7.917 -4.815 1.00 0.00 N ATOM 0 H HIS B 18 153.804 -10.535 -4.913 1.00 0.00 H new ATOM 0 HA HIS B 18 156.177 -12.020 -4.134 1.00 0.00 H new ATOM 0 HB2 HIS B 18 154.399 -9.918 -2.825 1.00 0.00 H new ATOM 0 HB3 HIS B 18 155.706 -10.696 -1.955 1.00 0.00 H new ATOM 0 HD2 HIS B 18 155.255 -8.209 -4.993 1.00 0.00 H new ATOM 0 HE1 HIS B 18 159.359 -8.356 -4.011 1.00 0.00 H new ATOM 0 HE2 HIS B 18 157.624 -7.161 -5.471 1.00 0.00 H new ATOM 1713 N SER B 19 153.185 -12.769 -3.029 1.00 0.00 N ATOM 1714 CA SER B 19 152.426 -13.773 -2.293 1.00 0.00 C ATOM 1715 C SER B 19 152.798 -15.176 -2.764 1.00 0.00 C ATOM 1716 O SER B 19 152.657 -16.148 -2.022 1.00 0.00 O ATOM 1717 CB SER B 19 150.928 -13.546 -2.492 1.00 0.00 C ATOM 1718 OG SER B 19 150.208 -14.271 -1.503 1.00 0.00 O ATOM 0 H SER B 19 152.616 -12.095 -3.540 1.00 0.00 H new ATOM 0 HA SER B 19 152.668 -13.681 -1.234 1.00 0.00 H new ATOM 0 HB2 SER B 19 150.697 -12.483 -2.421 1.00 0.00 H new ATOM 0 HB3 SER B 19 150.628 -13.871 -3.488 1.00 0.00 H new ATOM 0 HG SER B 19 149.247 -14.127 -1.627 1.00 0.00 H new ATOM 1852 N LEU B 28 151.202 -12.907 3.950 1.00 0.00 N ATOM 1853 CA LEU B 28 152.467 -12.211 3.729 1.00 0.00 C ATOM 1854 C LEU B 28 153.167 -11.946 5.060 1.00 0.00 C ATOM 1855 O LEU B 28 152.657 -11.213 5.906 1.00 0.00 O ATOM 1856 CB LEU B 28 152.207 -10.885 3.004 1.00 0.00 C ATOM 1857 CG LEU B 28 153.426 -10.501 2.155 1.00 0.00 C ATOM 1858 CD1 LEU B 28 154.682 -10.511 3.029 1.00 0.00 C ATOM 1859 CD2 LEU B 28 153.595 -11.495 0.993 1.00 0.00 C ATOM 0 HA LEU B 28 153.112 -12.839 3.114 1.00 0.00 H new ATOM 0 HB2 LEU B 28 151.326 -10.975 2.369 1.00 0.00 H new ATOM 0 HB3 LEU B 28 151.998 -10.099 3.730 1.00 0.00 H new ATOM 0 HG LEU B 28 153.275 -9.502 1.746 1.00 0.00 H new ATOM 0 HD11 LEU B 28 155.548 -10.238 2.425 1.00 0.00 H new ATOM 0 HD12 LEU B 28 154.566 -9.794 3.841 1.00 0.00 H new ATOM 0 HD13 LEU B 28 154.829 -11.508 3.444 1.00 0.00 H new ATOM 0 HD21 LEU B 28 154.463 -11.213 0.397 1.00 0.00 H new ATOM 0 HD22 LEU B 28 153.739 -12.499 1.391 1.00 0.00 H new ATOM 0 HD23 LEU B 28 152.703 -11.477 0.367 1.00 0.00 H new ATOM 1871 N SER B 29 154.337 -12.554 5.239 1.00 0.00 N ATOM 1872 CA SER B 29 155.098 -12.382 6.473 1.00 0.00 C ATOM 1873 C SER B 29 155.464 -10.915 6.686 1.00 0.00 C ATOM 1874 O SER B 29 155.887 -10.229 5.757 1.00 0.00 O ATOM 1875 CB SER B 29 156.372 -13.223 6.420 1.00 0.00 C ATOM 1876 OG SER B 29 157.151 -12.969 7.583 1.00 0.00 O ATOM 0 H SER B 29 154.776 -13.166 4.551 1.00 0.00 H new ATOM 0 HA SER B 29 154.477 -12.711 7.306 1.00 0.00 H new ATOM 0 HB2 SER B 29 156.120 -14.282 6.361 1.00 0.00 H new ATOM 0 HB3 SER B 29 156.945 -12.981 5.525 1.00 0.00 H new ATOM 0 HG SER B 29 157.969 -13.508 7.553 1.00 0.00 H new ATOM 1882 N LYS B 30 155.298 -10.443 7.918 1.00 0.00 N ATOM 1883 CA LYS B 30 155.615 -9.057 8.245 1.00 0.00 C ATOM 1884 C LYS B 30 157.068 -8.743 7.901 1.00 0.00 C ATOM 1885 O LYS B 30 157.364 -7.708 7.304 1.00 0.00 O ATOM 1886 CB LYS B 30 155.376 -8.801 9.734 1.00 0.00 C ATOM 1887 CG LYS B 30 153.871 -8.774 10.013 1.00 0.00 C ATOM 1888 CD LYS B 30 153.630 -8.380 11.471 1.00 0.00 C ATOM 1889 CE LYS B 30 152.127 -8.245 11.721 1.00 0.00 C ATOM 1890 NZ LYS B 30 151.476 -9.577 11.568 1.00 0.00 N ATOM 0 H LYS B 30 154.948 -10.995 8.701 1.00 0.00 H new ATOM 0 HA LYS B 30 154.965 -8.409 7.657 1.00 0.00 H new ATOM 0 HB2 LYS B 30 155.853 -9.580 10.329 1.00 0.00 H new ATOM 0 HB3 LYS B 30 155.828 -7.854 10.028 1.00 0.00 H new ATOM 0 HG2 LYS B 30 153.380 -8.064 9.347 1.00 0.00 H new ATOM 0 HG3 LYS B 30 153.436 -9.753 9.813 1.00 0.00 H new ATOM 0 HD2 LYS B 30 154.054 -9.132 12.137 1.00 0.00 H new ATOM 0 HD3 LYS B 30 154.132 -7.438 11.692 1.00 0.00 H new ATOM 0 HE2 LYS B 30 151.948 -7.854 12.722 1.00 0.00 H new ATOM 0 HE3 LYS B 30 151.693 -7.533 11.018 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 150.582 -9.469 11.047 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 152.108 -10.214 11.042 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 151.283 -9.979 12.508 1.00 0.00 H new ATOM 1904 N LYS B 31 157.970 -9.642 8.280 1.00 0.00 N ATOM 1905 CA LYS B 31 159.388 -9.448 8.004 1.00 0.00 C ATOM 1906 C LYS B 31 159.614 -9.218 6.513 1.00 0.00 C ATOM 1907 O LYS B 31 160.342 -8.308 6.120 1.00 0.00 O ATOM 1908 CB LYS B 31 160.182 -10.673 8.461 1.00 0.00 C ATOM 1909 CG LYS B 31 161.679 -10.372 8.375 1.00 0.00 C ATOM 1910 CD LYS B 31 162.475 -11.615 8.777 1.00 0.00 C ATOM 1911 CE LYS B 31 163.964 -11.272 8.836 1.00 0.00 C ATOM 1912 NZ LYS B 31 164.456 -10.964 7.463 1.00 0.00 N ATOM 0 H LYS B 31 157.747 -10.505 8.775 1.00 0.00 H new ATOM 0 HA LYS B 31 159.730 -8.570 8.552 1.00 0.00 H new ATOM 0 HB2 LYS B 31 159.911 -10.934 9.484 1.00 0.00 H new ATOM 0 HB3 LYS B 31 159.937 -11.532 7.837 1.00 0.00 H new ATOM 0 HG2 LYS B 31 161.942 -10.071 7.361 1.00 0.00 H new ATOM 0 HG3 LYS B 31 161.931 -9.538 9.030 1.00 0.00 H new ATOM 0 HD2 LYS B 31 162.136 -11.978 9.747 1.00 0.00 H new ATOM 0 HD3 LYS B 31 162.304 -12.417 8.059 1.00 0.00 H new ATOM 0 HE2 LYS B 31 164.126 -10.417 9.492 1.00 0.00 H new ATOM 0 HE3 LYS B 31 164.524 -12.107 9.256 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 165.495 -10.931 7.466 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 164.135 -11.703 6.805 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 164.081 -10.043 7.158 1.00 0.00 H new ATOM 1926 N GLN B 32 158.981 -10.048 5.691 1.00 0.00 N ATOM 1927 CA GLN B 32 159.117 -9.924 4.245 1.00 0.00 C ATOM 1928 C GLN B 32 158.365 -8.695 3.743 1.00 0.00 C ATOM 1929 O GLN B 32 158.758 -8.075 2.755 1.00 0.00 O ATOM 1930 CB GLN B 32 158.568 -11.177 3.560 1.00 0.00 C ATOM 1931 CG GLN B 32 159.373 -12.398 4.006 1.00 0.00 C ATOM 1932 CD GLN B 32 160.780 -12.337 3.421 1.00 0.00 C ATOM 1933 OE1 GLN B 32 160.974 -11.817 2.323 1.00 0.00 O ATOM 1934 NE2 GLN B 32 161.779 -12.841 4.093 1.00 0.00 N ATOM 0 H GLN B 32 158.374 -10.808 5.998 1.00 0.00 H new ATOM 0 HA GLN B 32 160.174 -9.814 4.004 1.00 0.00 H new ATOM 0 HB2 GLN B 32 157.516 -11.310 3.812 1.00 0.00 H new ATOM 0 HB3 GLN B 32 158.625 -11.067 2.477 1.00 0.00 H new ATOM 0 HG2 GLN B 32 159.424 -12.433 5.094 1.00 0.00 H new ATOM 0 HG3 GLN B 32 158.874 -13.311 3.681 1.00 0.00 H new ATOM 0 HE21 GLN B 32 161.616 -13.272 5.003 1.00 0.00 H new ATOM 0 HE22 GLN B 32 162.723 -12.804 3.708 1.00 0.00 H new ATOM 1943 N LEU B 33 157.281 -8.351 4.432 1.00 0.00 N ATOM 1944 CA LEU B 33 156.480 -7.195 4.049 1.00 0.00 C ATOM 1945 C LEU B 33 157.333 -5.930 4.038 1.00 0.00 C ATOM 1946 O LEU B 33 157.091 -5.012 3.255 1.00 0.00 O ATOM 1947 CB LEU B 33 155.313 -7.021 5.025 1.00 0.00 C ATOM 1948 CG LEU B 33 154.415 -5.870 4.560 1.00 0.00 C ATOM 1949 CD1 LEU B 33 153.740 -6.243 3.237 1.00 0.00 C ATOM 1950 CD2 LEU B 33 153.344 -5.606 5.621 1.00 0.00 C ATOM 0 H LEU B 33 156.940 -8.852 5.252 1.00 0.00 H new ATOM 0 HA LEU B 33 156.090 -7.363 3.045 1.00 0.00 H new ATOM 0 HB2 LEU B 33 154.736 -7.944 5.084 1.00 0.00 H new ATOM 0 HB3 LEU B 33 155.692 -6.817 6.027 1.00 0.00 H new ATOM 0 HG LEU B 33 155.019 -4.974 4.415 1.00 0.00 H new ATOM 0 HD11 LEU B 33 153.102 -5.422 2.910 1.00 0.00 H new ATOM 0 HD12 LEU B 33 154.502 -6.434 2.481 1.00 0.00 H new ATOM 0 HD13 LEU B 33 153.135 -7.139 3.377 1.00 0.00 H new ATOM 0 HD21 LEU B 33 152.702 -4.788 5.295 1.00 0.00 H new ATOM 0 HD22 LEU B 33 152.743 -6.504 5.762 1.00 0.00 H new ATOM 0 HD23 LEU B 33 153.823 -5.338 6.563 1.00 0.00 H new ATOM 1962 N LYS B 34 158.331 -5.889 4.916 1.00 0.00 N ATOM 1963 CA LYS B 34 159.213 -4.733 5.004 1.00 0.00 C ATOM 1964 C LYS B 34 159.946 -4.507 3.685 1.00 0.00 C ATOM 1965 O LYS B 34 160.081 -3.373 3.225 1.00 0.00 O ATOM 1966 CB LYS B 34 160.230 -4.944 6.129 1.00 0.00 C ATOM 1967 CG LYS B 34 161.319 -3.874 6.047 1.00 0.00 C ATOM 1968 CD LYS B 34 162.169 -3.912 7.319 1.00 0.00 C ATOM 1969 CE LYS B 34 163.072 -2.678 7.367 1.00 0.00 C ATOM 1970 NZ LYS B 34 163.721 -2.589 8.705 1.00 0.00 N ATOM 0 H LYS B 34 158.547 -6.639 5.573 1.00 0.00 H new ATOM 0 HA LYS B 34 158.607 -3.853 5.218 1.00 0.00 H new ATOM 0 HB2 LYS B 34 159.731 -4.895 7.097 1.00 0.00 H new ATOM 0 HB3 LYS B 34 160.675 -5.936 6.049 1.00 0.00 H new ATOM 0 HG2 LYS B 34 161.947 -4.045 5.172 1.00 0.00 H new ATOM 0 HG3 LYS B 34 160.868 -2.889 5.928 1.00 0.00 H new ATOM 0 HD2 LYS B 34 161.525 -3.939 8.198 1.00 0.00 H new ATOM 0 HD3 LYS B 34 162.773 -4.819 7.338 1.00 0.00 H new ATOM 0 HE2 LYS B 34 163.830 -2.739 6.586 1.00 0.00 H new ATOM 0 HE3 LYS B 34 162.487 -1.779 7.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 164.335 -1.750 8.738 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 162.990 -2.512 9.441 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 164.292 -3.442 8.872 1.00 0.00 H new ATOM 1984 N GLU B 35 160.419 -5.593 3.082 1.00 0.00 N ATOM 1985 CA GLU B 35 161.141 -5.500 1.817 1.00 0.00 C ATOM 1986 C GLU B 35 160.175 -5.268 0.657 1.00 0.00 C ATOM 1987 O GLU B 35 160.557 -4.726 -0.380 1.00 0.00 O ATOM 1988 CB GLU B 35 161.932 -6.786 1.574 1.00 0.00 C ATOM 1989 CG GLU B 35 163.063 -6.891 2.600 1.00 0.00 C ATOM 1990 CD GLU B 35 162.500 -7.294 3.958 1.00 0.00 C ATOM 1991 OE1 GLU B 35 161.374 -7.762 3.994 1.00 0.00 O ATOM 1992 OE2 GLU B 35 163.202 -7.131 4.942 1.00 0.00 O ATOM 0 H GLU B 35 160.317 -6.541 3.445 1.00 0.00 H new ATOM 0 HA GLU B 35 161.826 -4.654 1.875 1.00 0.00 H new ATOM 0 HB2 GLU B 35 161.274 -7.651 1.653 1.00 0.00 H new ATOM 0 HB3 GLU B 35 162.342 -6.788 0.564 1.00 0.00 H new ATOM 0 HG2 GLU B 35 163.798 -7.625 2.269 1.00 0.00 H new ATOM 0 HG3 GLU B 35 163.581 -5.936 2.681 1.00 0.00 H new ATOM 1999 N LEU B 36 158.929 -5.687 0.838 1.00 0.00 N ATOM 2000 CA LEU B 36 157.916 -5.527 -0.201 1.00 0.00 C ATOM 2001 C LEU B 36 157.381 -4.098 -0.228 1.00 0.00 C ATOM 2002 O LEU B 36 157.019 -3.581 -1.285 1.00 0.00 O ATOM 2003 CB LEU B 36 156.761 -6.500 0.050 1.00 0.00 C ATOM 2004 CG LEU B 36 155.642 -6.255 -0.965 1.00 0.00 C ATOM 2005 CD1 LEU B 36 156.205 -6.339 -2.384 1.00 0.00 C ATOM 2006 CD2 LEU B 36 154.556 -7.320 -0.787 1.00 0.00 C ATOM 0 H LEU B 36 158.595 -6.138 1.690 1.00 0.00 H new ATOM 0 HA LEU B 36 158.378 -5.742 -1.165 1.00 0.00 H new ATOM 0 HB2 LEU B 36 157.116 -7.527 -0.029 1.00 0.00 H new ATOM 0 HB3 LEU B 36 156.379 -6.371 1.063 1.00 0.00 H new ATOM 0 HG LEU B 36 155.217 -5.264 -0.803 1.00 0.00 H new ATOM 0 HD11 LEU B 36 155.405 -6.164 -3.104 1.00 0.00 H new ATOM 0 HD12 LEU B 36 156.981 -5.584 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU B 36 156.631 -7.329 -2.548 1.00 0.00 H new ATOM 0 HD21 LEU B 36 153.757 -7.149 -1.508 1.00 0.00 H new ATOM 0 HD22 LEU B 36 154.986 -8.309 -0.949 1.00 0.00 H new ATOM 0 HD23 LEU B 36 154.151 -7.262 0.223 1.00 0.00 H new ATOM 2018 N LEU B 37 157.320 -3.469 0.940 1.00 0.00 N ATOM 2019 CA LEU B 37 156.811 -2.105 1.034 1.00 0.00 C ATOM 2020 C LEU B 37 157.853 -1.093 0.562 1.00 0.00 C ATOM 2021 O LEU B 37 157.522 -0.121 -0.115 1.00 0.00 O ATOM 2022 CB LEU B 37 156.413 -1.798 2.482 1.00 0.00 C ATOM 2023 CG LEU B 37 155.283 -0.764 2.501 1.00 0.00 C ATOM 2024 CD1 LEU B 37 153.935 -1.476 2.372 1.00 0.00 C ATOM 2025 CD2 LEU B 37 155.323 0.015 3.818 1.00 0.00 C ATOM 0 H LEU B 37 157.614 -3.877 1.828 1.00 0.00 H new ATOM 0 HA LEU B 37 155.937 -2.023 0.387 1.00 0.00 H new ATOM 0 HB2 LEU B 37 156.091 -2.712 2.982 1.00 0.00 H new ATOM 0 HB3 LEU B 37 157.274 -1.420 3.033 1.00 0.00 H new ATOM 0 HG LEU B 37 155.411 -0.074 1.667 1.00 0.00 H new ATOM 0 HD11 LEU B 37 153.132 -0.739 2.386 1.00 0.00 H new ATOM 0 HD12 LEU B 37 153.904 -2.029 1.433 1.00 0.00 H new ATOM 0 HD13 LEU B 37 153.807 -2.167 3.205 1.00 0.00 H new ATOM 0 HD21 LEU B 37 154.519 0.750 3.830 1.00 0.00 H new ATOM 0 HD22 LEU B 37 155.197 -0.675 4.653 1.00 0.00 H new ATOM 0 HD23 LEU B 37 156.282 0.525 3.910 1.00 0.00 H new ATOM 2037 N GLN B 38 159.109 -1.320 0.932 1.00 0.00 N ATOM 2038 CA GLN B 38 160.184 -0.409 0.546 1.00 0.00 C ATOM 2039 C GLN B 38 160.530 -0.564 -0.933 1.00 0.00 C ATOM 2040 O GLN B 38 160.704 0.426 -1.644 1.00 0.00 O ATOM 2041 CB GLN B 38 161.428 -0.679 1.394 1.00 0.00 C ATOM 2042 CG GLN B 38 162.108 -1.963 0.913 1.00 0.00 C ATOM 2043 CD GLN B 38 163.127 -2.431 1.946 1.00 0.00 C ATOM 2044 OE1 GLN B 38 164.218 -2.872 1.587 1.00 0.00 O ATOM 2045 NE2 GLN B 38 162.834 -2.360 3.216 1.00 0.00 N ATOM 0 H GLN B 38 159.407 -2.118 1.493 1.00 0.00 H new ATOM 0 HA GLN B 38 159.840 0.611 0.716 1.00 0.00 H new ATOM 0 HB2 GLN B 38 162.120 0.160 1.321 1.00 0.00 H new ATOM 0 HB3 GLN B 38 161.151 -0.773 2.444 1.00 0.00 H new ATOM 0 HG2 GLN B 38 161.362 -2.740 0.748 1.00 0.00 H new ATOM 0 HG3 GLN B 38 162.601 -1.787 -0.043 1.00 0.00 H new ATOM 0 HE21 GLN B 38 161.929 -1.994 3.511 1.00 0.00 H new ATOM 0 HE22 GLN B 38 163.510 -2.671 3.914 1.00 0.00 H new ATOM 2054 N THR B 39 160.633 -1.807 -1.390 1.00 0.00 N ATOM 2055 CA THR B 39 160.967 -2.070 -2.787 1.00 0.00 C ATOM 2056 C THR B 39 159.913 -1.479 -3.717 1.00 0.00 C ATOM 2057 O THR B 39 160.242 -0.883 -4.742 1.00 0.00 O ATOM 2058 CB THR B 39 161.075 -3.578 -3.024 1.00 0.00 C ATOM 2059 OG1 THR B 39 161.667 -3.814 -4.295 1.00 0.00 O ATOM 2060 CG2 THR B 39 159.680 -4.204 -2.986 1.00 0.00 C ATOM 0 H THR B 39 160.492 -2.642 -0.821 1.00 0.00 H new ATOM 0 HA THR B 39 161.926 -1.599 -3.004 1.00 0.00 H new ATOM 0 HB THR B 39 161.693 -4.025 -2.245 1.00 0.00 H new ATOM 0 HG1 THR B 39 161.739 -4.779 -4.448 1.00 0.00 H new ATOM 0 HG21 THR B 39 159.758 -5.278 -3.155 1.00 0.00 H new ATOM 0 HG22 THR B 39 159.226 -4.022 -2.012 1.00 0.00 H new ATOM 0 HG23 THR B 39 159.060 -3.759 -3.764 1.00 0.00 H new ATOM 2068 N GLU B 40 158.645 -1.650 -3.355 1.00 0.00 N ATOM 2069 CA GLU B 40 157.553 -1.130 -4.171 1.00 0.00 C ATOM 2070 C GLU B 40 157.538 0.395 -4.144 1.00 0.00 C ATOM 2071 O GLU B 40 157.482 1.043 -5.189 1.00 0.00 O ATOM 2072 CB GLU B 40 156.215 -1.665 -3.653 1.00 0.00 C ATOM 2073 CG GLU B 40 155.953 -3.052 -4.245 1.00 0.00 C ATOM 2074 CD GLU B 40 154.779 -3.711 -3.529 1.00 0.00 C ATOM 2075 OE1 GLU B 40 154.360 -3.185 -2.512 1.00 0.00 O ATOM 2076 OE2 GLU B 40 154.317 -4.733 -4.009 1.00 0.00 O ATOM 0 H GLU B 40 158.350 -2.140 -2.510 1.00 0.00 H new ATOM 0 HA GLU B 40 157.705 -1.460 -5.199 1.00 0.00 H new ATOM 0 HB2 GLU B 40 156.231 -1.720 -2.565 1.00 0.00 H new ATOM 0 HB3 GLU B 40 155.409 -0.984 -3.926 1.00 0.00 H new ATOM 0 HG2 GLU B 40 155.739 -2.967 -5.310 1.00 0.00 H new ATOM 0 HG3 GLU B 40 156.844 -3.672 -4.147 1.00 0.00 H new ATOM 2083 N LEU B 41 157.585 0.963 -2.943 1.00 0.00 N ATOM 2084 CA LEU B 41 157.574 2.415 -2.793 1.00 0.00 C ATOM 2085 C LEU B 41 158.993 2.949 -2.621 1.00 0.00 C ATOM 2086 O LEU B 41 159.219 3.910 -1.885 1.00 0.00 O ATOM 2087 CB LEU B 41 156.727 2.807 -1.580 1.00 0.00 C ATOM 2088 CG LEU B 41 155.240 2.692 -1.931 1.00 0.00 C ATOM 2089 CD1 LEU B 41 154.431 2.440 -0.658 1.00 0.00 C ATOM 2090 CD2 LEU B 41 154.762 3.993 -2.584 1.00 0.00 C ATOM 0 H LEU B 41 157.631 0.445 -2.065 1.00 0.00 H new ATOM 0 HA LEU B 41 157.143 2.851 -3.694 1.00 0.00 H new ATOM 0 HB2 LEU B 41 156.962 2.160 -0.735 1.00 0.00 H new ATOM 0 HB3 LEU B 41 156.961 3.827 -1.275 1.00 0.00 H new ATOM 0 HG LEU B 41 155.099 1.863 -2.625 1.00 0.00 H new ATOM 0 HD11 LEU B 41 153.373 2.358 -0.909 1.00 0.00 H new ATOM 0 HD12 LEU B 41 154.766 1.513 -0.192 1.00 0.00 H new ATOM 0 HD13 LEU B 41 154.576 3.268 0.035 1.00 0.00 H new ATOM 0 HD21 LEU B 41 153.704 3.908 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU B 41 154.907 4.822 -1.891 1.00 0.00 H new ATOM 0 HD23 LEU B 41 155.335 4.176 -3.493 1.00 0.00 H new ATOM 2102 N SER B 42 159.944 2.321 -3.304 1.00 0.00 N ATOM 2103 CA SER B 42 161.336 2.743 -3.219 1.00 0.00 C ATOM 2104 C SER B 42 161.497 4.168 -3.739 1.00 0.00 C ATOM 2105 O SER B 42 162.185 4.988 -3.130 1.00 0.00 O ATOM 2106 CB SER B 42 162.219 1.798 -4.034 1.00 0.00 C ATOM 2107 OG SER B 42 163.585 2.118 -3.806 1.00 0.00 O ATOM 0 H SER B 42 159.778 1.524 -3.918 1.00 0.00 H new ATOM 0 HA SER B 42 161.641 2.713 -2.173 1.00 0.00 H new ATOM 0 HB2 SER B 42 162.024 0.764 -3.750 1.00 0.00 H new ATOM 0 HB3 SER B 42 161.985 1.887 -5.095 1.00 0.00 H new ATOM 0 HG SER B 42 164.154 1.513 -4.326 1.00 0.00 H new ATOM 2113 N GLY B 43 160.858 4.455 -4.869 1.00 0.00 N ATOM 2114 CA GLY B 43 160.937 5.785 -5.463 1.00 0.00 C ATOM 2115 C GLY B 43 160.239 6.818 -4.586 1.00 0.00 C ATOM 2116 O GLY B 43 160.759 7.912 -4.366 1.00 0.00 O ATOM 0 H GLY B 43 160.284 3.790 -5.388 1.00 0.00 H new ATOM 0 HA2 GLY B 43 161.982 6.065 -5.599 1.00 0.00 H new ATOM 0 HA3 GLY B 43 160.479 5.773 -6.452 1.00 0.00 H new ATOM 2120 N PHE B 44 159.058 6.464 -4.088 1.00 0.00 N ATOM 2121 CA PHE B 44 158.297 7.371 -3.236 1.00 0.00 C ATOM 2122 C PHE B 44 159.123 7.773 -2.017 1.00 0.00 C ATOM 2123 O PHE B 44 159.076 8.921 -1.575 1.00 0.00 O ATOM 2124 CB PHE B 44 156.997 6.695 -2.781 1.00 0.00 C ATOM 2125 CG PHE B 44 155.904 6.940 -3.797 1.00 0.00 C ATOM 2126 CD1 PHE B 44 156.210 6.998 -5.163 1.00 0.00 C ATOM 2127 CD2 PHE B 44 154.581 7.107 -3.370 1.00 0.00 C ATOM 2128 CE1 PHE B 44 155.195 7.225 -6.100 1.00 0.00 C ATOM 2129 CE2 PHE B 44 153.566 7.335 -4.307 1.00 0.00 C ATOM 2130 CZ PHE B 44 153.872 7.394 -5.671 1.00 0.00 C ATOM 0 H PHE B 44 158.610 5.563 -4.258 1.00 0.00 H new ATOM 0 HA PHE B 44 158.055 8.266 -3.809 1.00 0.00 H new ATOM 0 HB2 PHE B 44 157.158 5.624 -2.659 1.00 0.00 H new ATOM 0 HB3 PHE B 44 156.695 7.085 -1.809 1.00 0.00 H new ATOM 0 HD1 PHE B 44 157.230 6.867 -5.493 1.00 0.00 H new ATOM 0 HD2 PHE B 44 154.343 7.060 -2.318 1.00 0.00 H new ATOM 0 HE1 PHE B 44 155.432 7.270 -7.153 1.00 0.00 H new ATOM 0 HE2 PHE B 44 152.546 7.465 -3.977 1.00 0.00 H new ATOM 0 HZ PHE B 44 153.088 7.570 -6.393 1.00 0.00 H new ATOM 2140 N LEU B 45 159.878 6.821 -1.479 1.00 0.00 N ATOM 2141 CA LEU B 45 160.710 7.089 -0.312 1.00 0.00 C ATOM 2142 C LEU B 45 161.710 8.201 -0.612 1.00 0.00 C ATOM 2143 O LEU B 45 162.036 9.008 0.260 1.00 0.00 O ATOM 2144 CB LEU B 45 161.463 5.820 0.097 1.00 0.00 C ATOM 2145 CG LEU B 45 160.524 4.893 0.877 1.00 0.00 C ATOM 2146 CD1 LEU B 45 160.991 3.444 0.723 1.00 0.00 C ATOM 2147 CD2 LEU B 45 160.538 5.276 2.359 1.00 0.00 C ATOM 0 H LEU B 45 159.931 5.864 -1.829 1.00 0.00 H new ATOM 0 HA LEU B 45 160.064 7.407 0.506 1.00 0.00 H new ATOM 0 HB2 LEU B 45 161.842 5.309 -0.788 1.00 0.00 H new ATOM 0 HB3 LEU B 45 162.326 6.079 0.710 1.00 0.00 H new ATOM 0 HG LEU B 45 159.512 4.993 0.485 1.00 0.00 H new ATOM 0 HD11 LEU B 45 160.323 2.785 1.278 1.00 0.00 H new ATOM 0 HD12 LEU B 45 160.979 3.168 -0.331 1.00 0.00 H new ATOM 0 HD13 LEU B 45 162.004 3.345 1.113 1.00 0.00 H new ATOM 0 HD21 LEU B 45 159.870 4.616 2.912 1.00 0.00 H new ATOM 0 HD22 LEU B 45 161.551 5.178 2.751 1.00 0.00 H new ATOM 0 HD23 LEU B 45 160.204 6.307 2.471 1.00 0.00 H new ATOM 2159 N ASP B 46 162.191 8.239 -1.850 1.00 0.00 N ATOM 2160 CA ASP B 46 163.151 9.260 -2.255 1.00 0.00 C ATOM 2161 C ASP B 46 162.473 10.623 -2.346 1.00 0.00 C ATOM 2162 O ASP B 46 163.089 11.608 -2.753 1.00 0.00 O ATOM 2163 CB ASP B 46 163.759 8.898 -3.611 1.00 0.00 C ATOM 2164 CG ASP B 46 164.665 7.681 -3.466 1.00 0.00 C ATOM 2165 OD1 ASP B 46 165.021 7.361 -2.344 1.00 0.00 O ATOM 2166 OD2 ASP B 46 164.990 7.085 -4.480 1.00 0.00 O ATOM 0 H ASP B 46 161.935 7.580 -2.585 1.00 0.00 H new ATOM 0 HA ASP B 46 163.941 9.308 -1.506 1.00 0.00 H new ATOM 0 HB2 ASP B 46 162.967 8.689 -4.330 1.00 0.00 H new ATOM 0 HB3 ASP B 46 164.329 9.742 -4.001 1.00 0.00 H new ATOM 2171 N ALA B 47 161.202 10.671 -1.961 1.00 0.00 N ATOM 2172 CA ALA B 47 160.446 11.917 -2.002 1.00 0.00 C ATOM 2173 C ALA B 47 159.342 11.906 -0.951 1.00 0.00 C ATOM 2174 O ALA B 47 158.218 11.486 -1.222 1.00 0.00 O ATOM 2175 CB ALA B 47 159.831 12.109 -3.389 1.00 0.00 C ATOM 0 H ALA B 47 160.676 9.866 -1.619 1.00 0.00 H new ATOM 0 HA ALA B 47 161.127 12.741 -1.790 1.00 0.00 H new ATOM 0 HB1 ALA B 47 159.268 13.042 -3.411 1.00 0.00 H new ATOM 0 HB2 ALA B 47 160.623 12.145 -4.137 1.00 0.00 H new ATOM 0 HB3 ALA B 47 159.163 11.277 -3.609 1.00 0.00 H new ATOM 2181 N GLN B 48 159.671 12.369 0.252 1.00 0.00 N ATOM 2182 CA GLN B 48 158.701 12.408 1.342 1.00 0.00 C ATOM 2183 C GLN B 48 158.808 13.723 2.108 1.00 0.00 C ATOM 2184 O GLN B 48 159.733 14.505 1.890 1.00 0.00 O ATOM 2185 CB GLN B 48 158.941 11.238 2.297 1.00 0.00 C ATOM 2186 CG GLN B 48 158.833 9.920 1.527 1.00 0.00 C ATOM 2187 CD GLN B 48 158.959 8.743 2.488 1.00 0.00 C ATOM 2188 OE1 GLN B 48 158.178 7.794 2.416 1.00 0.00 O ATOM 2189 NE2 GLN B 48 159.901 8.748 3.391 1.00 0.00 N ATOM 0 H GLN B 48 160.597 12.721 0.496 1.00 0.00 H new ATOM 0 HA GLN B 48 157.701 12.329 0.916 1.00 0.00 H new ATOM 0 HB2 GLN B 48 159.927 11.324 2.754 1.00 0.00 H new ATOM 0 HB3 GLN B 48 158.211 11.260 3.106 1.00 0.00 H new ATOM 0 HG2 GLN B 48 157.878 9.872 1.004 1.00 0.00 H new ATOM 0 HG3 GLN B 48 159.615 9.867 0.769 1.00 0.00 H new ATOM 0 HE21 GLN B 48 160.547 9.535 3.449 1.00 0.00 H new ATOM 0 HE22 GLN B 48 159.991 7.965 4.038 1.00 0.00 H new ATOM 2198 N LYS B 49 157.857 13.959 3.006 1.00 0.00 N ATOM 2199 CA LYS B 49 157.852 15.184 3.801 1.00 0.00 C ATOM 2200 C LYS B 49 157.498 14.878 5.252 1.00 0.00 C ATOM 2201 O LYS B 49 157.546 15.759 6.111 1.00 0.00 O ATOM 2202 CB LYS B 49 156.837 16.173 3.227 1.00 0.00 C ATOM 2203 CG LYS B 49 157.183 16.475 1.768 1.00 0.00 C ATOM 2204 CD LYS B 49 156.171 17.472 1.201 1.00 0.00 C ATOM 2205 CE LYS B 49 156.357 17.587 -0.313 1.00 0.00 C ATOM 2206 NZ LYS B 49 156.353 16.226 -0.920 1.00 0.00 N ATOM 0 H LYS B 49 157.084 13.323 3.202 1.00 0.00 H new ATOM 0 HA LYS B 49 158.849 15.623 3.765 1.00 0.00 H new ATOM 0 HB2 LYS B 49 155.831 15.758 3.294 1.00 0.00 H new ATOM 0 HB3 LYS B 49 156.841 17.094 3.810 1.00 0.00 H new ATOM 0 HG2 LYS B 49 158.191 16.884 1.699 1.00 0.00 H new ATOM 0 HG3 LYS B 49 157.172 15.556 1.182 1.00 0.00 H new ATOM 0 HD2 LYS B 49 155.156 17.145 1.429 1.00 0.00 H new ATOM 0 HD3 LYS B 49 156.305 18.447 1.669 1.00 0.00 H new ATOM 0 HE2 LYS B 49 155.558 18.191 -0.743 1.00 0.00 H new ATOM 0 HE3 LYS B 49 157.296 18.094 -0.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 156.057 16.290 -1.915 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 157.309 15.820 -0.869 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 155.690 15.616 -0.400 1.00 0.00 H new ATOM 2220 N ASP B 50 157.143 13.625 5.520 1.00 0.00 N ATOM 2221 CA ASP B 50 156.782 13.213 6.873 1.00 0.00 C ATOM 2222 C ASP B 50 157.344 11.828 7.179 1.00 0.00 C ATOM 2223 O ASP B 50 156.604 10.845 7.233 1.00 0.00 O ATOM 2224 CB ASP B 50 155.260 13.192 7.025 1.00 0.00 C ATOM 2225 CG ASP B 50 154.686 14.570 6.715 1.00 0.00 C ATOM 2226 OD1 ASP B 50 155.076 15.516 7.379 1.00 0.00 O ATOM 2227 OD2 ASP B 50 153.864 14.660 5.818 1.00 0.00 O ATOM 0 H ASP B 50 157.098 12.881 4.823 1.00 0.00 H new ATOM 0 HA ASP B 50 157.207 13.930 7.576 1.00 0.00 H new ATOM 0 HB2 ASP B 50 154.829 12.450 6.353 1.00 0.00 H new ATOM 0 HB3 ASP B 50 154.992 12.897 8.039 1.00 0.00 H new ATOM 2232 N VAL B 51 158.656 11.758 7.378 1.00 0.00 N ATOM 2233 CA VAL B 51 159.308 10.490 7.678 1.00 0.00 C ATOM 2234 C VAL B 51 158.846 9.957 9.030 1.00 0.00 C ATOM 2235 O VAL B 51 158.997 8.772 9.325 1.00 0.00 O ATOM 2236 CB VAL B 51 160.826 10.673 7.690 1.00 0.00 C ATOM 2237 CG1 VAL B 51 161.213 11.645 8.806 1.00 0.00 C ATOM 2238 CG2 VAL B 51 161.500 9.322 7.936 1.00 0.00 C ATOM 0 H VAL B 51 159.285 12.560 7.337 1.00 0.00 H new ATOM 0 HA VAL B 51 159.036 9.771 6.905 1.00 0.00 H new ATOM 0 HB VAL B 51 161.152 11.073 6.730 1.00 0.00 H new ATOM 0 HG11 VAL B 51 162.295 11.776 8.815 1.00 0.00 H new ATOM 0 HG12 VAL B 51 160.732 12.608 8.633 1.00 0.00 H new ATOM 0 HG13 VAL B 51 160.888 11.245 9.766 1.00 0.00 H new ATOM 0 HG21 VAL B 51 162.582 9.452 7.945 1.00 0.00 H new ATOM 0 HG22 VAL B 51 161.175 8.923 8.897 1.00 0.00 H new ATOM 0 HG23 VAL B 51 161.224 8.628 7.142 1.00 0.00 H new ATOM 2248 N ASP B 52 158.283 10.841 9.847 1.00 0.00 N ATOM 2249 CA ASP B 52 157.803 10.448 11.167 1.00 0.00 C ATOM 2250 C ASP B 52 156.821 9.285 11.057 1.00 0.00 C ATOM 2251 O ASP B 52 156.849 8.360 11.867 1.00 0.00 O ATOM 2252 CB ASP B 52 157.117 11.635 11.846 1.00 0.00 C ATOM 2253 CG ASP B 52 155.857 12.019 11.078 1.00 0.00 C ATOM 2254 OD1 ASP B 52 154.936 11.220 11.051 1.00 0.00 O ATOM 2255 OD2 ASP B 52 155.833 13.107 10.526 1.00 0.00 O ATOM 0 H ASP B 52 158.149 11.827 9.621 1.00 0.00 H new ATOM 0 HA ASP B 52 158.658 10.131 11.765 1.00 0.00 H new ATOM 0 HB2 ASP B 52 156.862 11.379 12.874 1.00 0.00 H new ATOM 0 HB3 ASP B 52 157.799 12.484 11.889 1.00 0.00 H new ATOM 2260 N ALA B 53 155.957 9.340 10.049 1.00 0.00 N ATOM 2261 CA ALA B 53 154.973 8.285 9.844 1.00 0.00 C ATOM 2262 C ALA B 53 155.603 7.097 9.123 1.00 0.00 C ATOM 2263 O ALA B 53 155.398 5.945 9.509 1.00 0.00 O ATOM 2264 CB ALA B 53 153.797 8.818 9.023 1.00 0.00 C ATOM 0 H ALA B 53 155.918 10.097 9.367 1.00 0.00 H new ATOM 0 HA ALA B 53 154.614 7.955 10.819 1.00 0.00 H new ATOM 0 HB1 ALA B 53 153.067 8.023 8.875 1.00 0.00 H new ATOM 0 HB2 ALA B 53 153.328 9.647 9.554 1.00 0.00 H new ATOM 0 HB3 ALA B 53 154.157 9.165 8.054 1.00 0.00 H new ATOM 2270 N VAL B 54 156.371 7.385 8.077 1.00 0.00 N ATOM 2271 CA VAL B 54 157.026 6.330 7.312 1.00 0.00 C ATOM 2272 C VAL B 54 157.886 5.465 8.227 1.00 0.00 C ATOM 2273 O VAL B 54 157.811 4.237 8.187 1.00 0.00 O ATOM 2274 CB VAL B 54 157.900 6.944 6.217 1.00 0.00 C ATOM 2275 CG1 VAL B 54 158.512 5.829 5.366 1.00 0.00 C ATOM 2276 CG2 VAL B 54 157.042 7.849 5.330 1.00 0.00 C ATOM 0 H VAL B 54 156.554 8.331 7.742 1.00 0.00 H new ATOM 0 HA VAL B 54 156.258 5.706 6.855 1.00 0.00 H new ATOM 0 HB VAL B 54 158.697 7.530 6.674 1.00 0.00 H new ATOM 0 HG11 VAL B 54 159.135 6.267 4.586 1.00 0.00 H new ATOM 0 HG12 VAL B 54 159.122 5.183 5.997 1.00 0.00 H new ATOM 0 HG13 VAL B 54 157.716 5.242 4.908 1.00 0.00 H new ATOM 0 HG21 VAL B 54 157.663 8.288 4.549 1.00 0.00 H new ATOM 0 HG22 VAL B 54 156.246 7.261 4.873 1.00 0.00 H new ATOM 0 HG23 VAL B 54 156.605 8.643 5.935 1.00 0.00 H new ATOM 2286 N ASP B 55 158.703 6.114 9.051 1.00 0.00 N ATOM 2287 CA ASP B 55 159.572 5.393 9.973 1.00 0.00 C ATOM 2288 C ASP B 55 158.741 4.620 10.992 1.00 0.00 C ATOM 2289 O ASP B 55 159.104 3.514 11.391 1.00 0.00 O ATOM 2290 CB ASP B 55 160.492 6.375 10.700 1.00 0.00 C ATOM 2291 CG ASP B 55 161.527 5.611 11.518 1.00 0.00 C ATOM 2292 OD1 ASP B 55 161.562 4.397 11.407 1.00 0.00 O ATOM 2293 OD2 ASP B 55 162.271 6.251 12.243 1.00 0.00 O ATOM 0 H ASP B 55 158.781 7.130 9.099 1.00 0.00 H new ATOM 0 HA ASP B 55 160.176 4.688 9.401 1.00 0.00 H new ATOM 0 HB2 ASP B 55 160.992 7.021 9.978 1.00 0.00 H new ATOM 0 HB3 ASP B 55 159.905 7.021 11.353 1.00 0.00 H new ATOM 2298 N LYS B 56 157.626 5.211 11.409 1.00 0.00 N ATOM 2299 CA LYS B 56 156.750 4.569 12.383 1.00 0.00 C ATOM 2300 C LYS B 56 156.234 3.238 11.843 1.00 0.00 C ATOM 2301 O LYS B 56 156.096 2.267 12.586 1.00 0.00 O ATOM 2302 CB LYS B 56 155.567 5.484 12.706 1.00 0.00 C ATOM 2303 CG LYS B 56 154.562 4.728 13.576 1.00 0.00 C ATOM 2304 CD LYS B 56 153.521 5.707 14.122 1.00 0.00 C ATOM 2305 CE LYS B 56 152.563 4.966 15.058 1.00 0.00 C ATOM 2306 NZ LYS B 56 153.346 4.092 15.980 1.00 0.00 N ATOM 0 H LYS B 56 157.309 6.127 11.091 1.00 0.00 H new ATOM 0 HA LYS B 56 157.323 4.383 13.292 1.00 0.00 H new ATOM 0 HB2 LYS B 56 155.915 6.377 13.226 1.00 0.00 H new ATOM 0 HB3 LYS B 56 155.089 5.817 11.785 1.00 0.00 H new ATOM 0 HG2 LYS B 56 154.073 3.949 12.991 1.00 0.00 H new ATOM 0 HG3 LYS B 56 155.078 4.233 14.399 1.00 0.00 H new ATOM 0 HD2 LYS B 56 154.015 6.518 14.658 1.00 0.00 H new ATOM 0 HD3 LYS B 56 152.966 6.159 13.300 1.00 0.00 H new ATOM 0 HE2 LYS B 56 151.972 5.680 15.631 1.00 0.00 H new ATOM 0 HE3 LYS B 56 151.862 4.366 14.478 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 152.800 3.927 16.850 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 153.540 3.182 15.515 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 154.245 4.557 16.219 1.00 0.00 H new ATOM 2320 N VAL B 57 155.951 3.202 10.545 1.00 0.00 N ATOM 2321 CA VAL B 57 155.452 1.984 9.916 1.00 0.00 C ATOM 2322 C VAL B 57 156.583 0.980 9.719 1.00 0.00 C ATOM 2323 O VAL B 57 156.379 -0.229 9.826 1.00 0.00 O ATOM 2324 CB VAL B 57 154.821 2.318 8.563 1.00 0.00 C ATOM 2325 CG1 VAL B 57 154.402 1.025 7.860 1.00 0.00 C ATOM 2326 CG2 VAL B 57 153.591 3.202 8.778 1.00 0.00 C ATOM 0 H VAL B 57 156.057 3.995 9.912 1.00 0.00 H new ATOM 0 HA VAL B 57 154.700 1.541 10.569 1.00 0.00 H new ATOM 0 HB VAL B 57 155.547 2.848 7.946 1.00 0.00 H new ATOM 0 HG11 VAL B 57 153.953 1.264 6.896 1.00 0.00 H new ATOM 0 HG12 VAL B 57 155.278 0.395 7.706 1.00 0.00 H new ATOM 0 HG13 VAL B 57 153.677 0.494 8.477 1.00 0.00 H new ATOM 0 HG21 VAL B 57 153.141 3.440 7.814 1.00 0.00 H new ATOM 0 HG22 VAL B 57 152.866 2.672 9.396 1.00 0.00 H new ATOM 0 HG23 VAL B 57 153.888 4.124 9.277 1.00 0.00 H new ATOM 2336 N MET B 58 157.776 1.491 9.431 1.00 0.00 N ATOM 2337 CA MET B 58 158.935 0.630 9.219 1.00 0.00 C ATOM 2338 C MET B 58 159.361 -0.033 10.525 1.00 0.00 C ATOM 2339 O MET B 58 159.551 -1.248 10.582 1.00 0.00 O ATOM 2340 CB MET B 58 160.099 1.451 8.659 1.00 0.00 C ATOM 2341 CG MET B 58 159.747 1.947 7.256 1.00 0.00 C ATOM 2342 SD MET B 58 159.905 0.584 6.076 1.00 0.00 S ATOM 2343 CE MET B 58 158.711 1.195 4.862 1.00 0.00 C ATOM 0 H MET B 58 157.965 2.489 9.340 1.00 0.00 H new ATOM 0 HA MET B 58 158.659 -0.147 8.506 1.00 0.00 H new ATOM 0 HB2 MET B 58 160.308 2.297 9.313 1.00 0.00 H new ATOM 0 HB3 MET B 58 161.003 0.843 8.625 1.00 0.00 H new ATOM 0 HG2 MET B 58 158.730 2.338 7.242 1.00 0.00 H new ATOM 0 HG3 MET B 58 160.408 2.766 6.972 1.00 0.00 H new ATOM 0 HE1 MET B 58 158.527 0.425 4.113 1.00 0.00 H new ATOM 0 HE2 MET B 58 157.776 1.443 5.364 1.00 0.00 H new ATOM 0 HE3 MET B 58 159.109 2.086 4.376 1.00 0.00 H new ATOM 2353 N LYS B 59 159.513 0.772 11.572 1.00 0.00 N ATOM 2354 CA LYS B 59 159.921 0.250 12.872 1.00 0.00 C ATOM 2355 C LYS B 59 158.844 -0.668 13.443 1.00 0.00 C ATOM 2356 O LYS B 59 159.132 -1.540 14.265 1.00 0.00 O ATOM 2357 CB LYS B 59 160.185 1.407 13.842 1.00 0.00 C ATOM 2358 CG LYS B 59 158.854 1.989 14.350 1.00 0.00 C ATOM 2359 CD LYS B 59 158.518 1.411 15.729 1.00 0.00 C ATOM 2360 CE LYS B 59 157.019 1.559 15.995 1.00 0.00 C ATOM 2361 NZ LYS B 59 156.679 3.003 16.128 1.00 0.00 N ATOM 0 H LYS B 59 159.361 1.780 11.547 1.00 0.00 H new ATOM 0 HA LYS B 59 160.837 -0.326 12.741 1.00 0.00 H new ATOM 0 HB2 LYS B 59 160.782 1.056 14.684 1.00 0.00 H new ATOM 0 HB3 LYS B 59 160.763 2.185 13.343 1.00 0.00 H new ATOM 0 HG2 LYS B 59 158.922 3.075 14.409 1.00 0.00 H new ATOM 0 HG3 LYS B 59 158.055 1.758 13.646 1.00 0.00 H new ATOM 0 HD2 LYS B 59 158.804 0.360 15.774 1.00 0.00 H new ATOM 0 HD3 LYS B 59 159.088 1.929 16.500 1.00 0.00 H new ATOM 0 HE2 LYS B 59 156.448 1.114 15.180 1.00 0.00 H new ATOM 0 HE3 LYS B 59 156.746 1.025 16.905 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 155.666 3.103 16.343 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 157.239 3.422 16.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 156.894 3.494 15.237 1.00 0.00 H new ATOM 2375 N GLU B 60 157.607 -0.470 13.002 1.00 0.00 N ATOM 2376 CA GLU B 60 156.498 -1.290 13.477 1.00 0.00 C ATOM 2377 C GLU B 60 156.719 -2.753 13.108 1.00 0.00 C ATOM 2378 O GLU B 60 156.421 -3.653 13.893 1.00 0.00 O ATOM 2379 CB GLU B 60 155.185 -0.801 12.864 1.00 0.00 C ATOM 2380 CG GLU B 60 154.014 -1.555 13.497 1.00 0.00 C ATOM 2381 CD GLU B 60 152.719 -1.211 12.770 1.00 0.00 C ATOM 2382 OE1 GLU B 60 152.791 -0.525 11.764 1.00 0.00 O ATOM 2383 OE2 GLU B 60 151.672 -1.638 13.231 1.00 0.00 O ATOM 0 H GLU B 60 157.348 0.245 12.322 1.00 0.00 H new ATOM 0 HA GLU B 60 156.446 -1.203 14.562 1.00 0.00 H new ATOM 0 HB2 GLU B 60 155.072 0.271 13.027 1.00 0.00 H new ATOM 0 HB3 GLU B 60 155.193 -0.960 11.786 1.00 0.00 H new ATOM 0 HG2 GLU B 60 154.194 -2.629 13.449 1.00 0.00 H new ATOM 0 HG3 GLU B 60 153.929 -1.293 14.552 1.00 0.00 H new ATOM 2390 N LEU B 61 157.245 -2.982 11.910 1.00 0.00 N ATOM 2391 CA LEU B 61 157.504 -4.340 11.445 1.00 0.00 C ATOM 2392 C LEU B 61 158.767 -4.898 12.094 1.00 0.00 C ATOM 2393 O LEU B 61 158.873 -6.101 12.334 1.00 0.00 O ATOM 2394 CB LEU B 61 157.664 -4.348 9.923 1.00 0.00 C ATOM 2395 CG LEU B 61 156.488 -3.610 9.281 1.00 0.00 C ATOM 2396 CD1 LEU B 61 156.642 -3.633 7.759 1.00 0.00 C ATOM 2397 CD2 LEU B 61 155.180 -4.302 9.670 1.00 0.00 C ATOM 0 H LEU B 61 157.499 -2.250 11.247 1.00 0.00 H new ATOM 0 HA LEU B 61 156.658 -4.968 11.726 1.00 0.00 H new ATOM 0 HB2 LEU B 61 158.603 -3.870 9.643 1.00 0.00 H new ATOM 0 HB3 LEU B 61 157.707 -5.374 9.557 1.00 0.00 H new ATOM 0 HG LEU B 61 156.472 -2.577 9.630 1.00 0.00 H new ATOM 0 HD11 LEU B 61 155.804 -3.107 7.301 1.00 0.00 H new ATOM 0 HD12 LEU B 61 157.575 -3.143 7.480 1.00 0.00 H new ATOM 0 HD13 LEU B 61 156.657 -4.666 7.410 1.00 0.00 H new ATOM 0 HD21 LEU B 61 154.341 -3.777 9.213 1.00 0.00 H new ATOM 0 HD22 LEU B 61 155.196 -5.334 9.320 1.00 0.00 H new ATOM 0 HD23 LEU B 61 155.070 -4.288 10.754 1.00 0.00 H new ATOM 2409 N ASP B 62 159.722 -4.017 12.374 1.00 0.00 N ATOM 2410 CA ASP B 62 160.974 -4.433 12.993 1.00 0.00 C ATOM 2411 C ASP B 62 160.712 -5.122 14.329 1.00 0.00 C ATOM 2412 O ASP B 62 161.242 -6.200 14.596 1.00 0.00 O ATOM 2413 CB ASP B 62 161.877 -3.216 13.212 1.00 0.00 C ATOM 2414 CG ASP B 62 163.249 -3.667 13.704 1.00 0.00 C ATOM 2415 OD1 ASP B 62 163.455 -4.865 13.806 1.00 0.00 O ATOM 2416 OD2 ASP B 62 164.071 -2.807 13.971 1.00 0.00 O ATOM 0 H ASP B 62 159.653 -3.017 12.183 1.00 0.00 H new ATOM 0 HA ASP B 62 161.469 -5.139 12.326 1.00 0.00 H new ATOM 0 HB2 ASP B 62 161.981 -2.657 12.282 1.00 0.00 H new ATOM 0 HB3 ASP B 62 161.424 -2.543 13.939 1.00 0.00 H new ATOM 2421 N GLU B 63 159.891 -4.493 15.163 1.00 0.00 N ATOM 2422 CA GLU B 63 159.566 -5.056 16.469 1.00 0.00 C ATOM 2423 C GLU B 63 158.793 -6.361 16.311 1.00 0.00 C ATOM 2424 O GLU B 63 158.916 -7.271 17.131 1.00 0.00 O ATOM 2425 CB GLU B 63 158.733 -4.060 17.275 1.00 0.00 C ATOM 2426 CG GLU B 63 159.570 -2.811 17.562 1.00 0.00 C ATOM 2427 CD GLU B 63 158.780 -1.843 18.437 1.00 0.00 C ATOM 2428 OE1 GLU B 63 157.590 -2.059 18.600 1.00 0.00 O ATOM 2429 OE2 GLU B 63 159.376 -0.899 18.929 1.00 0.00 O ATOM 0 H GLU B 63 159.441 -3.600 14.961 1.00 0.00 H new ATOM 0 HA GLU B 63 160.497 -5.260 16.998 1.00 0.00 H new ATOM 0 HB2 GLU B 63 157.834 -3.789 16.721 1.00 0.00 H new ATOM 0 HB3 GLU B 63 158.407 -4.515 18.210 1.00 0.00 H new ATOM 0 HG2 GLU B 63 160.497 -3.092 18.061 1.00 0.00 H new ATOM 0 HG3 GLU B 63 159.846 -2.325 16.626 1.00 0.00 H new ATOM 2436 N ASN B 64 157.995 -6.446 15.250 1.00 0.00 N ATOM 2437 CA ASN B 64 157.205 -7.646 14.991 1.00 0.00 C ATOM 2438 C ASN B 64 157.902 -8.535 13.967 1.00 0.00 C ATOM 2439 O ASN B 64 159.020 -8.248 13.539 1.00 0.00 O ATOM 2440 CB ASN B 64 155.820 -7.256 14.472 1.00 0.00 C ATOM 2441 CG ASN B 64 155.043 -6.524 15.560 1.00 0.00 C ATOM 2442 OD1 ASN B 64 154.990 -5.293 15.566 1.00 0.00 O ATOM 2443 ND2 ASN B 64 154.434 -7.210 16.488 1.00 0.00 N ATOM 0 H ASN B 64 157.879 -5.704 14.560 1.00 0.00 H new ATOM 0 HA ASN B 64 157.101 -8.199 15.924 1.00 0.00 H new ATOM 0 HB2 ASN B 64 155.918 -6.619 13.593 1.00 0.00 H new ATOM 0 HB3 ASN B 64 155.275 -8.147 14.161 1.00 0.00 H new ATOM 0 HD21 ASN B 64 153.913 -6.727 17.220 1.00 0.00 H new ATOM 0 HD22 ASN B 64 154.479 -8.229 16.481 1.00 0.00 H new ATOM 2450 N GLY B 65 157.235 -9.617 13.578 1.00 0.00 N ATOM 2451 CA GLY B 65 157.802 -10.542 12.603 1.00 0.00 C ATOM 2452 C GLY B 65 157.060 -11.874 12.621 1.00 0.00 C ATOM 2453 O GLY B 65 156.707 -12.413 11.572 1.00 0.00 O ATOM 0 H GLY B 65 156.309 -9.874 13.920 1.00 0.00 H new ATOM 0 HA2 GLY B 65 157.748 -10.104 11.606 1.00 0.00 H new ATOM 0 HA3 GLY B 65 158.857 -10.706 12.822 1.00 0.00 H new ATOM 2457 N ASP B 66 156.826 -12.400 13.820 1.00 0.00 N ATOM 2458 CA ASP B 66 156.124 -13.670 13.961 1.00 0.00 C ATOM 2459 C ASP B 66 154.691 -13.549 13.453 1.00 0.00 C ATOM 2460 O ASP B 66 154.074 -14.541 13.062 1.00 0.00 O ATOM 2461 CB ASP B 66 156.113 -14.100 15.429 1.00 0.00 C ATOM 2462 CG ASP B 66 157.533 -14.414 15.892 1.00 0.00 C ATOM 2463 OD1 ASP B 66 158.007 -15.496 15.591 1.00 0.00 O ATOM 2464 OD2 ASP B 66 158.124 -13.566 16.540 1.00 0.00 O ATOM 0 H ASP B 66 157.110 -11.970 14.700 1.00 0.00 H new ATOM 0 HA ASP B 66 156.646 -14.420 13.367 1.00 0.00 H new ATOM 0 HB2 ASP B 66 155.688 -13.308 16.045 1.00 0.00 H new ATOM 0 HB3 ASP B 66 155.478 -14.977 15.555 1.00 0.00 H new ATOM 2469 N GLY B 67 154.167 -12.329 13.463 1.00 0.00 N ATOM 2470 CA GLY B 67 152.803 -12.088 13.001 1.00 0.00 C ATOM 2471 C GLY B 67 152.741 -12.053 11.478 1.00 0.00 C ATOM 2472 O GLY B 67 153.767 -12.136 10.803 1.00 0.00 O ATOM 0 H GLY B 67 154.661 -11.496 13.783 1.00 0.00 H new ATOM 0 HA2 GLY B 67 152.144 -12.870 13.378 1.00 0.00 H new ATOM 0 HA3 GLY B 67 152.440 -11.143 13.405 1.00 0.00 H new ATOM 2476 N GLU B 68 151.530 -11.931 10.944 1.00 0.00 N ATOM 2477 CA GLU B 68 151.341 -11.886 9.497 1.00 0.00 C ATOM 2478 C GLU B 68 150.235 -10.901 9.132 1.00 0.00 C ATOM 2479 O GLU B 68 149.568 -10.350 10.007 1.00 0.00 O ATOM 2480 CB GLU B 68 150.982 -13.279 8.977 1.00 0.00 C ATOM 2481 CG GLU B 68 151.971 -14.302 9.539 1.00 0.00 C ATOM 2482 CD GLU B 68 151.587 -14.670 10.967 1.00 0.00 C ATOM 2483 OE1 GLU B 68 150.561 -14.193 11.425 1.00 0.00 O ATOM 2484 OE2 GLU B 68 152.324 -15.422 11.583 1.00 0.00 O ATOM 0 H GLU B 68 150.669 -11.862 11.487 1.00 0.00 H new ATOM 0 HA GLU B 68 152.271 -11.555 9.036 1.00 0.00 H new ATOM 0 HB2 GLU B 68 149.966 -13.539 9.273 1.00 0.00 H new ATOM 0 HB3 GLU B 68 151.010 -13.291 7.887 1.00 0.00 H new ATOM 0 HG2 GLU B 68 151.977 -15.195 8.914 1.00 0.00 H new ATOM 0 HG3 GLU B 68 152.981 -13.892 9.520 1.00 0.00 H new ATOM 2491 N VAL B 69 150.047 -10.683 7.833 1.00 0.00 N ATOM 2492 CA VAL B 69 149.018 -9.760 7.360 1.00 0.00 C ATOM 2493 C VAL B 69 148.314 -10.322 6.128 1.00 0.00 C ATOM 2494 O VAL B 69 148.749 -11.319 5.553 1.00 0.00 O ATOM 2495 CB VAL B 69 149.648 -8.410 7.017 1.00 0.00 C ATOM 2496 CG1 VAL B 69 149.965 -7.648 8.305 1.00 0.00 C ATOM 2497 CG2 VAL B 69 150.939 -8.636 6.227 1.00 0.00 C ATOM 0 H VAL B 69 150.589 -11.129 7.093 1.00 0.00 H new ATOM 0 HA VAL B 69 148.283 -9.629 8.154 1.00 0.00 H new ATOM 0 HB VAL B 69 148.950 -7.828 6.416 1.00 0.00 H new ATOM 0 HG11 VAL B 69 150.414 -6.686 8.058 1.00 0.00 H new ATOM 0 HG12 VAL B 69 149.045 -7.485 8.867 1.00 0.00 H new ATOM 0 HG13 VAL B 69 150.662 -8.229 8.909 1.00 0.00 H new ATOM 0 HG21 VAL B 69 151.389 -7.674 5.982 1.00 0.00 H new ATOM 0 HG22 VAL B 69 151.636 -9.220 6.828 1.00 0.00 H new ATOM 0 HG23 VAL B 69 150.713 -9.176 5.307 1.00 0.00 H new ATOM 2507 N ASP B 70 147.225 -9.670 5.729 1.00 0.00 N ATOM 2508 CA ASP B 70 146.461 -10.105 4.561 1.00 0.00 C ATOM 2509 C ASP B 70 146.576 -9.081 3.436 1.00 0.00 C ATOM 2510 O ASP B 70 147.328 -8.112 3.540 1.00 0.00 O ATOM 2511 CB ASP B 70 144.990 -10.286 4.939 1.00 0.00 C ATOM 2512 CG ASP B 70 144.260 -11.055 3.842 1.00 0.00 C ATOM 2513 OD1 ASP B 70 144.929 -11.578 2.967 1.00 0.00 O ATOM 2514 OD2 ASP B 70 143.043 -11.109 3.895 1.00 0.00 O ATOM 0 H ASP B 70 146.852 -8.842 6.194 1.00 0.00 H new ATOM 0 HA ASP B 70 146.868 -11.056 4.216 1.00 0.00 H new ATOM 0 HB2 ASP B 70 144.912 -10.823 5.884 1.00 0.00 H new ATOM 0 HB3 ASP B 70 144.521 -9.313 5.086 1.00 0.00 H new ATOM 2519 N PHE B 71 145.826 -9.303 2.362 1.00 0.00 N ATOM 2520 CA PHE B 71 145.852 -8.391 1.222 1.00 0.00 C ATOM 2521 C PHE B 71 145.289 -7.028 1.610 1.00 0.00 C ATOM 2522 O PHE B 71 145.938 -6.000 1.415 1.00 0.00 O ATOM 2523 CB PHE B 71 145.032 -8.973 0.069 1.00 0.00 C ATOM 2524 CG PHE B 71 144.900 -7.941 -1.025 1.00 0.00 C ATOM 2525 CD1 PHE B 71 146.027 -7.550 -1.758 1.00 0.00 C ATOM 2526 CD2 PHE B 71 143.651 -7.375 -1.306 1.00 0.00 C ATOM 2527 CE1 PHE B 71 145.905 -6.593 -2.772 1.00 0.00 C ATOM 2528 CE2 PHE B 71 143.529 -6.418 -2.320 1.00 0.00 C ATOM 2529 CZ PHE B 71 144.655 -6.027 -3.053 1.00 0.00 C ATOM 0 H PHE B 71 145.197 -10.099 2.256 1.00 0.00 H new ATOM 0 HA PHE B 71 146.888 -8.266 0.906 1.00 0.00 H new ATOM 0 HB2 PHE B 71 145.515 -9.870 -0.319 1.00 0.00 H new ATOM 0 HB3 PHE B 71 144.045 -9.271 0.424 1.00 0.00 H new ATOM 0 HD1 PHE B 71 146.991 -7.987 -1.541 1.00 0.00 H new ATOM 0 HD2 PHE B 71 142.782 -7.677 -0.741 1.00 0.00 H new ATOM 0 HE1 PHE B 71 146.774 -6.291 -3.337 1.00 0.00 H new ATOM 0 HE2 PHE B 71 142.565 -5.981 -2.537 1.00 0.00 H new ATOM 0 HZ PHE B 71 144.560 -5.289 -3.836 1.00 0.00 H new ATOM 2539 N GLN B 72 144.078 -7.024 2.157 1.00 0.00 N ATOM 2540 CA GLN B 72 143.441 -5.778 2.564 1.00 0.00 C ATOM 2541 C GLN B 72 144.395 -4.941 3.413 1.00 0.00 C ATOM 2542 O GLN B 72 144.424 -3.717 3.305 1.00 0.00 O ATOM 2543 CB GLN B 72 142.170 -6.075 3.362 1.00 0.00 C ATOM 2544 CG GLN B 72 142.452 -7.183 4.378 1.00 0.00 C ATOM 2545 CD GLN B 72 141.205 -7.458 5.211 1.00 0.00 C ATOM 2546 OE1 GLN B 72 140.776 -8.606 5.328 1.00 0.00 O ATOM 2547 NE2 GLN B 72 140.592 -6.467 5.799 1.00 0.00 N ATOM 0 H GLN B 72 143.522 -7.862 2.327 1.00 0.00 H new ATOM 0 HA GLN B 72 143.181 -5.215 1.667 1.00 0.00 H new ATOM 0 HB2 GLN B 72 141.831 -5.175 3.875 1.00 0.00 H new ATOM 0 HB3 GLN B 72 141.368 -6.380 2.689 1.00 0.00 H new ATOM 0 HG2 GLN B 72 142.761 -8.091 3.861 1.00 0.00 H new ATOM 0 HG3 GLN B 72 143.276 -6.890 5.028 1.00 0.00 H new ATOM 0 HE21 GLN B 72 140.949 -5.516 5.701 1.00 0.00 H new ATOM 0 HE22 GLN B 72 139.756 -6.643 6.357 1.00 0.00 H new ATOM 2556 N GLU B 73 145.172 -5.613 4.256 1.00 0.00 N ATOM 2557 CA GLU B 73 146.123 -4.922 5.120 1.00 0.00 C ATOM 2558 C GLU B 73 147.200 -4.232 4.288 1.00 0.00 C ATOM 2559 O GLU B 73 147.624 -3.120 4.604 1.00 0.00 O ATOM 2560 CB GLU B 73 146.773 -5.919 6.081 1.00 0.00 C ATOM 2561 CG GLU B 73 145.731 -6.412 7.087 1.00 0.00 C ATOM 2562 CD GLU B 73 146.420 -7.096 8.262 1.00 0.00 C ATOM 2563 OE1 GLU B 73 146.954 -6.391 9.101 1.00 0.00 O ATOM 2564 OE2 GLU B 73 146.402 -8.316 8.306 1.00 0.00 O ATOM 0 H GLU B 73 145.163 -6.628 4.359 1.00 0.00 H new ATOM 0 HA GLU B 73 145.585 -4.166 5.692 1.00 0.00 H new ATOM 0 HB2 GLU B 73 147.184 -6.761 5.525 1.00 0.00 H new ATOM 0 HB3 GLU B 73 147.604 -5.447 6.604 1.00 0.00 H new ATOM 0 HG2 GLU B 73 145.133 -5.573 7.444 1.00 0.00 H new ATOM 0 HG3 GLU B 73 145.046 -7.108 6.602 1.00 0.00 H new ATOM 2571 N TYR B 74 147.636 -4.895 3.221 1.00 0.00 N ATOM 2572 CA TYR B 74 148.661 -4.331 2.349 1.00 0.00 C ATOM 2573 C TYR B 74 148.152 -3.049 1.693 1.00 0.00 C ATOM 2574 O TYR B 74 148.934 -2.164 1.348 1.00 0.00 O ATOM 2575 CB TYR B 74 149.047 -5.351 1.271 1.00 0.00 C ATOM 2576 CG TYR B 74 149.835 -4.668 0.176 1.00 0.00 C ATOM 2577 CD1 TYR B 74 149.161 -4.028 -0.871 1.00 0.00 C ATOM 2578 CD2 TYR B 74 151.234 -4.676 0.207 1.00 0.00 C ATOM 2579 CE1 TYR B 74 149.888 -3.395 -1.887 1.00 0.00 C ATOM 2580 CE2 TYR B 74 151.961 -4.044 -0.809 1.00 0.00 C ATOM 2581 CZ TYR B 74 151.287 -3.403 -1.856 1.00 0.00 C ATOM 2582 OH TYR B 74 152.003 -2.779 -2.858 1.00 0.00 O ATOM 0 H TYR B 74 147.299 -5.816 2.941 1.00 0.00 H new ATOM 0 HA TYR B 74 149.540 -4.093 2.948 1.00 0.00 H new ATOM 0 HB2 TYR B 74 149.640 -6.153 1.712 1.00 0.00 H new ATOM 0 HB3 TYR B 74 148.150 -5.810 0.854 1.00 0.00 H new ATOM 0 HD1 TYR B 74 148.081 -4.022 -0.895 1.00 0.00 H new ATOM 0 HD2 TYR B 74 151.753 -5.170 1.015 1.00 0.00 H new ATOM 0 HE1 TYR B 74 149.369 -2.901 -2.695 1.00 0.00 H new ATOM 0 HE2 TYR B 74 153.041 -4.051 -0.785 1.00 0.00 H new ATOM 0 HH TYR B 74 152.905 -2.572 -2.535 1.00 0.00 H new ATOM 2592 N VAL B 75 146.837 -2.959 1.526 1.00 0.00 N ATOM 2593 CA VAL B 75 146.232 -1.783 0.912 1.00 0.00 C ATOM 2594 C VAL B 75 146.185 -0.621 1.901 1.00 0.00 C ATOM 2595 O VAL B 75 146.164 0.544 1.504 1.00 0.00 O ATOM 2596 CB VAL B 75 144.815 -2.116 0.436 1.00 0.00 C ATOM 2597 CG1 VAL B 75 144.070 -0.826 0.088 1.00 0.00 C ATOM 2598 CG2 VAL B 75 144.897 -3.006 -0.807 1.00 0.00 C ATOM 0 H VAL B 75 146.173 -3.681 1.805 1.00 0.00 H new ATOM 0 HA VAL B 75 146.841 -1.487 0.058 1.00 0.00 H new ATOM 0 HB VAL B 75 144.280 -2.638 1.229 1.00 0.00 H new ATOM 0 HG11 VAL B 75 143.062 -1.068 -0.250 1.00 0.00 H new ATOM 0 HG12 VAL B 75 144.014 -0.189 0.971 1.00 0.00 H new ATOM 0 HG13 VAL B 75 144.603 -0.301 -0.705 1.00 0.00 H new ATOM 0 HG21 VAL B 75 143.890 -3.246 -1.150 1.00 0.00 H new ATOM 0 HG22 VAL B 75 145.433 -2.480 -1.597 1.00 0.00 H new ATOM 0 HG23 VAL B 75 145.426 -3.927 -0.561 1.00 0.00 H new ATOM 2608 N VAL B 76 146.166 -0.947 3.189 1.00 0.00 N ATOM 2609 CA VAL B 76 146.118 0.079 4.226 1.00 0.00 C ATOM 2610 C VAL B 76 147.455 0.807 4.332 1.00 0.00 C ATOM 2611 O VAL B 76 147.507 2.036 4.304 1.00 0.00 O ATOM 2612 CB VAL B 76 145.778 -0.560 5.574 1.00 0.00 C ATOM 2613 CG1 VAL B 76 145.655 0.531 6.640 1.00 0.00 C ATOM 2614 CG2 VAL B 76 144.451 -1.316 5.462 1.00 0.00 C ATOM 0 H VAL B 76 146.183 -1.905 3.539 1.00 0.00 H new ATOM 0 HA VAL B 76 145.347 0.801 3.957 1.00 0.00 H new ATOM 0 HB VAL B 76 146.569 -1.255 5.855 1.00 0.00 H new ATOM 0 HG11 VAL B 76 145.413 0.076 7.600 1.00 0.00 H new ATOM 0 HG12 VAL B 76 146.600 1.068 6.721 1.00 0.00 H new ATOM 0 HG13 VAL B 76 144.865 1.227 6.359 1.00 0.00 H new ATOM 0 HG21 VAL B 76 144.209 -1.771 6.423 1.00 0.00 H new ATOM 0 HG22 VAL B 76 143.659 -0.622 5.180 1.00 0.00 H new ATOM 0 HG23 VAL B 76 144.538 -2.094 4.704 1.00 0.00 H new ATOM 2624 N LEU B 77 148.533 0.039 4.457 1.00 0.00 N ATOM 2625 CA LEU B 77 149.867 0.620 4.573 1.00 0.00 C ATOM 2626 C LEU B 77 150.159 1.551 3.399 1.00 0.00 C ATOM 2627 O LEU B 77 150.418 2.739 3.588 1.00 0.00 O ATOM 2628 CB LEU B 77 150.916 -0.492 4.618 1.00 0.00 C ATOM 2629 CG LEU B 77 150.578 -1.469 5.746 1.00 0.00 C ATOM 2630 CD1 LEU B 77 151.649 -2.559 5.814 1.00 0.00 C ATOM 2631 CD2 LEU B 77 150.535 -0.715 7.078 1.00 0.00 C ATOM 0 H LEU B 77 148.510 -0.980 4.481 1.00 0.00 H new ATOM 0 HA LEU B 77 149.908 1.200 5.495 1.00 0.00 H new ATOM 0 HB2 LEU B 77 150.945 -1.018 3.664 1.00 0.00 H new ATOM 0 HB3 LEU B 77 151.906 -0.066 4.777 1.00 0.00 H new ATOM 0 HG LEU B 77 149.607 -1.924 5.553 1.00 0.00 H new ATOM 0 HD11 LEU B 77 151.409 -3.255 6.617 1.00 0.00 H new ATOM 0 HD12 LEU B 77 151.682 -3.096 4.866 1.00 0.00 H new ATOM 0 HD13 LEU B 77 152.620 -2.103 6.007 1.00 0.00 H new ATOM 0 HD21 LEU B 77 150.294 -1.410 7.882 1.00 0.00 H new ATOM 0 HD22 LEU B 77 151.507 -0.260 7.270 1.00 0.00 H new ATOM 0 HD23 LEU B 77 149.773 0.063 7.031 1.00 0.00 H new ATOM 2643 N VAL B 78 150.122 1.003 2.190 1.00 0.00 N ATOM 2644 CA VAL B 78 150.390 1.795 0.994 1.00 0.00 C ATOM 2645 C VAL B 78 149.641 3.123 1.047 1.00 0.00 C ATOM 2646 O VAL B 78 150.142 4.147 0.583 1.00 0.00 O ATOM 2647 CB VAL B 78 149.966 1.018 -0.254 1.00 0.00 C ATOM 2648 CG1 VAL B 78 150.847 -0.222 -0.411 1.00 0.00 C ATOM 2649 CG2 VAL B 78 148.504 0.589 -0.112 1.00 0.00 C ATOM 0 H VAL B 78 149.911 0.021 2.012 1.00 0.00 H new ATOM 0 HA VAL B 78 151.460 1.997 0.951 1.00 0.00 H new ATOM 0 HB VAL B 78 150.077 1.654 -1.132 1.00 0.00 H new ATOM 0 HG11 VAL B 78 150.543 -0.774 -1.300 1.00 0.00 H new ATOM 0 HG12 VAL B 78 151.889 0.082 -0.511 1.00 0.00 H new ATOM 0 HG13 VAL B 78 150.738 -0.859 0.466 1.00 0.00 H new ATOM 0 HG21 VAL B 78 148.199 0.035 -1.000 1.00 0.00 H new ATOM 0 HG22 VAL B 78 148.395 -0.046 0.767 1.00 0.00 H new ATOM 0 HG23 VAL B 78 147.875 1.472 -0.002 1.00 0.00 H new ATOM 2659 N ALA B 79 148.440 3.097 1.614 1.00 0.00 N ATOM 2660 CA ALA B 79 147.630 4.306 1.719 1.00 0.00 C ATOM 2661 C ALA B 79 148.258 5.294 2.697 1.00 0.00 C ATOM 2662 O ALA B 79 148.201 6.507 2.492 1.00 0.00 O ATOM 2663 CB ALA B 79 146.219 3.949 2.188 1.00 0.00 C ATOM 0 H ALA B 79 148.008 2.260 2.005 1.00 0.00 H new ATOM 0 HA ALA B 79 147.580 4.772 0.735 1.00 0.00 H new ATOM 0 HB1 ALA B 79 145.620 4.857 2.264 1.00 0.00 H new ATOM 0 HB2 ALA B 79 145.758 3.269 1.471 1.00 0.00 H new ATOM 0 HB3 ALA B 79 146.271 3.466 3.164 1.00 0.00 H new ATOM 2669 N ALA B 80 148.857 4.770 3.762 1.00 0.00 N ATOM 2670 CA ALA B 80 149.489 5.618 4.766 1.00 0.00 C ATOM 2671 C ALA B 80 150.682 6.361 4.172 1.00 0.00 C ATOM 2672 O ALA B 80 150.803 7.577 4.319 1.00 0.00 O ATOM 2673 CB ALA B 80 149.955 4.769 5.949 1.00 0.00 C ATOM 0 H ALA B 80 148.918 3.770 3.951 1.00 0.00 H new ATOM 0 HA ALA B 80 148.755 6.348 5.108 1.00 0.00 H new ATOM 0 HB1 ALA B 80 150.426 5.410 6.694 1.00 0.00 H new ATOM 0 HB2 ALA B 80 149.098 4.264 6.394 1.00 0.00 H new ATOM 0 HB3 ALA B 80 150.674 4.026 5.603 1.00 0.00 H new ATOM 2679 N LEU B 81 151.561 5.622 3.503 1.00 0.00 N ATOM 2680 CA LEU B 81 152.743 6.223 2.895 1.00 0.00 C ATOM 2681 C LEU B 81 152.343 7.223 1.815 1.00 0.00 C ATOM 2682 O LEU B 81 152.997 8.252 1.636 1.00 0.00 O ATOM 2683 CB LEU B 81 153.626 5.135 2.281 1.00 0.00 C ATOM 2684 CG LEU B 81 154.473 4.486 3.377 1.00 0.00 C ATOM 2685 CD1 LEU B 81 153.561 3.742 4.355 1.00 0.00 C ATOM 2686 CD2 LEU B 81 155.454 3.497 2.743 1.00 0.00 C ATOM 0 H LEU B 81 151.479 4.614 3.369 1.00 0.00 H new ATOM 0 HA LEU B 81 153.299 6.748 3.672 1.00 0.00 H new ATOM 0 HB2 LEU B 81 153.007 4.383 1.792 1.00 0.00 H new ATOM 0 HB3 LEU B 81 154.271 5.565 1.515 1.00 0.00 H new ATOM 0 HG LEU B 81 155.027 5.257 3.912 1.00 0.00 H new ATOM 0 HD11 LEU B 81 154.165 3.280 5.136 1.00 0.00 H new ATOM 0 HD12 LEU B 81 152.861 4.445 4.806 1.00 0.00 H new ATOM 0 HD13 LEU B 81 153.007 2.971 3.821 1.00 0.00 H new ATOM 0 HD21 LEU B 81 156.058 3.034 3.523 1.00 0.00 H new ATOM 0 HD22 LEU B 81 154.899 2.726 2.208 1.00 0.00 H new ATOM 0 HD23 LEU B 81 156.104 4.026 2.046 1.00 0.00 H new ATOM 2698 N THR B 82 151.268 6.916 1.098 1.00 0.00 N ATOM 2699 CA THR B 82 150.794 7.799 0.037 1.00 0.00 C ATOM 2700 C THR B 82 150.541 9.202 0.580 1.00 0.00 C ATOM 2701 O THR B 82 150.893 10.196 -0.056 1.00 0.00 O ATOM 2702 CB THR B 82 149.503 7.244 -0.567 1.00 0.00 C ATOM 2703 OG1 THR B 82 149.733 5.924 -1.041 1.00 0.00 O ATOM 2704 CG2 THR B 82 149.058 8.135 -1.729 1.00 0.00 C ATOM 0 H THR B 82 150.712 6.071 1.229 1.00 0.00 H new ATOM 0 HA THR B 82 151.562 7.853 -0.734 1.00 0.00 H new ATOM 0 HB THR B 82 148.723 7.226 0.194 1.00 0.00 H new ATOM 0 HG1 THR B 82 149.445 5.278 -0.363 1.00 0.00 H new ATOM 0 HG21 THR B 82 148.138 7.739 -2.159 1.00 0.00 H new ATOM 0 HG22 THR B 82 148.882 9.147 -1.365 1.00 0.00 H new ATOM 0 HG23 THR B 82 149.836 8.154 -2.492 1.00 0.00 H new ATOM 2712 N VAL B 83 149.928 9.275 1.756 1.00 0.00 N ATOM 2713 CA VAL B 83 149.633 10.563 2.374 1.00 0.00 C ATOM 2714 C VAL B 83 150.922 11.292 2.737 1.00 0.00 C ATOM 2715 O VAL B 83 151.035 12.504 2.551 1.00 0.00 O ATOM 2716 CB VAL B 83 148.791 10.357 3.634 1.00 0.00 C ATOM 2717 CG1 VAL B 83 148.512 11.711 4.288 1.00 0.00 C ATOM 2718 CG2 VAL B 83 147.464 9.693 3.255 1.00 0.00 C ATOM 0 H VAL B 83 149.627 8.464 2.297 1.00 0.00 H new ATOM 0 HA VAL B 83 149.076 11.168 1.659 1.00 0.00 H new ATOM 0 HB VAL B 83 149.332 9.720 4.333 1.00 0.00 H new ATOM 0 HG11 VAL B 83 147.912 11.565 5.186 1.00 0.00 H new ATOM 0 HG12 VAL B 83 149.455 12.187 4.556 1.00 0.00 H new ATOM 0 HG13 VAL B 83 147.970 12.348 3.589 1.00 0.00 H new ATOM 0 HG21 VAL B 83 146.862 9.545 4.152 1.00 0.00 H new ATOM 0 HG22 VAL B 83 146.924 10.332 2.557 1.00 0.00 H new ATOM 0 HG23 VAL B 83 147.660 8.729 2.787 1.00 0.00 H new ATOM 2728 N ALA B 84 151.893 10.547 3.255 1.00 0.00 N ATOM 2729 CA ALA B 84 153.170 11.135 3.640 1.00 0.00 C ATOM 2730 C ALA B 84 153.817 11.837 2.451 1.00 0.00 C ATOM 2731 O ALA B 84 154.336 12.947 2.580 1.00 0.00 O ATOM 2732 CB ALA B 84 154.109 10.047 4.165 1.00 0.00 C ATOM 0 H ALA B 84 151.821 9.542 3.417 1.00 0.00 H new ATOM 0 HA ALA B 84 152.988 11.868 4.426 1.00 0.00 H new ATOM 0 HB1 ALA B 84 155.061 10.495 4.450 1.00 0.00 H new ATOM 0 HB2 ALA B 84 153.659 9.566 5.034 1.00 0.00 H new ATOM 0 HB3 ALA B 84 154.277 9.304 3.385 1.00 0.00 H new ATOM 2738 N CYS B 85 153.781 11.184 1.295 1.00 0.00 N ATOM 2739 CA CYS B 85 154.366 11.756 0.087 1.00 0.00 C ATOM 2740 C CYS B 85 153.528 12.929 -0.411 1.00 0.00 C ATOM 2741 O CYS B 85 154.041 13.839 -1.062 1.00 0.00 O ATOM 2742 CB CYS B 85 154.456 10.689 -1.005 1.00 0.00 C ATOM 2743 SG CYS B 85 155.242 9.203 -0.333 1.00 0.00 S ATOM 0 H CYS B 85 153.357 10.265 1.168 1.00 0.00 H new ATOM 0 HA CYS B 85 155.367 12.116 0.326 1.00 0.00 H new ATOM 0 HB2 CYS B 85 153.460 10.450 -1.378 1.00 0.00 H new ATOM 0 HB3 CYS B 85 155.031 11.067 -1.851 1.00 0.00 H new ATOM 0 HG CYS B 85 154.448 8.645 0.532 1.00 0.00 H new ATOM 2749 N ASN B 86 152.236 12.899 -0.102 1.00 0.00 N ATOM 2750 CA ASN B 86 151.335 13.966 -0.525 1.00 0.00 C ATOM 2751 C ASN B 86 151.277 15.068 0.529 1.00 0.00 C ATOM 2752 O ASN B 86 151.332 14.796 1.729 1.00 0.00 O ATOM 2753 CB ASN B 86 149.931 13.403 -0.755 1.00 0.00 C ATOM 2754 CG ASN B 86 149.870 12.693 -2.103 1.00 0.00 C ATOM 2755 OD1 ASN B 86 150.587 11.718 -2.325 1.00 0.00 O ATOM 2756 ND2 ASN B 86 149.050 13.126 -3.022 1.00 0.00 N ATOM 0 H ASN B 86 151.792 12.154 0.435 1.00 0.00 H new ATOM 0 HA ASN B 86 151.714 14.389 -1.456 1.00 0.00 H new ATOM 0 HB2 ASN B 86 149.673 12.708 0.044 1.00 0.00 H new ATOM 0 HB3 ASN B 86 149.197 14.209 -0.725 1.00 0.00 H new ATOM 0 HD21 ASN B 86 149.003 12.656 -3.926 1.00 0.00 H new ATOM 0 HD22 ASN B 86 148.456 13.934 -2.836 1.00 0.00 H new