USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1137 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 113 SER OG : rot 180:sc= -0.499 USER MOD Set 1.2: A 117 GLN : amide:sc= -5.53! K(o=-6!,f=-1.4) USER MOD Set 2.1: A 21 MET CE :methyl 156:sc= -5.43 (180deg=-4.45!) USER MOD Set 2.2: A 28 CYS SG : rot -30:sc= -3.93 USER MOD Set 3.1: A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 46 GLN : amide:sc= -5.17! C(o=-5.2!,f=-7.9!) USER MOD Set 4.1: A 3 ASN : amide:sc= -3.12 K(o=-3.1,f=-2.3!) USER MOD Set 4.2: A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 HIS : no HD1:sc= -1.02 X(o=-1,f=-0.69) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -5.37! K(o=-5.4!,f=-2.3) USER MOD Single : A 15 HIS : no HE2:sc= -3.53! C(o=-3.5!,f=-3.4!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot -29:sc= -4.44! USER MOD Single : A 22 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0261) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot -60:sc= -6.85! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= -8.57! C(o=-8.6!,f=-12!) USER MOD Single : A 33 HIS : no HD1:sc= 0.0246 K(o=0.025,f=-1.3) USER MOD Single : A 40 LYS NZ :NH3+ 160:sc= -0.0067 (180deg=-0.164) USER MOD Single : A 44 MET CE :methyl 151:sc= -0.176 (180deg=-0.48) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 MET CE :methyl 148:sc= -4.63! (180deg=-10.3!) USER MOD Single : A 63 ASN : amide:sc= -2 X(o=-2,f=-2.2) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= -2.28 K(o=-2.3,f=-5.6!) USER MOD Single : A 78 LYS NZ :NH3+ -156:sc= -0.0927 (180deg=-0.448) USER MOD Single : A 80 SER OG : rot -83:sc= 1.27 USER MOD Single : A 81 ASN : amide:sc= -0.917 K(o=-0.92,f=-4.9!) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -1.5 K(o=-1.5,f=-2.3!) USER MOD Single : A 86 CYS SG : rot -24:sc= 0.0352 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.7!) USER MOD Single : A 95 LYS NZ :NH3+ -155:sc= -0.0517 (180deg=-0.534) USER MOD Single : A 99 LYS NZ :NH3+ -164:sc= -3.18 (180deg=-4.35) USER MOD Single : A 102 ASN : amide:sc= -6.34! C(o=-6.3!,f=-14!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc=-0.00459 (180deg=-0.00459) USER MOD Single : A 120 GLN : amide:sc= -8.1! C(o=-8.1!,f=-13!) USER MOD Single : A 122 MET CE :methyl 150:sc= -7.51! (180deg=-11.6!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -10.4! C(o=-10!,f=-21!) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -1.69 K(o=-1.7,f=-2.9!) USER MOD Single : A 138 GLN : amide:sc= -0.881 K(o=-0.88,f=0) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 -18.115 -0.906 -5.802 1.00 0.00 N ATOM 21 CA GLU A 2 -17.381 -1.609 -6.849 1.00 0.00 C ATOM 22 C GLU A 2 -15.875 -1.617 -6.589 1.00 0.00 C ATOM 23 O GLU A 2 -15.252 -2.678 -6.536 1.00 0.00 O ATOM 24 CB GLU A 2 -17.669 -0.969 -8.209 1.00 0.00 C ATOM 25 CG GLU A 2 -19.128 -1.064 -8.629 1.00 0.00 C ATOM 26 CD GLU A 2 -19.307 -1.015 -10.134 1.00 0.00 C ATOM 27 OE1 GLU A 2 -18.531 -1.685 -10.846 1.00 0.00 O ATOM 28 OE2 GLU A 2 -20.224 -0.306 -10.599 1.00 0.00 O ATOM 0 HA GLU A 2 -17.721 -2.644 -6.848 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -17.376 0.080 -8.177 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -17.049 -1.450 -8.966 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -19.552 -1.992 -8.247 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -19.687 -0.247 -8.174 1.00 0.00 H new ATOM 35 N ASN A 3 -15.292 -0.431 -6.447 1.00 0.00 N ATOM 36 CA ASN A 3 -13.857 -0.301 -6.218 1.00 0.00 C ATOM 37 C ASN A 3 -13.427 -0.939 -4.902 1.00 0.00 C ATOM 38 O ASN A 3 -12.341 -1.509 -4.807 1.00 0.00 O ATOM 39 CB ASN A 3 -13.463 1.172 -6.202 1.00 0.00 C ATOM 40 CG ASN A 3 -13.944 1.926 -7.422 1.00 0.00 C ATOM 41 OD1 ASN A 3 -14.523 1.349 -8.340 1.00 0.00 O ATOM 42 ND2 ASN A 3 -13.699 3.229 -7.431 1.00 0.00 N ATOM 0 H ASN A 3 -15.793 0.457 -6.487 1.00 0.00 H new ATOM 0 HA ASN A 3 -13.354 -0.822 -7.032 1.00 0.00 H new ATOM 0 HB2 ASN A 3 -13.871 1.642 -5.307 1.00 0.00 H new ATOM 0 HB3 ASN A 3 -12.378 1.251 -6.137 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -13.995 3.798 -8.224 1.00 0.00 H new ATOM 0 HD22 ASN A 3 -13.215 3.662 -6.645 1.00 0.00 H new ATOM 49 N LEU A 4 -14.268 -0.817 -3.883 1.00 0.00 N ATOM 50 CA LEU A 4 -13.954 -1.361 -2.568 1.00 0.00 C ATOM 51 C LEU A 4 -13.628 -2.845 -2.646 1.00 0.00 C ATOM 52 O LEU A 4 -12.644 -3.300 -2.069 1.00 0.00 O ATOM 53 CB LEU A 4 -15.112 -1.115 -1.600 1.00 0.00 C ATOM 54 CG LEU A 4 -14.925 0.089 -0.678 1.00 0.00 C ATOM 55 CD1 LEU A 4 -16.262 0.553 -0.121 1.00 0.00 C ATOM 56 CD2 LEU A 4 -13.962 -0.251 0.449 1.00 0.00 C ATOM 0 H LEU A 4 -15.171 -0.347 -3.941 1.00 0.00 H new ATOM 0 HA LEU A 4 -13.069 -0.846 -2.194 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -16.027 -0.976 -2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -15.253 -2.006 -0.988 1.00 0.00 H new ATOM 0 HG LEU A 4 -14.499 0.906 -1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -16.106 1.411 0.533 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -16.919 0.838 -0.943 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -16.720 -0.257 0.447 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -13.839 0.617 1.097 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -14.360 -1.084 1.029 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -12.995 -0.530 0.030 1.00 0.00 H new ATOM 68 N LYS A 5 -14.447 -3.597 -3.363 1.00 0.00 N ATOM 69 CA LYS A 5 -14.215 -5.031 -3.500 1.00 0.00 C ATOM 70 C LYS A 5 -12.899 -5.297 -4.221 1.00 0.00 C ATOM 71 O LYS A 5 -12.294 -6.355 -4.058 1.00 0.00 O ATOM 72 CB LYS A 5 -15.370 -5.707 -4.243 1.00 0.00 C ATOM 73 CG LYS A 5 -16.743 -5.172 -3.869 1.00 0.00 C ATOM 74 CD LYS A 5 -16.949 -5.147 -2.362 1.00 0.00 C ATOM 75 CE LYS A 5 -18.335 -4.640 -1.995 1.00 0.00 C ATOM 76 NZ LYS A 5 -19.237 -5.745 -1.569 1.00 0.00 N ATOM 0 H LYS A 5 -15.269 -3.247 -3.855 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.157 -5.456 -2.498 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -15.222 -5.581 -5.315 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -15.341 -6.778 -4.041 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -16.862 -4.165 -4.269 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.512 -5.791 -4.331 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.809 -6.150 -1.958 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -16.194 -4.510 -1.901 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -18.253 -3.909 -1.191 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -18.771 -4.125 -2.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -20.171 -5.357 -1.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -19.337 -6.430 -2.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.834 -6.221 -0.736 1.00 0.00 H new ATOM 90 N HIS A 6 -12.449 -4.319 -5.000 1.00 0.00 N ATOM 91 CA HIS A 6 -11.189 -4.442 -5.720 1.00 0.00 C ATOM 92 C HIS A 6 -10.050 -3.970 -4.828 1.00 0.00 C ATOM 93 O HIS A 6 -8.932 -4.480 -4.895 1.00 0.00 O ATOM 94 CB HIS A 6 -11.225 -3.629 -7.016 1.00 0.00 C ATOM 95 CG HIS A 6 -10.581 -4.326 -8.176 1.00 0.00 C ATOM 96 ND1 HIS A 6 -10.579 -5.697 -8.324 1.00 0.00 N ATOM 97 CD2 HIS A 6 -9.910 -3.833 -9.245 1.00 0.00 C ATOM 98 CE1 HIS A 6 -9.936 -6.018 -9.433 1.00 0.00 C ATOM 99 NE2 HIS A 6 -9.522 -4.906 -10.010 1.00 0.00 N ATOM 0 H HIS A 6 -12.937 -3.436 -5.148 1.00 0.00 H new ATOM 0 HA HIS A 6 -11.031 -5.488 -5.984 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -12.262 -3.405 -7.267 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -10.724 -2.675 -6.851 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -9.716 -2.792 -9.456 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -9.777 -7.020 -9.804 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -8.998 -4.852 -10.884 1.00 0.00 H new ATOM 108 N ILE A 7 -10.362 -2.997 -3.979 1.00 0.00 N ATOM 109 CA ILE A 7 -9.399 -2.442 -3.043 1.00 0.00 C ATOM 110 C ILE A 7 -9.163 -3.411 -1.890 1.00 0.00 C ATOM 111 O ILE A 7 -8.024 -3.681 -1.515 1.00 0.00 O ATOM 112 CB ILE A 7 -9.911 -1.091 -2.499 1.00 0.00 C ATOM 113 CG1 ILE A 7 -9.611 0.024 -3.504 1.00 0.00 C ATOM 114 CG2 ILE A 7 -9.305 -0.754 -1.140 1.00 0.00 C ATOM 115 CD1 ILE A 7 -10.847 0.680 -4.076 1.00 0.00 C ATOM 0 H ILE A 7 -11.288 -2.574 -3.922 1.00 0.00 H new ATOM 0 HA ILE A 7 -8.456 -2.282 -3.565 1.00 0.00 H new ATOM 0 HB ILE A 7 -10.989 -1.177 -2.361 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -9.000 0.784 -3.017 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -9.018 -0.386 -4.321 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -9.693 0.205 -0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -9.568 -1.531 -0.422 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -8.220 -0.695 -1.230 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -10.553 1.459 -4.779 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -11.449 -0.067 -4.593 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -11.431 1.122 -3.269 1.00 0.00 H new ATOM 127 N ILE A 8 -10.253 -3.930 -1.335 1.00 0.00 N ATOM 128 CA ILE A 8 -10.173 -4.870 -0.230 1.00 0.00 C ATOM 129 C ILE A 8 -9.503 -6.154 -0.682 1.00 0.00 C ATOM 130 O ILE A 8 -8.556 -6.634 -0.058 1.00 0.00 O ATOM 131 CB ILE A 8 -11.570 -5.210 0.310 1.00 0.00 C ATOM 132 CG1 ILE A 8 -12.333 -3.933 0.667 1.00 0.00 C ATOM 133 CG2 ILE A 8 -11.470 -6.132 1.515 1.00 0.00 C ATOM 134 CD1 ILE A 8 -13.833 -4.126 0.733 1.00 0.00 C ATOM 0 H ILE A 8 -11.203 -3.713 -1.635 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.588 -4.400 0.560 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.123 -5.731 -0.472 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.979 -3.565 1.630 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -12.105 -3.164 -0.072 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -12.470 -6.361 1.882 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.970 -7.056 1.226 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -10.898 -5.641 2.302 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -14.310 -3.181 0.991 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -14.199 -4.465 -0.236 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -14.071 -4.871 1.492 1.00 0.00 H new ATOM 146 N THR A 9 -10.000 -6.700 -1.784 1.00 0.00 N ATOM 147 CA THR A 9 -9.447 -7.928 -2.339 1.00 0.00 C ATOM 148 C THR A 9 -7.981 -7.718 -2.689 1.00 0.00 C ATOM 149 O THR A 9 -7.122 -8.519 -2.324 1.00 0.00 O ATOM 150 CB THR A 9 -10.238 -8.368 -3.575 1.00 0.00 C ATOM 151 OG1 THR A 9 -10.022 -9.741 -3.846 1.00 0.00 O ATOM 152 CG2 THR A 9 -9.881 -7.593 -4.823 1.00 0.00 C ATOM 0 H THR A 9 -10.783 -6.313 -2.310 1.00 0.00 H new ATOM 0 HA THR A 9 -9.524 -8.718 -1.592 1.00 0.00 H new ATOM 0 HB THR A 9 -11.282 -8.172 -3.333 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.537 -10.003 -4.638 1.00 0.00 H new ATOM 0 HG21 THR A 9 -10.478 -7.956 -5.660 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.084 -6.534 -4.664 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.823 -7.730 -5.046 1.00 0.00 H new ATOM 160 N LEU A 10 -7.701 -6.615 -3.381 1.00 0.00 N ATOM 161 CA LEU A 10 -6.337 -6.289 -3.750 1.00 0.00 C ATOM 162 C LEU A 10 -5.534 -6.004 -2.499 1.00 0.00 C ATOM 163 O LEU A 10 -4.342 -6.303 -2.430 1.00 0.00 O ATOM 164 CB LEU A 10 -6.286 -5.088 -4.696 1.00 0.00 C ATOM 165 CG LEU A 10 -4.895 -4.762 -5.249 1.00 0.00 C ATOM 166 CD1 LEU A 10 -4.103 -6.037 -5.511 1.00 0.00 C ATOM 167 CD2 LEU A 10 -5.012 -3.932 -6.519 1.00 0.00 C ATOM 0 H LEU A 10 -8.399 -5.940 -3.693 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.908 -7.141 -4.277 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -6.959 -5.274 -5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -6.666 -4.213 -4.169 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.357 -4.179 -4.502 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.119 -5.780 -5.903 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.989 -6.592 -4.580 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.634 -6.652 -6.238 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -4.016 -3.708 -6.900 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -5.570 -4.492 -7.269 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.534 -3.001 -6.298 1.00 0.00 H new ATOM 179 N GLY A 11 -6.205 -5.455 -1.489 1.00 0.00 N ATOM 180 CA GLY A 11 -5.533 -5.184 -0.242 1.00 0.00 C ATOM 181 C GLY A 11 -5.031 -6.471 0.369 1.00 0.00 C ATOM 182 O GLY A 11 -4.017 -6.489 1.063 1.00 0.00 O ATOM 0 H GLY A 11 -7.192 -5.197 -1.516 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -4.699 -4.503 -0.410 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -6.216 -4.687 0.447 1.00 0.00 H new ATOM 186 N GLN A 12 -5.746 -7.560 0.079 1.00 0.00 N ATOM 187 CA GLN A 12 -5.376 -8.877 0.574 1.00 0.00 C ATOM 188 C GLN A 12 -4.248 -9.460 -0.263 1.00 0.00 C ATOM 189 O GLN A 12 -3.343 -10.108 0.261 1.00 0.00 O ATOM 190 CB GLN A 12 -6.584 -9.816 0.548 1.00 0.00 C ATOM 191 CG GLN A 12 -7.686 -9.419 1.514 1.00 0.00 C ATOM 192 CD GLN A 12 -7.177 -9.218 2.927 1.00 0.00 C ATOM 193 OE1 GLN A 12 -6.286 -9.931 3.387 1.00 0.00 O ATOM 194 NE2 GLN A 12 -7.745 -8.241 3.623 1.00 0.00 N ATOM 0 H GLN A 12 -6.587 -7.550 -0.499 1.00 0.00 H new ATOM 0 HA GLN A 12 -5.033 -8.773 1.604 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -6.991 -9.842 -0.463 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -6.252 -10.827 0.784 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -8.155 -8.499 1.166 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -8.458 -10.189 1.516 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -8.481 -7.675 3.200 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -7.446 -8.056 4.580 1.00 0.00 H new ATOM 203 N VAL A 13 -4.293 -9.207 -1.568 1.00 0.00 N ATOM 204 CA VAL A 13 -3.258 -9.691 -2.464 1.00 0.00 C ATOM 205 C VAL A 13 -1.971 -8.945 -2.186 1.00 0.00 C ATOM 206 O VAL A 13 -0.963 -9.537 -1.814 1.00 0.00 O ATOM 207 CB VAL A 13 -3.659 -9.505 -3.933 1.00 0.00 C ATOM 208 CG1 VAL A 13 -2.462 -9.676 -4.855 1.00 0.00 C ATOM 209 CG2 VAL A 13 -4.769 -10.476 -4.291 1.00 0.00 C ATOM 0 H VAL A 13 -5.033 -8.672 -2.023 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.119 -10.758 -2.287 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.028 -8.488 -4.067 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.777 -9.539 -5.889 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.702 -8.936 -4.606 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -2.048 -10.677 -4.732 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.049 -10.339 -5.335 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -4.421 -11.498 -4.140 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -5.635 -10.289 -3.655 1.00 0.00 H new ATOM 219 N ILE A 14 -2.029 -7.628 -2.332 1.00 0.00 N ATOM 220 CA ILE A 14 -0.882 -6.780 -2.053 1.00 0.00 C ATOM 221 C ILE A 14 -0.249 -7.203 -0.729 1.00 0.00 C ATOM 222 O ILE A 14 0.960 -7.087 -0.532 1.00 0.00 O ATOM 223 CB ILE A 14 -1.311 -5.295 -1.983 1.00 0.00 C ATOM 224 CG1 ILE A 14 -0.811 -4.532 -3.207 1.00 0.00 C ATOM 225 CG2 ILE A 14 -0.819 -4.630 -0.707 1.00 0.00 C ATOM 226 CD1 ILE A 14 -1.735 -3.412 -3.618 1.00 0.00 C ATOM 0 H ILE A 14 -2.860 -7.125 -2.643 1.00 0.00 H new ATOM 0 HA ILE A 14 -0.154 -6.891 -2.857 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.401 -5.268 -1.974 1.00 0.00 H new ATOM 0 HG12 ILE A 14 0.177 -4.122 -2.995 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -0.696 -5.226 -4.040 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.139 -3.588 -0.693 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -1.234 -5.149 0.157 1.00 0.00 H new ATOM 0 HG23 ILE A 14 0.269 -4.676 -0.669 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.327 -2.906 -4.493 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.716 -3.820 -3.859 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -1.830 -2.699 -2.799 1.00 0.00 H new ATOM 238 N HIS A 15 -1.097 -7.703 0.170 1.00 0.00 N ATOM 239 CA HIS A 15 -0.660 -8.160 1.476 1.00 0.00 C ATOM 240 C HIS A 15 -0.128 -9.592 1.399 1.00 0.00 C ATOM 241 O HIS A 15 0.849 -9.933 2.064 1.00 0.00 O ATOM 242 CB HIS A 15 -1.827 -8.059 2.465 1.00 0.00 C ATOM 243 CG HIS A 15 -1.941 -9.208 3.414 1.00 0.00 C ATOM 244 ND1 HIS A 15 -2.915 -10.173 3.300 1.00 0.00 N ATOM 245 CD2 HIS A 15 -1.198 -9.548 4.493 1.00 0.00 C ATOM 246 CE1 HIS A 15 -2.772 -11.055 4.267 1.00 0.00 C ATOM 247 NE2 HIS A 15 -1.736 -10.702 5.007 1.00 0.00 N ATOM 0 H HIS A 15 -2.099 -7.800 0.009 1.00 0.00 H new ATOM 0 HA HIS A 15 0.155 -7.526 1.824 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -1.720 -7.139 3.040 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -2.757 -7.976 1.902 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -3.636 -10.201 2.579 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -0.343 -9.012 4.877 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -3.396 -11.921 4.428 1.00 0.00 H new ATOM 256 N LYS A 16 -0.776 -10.429 0.588 1.00 0.00 N ATOM 257 CA LYS A 16 -0.347 -11.819 0.448 1.00 0.00 C ATOM 258 C LYS A 16 0.903 -11.924 -0.425 1.00 0.00 C ATOM 259 O LYS A 16 1.807 -12.709 -0.140 1.00 0.00 O ATOM 260 CB LYS A 16 -1.482 -12.680 -0.124 1.00 0.00 C ATOM 261 CG LYS A 16 -1.576 -12.670 -1.642 1.00 0.00 C ATOM 262 CD LYS A 16 -2.917 -13.202 -2.115 1.00 0.00 C ATOM 263 CE LYS A 16 -2.966 -13.324 -3.629 1.00 0.00 C ATOM 264 NZ LYS A 16 -4.056 -14.232 -4.079 1.00 0.00 N ATOM 0 H LYS A 16 -1.588 -10.173 0.026 1.00 0.00 H new ATOM 0 HA LYS A 16 -0.096 -12.195 1.440 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -1.347 -13.708 0.212 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.429 -12.332 0.289 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.435 -11.654 -2.011 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -0.773 -13.276 -2.062 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -3.102 -14.177 -1.664 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.713 -12.538 -1.777 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -3.112 -12.337 -4.068 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -2.009 -13.697 -3.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -4.055 -14.288 -5.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -3.904 -15.181 -3.681 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -4.972 -13.863 -3.753 1.00 0.00 H new ATOM 278 N ARG A 17 0.949 -11.127 -1.487 1.00 0.00 N ATOM 279 CA ARG A 17 2.087 -11.128 -2.399 1.00 0.00 C ATOM 280 C ARG A 17 3.311 -10.500 -1.740 1.00 0.00 C ATOM 281 O ARG A 17 4.443 -10.906 -1.999 1.00 0.00 O ATOM 282 CB ARG A 17 1.738 -10.377 -3.686 1.00 0.00 C ATOM 283 CG ARG A 17 1.626 -11.277 -4.905 1.00 0.00 C ATOM 284 CD ARG A 17 1.610 -10.468 -6.193 1.00 0.00 C ATOM 285 NE ARG A 17 0.718 -11.048 -7.194 1.00 0.00 N ATOM 286 CZ ARG A 17 0.246 -10.379 -8.243 1.00 0.00 C ATOM 287 NH1 ARG A 17 0.578 -9.107 -8.432 1.00 0.00 N ATOM 288 NH2 ARG A 17 -0.558 -10.981 -9.107 1.00 0.00 N ATOM 0 H ARG A 17 0.210 -10.471 -1.738 1.00 0.00 H new ATOM 0 HA ARG A 17 2.323 -12.163 -2.647 1.00 0.00 H new ATOM 0 HB2 ARG A 17 0.794 -9.851 -3.545 1.00 0.00 H new ATOM 0 HB3 ARG A 17 2.500 -9.620 -3.873 1.00 0.00 H new ATOM 0 HG2 ARG A 17 2.463 -11.975 -4.922 1.00 0.00 H new ATOM 0 HG3 ARG A 17 0.716 -11.873 -4.837 1.00 0.00 H new ATOM 0 HD2 ARG A 17 1.296 -9.447 -5.976 1.00 0.00 H new ATOM 0 HD3 ARG A 17 2.620 -10.411 -6.598 1.00 0.00 H new ATOM 0 HE ARG A 17 0.441 -12.023 -7.082 1.00 0.00 H new ATOM 0 HH11 ARG A 17 1.198 -8.638 -7.771 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.213 -8.599 -9.238 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.816 -11.958 -8.968 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -0.919 -10.467 -9.911 1.00 0.00 H new ATOM 302 N CYS A 18 3.078 -9.514 -0.880 1.00 0.00 N ATOM 303 CA CYS A 18 4.170 -8.849 -0.183 1.00 0.00 C ATOM 304 C CYS A 18 4.629 -9.694 0.998 1.00 0.00 C ATOM 305 O CYS A 18 5.810 -9.711 1.345 1.00 0.00 O ATOM 306 CB CYS A 18 3.742 -7.456 0.287 1.00 0.00 C ATOM 307 SG CYS A 18 2.698 -7.445 1.763 1.00 0.00 S ATOM 0 H CYS A 18 2.149 -9.160 -0.651 1.00 0.00 H new ATOM 0 HA CYS A 18 5.004 -8.732 -0.875 1.00 0.00 H new ATOM 0 HB2 CYS A 18 4.635 -6.864 0.486 1.00 0.00 H new ATOM 0 HB3 CYS A 18 3.207 -6.962 -0.524 1.00 0.00 H new ATOM 0 HG CYS A 18 2.002 -8.542 1.810 1.00 0.00 H new ATOM 313 N GLU A 19 3.684 -10.405 1.602 1.00 0.00 N ATOM 314 CA GLU A 19 3.987 -11.269 2.733 1.00 0.00 C ATOM 315 C GLU A 19 4.829 -12.454 2.276 1.00 0.00 C ATOM 316 O GLU A 19 5.613 -13.006 3.047 1.00 0.00 O ATOM 317 CB GLU A 19 2.697 -11.763 3.388 1.00 0.00 C ATOM 318 CG GLU A 19 2.201 -10.867 4.511 1.00 0.00 C ATOM 319 CD GLU A 19 2.692 -11.316 5.875 1.00 0.00 C ATOM 320 OE1 GLU A 19 3.914 -11.240 6.120 1.00 0.00 O ATOM 321 OE2 GLU A 19 1.852 -11.744 6.695 1.00 0.00 O ATOM 0 H GLU A 19 2.702 -10.399 1.326 1.00 0.00 H new ATOM 0 HA GLU A 19 4.552 -10.695 3.467 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.920 -11.841 2.627 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.860 -12.767 3.781 1.00 0.00 H new ATOM 0 HG2 GLU A 19 2.532 -9.845 4.328 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.111 -10.855 4.507 1.00 0.00 H new ATOM 328 N GLU A 20 4.661 -12.836 1.012 1.00 0.00 N ATOM 329 CA GLU A 20 5.408 -13.956 0.449 1.00 0.00 C ATOM 330 C GLU A 20 6.649 -13.476 -0.309 1.00 0.00 C ATOM 331 O GLU A 20 7.383 -14.283 -0.879 1.00 0.00 O ATOM 332 CB GLU A 20 4.515 -14.781 -0.480 1.00 0.00 C ATOM 333 CG GLU A 20 4.042 -14.020 -1.708 1.00 0.00 C ATOM 334 CD GLU A 20 4.404 -14.717 -3.005 1.00 0.00 C ATOM 335 OE1 GLU A 20 4.437 -15.965 -3.020 1.00 0.00 O ATOM 336 OE2 GLU A 20 4.656 -14.013 -4.006 1.00 0.00 O ATOM 0 H GLU A 20 4.016 -12.388 0.361 1.00 0.00 H new ATOM 0 HA GLU A 20 5.738 -14.583 1.278 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.061 -15.668 -0.801 1.00 0.00 H new ATOM 0 HB3 GLU A 20 3.646 -15.127 0.079 1.00 0.00 H new ATOM 0 HG2 GLU A 20 2.960 -13.894 -1.658 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.480 -13.022 -1.702 1.00 0.00 H new ATOM 343 N MET A 21 6.882 -12.162 -0.312 1.00 0.00 N ATOM 344 CA MET A 21 8.038 -11.593 -1.001 1.00 0.00 C ATOM 345 C MET A 21 9.335 -12.211 -0.493 1.00 0.00 C ATOM 346 O MET A 21 9.620 -12.182 0.704 1.00 0.00 O ATOM 347 CB MET A 21 8.083 -10.074 -0.810 1.00 0.00 C ATOM 348 CG MET A 21 7.315 -9.298 -1.869 1.00 0.00 C ATOM 349 SD MET A 21 8.093 -9.379 -3.494 1.00 0.00 S ATOM 350 CE MET A 21 8.871 -7.767 -3.595 1.00 0.00 C ATOM 0 H MET A 21 6.288 -11.476 0.153 1.00 0.00 H new ATOM 0 HA MET A 21 7.936 -11.818 -2.063 1.00 0.00 H new ATOM 0 HB2 MET A 21 7.678 -9.829 0.172 1.00 0.00 H new ATOM 0 HB3 MET A 21 9.123 -9.747 -0.816 1.00 0.00 H new ATOM 0 HG2 MET A 21 6.300 -9.691 -1.937 1.00 0.00 H new ATOM 0 HG3 MET A 21 7.233 -8.255 -1.562 1.00 0.00 H new ATOM 0 HE1 MET A 21 9.706 -7.809 -4.294 1.00 0.00 H new ATOM 0 HE2 MET A 21 8.144 -7.033 -3.943 1.00 0.00 H new ATOM 0 HE3 MET A 21 9.237 -7.477 -2.610 1.00 0.00 H new ATOM 360 N LYS A 22 10.121 -12.760 -1.409 1.00 0.00 N ATOM 361 CA LYS A 22 11.394 -13.375 -1.051 1.00 0.00 C ATOM 362 C LYS A 22 12.482 -12.314 -0.900 1.00 0.00 C ATOM 363 O LYS A 22 13.541 -12.576 -0.330 1.00 0.00 O ATOM 364 CB LYS A 22 11.805 -14.401 -2.109 1.00 0.00 C ATOM 365 CG LYS A 22 12.891 -15.356 -1.639 1.00 0.00 C ATOM 366 CD LYS A 22 12.758 -16.719 -2.299 1.00 0.00 C ATOM 367 CE LYS A 22 13.418 -17.807 -1.468 1.00 0.00 C ATOM 368 NZ LYS A 22 12.589 -18.187 -0.290 1.00 0.00 N ATOM 0 H LYS A 22 9.901 -12.793 -2.404 1.00 0.00 H new ATOM 0 HA LYS A 22 11.271 -13.884 -0.095 1.00 0.00 H new ATOM 0 HB2 LYS A 22 10.928 -14.978 -2.404 1.00 0.00 H new ATOM 0 HB3 LYS A 22 12.155 -13.875 -2.997 1.00 0.00 H new ATOM 0 HG2 LYS A 22 13.870 -14.935 -1.866 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.835 -15.468 -0.556 1.00 0.00 H new ATOM 0 HD2 LYS A 22 11.703 -16.956 -2.438 1.00 0.00 H new ATOM 0 HD3 LYS A 22 13.212 -16.691 -3.290 1.00 0.00 H new ATOM 0 HE2 LYS A 22 13.589 -18.686 -2.090 1.00 0.00 H new ATOM 0 HE3 LYS A 22 14.395 -17.462 -1.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 12.995 -19.030 0.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 12.573 -17.402 0.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 11.619 -18.395 -0.601 1.00 0.00 H new ATOM 382 N TYR A 23 12.213 -11.116 -1.415 1.00 0.00 N ATOM 383 CA TYR A 23 13.168 -10.018 -1.334 1.00 0.00 C ATOM 384 C TYR A 23 12.499 -8.754 -0.806 1.00 0.00 C ATOM 385 O TYR A 23 11.291 -8.570 -0.960 1.00 0.00 O ATOM 386 CB TYR A 23 13.786 -9.751 -2.705 1.00 0.00 C ATOM 387 CG TYR A 23 15.018 -10.581 -2.985 1.00 0.00 C ATOM 388 CD1 TYR A 23 14.946 -11.967 -3.032 1.00 0.00 C ATOM 389 CD2 TYR A 23 16.251 -9.979 -3.199 1.00 0.00 C ATOM 390 CE1 TYR A 23 16.070 -12.731 -3.284 1.00 0.00 C ATOM 391 CE2 TYR A 23 17.380 -10.736 -3.453 1.00 0.00 C ATOM 392 CZ TYR A 23 17.283 -12.111 -3.494 1.00 0.00 C ATOM 393 OH TYR A 23 18.404 -12.868 -3.746 1.00 0.00 O ATOM 0 H TYR A 23 11.342 -10.883 -1.892 1.00 0.00 H new ATOM 0 HA TYR A 23 13.957 -10.305 -0.639 1.00 0.00 H new ATOM 0 HB2 TYR A 23 13.041 -9.950 -3.475 1.00 0.00 H new ATOM 0 HB3 TYR A 23 14.045 -8.695 -2.778 1.00 0.00 H new ATOM 0 HD1 TYR A 23 13.997 -12.456 -2.869 1.00 0.00 H new ATOM 0 HD2 TYR A 23 16.329 -8.902 -3.167 1.00 0.00 H new ATOM 0 HE1 TYR A 23 15.998 -13.808 -3.316 1.00 0.00 H new ATOM 0 HE2 TYR A 23 18.332 -10.253 -3.618 1.00 0.00 H new ATOM 0 HH TYR A 23 19.176 -12.278 -3.872 1.00 0.00 H new ATOM 403 N CYS A 24 13.295 -7.886 -0.184 1.00 0.00 N ATOM 404 CA CYS A 24 12.799 -6.631 0.373 1.00 0.00 C ATOM 405 C CYS A 24 11.432 -6.808 1.033 1.00 0.00 C ATOM 406 O CYS A 24 10.601 -5.900 1.015 1.00 0.00 O ATOM 407 CB CYS A 24 12.716 -5.571 -0.722 1.00 0.00 C ATOM 408 SG CYS A 24 14.304 -5.194 -1.500 1.00 0.00 S ATOM 0 H CYS A 24 14.296 -8.032 -0.053 1.00 0.00 H new ATOM 0 HA CYS A 24 13.501 -6.307 1.142 1.00 0.00 H new ATOM 0 HB2 CYS A 24 12.018 -5.909 -1.488 1.00 0.00 H new ATOM 0 HB3 CYS A 24 12.304 -4.655 -0.297 1.00 0.00 H new ATOM 0 HG CYS A 24 15.132 -4.748 -0.602 1.00 0.00 H new ATOM 414 N LYS A 25 11.206 -7.984 1.611 1.00 0.00 N ATOM 415 CA LYS A 25 9.937 -8.275 2.270 1.00 0.00 C ATOM 416 C LYS A 25 9.676 -7.303 3.416 1.00 0.00 C ATOM 417 O LYS A 25 8.533 -7.105 3.819 1.00 0.00 O ATOM 418 CB LYS A 25 9.903 -9.716 2.789 1.00 0.00 C ATOM 419 CG LYS A 25 11.229 -10.206 3.350 1.00 0.00 C ATOM 420 CD LYS A 25 11.052 -11.474 4.173 1.00 0.00 C ATOM 421 CE LYS A 25 11.935 -12.602 3.662 1.00 0.00 C ATOM 422 NZ LYS A 25 12.087 -13.687 4.669 1.00 0.00 N ATOM 0 H LYS A 25 11.882 -8.748 1.637 1.00 0.00 H new ATOM 0 HA LYS A 25 9.149 -8.154 1.526 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.142 -9.793 3.565 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.598 -10.376 1.977 1.00 0.00 H new ATOM 0 HG2 LYS A 25 11.923 -10.396 2.532 1.00 0.00 H new ATOM 0 HG3 LYS A 25 11.673 -9.427 3.970 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.292 -11.268 5.216 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.008 -11.786 4.142 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.507 -13.013 2.748 1.00 0.00 H new ATOM 0 HE3 LYS A 25 12.917 -12.206 3.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.696 -14.437 4.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 12.519 -13.301 5.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.153 -14.083 4.897 1.00 0.00 H new ATOM 436 N LYS A 26 10.735 -6.694 3.937 1.00 0.00 N ATOM 437 CA LYS A 26 10.595 -5.739 5.031 1.00 0.00 C ATOM 438 C LYS A 26 9.683 -4.588 4.616 1.00 0.00 C ATOM 439 O LYS A 26 8.634 -4.358 5.218 1.00 0.00 O ATOM 440 CB LYS A 26 11.964 -5.198 5.448 1.00 0.00 C ATOM 441 CG LYS A 26 12.968 -6.286 5.795 1.00 0.00 C ATOM 442 CD LYS A 26 13.873 -6.608 4.615 1.00 0.00 C ATOM 443 CE LYS A 26 15.301 -6.149 4.864 1.00 0.00 C ATOM 444 NZ LYS A 26 16.272 -6.841 3.973 1.00 0.00 N ATOM 0 H LYS A 26 11.694 -6.843 3.623 1.00 0.00 H new ATOM 0 HA LYS A 26 10.149 -6.254 5.882 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.366 -4.588 4.639 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.839 -4.542 6.310 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.574 -5.966 6.643 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.438 -7.187 6.104 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.862 -7.682 4.430 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.487 -6.126 3.717 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.368 -5.072 4.707 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.566 -6.337 5.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.233 -6.499 4.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.227 -7.866 4.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.035 -6.641 2.980 1.00 0.00 H new ATOM 458 N GLN A 27 10.089 -3.873 3.574 1.00 0.00 N ATOM 459 CA GLN A 27 9.312 -2.752 3.067 1.00 0.00 C ATOM 460 C GLN A 27 8.020 -3.244 2.422 1.00 0.00 C ATOM 461 O GLN A 27 6.967 -2.622 2.562 1.00 0.00 O ATOM 462 CB GLN A 27 10.137 -1.955 2.055 1.00 0.00 C ATOM 463 CG GLN A 27 11.367 -1.306 2.664 1.00 0.00 C ATOM 464 CD GLN A 27 12.538 -1.256 1.704 1.00 0.00 C ATOM 465 OE1 GLN A 27 12.831 -0.214 1.118 1.00 0.00 O ATOM 466 NE2 GLN A 27 13.217 -2.385 1.539 1.00 0.00 N ATOM 0 H GLN A 27 10.954 -4.051 3.064 1.00 0.00 H new ATOM 0 HA GLN A 27 9.055 -2.102 3.903 1.00 0.00 H new ATOM 0 HB2 GLN A 27 10.446 -2.617 1.246 1.00 0.00 H new ATOM 0 HB3 GLN A 27 9.509 -1.183 1.612 1.00 0.00 H new ATOM 0 HG2 GLN A 27 11.119 -0.293 2.981 1.00 0.00 H new ATOM 0 HG3 GLN A 27 11.659 -1.857 3.558 1.00 0.00 H new ATOM 0 HE21 GLN A 27 12.939 -3.226 2.045 1.00 0.00 H new ATOM 0 HE22 GLN A 27 14.016 -2.411 0.906 1.00 0.00 H new ATOM 475 N CYS A 28 8.110 -4.366 1.716 1.00 0.00 N ATOM 476 CA CYS A 28 6.952 -4.945 1.047 1.00 0.00 C ATOM 477 C CYS A 28 5.904 -5.418 2.055 1.00 0.00 C ATOM 478 O CYS A 28 4.757 -4.975 2.019 1.00 0.00 O ATOM 479 CB CYS A 28 7.382 -6.107 0.155 1.00 0.00 C ATOM 480 SG CYS A 28 7.800 -5.619 -1.535 1.00 0.00 S ATOM 0 H CYS A 28 8.975 -4.893 1.592 1.00 0.00 H new ATOM 0 HA CYS A 28 6.501 -4.168 0.430 1.00 0.00 H new ATOM 0 HB2 CYS A 28 8.245 -6.597 0.605 1.00 0.00 H new ATOM 0 HB3 CYS A 28 6.579 -6.843 0.122 1.00 0.00 H new ATOM 0 HG CYS A 28 7.092 -4.583 -1.875 1.00 0.00 H new ATOM 486 N ARG A 29 6.301 -6.323 2.949 1.00 0.00 N ATOM 487 CA ARG A 29 5.384 -6.854 3.959 1.00 0.00 C ATOM 488 C ARG A 29 4.604 -5.732 4.641 1.00 0.00 C ATOM 489 O ARG A 29 3.429 -5.895 4.974 1.00 0.00 O ATOM 490 CB ARG A 29 6.142 -7.684 5.002 1.00 0.00 C ATOM 491 CG ARG A 29 6.919 -6.852 6.012 1.00 0.00 C ATOM 492 CD ARG A 29 6.102 -6.600 7.269 1.00 0.00 C ATOM 493 NE ARG A 29 6.193 -7.711 8.214 1.00 0.00 N ATOM 494 CZ ARG A 29 7.201 -7.883 9.065 1.00 0.00 C ATOM 495 NH1 ARG A 29 8.209 -7.019 9.095 1.00 0.00 N ATOM 496 NH2 ARG A 29 7.202 -8.921 9.890 1.00 0.00 N ATOM 0 H ARG A 29 7.247 -6.703 2.995 1.00 0.00 H new ATOM 0 HA ARG A 29 4.672 -7.503 3.449 1.00 0.00 H new ATOM 0 HB2 ARG A 29 5.431 -8.314 5.536 1.00 0.00 H new ATOM 0 HB3 ARG A 29 6.834 -8.351 4.487 1.00 0.00 H new ATOM 0 HG2 ARG A 29 7.844 -7.366 6.274 1.00 0.00 H new ATOM 0 HG3 ARG A 29 7.200 -5.900 5.562 1.00 0.00 H new ATOM 0 HD2 ARG A 29 6.450 -5.686 7.750 1.00 0.00 H new ATOM 0 HD3 ARG A 29 5.059 -6.440 6.997 1.00 0.00 H new ATOM 0 HE ARG A 29 5.438 -8.396 8.222 1.00 0.00 H new ATOM 0 HH11 ARG A 29 8.213 -6.218 8.463 1.00 0.00 H new ATOM 0 HH12 ARG A 29 8.979 -7.156 9.750 1.00 0.00 H new ATOM 0 HH21 ARG A 29 6.430 -9.587 9.872 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.975 -9.053 10.543 1.00 0.00 H new ATOM 510 N ARG A 30 5.259 -4.592 4.837 1.00 0.00 N ATOM 511 CA ARG A 30 4.617 -3.446 5.470 1.00 0.00 C ATOM 512 C ARG A 30 3.583 -2.835 4.539 1.00 0.00 C ATOM 513 O ARG A 30 2.451 -2.573 4.939 1.00 0.00 O ATOM 514 CB ARG A 30 5.644 -2.383 5.844 1.00 0.00 C ATOM 515 CG ARG A 30 6.328 -2.635 7.178 1.00 0.00 C ATOM 516 CD ARG A 30 7.752 -2.103 7.182 1.00 0.00 C ATOM 517 NE ARG A 30 8.141 -1.585 8.492 1.00 0.00 N ATOM 518 CZ ARG A 30 8.509 -2.355 9.514 1.00 0.00 C ATOM 519 NH1 ARG A 30 8.538 -3.675 9.383 1.00 0.00 N ATOM 520 NH2 ARG A 30 8.850 -1.803 10.671 1.00 0.00 N ATOM 0 H ARG A 30 6.231 -4.438 4.568 1.00 0.00 H new ATOM 0 HA ARG A 30 4.127 -3.800 6.377 1.00 0.00 H new ATOM 0 HB2 ARG A 30 6.401 -2.331 5.062 1.00 0.00 H new ATOM 0 HB3 ARG A 30 5.152 -1.411 5.876 1.00 0.00 H new ATOM 0 HG2 ARG A 30 5.758 -2.159 7.976 1.00 0.00 H new ATOM 0 HG3 ARG A 30 6.337 -3.705 7.387 1.00 0.00 H new ATOM 0 HD2 ARG A 30 8.437 -2.899 6.889 1.00 0.00 H new ATOM 0 HD3 ARG A 30 7.845 -1.312 6.438 1.00 0.00 H new ATOM 0 HE ARG A 30 8.130 -0.575 8.632 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.278 -4.105 8.496 1.00 0.00 H new ATOM 0 HH12 ARG A 30 8.821 -4.259 10.170 1.00 0.00 H new ATOM 0 HH21 ARG A 30 8.830 -0.789 10.778 1.00 0.00 H new ATOM 0 HH22 ARG A 30 9.132 -2.393 11.454 1.00 0.00 H new ATOM 534 N LEU A 31 3.985 -2.606 3.291 1.00 0.00 N ATOM 535 CA LEU A 31 3.096 -2.023 2.292 1.00 0.00 C ATOM 536 C LEU A 31 1.723 -2.684 2.341 1.00 0.00 C ATOM 537 O LEU A 31 0.700 -2.010 2.446 1.00 0.00 O ATOM 538 CB LEU A 31 3.704 -2.174 0.893 1.00 0.00 C ATOM 539 CG LEU A 31 2.734 -1.953 -0.273 1.00 0.00 C ATOM 540 CD1 LEU A 31 1.950 -0.663 -0.081 1.00 0.00 C ATOM 541 CD2 LEU A 31 3.489 -1.935 -1.595 1.00 0.00 C ATOM 0 H LEU A 31 4.922 -2.816 2.948 1.00 0.00 H new ATOM 0 HA LEU A 31 2.976 -0.963 2.515 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.529 -1.468 0.796 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.128 -3.174 0.806 1.00 0.00 H new ATOM 0 HG LEU A 31 2.025 -2.780 -0.295 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.267 -0.524 -0.919 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.380 -0.718 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.641 0.179 -0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.786 -1.777 -2.413 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.221 -1.128 -1.585 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.001 -2.887 -1.735 1.00 0.00 H new ATOM 553 N GLY A 32 1.714 -4.008 2.272 1.00 0.00 N ATOM 554 CA GLY A 32 0.469 -4.741 2.315 1.00 0.00 C ATOM 555 C GLY A 32 -0.177 -4.702 3.684 1.00 0.00 C ATOM 556 O GLY A 32 -1.379 -4.465 3.803 1.00 0.00 O ATOM 0 H GLY A 32 2.550 -4.587 2.187 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.220 -4.325 1.579 1.00 0.00 H new ATOM 0 HA3 GLY A 32 0.651 -5.778 2.031 1.00 0.00 H new ATOM 560 N HIS A 33 0.621 -4.932 4.721 1.00 0.00 N ATOM 561 CA HIS A 33 0.113 -4.915 6.087 1.00 0.00 C ATOM 562 C HIS A 33 -0.511 -3.561 6.402 1.00 0.00 C ATOM 563 O HIS A 33 -1.537 -3.481 7.079 1.00 0.00 O ATOM 564 CB HIS A 33 1.234 -5.225 7.081 1.00 0.00 C ATOM 565 CG HIS A 33 1.261 -6.653 7.528 1.00 0.00 C ATOM 566 ND1 HIS A 33 1.121 -7.033 8.846 1.00 0.00 N ATOM 567 CD2 HIS A 33 1.415 -7.800 6.823 1.00 0.00 C ATOM 568 CE1 HIS A 33 1.187 -8.350 8.933 1.00 0.00 C ATOM 569 NE2 HIS A 33 1.365 -8.838 7.721 1.00 0.00 N ATOM 0 H HIS A 33 1.618 -5.132 4.642 1.00 0.00 H new ATOM 0 HA HIS A 33 -0.654 -5.684 6.179 1.00 0.00 H new ATOM 0 HB2 HIS A 33 2.192 -4.978 6.624 1.00 0.00 H new ATOM 0 HB3 HIS A 33 1.122 -4.582 7.954 1.00 0.00 H new ATOM 0 HD2 HIS A 33 1.552 -7.882 5.755 1.00 0.00 H new ATOM 0 HE1 HIS A 33 1.109 -8.928 9.842 1.00 0.00 H new ATOM 0 HE2 HIS A 33 1.452 -9.827 7.488 1.00 0.00 H new ATOM 578 N ARG A 34 0.099 -2.497 5.885 1.00 0.00 N ATOM 579 CA ARG A 34 -0.422 -1.155 6.094 1.00 0.00 C ATOM 580 C ARG A 34 -1.633 -0.959 5.203 1.00 0.00 C ATOM 581 O ARG A 34 -2.661 -0.431 5.627 1.00 0.00 O ATOM 582 CB ARG A 34 0.647 -0.106 5.790 1.00 0.00 C ATOM 583 CG ARG A 34 1.614 0.120 6.943 1.00 0.00 C ATOM 584 CD ARG A 34 3.061 0.019 6.489 1.00 0.00 C ATOM 585 NE ARG A 34 3.987 0.561 7.480 1.00 0.00 N ATOM 586 CZ ARG A 34 4.262 -0.031 8.640 1.00 0.00 C ATOM 587 NH1 ARG A 34 3.687 -1.185 8.958 1.00 0.00 N ATOM 588 NH2 ARG A 34 5.116 0.531 9.485 1.00 0.00 N ATOM 0 H ARG A 34 0.949 -2.540 5.322 1.00 0.00 H new ATOM 0 HA ARG A 34 -0.713 -1.035 7.138 1.00 0.00 H new ATOM 0 HB2 ARG A 34 1.209 -0.415 4.909 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.160 0.838 5.543 1.00 0.00 H new ATOM 0 HG2 ARG A 34 1.437 1.103 7.379 1.00 0.00 H new ATOM 0 HG3 ARG A 34 1.426 -0.615 7.726 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.308 -1.025 6.296 1.00 0.00 H new ATOM 0 HD3 ARG A 34 3.183 0.555 5.548 1.00 0.00 H new ATOM 0 HE ARG A 34 4.450 1.445 7.271 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.030 -1.623 8.312 1.00 0.00 H new ATOM 0 HH12 ARG A 34 3.902 -1.634 9.848 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.562 1.417 9.246 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.327 0.078 10.374 1.00 0.00 H new ATOM 602 N VAL A 35 -1.510 -1.429 3.964 1.00 0.00 N ATOM 603 CA VAL A 35 -2.607 -1.348 3.008 1.00 0.00 C ATOM 604 C VAL A 35 -3.860 -1.971 3.616 1.00 0.00 C ATOM 605 O VAL A 35 -4.935 -1.373 3.606 1.00 0.00 O ATOM 606 CB VAL A 35 -2.256 -2.070 1.688 1.00 0.00 C ATOM 607 CG1 VAL A 35 -3.511 -2.427 0.902 1.00 0.00 C ATOM 608 CG2 VAL A 35 -1.322 -1.216 0.846 1.00 0.00 C ATOM 0 H VAL A 35 -0.664 -1.868 3.601 1.00 0.00 H new ATOM 0 HA VAL A 35 -2.786 -0.297 2.782 1.00 0.00 H new ATOM 0 HB VAL A 35 -1.745 -2.999 1.940 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.230 -2.934 -0.021 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.140 -3.086 1.501 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -4.062 -1.517 0.663 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.085 -1.740 -0.080 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.807 -0.268 0.613 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.403 -1.027 1.401 1.00 0.00 H new ATOM 618 N LEU A 36 -3.699 -3.173 4.168 1.00 0.00 N ATOM 619 CA LEU A 36 -4.803 -3.879 4.808 1.00 0.00 C ATOM 620 C LEU A 36 -5.500 -2.962 5.802 1.00 0.00 C ATOM 621 O LEU A 36 -6.727 -2.875 5.837 1.00 0.00 O ATOM 622 CB LEU A 36 -4.296 -5.127 5.542 1.00 0.00 C ATOM 623 CG LEU A 36 -3.948 -6.329 4.659 1.00 0.00 C ATOM 624 CD1 LEU A 36 -3.825 -7.585 5.505 1.00 0.00 C ATOM 625 CD2 LEU A 36 -4.994 -6.526 3.577 1.00 0.00 C ATOM 0 H LEU A 36 -2.812 -3.677 4.184 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.506 -4.184 4.033 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.410 -4.853 6.114 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -5.056 -5.436 6.260 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.990 -6.132 4.177 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.577 -8.432 4.865 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.038 -7.448 6.247 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -4.771 -7.777 6.011 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.725 -7.385 2.963 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.966 -6.700 4.038 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.043 -5.634 2.952 1.00 0.00 H new ATOM 637 N GLY A 37 -4.696 -2.271 6.604 1.00 0.00 N ATOM 638 CA GLY A 37 -5.238 -1.357 7.590 1.00 0.00 C ATOM 639 C GLY A 37 -6.098 -0.281 6.961 1.00 0.00 C ATOM 640 O GLY A 37 -6.971 0.287 7.613 1.00 0.00 O ATOM 0 H GLY A 37 -3.678 -2.329 6.588 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.831 -1.916 8.314 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -4.420 -0.891 8.139 1.00 0.00 H new ATOM 644 N LEU A 38 -5.852 -0.003 5.684 1.00 0.00 N ATOM 645 CA LEU A 38 -6.613 1.007 4.960 1.00 0.00 C ATOM 646 C LEU A 38 -7.942 0.420 4.504 1.00 0.00 C ATOM 647 O LEU A 38 -8.956 1.116 4.437 1.00 0.00 O ATOM 648 CB LEU A 38 -5.817 1.515 3.759 1.00 0.00 C ATOM 649 CG LEU A 38 -4.467 2.149 4.102 1.00 0.00 C ATOM 650 CD1 LEU A 38 -3.767 2.615 2.838 1.00 0.00 C ATOM 651 CD2 LEU A 38 -4.647 3.310 5.072 1.00 0.00 C ATOM 0 H LEU A 38 -5.131 -0.464 5.130 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.805 1.849 5.625 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.648 0.683 3.075 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.421 2.248 3.225 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.846 1.395 4.586 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.808 3.064 3.097 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.602 1.763 2.178 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.387 3.353 2.330 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.675 3.746 5.302 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.286 4.067 4.618 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -5.109 2.948 5.991 1.00 0.00 H new ATOM 663 N ILE A 39 -7.924 -0.875 4.208 1.00 0.00 N ATOM 664 CA ILE A 39 -9.118 -1.583 3.776 1.00 0.00 C ATOM 665 C ILE A 39 -9.895 -2.095 4.987 1.00 0.00 C ATOM 666 O ILE A 39 -11.090 -2.379 4.897 1.00 0.00 O ATOM 667 CB ILE A 39 -8.767 -2.764 2.828 1.00 0.00 C ATOM 668 CG1 ILE A 39 -8.883 -4.118 3.543 1.00 0.00 C ATOM 669 CG2 ILE A 39 -7.368 -2.598 2.253 1.00 0.00 C ATOM 670 CD1 ILE A 39 -8.411 -5.291 2.707 1.00 0.00 C ATOM 0 H ILE A 39 -7.088 -1.457 4.261 1.00 0.00 H new ATOM 0 HA ILE A 39 -9.740 -0.881 3.221 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.490 -2.749 2.012 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.302 -4.083 4.465 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -9.923 -4.281 3.827 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -7.144 -3.436 1.593 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -7.315 -1.667 1.689 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.642 -2.572 3.065 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -8.523 -6.213 3.278 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.008 -5.353 1.797 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -7.362 -5.152 2.444 1.00 0.00 H new ATOM 682 N LYS A 40 -9.200 -2.220 6.115 1.00 0.00 N ATOM 683 CA LYS A 40 -9.816 -2.709 7.345 1.00 0.00 C ATOM 684 C LYS A 40 -11.057 -1.891 7.724 1.00 0.00 C ATOM 685 O LYS A 40 -12.156 -2.437 7.803 1.00 0.00 O ATOM 686 CB LYS A 40 -8.798 -2.705 8.492 1.00 0.00 C ATOM 687 CG LYS A 40 -7.920 -3.948 8.544 1.00 0.00 C ATOM 688 CD LYS A 40 -8.745 -5.226 8.520 1.00 0.00 C ATOM 689 CE LYS A 40 -8.071 -6.337 9.306 1.00 0.00 C ATOM 690 NZ LYS A 40 -8.111 -6.085 10.773 1.00 0.00 N ATOM 0 H LYS A 40 -8.210 -1.989 6.202 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.142 -3.734 7.166 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -8.161 -1.826 8.396 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.332 -2.610 9.438 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -7.233 -3.943 7.698 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.312 -3.925 9.448 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.733 -5.031 8.937 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.892 -5.546 7.489 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -8.562 -7.285 9.087 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.034 -6.433 8.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -7.962 -6.979 11.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -7.362 -5.411 11.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -9.037 -5.689 11.032 1.00 0.00 H new ATOM 704 N PRO A 41 -10.914 -0.571 7.963 1.00 0.00 N ATOM 705 CA PRO A 41 -12.051 0.283 8.328 1.00 0.00 C ATOM 706 C PRO A 41 -13.205 0.148 7.344 1.00 0.00 C ATOM 707 O PRO A 41 -14.372 0.128 7.739 1.00 0.00 O ATOM 708 CB PRO A 41 -11.473 1.702 8.294 1.00 0.00 C ATOM 709 CG PRO A 41 -10.007 1.527 8.490 1.00 0.00 C ATOM 710 CD PRO A 41 -9.652 0.189 7.896 1.00 0.00 C ATOM 0 HA PRO A 41 -12.468 0.013 9.298 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -11.688 2.193 7.345 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -11.905 2.323 9.079 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -9.452 2.328 8.001 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.750 1.562 9.549 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.299 0.288 6.870 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -8.859 -0.302 8.460 1.00 0.00 H new ATOM 718 N LEU A 42 -12.878 0.043 6.062 1.00 0.00 N ATOM 719 CA LEU A 42 -13.901 -0.104 5.037 1.00 0.00 C ATOM 720 C LEU A 42 -14.698 -1.375 5.271 1.00 0.00 C ATOM 721 O LEU A 42 -15.909 -1.405 5.063 1.00 0.00 O ATOM 722 CB LEU A 42 -13.277 -0.139 3.645 1.00 0.00 C ATOM 723 CG LEU A 42 -12.303 0.993 3.339 1.00 0.00 C ATOM 724 CD1 LEU A 42 -11.372 0.584 2.214 1.00 0.00 C ATOM 725 CD2 LEU A 42 -13.057 2.264 2.978 1.00 0.00 C ATOM 0 H LEU A 42 -11.921 0.057 5.710 1.00 0.00 H new ATOM 0 HA LEU A 42 -14.567 0.757 5.098 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.755 -1.088 3.522 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -14.077 -0.117 2.905 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.708 1.195 4.229 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.679 1.398 2.001 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.811 -0.302 2.510 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -11.956 0.362 1.321 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.345 3.061 2.763 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -13.675 2.083 2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -13.692 2.560 3.813 1.00 0.00 H new ATOM 737 N GLU A 43 -14.016 -2.425 5.718 1.00 0.00 N ATOM 738 CA GLU A 43 -14.676 -3.692 5.988 1.00 0.00 C ATOM 739 C GLU A 43 -15.879 -3.469 6.897 1.00 0.00 C ATOM 740 O GLU A 43 -16.882 -4.174 6.806 1.00 0.00 O ATOM 741 CB GLU A 43 -13.706 -4.686 6.631 1.00 0.00 C ATOM 742 CG GLU A 43 -12.530 -5.052 5.740 1.00 0.00 C ATOM 743 CD GLU A 43 -11.914 -6.387 6.109 1.00 0.00 C ATOM 744 OE1 GLU A 43 -11.031 -6.410 6.993 1.00 0.00 O ATOM 745 OE2 GLU A 43 -12.314 -7.410 5.514 1.00 0.00 O ATOM 0 H GLU A 43 -13.012 -2.421 5.899 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.016 -4.112 5.041 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.328 -4.262 7.561 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -14.250 -5.594 6.892 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -12.861 -5.083 4.702 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -11.770 -4.274 5.809 1.00 0.00 H new ATOM 752 N MET A 44 -15.776 -2.469 7.768 1.00 0.00 N ATOM 753 CA MET A 44 -16.864 -2.142 8.679 1.00 0.00 C ATOM 754 C MET A 44 -17.913 -1.288 7.970 1.00 0.00 C ATOM 755 O MET A 44 -19.080 -1.275 8.358 1.00 0.00 O ATOM 756 CB MET A 44 -16.327 -1.403 9.906 1.00 0.00 C ATOM 757 CG MET A 44 -15.276 -2.186 10.677 1.00 0.00 C ATOM 758 SD MET A 44 -14.069 -1.121 11.487 1.00 0.00 S ATOM 759 CE MET A 44 -12.561 -2.048 11.214 1.00 0.00 C ATOM 0 H MET A 44 -14.953 -1.874 7.861 1.00 0.00 H new ATOM 0 HA MET A 44 -17.331 -3.071 9.006 1.00 0.00 H new ATOM 0 HB2 MET A 44 -15.899 -0.452 9.589 1.00 0.00 H new ATOM 0 HB3 MET A 44 -17.158 -1.172 10.573 1.00 0.00 H new ATOM 0 HG2 MET A 44 -15.768 -2.806 11.426 1.00 0.00 H new ATOM 0 HG3 MET A 44 -14.759 -2.861 9.995 1.00 0.00 H new ATOM 0 HE1 MET A 44 -11.715 -1.362 11.168 1.00 0.00 H new ATOM 0 HE2 MET A 44 -12.413 -2.752 12.033 1.00 0.00 H new ATOM 0 HE3 MET A 44 -12.635 -2.595 10.274 1.00 0.00 H new ATOM 769 N LEU A 45 -17.483 -0.570 6.935 1.00 0.00 N ATOM 770 CA LEU A 45 -18.378 0.294 6.170 1.00 0.00 C ATOM 771 C LEU A 45 -19.004 -0.436 4.982 1.00 0.00 C ATOM 772 O LEU A 45 -20.226 -0.524 4.867 1.00 0.00 O ATOM 773 CB LEU A 45 -17.614 1.520 5.668 1.00 0.00 C ATOM 774 CG LEU A 45 -17.641 2.729 6.601 1.00 0.00 C ATOM 775 CD1 LEU A 45 -16.542 2.620 7.646 1.00 0.00 C ATOM 776 CD2 LEU A 45 -17.498 4.015 5.801 1.00 0.00 C ATOM 0 H LEU A 45 -16.517 -0.570 6.606 1.00 0.00 H new ATOM 0 HA LEU A 45 -19.184 0.601 6.837 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -16.576 1.236 5.497 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -18.027 1.816 4.704 1.00 0.00 H new ATOM 0 HG LEU A 45 -18.601 2.750 7.118 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -16.576 3.490 8.302 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -16.689 1.715 8.235 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -15.572 2.577 7.151 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -17.519 4.869 6.478 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -16.552 4.004 5.260 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -18.321 4.095 5.091 1.00 0.00 H new ATOM 788 N GLN A 46 -18.161 -0.931 4.081 1.00 0.00 N ATOM 789 CA GLN A 46 -18.635 -1.620 2.885 1.00 0.00 C ATOM 790 C GLN A 46 -19.225 -2.996 3.195 1.00 0.00 C ATOM 791 O GLN A 46 -20.229 -3.392 2.602 1.00 0.00 O ATOM 792 CB GLN A 46 -17.494 -1.758 1.873 1.00 0.00 C ATOM 793 CG GLN A 46 -16.442 -2.785 2.265 1.00 0.00 C ATOM 794 CD GLN A 46 -16.810 -4.189 1.828 1.00 0.00 C ATOM 795 OE1 GLN A 46 -17.683 -4.381 0.983 1.00 0.00 O ATOM 796 NE2 GLN A 46 -16.142 -5.182 2.406 1.00 0.00 N ATOM 0 H GLN A 46 -17.146 -0.868 4.156 1.00 0.00 H new ATOM 0 HA GLN A 46 -19.436 -1.014 2.462 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -17.912 -2.032 0.904 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.012 -0.788 1.749 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -15.486 -2.509 1.821 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.308 -2.768 3.347 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -15.425 -4.977 3.102 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -16.346 -6.149 2.153 1.00 0.00 H new ATOM 805 N ASP A 47 -18.593 -3.736 4.100 1.00 0.00 N ATOM 806 CA ASP A 47 -19.066 -5.076 4.442 1.00 0.00 C ATOM 807 C ASP A 47 -20.267 -5.045 5.387 1.00 0.00 C ATOM 808 O ASP A 47 -21.399 -5.289 4.968 1.00 0.00 O ATOM 809 CB ASP A 47 -17.933 -5.902 5.058 1.00 0.00 C ATOM 810 CG ASP A 47 -17.799 -7.267 4.413 1.00 0.00 C ATOM 811 OD1 ASP A 47 -18.835 -7.837 4.011 1.00 0.00 O ATOM 812 OD2 ASP A 47 -16.659 -7.766 4.310 1.00 0.00 O ATOM 0 H ASP A 47 -17.760 -3.436 4.606 1.00 0.00 H new ATOM 0 HA ASP A 47 -19.394 -5.545 3.514 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -16.993 -5.360 4.954 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -18.114 -6.024 6.126 1.00 0.00 H new ATOM 928 N SER A 55 -20.905 8.146 -4.254 1.00 0.00 N ATOM 929 CA SER A 55 -20.861 9.420 -4.963 1.00 0.00 C ATOM 930 C SER A 55 -19.724 9.440 -5.980 1.00 0.00 C ATOM 931 O SER A 55 -18.830 8.595 -5.944 1.00 0.00 O ATOM 932 CB SER A 55 -20.693 10.573 -3.973 1.00 0.00 C ATOM 933 OG SER A 55 -21.424 11.714 -4.389 1.00 0.00 O ATOM 0 HA SER A 55 -21.804 9.541 -5.497 1.00 0.00 H new ATOM 0 HB2 SER A 55 -21.032 10.260 -2.985 1.00 0.00 H new ATOM 0 HB3 SER A 55 -19.637 10.827 -3.882 1.00 0.00 H new ATOM 0 HG SER A 55 -21.301 12.436 -3.738 1.00 0.00 H new ATOM 939 N GLU A 56 -19.767 10.410 -6.889 1.00 0.00 N ATOM 940 CA GLU A 56 -18.741 10.540 -7.917 1.00 0.00 C ATOM 941 C GLU A 56 -17.376 10.812 -7.292 1.00 0.00 C ATOM 942 O GLU A 56 -16.344 10.425 -7.841 1.00 0.00 O ATOM 943 CB GLU A 56 -19.104 11.666 -8.888 1.00 0.00 C ATOM 944 CG GLU A 56 -18.101 11.842 -10.018 1.00 0.00 C ATOM 945 CD GLU A 56 -17.382 13.176 -9.958 1.00 0.00 C ATOM 946 OE1 GLU A 56 -16.792 13.486 -8.902 1.00 0.00 O ATOM 947 OE2 GLU A 56 -17.409 13.911 -10.968 1.00 0.00 O ATOM 0 H GLU A 56 -20.501 11.117 -6.934 1.00 0.00 H new ATOM 0 HA GLU A 56 -18.688 9.599 -8.465 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -20.087 11.465 -9.314 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -19.182 12.601 -8.334 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.368 11.036 -9.977 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -18.617 11.755 -10.974 1.00 0.00 H new ATOM 954 N LYS A 57 -17.378 11.479 -6.142 1.00 0.00 N ATOM 955 CA LYS A 57 -16.140 11.800 -5.445 1.00 0.00 C ATOM 956 C LYS A 57 -15.609 10.580 -4.700 1.00 0.00 C ATOM 957 O LYS A 57 -14.410 10.301 -4.720 1.00 0.00 O ATOM 958 CB LYS A 57 -16.366 12.954 -4.465 1.00 0.00 C ATOM 959 CG LYS A 57 -16.356 14.324 -5.126 1.00 0.00 C ATOM 960 CD LYS A 57 -15.173 15.160 -4.664 1.00 0.00 C ATOM 961 CE LYS A 57 -15.563 16.105 -3.539 1.00 0.00 C ATOM 962 NZ LYS A 57 -14.940 17.449 -3.700 1.00 0.00 N ATOM 0 H LYS A 57 -18.223 11.807 -5.674 1.00 0.00 H new ATOM 0 HA LYS A 57 -15.400 12.104 -6.186 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -17.322 12.810 -3.961 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.593 12.924 -3.697 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -16.318 14.206 -6.209 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -17.284 14.847 -4.895 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -14.371 14.503 -4.327 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.782 15.734 -5.504 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -16.648 16.209 -3.512 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -15.260 15.677 -2.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -15.231 18.063 -2.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -13.904 17.354 -3.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -15.249 17.869 -4.600 1.00 0.00 H new ATOM 976 N LEU A 58 -16.511 9.853 -4.046 1.00 0.00 N ATOM 977 CA LEU A 58 -16.133 8.660 -3.297 1.00 0.00 C ATOM 978 C LEU A 58 -15.504 7.626 -4.221 1.00 0.00 C ATOM 979 O LEU A 58 -14.393 7.154 -3.976 1.00 0.00 O ATOM 980 CB LEU A 58 -17.355 8.063 -2.596 1.00 0.00 C ATOM 981 CG LEU A 58 -17.105 6.743 -1.863 1.00 0.00 C ATOM 982 CD1 LEU A 58 -15.900 6.863 -0.939 1.00 0.00 C ATOM 983 CD2 LEU A 58 -18.340 6.329 -1.078 1.00 0.00 C ATOM 0 H LEU A 58 -17.507 10.069 -4.020 1.00 0.00 H new ATOM 0 HA LEU A 58 -15.399 8.946 -2.543 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -17.735 8.792 -1.880 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -18.139 7.906 -3.337 1.00 0.00 H new ATOM 0 HG LEU A 58 -16.893 5.973 -2.604 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -15.738 5.915 -0.427 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -15.016 7.114 -1.525 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -16.082 7.646 -0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -18.145 5.388 -0.563 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -18.582 7.100 -0.347 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -19.180 6.201 -1.761 1.00 0.00 H new ATOM 995 N THR A 59 -16.215 7.283 -5.292 1.00 0.00 N ATOM 996 CA THR A 59 -15.715 6.311 -6.257 1.00 0.00 C ATOM 997 C THR A 59 -14.386 6.781 -6.840 1.00 0.00 C ATOM 998 O THR A 59 -13.508 5.977 -7.145 1.00 0.00 O ATOM 999 CB THR A 59 -16.736 6.093 -7.376 1.00 0.00 C ATOM 1000 OG1 THR A 59 -16.434 4.920 -8.108 1.00 0.00 O ATOM 1001 CG2 THR A 59 -16.807 7.242 -8.362 1.00 0.00 C ATOM 0 H THR A 59 -17.136 7.663 -5.512 1.00 0.00 H new ATOM 0 HA THR A 59 -15.557 5.363 -5.743 1.00 0.00 H new ATOM 0 HB THR A 59 -17.699 6.010 -6.872 1.00 0.00 H new ATOM 0 HG1 THR A 59 -17.098 4.797 -8.818 1.00 0.00 H new ATOM 0 HG21 THR A 59 -17.551 7.019 -9.127 1.00 0.00 H new ATOM 0 HG22 THR A 59 -17.088 8.155 -7.837 1.00 0.00 H new ATOM 0 HG23 THR A 59 -15.833 7.379 -8.832 1.00 0.00 H new ATOM 1009 N THR A 60 -14.246 8.097 -6.980 1.00 0.00 N ATOM 1010 CA THR A 60 -13.023 8.683 -7.512 1.00 0.00 C ATOM 1011 C THR A 60 -11.857 8.391 -6.574 1.00 0.00 C ATOM 1012 O THR A 60 -10.752 8.072 -7.015 1.00 0.00 O ATOM 1013 CB THR A 60 -13.205 10.196 -7.713 1.00 0.00 C ATOM 1014 OG1 THR A 60 -13.172 10.523 -9.091 1.00 0.00 O ATOM 1015 CG2 THR A 60 -12.156 11.044 -7.020 1.00 0.00 C ATOM 0 H THR A 60 -14.966 8.776 -6.732 1.00 0.00 H new ATOM 0 HA THR A 60 -12.802 8.237 -8.482 1.00 0.00 H new ATOM 0 HB THR A 60 -14.173 10.422 -7.266 1.00 0.00 H new ATOM 0 HG1 THR A 60 -13.291 11.490 -9.201 1.00 0.00 H new ATOM 0 HG21 THR A 60 -12.356 12.098 -7.211 1.00 0.00 H new ATOM 0 HG22 THR A 60 -12.188 10.857 -5.947 1.00 0.00 H new ATOM 0 HG23 THR A 60 -11.169 10.787 -7.403 1.00 0.00 H new ATOM 1023 N ALA A 61 -12.122 8.482 -5.275 1.00 0.00 N ATOM 1024 CA ALA A 61 -11.108 8.204 -4.271 1.00 0.00 C ATOM 1025 C ALA A 61 -10.781 6.728 -4.293 1.00 0.00 C ATOM 1026 O ALA A 61 -9.631 6.330 -4.477 1.00 0.00 O ATOM 1027 CB ALA A 61 -11.593 8.611 -2.891 1.00 0.00 C ATOM 0 H ALA A 61 -13.031 8.746 -4.895 1.00 0.00 H new ATOM 0 HA ALA A 61 -10.213 8.782 -4.499 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -10.819 8.394 -2.155 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -11.813 9.679 -2.883 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -12.496 8.053 -2.643 1.00 0.00 H new ATOM 1033 N MET A 62 -11.820 5.918 -4.137 1.00 0.00 N ATOM 1034 CA MET A 62 -11.674 4.478 -4.172 1.00 0.00 C ATOM 1035 C MET A 62 -11.044 4.072 -5.497 1.00 0.00 C ATOM 1036 O MET A 62 -10.315 3.083 -5.577 1.00 0.00 O ATOM 1037 CB MET A 62 -13.032 3.806 -3.987 1.00 0.00 C ATOM 1038 CG MET A 62 -13.735 4.216 -2.702 1.00 0.00 C ATOM 1039 SD MET A 62 -15.465 3.711 -2.657 1.00 0.00 S ATOM 1040 CE MET A 62 -15.350 2.071 -3.360 1.00 0.00 C ATOM 0 H MET A 62 -12.775 6.241 -3.985 1.00 0.00 H new ATOM 0 HA MET A 62 -11.026 4.155 -3.357 1.00 0.00 H new ATOM 0 HB2 MET A 62 -13.670 4.051 -4.836 1.00 0.00 H new ATOM 0 HB3 MET A 62 -12.898 2.724 -3.991 1.00 0.00 H new ATOM 0 HG2 MET A 62 -13.212 3.778 -1.852 1.00 0.00 H new ATOM 0 HG3 MET A 62 -13.675 5.299 -2.590 1.00 0.00 H new ATOM 0 HE1 MET A 62 -16.114 1.432 -2.919 1.00 0.00 H new ATOM 0 HE2 MET A 62 -15.501 2.126 -4.438 1.00 0.00 H new ATOM 0 HE3 MET A 62 -14.364 1.654 -3.152 1.00 0.00 H new ATOM 1050 N ASN A 63 -11.302 4.871 -6.534 1.00 0.00 N ATOM 1051 CA ASN A 63 -10.725 4.613 -7.844 1.00 0.00 C ATOM 1052 C ASN A 63 -9.220 4.779 -7.748 1.00 0.00 C ATOM 1053 O ASN A 63 -8.455 3.898 -8.140 1.00 0.00 O ATOM 1054 CB ASN A 63 -11.298 5.571 -8.890 1.00 0.00 C ATOM 1055 CG ASN A 63 -12.457 4.971 -9.659 1.00 0.00 C ATOM 1056 OD1 ASN A 63 -12.424 3.801 -10.042 1.00 0.00 O ATOM 1057 ND2 ASN A 63 -13.492 5.771 -9.888 1.00 0.00 N ATOM 0 H ASN A 63 -11.902 5.694 -6.488 1.00 0.00 H new ATOM 0 HA ASN A 63 -10.970 3.598 -8.156 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -11.629 6.485 -8.397 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -10.510 5.853 -9.589 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -14.303 5.422 -10.400 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -13.476 6.734 -9.552 1.00 0.00 H new ATOM 1064 N ARG A 64 -8.807 5.906 -7.179 1.00 0.00 N ATOM 1065 CA ARG A 64 -7.396 6.181 -6.976 1.00 0.00 C ATOM 1066 C ARG A 64 -6.818 5.121 -6.055 1.00 0.00 C ATOM 1067 O ARG A 64 -5.677 4.701 -6.205 1.00 0.00 O ATOM 1068 CB ARG A 64 -7.209 7.564 -6.351 1.00 0.00 C ATOM 1069 CG ARG A 64 -6.930 8.660 -7.360 1.00 0.00 C ATOM 1070 CD ARG A 64 -8.201 9.106 -8.062 1.00 0.00 C ATOM 1071 NE ARG A 64 -7.968 10.243 -8.950 1.00 0.00 N ATOM 1072 CZ ARG A 64 -7.888 11.505 -8.533 1.00 0.00 C ATOM 1073 NH1 ARG A 64 -8.019 11.796 -7.244 1.00 0.00 N ATOM 1074 NH2 ARG A 64 -7.676 12.479 -9.407 1.00 0.00 N ATOM 0 H ARG A 64 -9.432 6.642 -6.851 1.00 0.00 H new ATOM 0 HA ARG A 64 -6.881 6.162 -7.937 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.106 7.822 -5.788 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -6.386 7.522 -5.638 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -6.473 9.512 -6.857 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -6.212 8.303 -8.098 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -8.608 8.274 -8.637 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.950 9.375 -7.318 1.00 0.00 H new ATOM 0 HE ARG A 64 -7.860 10.059 -9.947 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.182 11.051 -6.567 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.957 12.765 -6.931 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.574 12.261 -10.398 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.615 13.446 -9.088 1.00 0.00 H new ATOM 1088 N PHE A 65 -7.640 4.697 -5.100 1.00 0.00 N ATOM 1089 CA PHE A 65 -7.257 3.681 -4.130 1.00 0.00 C ATOM 1090 C PHE A 65 -6.978 2.356 -4.819 1.00 0.00 C ATOM 1091 O PHE A 65 -5.875 1.817 -4.737 1.00 0.00 O ATOM 1092 CB PHE A 65 -8.381 3.516 -3.115 1.00 0.00 C ATOM 1093 CG PHE A 65 -7.974 2.901 -1.806 1.00 0.00 C ATOM 1094 CD1 PHE A 65 -6.647 2.865 -1.389 1.00 0.00 C ATOM 1095 CD2 PHE A 65 -8.944 2.369 -0.983 1.00 0.00 C ATOM 1096 CE1 PHE A 65 -6.309 2.301 -0.173 1.00 0.00 C ATOM 1097 CE2 PHE A 65 -8.614 1.810 0.232 1.00 0.00 C ATOM 1098 CZ PHE A 65 -7.294 1.773 0.639 1.00 0.00 C ATOM 0 H PHE A 65 -8.590 5.049 -4.978 1.00 0.00 H new ATOM 0 HA PHE A 65 -6.345 3.997 -3.624 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.818 4.495 -2.918 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -9.163 2.901 -3.560 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -5.875 3.281 -2.020 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -9.978 2.391 -1.296 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -5.276 2.273 0.142 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -9.387 1.401 0.866 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.033 1.332 1.590 1.00 0.00 H new ATOM 1108 N LYS A 66 -7.987 1.843 -5.509 1.00 0.00 N ATOM 1109 CA LYS A 66 -7.856 0.588 -6.228 1.00 0.00 C ATOM 1110 C LYS A 66 -6.723 0.688 -7.243 1.00 0.00 C ATOM 1111 O LYS A 66 -6.027 -0.291 -7.518 1.00 0.00 O ATOM 1112 CB LYS A 66 -9.198 0.254 -6.890 1.00 0.00 C ATOM 1113 CG LYS A 66 -9.103 -0.465 -8.221 1.00 0.00 C ATOM 1114 CD LYS A 66 -9.428 0.464 -9.380 1.00 0.00 C ATOM 1115 CE LYS A 66 -8.237 0.635 -10.307 1.00 0.00 C ATOM 1116 NZ LYS A 66 -8.496 1.652 -11.364 1.00 0.00 N ATOM 0 H LYS A 66 -8.906 2.279 -5.585 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.603 -0.221 -5.543 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.779 -0.362 -6.204 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.753 1.181 -7.035 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.098 -0.868 -8.347 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -9.789 -1.312 -8.228 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -10.273 0.065 -9.941 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -9.732 1.437 -8.994 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -7.364 0.931 -9.725 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -8.000 -0.321 -10.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -7.659 1.738 -11.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -9.313 1.358 -11.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -8.697 2.571 -10.920 1.00 0.00 H new ATOM 1130 N ALA A 67 -6.536 1.885 -7.781 1.00 0.00 N ATOM 1131 CA ALA A 67 -5.478 2.133 -8.750 1.00 0.00 C ATOM 1132 C ALA A 67 -4.117 2.202 -8.062 1.00 0.00 C ATOM 1133 O ALA A 67 -3.172 1.522 -8.467 1.00 0.00 O ATOM 1134 CB ALA A 67 -5.752 3.417 -9.519 1.00 0.00 C ATOM 0 H ALA A 67 -7.106 2.702 -7.562 1.00 0.00 H new ATOM 0 HA ALA A 67 -5.460 1.303 -9.456 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.952 3.588 -10.239 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.702 3.330 -10.046 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -5.799 4.255 -8.823 1.00 0.00 H new ATOM 1140 N ALA A 68 -4.022 3.015 -7.010 1.00 0.00 N ATOM 1141 CA ALA A 68 -2.773 3.150 -6.269 1.00 0.00 C ATOM 1142 C ALA A 68 -2.309 1.784 -5.773 1.00 0.00 C ATOM 1143 O ALA A 68 -1.114 1.542 -5.615 1.00 0.00 O ATOM 1144 CB ALA A 68 -2.921 4.129 -5.107 1.00 0.00 C ATOM 0 H ALA A 68 -4.790 3.585 -6.656 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.017 3.554 -6.942 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.973 4.208 -4.575 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.204 5.109 -5.491 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.692 3.770 -4.425 1.00 0.00 H new ATOM 1150 N LEU A 69 -3.267 0.889 -5.549 1.00 0.00 N ATOM 1151 CA LEU A 69 -2.958 -0.458 -5.098 1.00 0.00 C ATOM 1152 C LEU A 69 -2.199 -1.206 -6.179 1.00 0.00 C ATOM 1153 O LEU A 69 -1.115 -1.734 -5.937 1.00 0.00 O ATOM 1154 CB LEU A 69 -4.239 -1.207 -4.744 1.00 0.00 C ATOM 1155 CG LEU A 69 -4.773 -0.909 -3.349 1.00 0.00 C ATOM 1156 CD1 LEU A 69 -6.287 -1.059 -3.309 1.00 0.00 C ATOM 1157 CD2 LEU A 69 -4.105 -1.815 -2.327 1.00 0.00 C ATOM 0 H LEU A 69 -4.262 1.075 -5.673 1.00 0.00 H new ATOM 0 HA LEU A 69 -2.335 -0.393 -4.206 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.007 -0.956 -5.476 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.055 -2.278 -4.829 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.535 0.124 -3.097 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.648 -0.842 -2.304 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -6.740 -0.364 -4.015 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.559 -2.079 -3.579 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.495 -1.593 -1.334 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.312 -2.856 -2.573 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -3.028 -1.647 -2.340 1.00 0.00 H new ATOM 1169 N GLU A 70 -2.769 -1.229 -7.384 1.00 0.00 N ATOM 1170 CA GLU A 70 -2.133 -1.892 -8.516 1.00 0.00 C ATOM 1171 C GLU A 70 -0.656 -1.530 -8.557 1.00 0.00 C ATOM 1172 O GLU A 70 0.187 -2.340 -8.938 1.00 0.00 O ATOM 1173 CB GLU A 70 -2.813 -1.488 -9.827 1.00 0.00 C ATOM 1174 CG GLU A 70 -3.978 -2.388 -10.207 1.00 0.00 C ATOM 1175 CD GLU A 70 -3.958 -2.780 -11.672 1.00 0.00 C ATOM 1176 OE1 GLU A 70 -2.869 -3.120 -12.180 1.00 0.00 O ATOM 1177 OE2 GLU A 70 -5.030 -2.747 -12.311 1.00 0.00 O ATOM 0 H GLU A 70 -3.668 -0.797 -7.598 1.00 0.00 H new ATOM 0 HA GLU A 70 -2.235 -2.971 -8.396 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -3.170 -0.462 -9.741 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.076 -1.503 -10.630 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.952 -3.288 -9.593 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.915 -1.877 -9.984 1.00 0.00 H new ATOM 1184 N GLU A 71 -0.352 -0.309 -8.124 1.00 0.00 N ATOM 1185 CA GLU A 71 1.022 0.155 -8.072 1.00 0.00 C ATOM 1186 C GLU A 71 1.791 -0.668 -7.046 1.00 0.00 C ATOM 1187 O GLU A 71 2.836 -1.241 -7.355 1.00 0.00 O ATOM 1188 CB GLU A 71 1.077 1.639 -7.713 1.00 0.00 C ATOM 1189 CG GLU A 71 2.457 2.245 -7.878 1.00 0.00 C ATOM 1190 CD GLU A 71 2.815 2.497 -9.329 1.00 0.00 C ATOM 1191 OE1 GLU A 71 1.922 2.914 -10.096 1.00 0.00 O ATOM 1192 OE2 GLU A 71 3.987 2.275 -9.698 1.00 0.00 O ATOM 0 H GLU A 71 -1.041 0.372 -7.806 1.00 0.00 H new ATOM 0 HA GLU A 71 1.479 0.030 -9.054 1.00 0.00 H new ATOM 0 HB2 GLU A 71 0.371 2.184 -8.340 1.00 0.00 H new ATOM 0 HB3 GLU A 71 0.752 1.768 -6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.505 3.185 -7.328 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.197 1.578 -7.436 1.00 0.00 H new ATOM 1199 N ALA A 72 1.251 -0.748 -5.828 1.00 0.00 N ATOM 1200 CA ALA A 72 1.876 -1.532 -4.775 1.00 0.00 C ATOM 1201 C ALA A 72 1.948 -2.996 -5.192 1.00 0.00 C ATOM 1202 O ALA A 72 3.009 -3.616 -5.142 1.00 0.00 O ATOM 1203 CB ALA A 72 1.109 -1.383 -3.471 1.00 0.00 C ATOM 0 H ALA A 72 0.387 -0.280 -5.553 1.00 0.00 H new ATOM 0 HA ALA A 72 2.889 -1.163 -4.615 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.592 -1.977 -2.695 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.099 -0.335 -3.172 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.085 -1.730 -3.609 1.00 0.00 H new ATOM 1209 N ASN A 73 0.813 -3.540 -5.625 1.00 0.00 N ATOM 1210 CA ASN A 73 0.761 -4.927 -6.074 1.00 0.00 C ATOM 1211 C ASN A 73 1.722 -5.136 -7.238 1.00 0.00 C ATOM 1212 O ASN A 73 2.317 -6.203 -7.386 1.00 0.00 O ATOM 1213 CB ASN A 73 -0.659 -5.305 -6.503 1.00 0.00 C ATOM 1214 CG ASN A 73 -0.890 -6.802 -6.472 1.00 0.00 C ATOM 1215 OD1 ASN A 73 -0.267 -7.522 -5.691 1.00 0.00 O ATOM 1216 ND2 ASN A 73 -1.788 -7.281 -7.325 1.00 0.00 N ATOM 0 H ASN A 73 -0.077 -3.044 -5.674 1.00 0.00 H new ATOM 0 HA ASN A 73 1.056 -5.567 -5.242 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -1.377 -4.815 -5.846 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.843 -4.932 -7.511 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.984 -8.282 -7.350 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -2.281 -6.648 -7.955 1.00 0.00 H new ATOM 1223 N GLY A 74 1.874 -4.097 -8.055 1.00 0.00 N ATOM 1224 CA GLY A 74 2.771 -4.173 -9.193 1.00 0.00 C ATOM 1225 C GLY A 74 4.221 -4.074 -8.771 1.00 0.00 C ATOM 1226 O GLY A 74 5.068 -4.833 -9.244 1.00 0.00 O ATOM 0 H GLY A 74 1.392 -3.205 -7.948 1.00 0.00 H new ATOM 0 HA2 GLY A 74 2.609 -5.112 -9.722 1.00 0.00 H new ATOM 0 HA3 GLY A 74 2.540 -3.370 -9.893 1.00 0.00 H new ATOM 1230 N GLU A 75 4.505 -3.141 -7.867 1.00 0.00 N ATOM 1231 CA GLU A 75 5.859 -2.952 -7.368 1.00 0.00 C ATOM 1232 C GLU A 75 6.322 -4.208 -6.637 1.00 0.00 C ATOM 1233 O GLU A 75 7.460 -4.648 -6.790 1.00 0.00 O ATOM 1234 CB GLU A 75 5.921 -1.719 -6.448 1.00 0.00 C ATOM 1235 CG GLU A 75 5.687 -2.008 -4.971 1.00 0.00 C ATOM 1236 CD GLU A 75 6.922 -2.538 -4.272 1.00 0.00 C ATOM 1237 OE1 GLU A 75 7.964 -1.851 -4.309 1.00 0.00 O ATOM 1238 OE2 GLU A 75 6.850 -3.640 -3.690 1.00 0.00 O ATOM 0 H GLU A 75 3.815 -2.506 -7.467 1.00 0.00 H new ATOM 0 HA GLU A 75 6.531 -2.777 -8.208 1.00 0.00 H new ATOM 0 HB2 GLU A 75 6.898 -1.248 -6.561 1.00 0.00 H new ATOM 0 HB3 GLU A 75 5.178 -0.996 -6.784 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.358 -1.095 -4.475 1.00 0.00 H new ATOM 0 HG3 GLU A 75 4.880 -2.733 -4.871 1.00 0.00 H new ATOM 1245 N ILE A 76 5.415 -4.783 -5.856 1.00 0.00 N ATOM 1246 CA ILE A 76 5.698 -5.995 -5.107 1.00 0.00 C ATOM 1247 C ILE A 76 5.830 -7.188 -6.049 1.00 0.00 C ATOM 1248 O ILE A 76 6.565 -8.135 -5.772 1.00 0.00 O ATOM 1249 CB ILE A 76 4.585 -6.273 -4.076 1.00 0.00 C ATOM 1250 CG1 ILE A 76 4.510 -5.135 -3.058 1.00 0.00 C ATOM 1251 CG2 ILE A 76 4.822 -7.602 -3.372 1.00 0.00 C ATOM 1252 CD1 ILE A 76 3.170 -5.035 -2.363 1.00 0.00 C ATOM 0 H ILE A 76 4.470 -4.423 -5.726 1.00 0.00 H new ATOM 0 HA ILE A 76 6.641 -5.850 -4.579 1.00 0.00 H new ATOM 0 HB ILE A 76 3.633 -6.332 -4.604 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.289 -5.276 -2.309 1.00 0.00 H new ATOM 0 HG13 ILE A 76 4.720 -4.192 -3.563 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.025 -7.778 -2.649 1.00 0.00 H new ATOM 0 HG22 ILE A 76 4.829 -8.407 -4.107 1.00 0.00 H new ATOM 0 HG23 ILE A 76 5.781 -7.574 -2.855 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.188 -4.207 -1.655 1.00 0.00 H new ATOM 0 HD12 ILE A 76 2.388 -4.863 -3.103 1.00 0.00 H new ATOM 0 HD13 ILE A 76 2.967 -5.964 -1.830 1.00 0.00 H new ATOM 1264 N GLU A 77 5.111 -7.128 -7.165 1.00 0.00 N ATOM 1265 CA GLU A 77 5.146 -8.198 -8.155 1.00 0.00 C ATOM 1266 C GLU A 77 6.410 -8.106 -9.002 1.00 0.00 C ATOM 1267 O GLU A 77 7.080 -9.109 -9.247 1.00 0.00 O ATOM 1268 CB GLU A 77 3.907 -8.130 -9.051 1.00 0.00 C ATOM 1269 CG GLU A 77 3.878 -9.196 -10.135 1.00 0.00 C ATOM 1270 CD GLU A 77 2.968 -8.827 -11.290 1.00 0.00 C ATOM 1271 OE1 GLU A 77 1.751 -8.669 -11.058 1.00 0.00 O ATOM 1272 OE2 GLU A 77 3.471 -8.695 -12.426 1.00 0.00 O ATOM 0 H GLU A 77 4.497 -6.350 -7.406 1.00 0.00 H new ATOM 0 HA GLU A 77 5.151 -9.153 -7.629 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.016 -8.230 -8.432 1.00 0.00 H new ATOM 0 HB3 GLU A 77 3.861 -7.147 -9.519 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.889 -9.355 -10.510 1.00 0.00 H new ATOM 0 HG3 GLU A 77 3.546 -10.140 -9.703 1.00 0.00 H new ATOM 1279 N LYS A 78 6.728 -6.896 -9.445 1.00 0.00 N ATOM 1280 CA LYS A 78 7.912 -6.669 -10.266 1.00 0.00 C ATOM 1281 C LYS A 78 9.189 -6.797 -9.437 1.00 0.00 C ATOM 1282 O LYS A 78 10.280 -6.952 -9.986 1.00 0.00 O ATOM 1283 CB LYS A 78 7.845 -5.283 -10.911 1.00 0.00 C ATOM 1284 CG LYS A 78 8.260 -5.272 -12.374 1.00 0.00 C ATOM 1285 CD LYS A 78 9.770 -5.367 -12.529 1.00 0.00 C ATOM 1286 CE LYS A 78 10.478 -4.221 -11.822 1.00 0.00 C ATOM 1287 NZ LYS A 78 9.822 -2.912 -12.094 1.00 0.00 N ATOM 0 H LYS A 78 6.183 -6.056 -9.250 1.00 0.00 H new ATOM 0 HA LYS A 78 7.935 -7.429 -11.047 1.00 0.00 H new ATOM 0 HB2 LYS A 78 6.827 -4.901 -10.828 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.488 -4.601 -10.354 1.00 0.00 H new ATOM 0 HG2 LYS A 78 7.787 -6.106 -12.893 1.00 0.00 H new ATOM 0 HG3 LYS A 78 7.902 -4.358 -12.847 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.119 -6.317 -12.124 1.00 0.00 H new ATOM 0 HD3 LYS A 78 10.029 -5.358 -13.588 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.487 -4.407 -10.748 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.518 -4.181 -12.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 10.511 -2.144 -11.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.470 -2.897 -13.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 9.026 -2.780 -11.438 1.00 0.00 H new ATOM 1301 N PHE A 79 9.050 -6.730 -8.115 1.00 0.00 N ATOM 1302 CA PHE A 79 10.199 -6.836 -7.224 1.00 0.00 C ATOM 1303 C PHE A 79 10.384 -8.266 -6.719 1.00 0.00 C ATOM 1304 O PHE A 79 11.445 -8.614 -6.198 1.00 0.00 O ATOM 1305 CB PHE A 79 10.038 -5.885 -6.038 1.00 0.00 C ATOM 1306 CG PHE A 79 10.504 -4.484 -6.322 1.00 0.00 C ATOM 1307 CD1 PHE A 79 11.704 -4.254 -6.976 1.00 0.00 C ATOM 1308 CD2 PHE A 79 9.741 -3.398 -5.930 1.00 0.00 C ATOM 1309 CE1 PHE A 79 12.132 -2.966 -7.235 1.00 0.00 C ATOM 1310 CE2 PHE A 79 10.163 -2.107 -6.184 1.00 0.00 C ATOM 1311 CZ PHE A 79 11.361 -1.891 -6.837 1.00 0.00 C ATOM 0 H PHE A 79 8.156 -6.603 -7.640 1.00 0.00 H new ATOM 0 HA PHE A 79 11.086 -6.559 -7.793 1.00 0.00 H new ATOM 0 HB2 PHE A 79 8.988 -5.857 -5.745 1.00 0.00 H new ATOM 0 HB3 PHE A 79 10.596 -6.279 -5.189 1.00 0.00 H new ATOM 0 HD1 PHE A 79 12.312 -5.091 -7.287 1.00 0.00 H new ATOM 0 HD2 PHE A 79 8.804 -3.562 -5.419 1.00 0.00 H new ATOM 0 HE1 PHE A 79 13.068 -2.800 -7.748 1.00 0.00 H new ATOM 0 HE2 PHE A 79 9.558 -1.269 -5.873 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.694 -0.883 -7.036 1.00 0.00 H new ATOM 1321 N SER A 80 9.353 -9.093 -6.874 1.00 0.00 N ATOM 1322 CA SER A 80 9.415 -10.482 -6.429 1.00 0.00 C ATOM 1323 C SER A 80 10.629 -11.190 -7.017 1.00 0.00 C ATOM 1324 O SER A 80 11.209 -12.074 -6.386 1.00 0.00 O ATOM 1325 CB SER A 80 8.135 -11.224 -6.820 1.00 0.00 C ATOM 1326 OG SER A 80 8.013 -11.324 -8.229 1.00 0.00 O ATOM 0 H SER A 80 8.467 -8.826 -7.303 1.00 0.00 H new ATOM 0 HA SER A 80 9.509 -10.484 -5.343 1.00 0.00 H new ATOM 0 HB2 SER A 80 8.141 -12.222 -6.381 1.00 0.00 H new ATOM 0 HB3 SER A 80 7.269 -10.701 -6.413 1.00 0.00 H new ATOM 0 HG SER A 80 7.631 -10.494 -8.584 1.00 0.00 H new ATOM 1332 N ASN A 81 11.013 -10.793 -8.224 1.00 0.00 N ATOM 1333 CA ASN A 81 12.164 -11.387 -8.889 1.00 0.00 C ATOM 1334 C ASN A 81 13.461 -10.869 -8.277 1.00 0.00 C ATOM 1335 O ASN A 81 13.797 -9.693 -8.418 1.00 0.00 O ATOM 1336 CB ASN A 81 12.132 -11.077 -10.387 1.00 0.00 C ATOM 1337 CG ASN A 81 12.794 -12.162 -11.215 1.00 0.00 C ATOM 1338 OD1 ASN A 81 13.969 -12.473 -11.025 1.00 0.00 O ATOM 1339 ND2 ASN A 81 12.039 -12.742 -12.140 1.00 0.00 N ATOM 0 H ASN A 81 10.544 -10.063 -8.761 1.00 0.00 H new ATOM 0 HA ASN A 81 12.119 -12.467 -8.752 1.00 0.00 H new ATOM 0 HB2 ASN A 81 11.097 -10.958 -10.709 1.00 0.00 H new ATOM 0 HB3 ASN A 81 12.634 -10.127 -10.570 1.00 0.00 H new ATOM 0 HD21 ASN A 81 12.429 -13.478 -12.729 1.00 0.00 H new ATOM 0 HD22 ASN A 81 11.069 -12.452 -12.262 1.00 0.00 H new ATOM 1346 N ARG A 82 14.183 -11.751 -7.594 1.00 0.00 N ATOM 1347 CA ARG A 82 15.443 -11.379 -6.957 1.00 0.00 C ATOM 1348 C ARG A 82 16.352 -10.639 -7.934 1.00 0.00 C ATOM 1349 O ARG A 82 17.150 -9.791 -7.535 1.00 0.00 O ATOM 1350 CB ARG A 82 16.155 -12.625 -6.426 1.00 0.00 C ATOM 1351 CG ARG A 82 16.470 -13.652 -7.502 1.00 0.00 C ATOM 1352 CD ARG A 82 17.946 -14.016 -7.516 1.00 0.00 C ATOM 1353 NE ARG A 82 18.698 -13.217 -8.480 1.00 0.00 N ATOM 1354 CZ ARG A 82 19.903 -13.549 -8.937 1.00 0.00 C ATOM 1355 NH1 ARG A 82 20.495 -14.662 -8.522 1.00 0.00 N ATOM 1356 NH2 ARG A 82 20.519 -12.765 -9.813 1.00 0.00 N ATOM 0 H ARG A 82 13.918 -12.728 -7.467 1.00 0.00 H new ATOM 0 HA ARG A 82 15.217 -10.713 -6.125 1.00 0.00 H new ATOM 0 HB2 ARG A 82 17.083 -12.324 -5.941 1.00 0.00 H new ATOM 0 HB3 ARG A 82 15.533 -13.091 -5.662 1.00 0.00 H new ATOM 0 HG2 ARG A 82 15.875 -14.550 -7.334 1.00 0.00 H new ATOM 0 HG3 ARG A 82 16.183 -13.258 -8.477 1.00 0.00 H new ATOM 0 HD2 ARG A 82 18.365 -13.871 -6.520 1.00 0.00 H new ATOM 0 HD3 ARG A 82 18.056 -15.073 -7.757 1.00 0.00 H new ATOM 0 HE ARG A 82 18.275 -12.354 -8.823 1.00 0.00 H new ATOM 0 HH11 ARG A 82 20.026 -15.268 -7.849 1.00 0.00 H new ATOM 0 HH12 ARG A 82 21.419 -14.911 -8.876 1.00 0.00 H new ATOM 0 HH21 ARG A 82 20.069 -11.908 -10.136 1.00 0.00 H new ATOM 0 HH22 ARG A 82 21.443 -13.019 -10.164 1.00 0.00 H new ATOM 1370 N SER A 83 16.220 -10.962 -9.217 1.00 0.00 N ATOM 1371 CA SER A 83 17.023 -10.325 -10.252 1.00 0.00 C ATOM 1372 C SER A 83 16.620 -8.863 -10.425 1.00 0.00 C ATOM 1373 O SER A 83 17.429 -8.031 -10.831 1.00 0.00 O ATOM 1374 CB SER A 83 16.867 -11.070 -11.579 1.00 0.00 C ATOM 1375 OG SER A 83 17.767 -12.161 -11.661 1.00 0.00 O ATOM 0 H SER A 83 15.564 -11.662 -9.564 1.00 0.00 H new ATOM 0 HA SER A 83 18.068 -10.363 -9.944 1.00 0.00 H new ATOM 0 HB2 SER A 83 15.843 -11.431 -11.679 1.00 0.00 H new ATOM 0 HB3 SER A 83 17.045 -10.385 -12.407 1.00 0.00 H new ATOM 0 HG SER A 83 17.646 -12.621 -12.518 1.00 0.00 H new ATOM 1381 N ASN A 84 15.363 -8.563 -10.112 1.00 0.00 N ATOM 1382 CA ASN A 84 14.845 -7.203 -10.228 1.00 0.00 C ATOM 1383 C ASN A 84 15.273 -6.355 -9.034 1.00 0.00 C ATOM 1384 O ASN A 84 15.578 -5.171 -9.176 1.00 0.00 O ATOM 1385 CB ASN A 84 13.319 -7.227 -10.329 1.00 0.00 C ATOM 1386 CG ASN A 84 12.836 -7.671 -11.697 1.00 0.00 C ATOM 1387 OD1 ASN A 84 13.516 -7.470 -12.704 1.00 0.00 O ATOM 1388 ND2 ASN A 84 11.656 -8.279 -11.740 1.00 0.00 N ATOM 0 H ASN A 84 14.683 -9.245 -9.775 1.00 0.00 H new ATOM 0 HA ASN A 84 15.257 -6.758 -11.133 1.00 0.00 H new ATOM 0 HB2 ASN A 84 12.918 -7.898 -9.570 1.00 0.00 H new ATOM 0 HB3 ASN A 84 12.928 -6.233 -10.114 1.00 0.00 H new ATOM 0 HD21 ASN A 84 11.280 -8.600 -12.632 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.126 -8.425 -10.881 1.00 0.00 H new ATOM 1395 N ILE A 85 15.292 -6.971 -7.855 1.00 0.00 N ATOM 1396 CA ILE A 85 15.681 -6.280 -6.630 1.00 0.00 C ATOM 1397 C ILE A 85 17.157 -5.894 -6.664 1.00 0.00 C ATOM 1398 O ILE A 85 17.502 -4.713 -6.675 1.00 0.00 O ATOM 1399 CB ILE A 85 15.418 -7.161 -5.390 1.00 0.00 C ATOM 1400 CG1 ILE A 85 13.918 -7.456 -5.259 1.00 0.00 C ATOM 1401 CG2 ILE A 85 15.962 -6.504 -4.125 1.00 0.00 C ATOM 1402 CD1 ILE A 85 13.116 -6.356 -4.590 1.00 0.00 C ATOM 0 H ILE A 85 15.042 -7.951 -7.722 1.00 0.00 H new ATOM 0 HA ILE A 85 15.075 -5.376 -6.563 1.00 0.00 H new ATOM 0 HB ILE A 85 15.945 -8.106 -5.520 1.00 0.00 H new ATOM 0 HG12 ILE A 85 13.508 -7.634 -6.253 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.790 -8.378 -4.691 1.00 0.00 H new ATOM 0 HG21 ILE A 85 15.763 -7.146 -3.267 1.00 0.00 H new ATOM 0 HG22 ILE A 85 17.037 -6.356 -4.226 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.475 -5.540 -3.977 1.00 0.00 H new ATOM 0 HD11 ILE A 85 12.067 -6.649 -4.540 1.00 0.00 H new ATOM 0 HD12 ILE A 85 13.495 -6.191 -3.582 1.00 0.00 H new ATOM 0 HD13 ILE A 85 13.208 -5.436 -5.167 1.00 0.00 H new ATOM 1414 N CYS A 86 18.020 -6.903 -6.672 1.00 0.00 N ATOM 1415 CA CYS A 86 19.467 -6.690 -6.696 1.00 0.00 C ATOM 1416 C CYS A 86 19.860 -5.617 -7.708 1.00 0.00 C ATOM 1417 O CYS A 86 20.852 -4.911 -7.523 1.00 0.00 O ATOM 1418 CB CYS A 86 20.187 -8.000 -7.023 1.00 0.00 C ATOM 1419 SG CYS A 86 21.991 -7.873 -7.017 1.00 0.00 S ATOM 0 H CYS A 86 17.743 -7.885 -6.662 1.00 0.00 H new ATOM 0 HA CYS A 86 19.768 -6.346 -5.706 1.00 0.00 H new ATOM 0 HB2 CYS A 86 19.885 -8.758 -6.301 1.00 0.00 H new ATOM 0 HB3 CYS A 86 19.861 -8.346 -8.004 1.00 0.00 H new ATOM 0 HG CYS A 86 22.340 -6.641 -7.239 1.00 0.00 H new ATOM 1425 N ARG A 87 19.081 -5.498 -8.779 1.00 0.00 N ATOM 1426 CA ARG A 87 19.359 -4.509 -9.814 1.00 0.00 C ATOM 1427 C ARG A 87 18.741 -3.160 -9.460 1.00 0.00 C ATOM 1428 O ARG A 87 19.264 -2.111 -9.836 1.00 0.00 O ATOM 1429 CB ARG A 87 18.832 -4.987 -11.171 1.00 0.00 C ATOM 1430 CG ARG A 87 17.314 -4.985 -11.281 1.00 0.00 C ATOM 1431 CD ARG A 87 16.860 -4.845 -12.725 1.00 0.00 C ATOM 1432 NE ARG A 87 15.718 -3.942 -12.852 1.00 0.00 N ATOM 1433 CZ ARG A 87 14.888 -3.936 -13.893 1.00 0.00 C ATOM 1434 NH1 ARG A 87 15.068 -4.780 -14.901 1.00 0.00 N ATOM 1435 NH2 ARG A 87 13.874 -3.082 -13.926 1.00 0.00 N ATOM 0 H ARG A 87 18.256 -6.072 -8.952 1.00 0.00 H new ATOM 0 HA ARG A 87 20.440 -4.387 -9.879 1.00 0.00 H new ATOM 0 HB2 ARG A 87 19.244 -4.350 -11.954 1.00 0.00 H new ATOM 0 HB3 ARG A 87 19.198 -5.997 -11.356 1.00 0.00 H new ATOM 0 HG2 ARG A 87 16.917 -5.909 -10.862 1.00 0.00 H new ATOM 0 HG3 ARG A 87 16.906 -4.165 -10.689 1.00 0.00 H new ATOM 0 HD2 ARG A 87 17.686 -4.473 -13.331 1.00 0.00 H new ATOM 0 HD3 ARG A 87 16.593 -5.826 -13.118 1.00 0.00 H new ATOM 0 HE ARG A 87 15.547 -3.277 -12.098 1.00 0.00 H new ATOM 0 HH11 ARG A 87 15.846 -5.439 -14.882 1.00 0.00 H new ATOM 0 HH12 ARG A 87 14.428 -4.770 -15.695 1.00 0.00 H new ATOM 0 HH21 ARG A 87 13.731 -2.431 -13.154 1.00 0.00 H new ATOM 0 HH22 ARG A 87 13.238 -3.077 -14.723 1.00 0.00 H new ATOM 1449 N PHE A 88 17.625 -3.193 -8.740 1.00 0.00 N ATOM 1450 CA PHE A 88 16.941 -1.971 -8.346 1.00 0.00 C ATOM 1451 C PHE A 88 17.696 -1.264 -7.221 1.00 0.00 C ATOM 1452 O PHE A 88 17.785 -0.038 -7.200 1.00 0.00 O ATOM 1453 CB PHE A 88 15.495 -2.285 -7.924 1.00 0.00 C ATOM 1454 CG PHE A 88 15.120 -1.739 -6.576 1.00 0.00 C ATOM 1455 CD1 PHE A 88 15.045 -0.371 -6.367 1.00 0.00 C ATOM 1456 CD2 PHE A 88 14.858 -2.591 -5.517 1.00 0.00 C ATOM 1457 CE1 PHE A 88 14.720 0.136 -5.127 1.00 0.00 C ATOM 1458 CE2 PHE A 88 14.530 -2.092 -4.279 1.00 0.00 C ATOM 1459 CZ PHE A 88 14.462 -0.724 -4.081 1.00 0.00 C ATOM 0 H PHE A 88 17.177 -4.051 -8.419 1.00 0.00 H new ATOM 0 HA PHE A 88 16.913 -1.298 -9.203 1.00 0.00 H new ATOM 0 HB2 PHE A 88 14.813 -1.880 -8.671 1.00 0.00 H new ATOM 0 HB3 PHE A 88 15.356 -3.366 -7.918 1.00 0.00 H new ATOM 0 HD1 PHE A 88 15.243 0.306 -7.185 1.00 0.00 H new ATOM 0 HD2 PHE A 88 14.912 -3.659 -5.665 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.668 1.204 -4.975 1.00 0.00 H new ATOM 0 HE2 PHE A 88 14.325 -2.767 -3.461 1.00 0.00 H new ATOM 0 HZ PHE A 88 14.207 -0.331 -3.108 1.00 0.00 H new ATOM 1469 N LEU A 89 18.228 -2.041 -6.282 1.00 0.00 N ATOM 1470 CA LEU A 89 18.964 -1.473 -5.158 1.00 0.00 C ATOM 1471 C LEU A 89 20.186 -0.697 -5.644 1.00 0.00 C ATOM 1472 O LEU A 89 20.279 0.515 -5.450 1.00 0.00 O ATOM 1473 CB LEU A 89 19.402 -2.572 -4.185 1.00 0.00 C ATOM 1474 CG LEU A 89 18.281 -3.470 -3.650 1.00 0.00 C ATOM 1475 CD1 LEU A 89 18.820 -4.402 -2.577 1.00 0.00 C ATOM 1476 CD2 LEU A 89 17.132 -2.636 -3.098 1.00 0.00 C ATOM 0 H LEU A 89 18.164 -3.059 -6.277 1.00 0.00 H new ATOM 0 HA LEU A 89 18.297 -0.786 -4.638 1.00 0.00 H new ATOM 0 HB2 LEU A 89 20.140 -3.201 -4.684 1.00 0.00 H new ATOM 0 HB3 LEU A 89 19.903 -2.104 -3.338 1.00 0.00 H new ATOM 0 HG LEU A 89 17.899 -4.068 -4.477 1.00 0.00 H new ATOM 0 HD11 LEU A 89 18.013 -5.034 -2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 89 19.606 -5.028 -3.000 1.00 0.00 H new ATOM 0 HD13 LEU A 89 19.227 -3.813 -1.755 1.00 0.00 H new ATOM 0 HD21 LEU A 89 16.349 -3.297 -2.725 1.00 0.00 H new ATOM 0 HD22 LEU A 89 17.496 -2.009 -2.284 1.00 0.00 H new ATOM 0 HD23 LEU A 89 16.727 -2.005 -3.889 1.00 0.00 H new ATOM 1488 N THR A 90 21.118 -1.403 -6.275 1.00 0.00 N ATOM 1489 CA THR A 90 22.333 -0.779 -6.788 1.00 0.00 C ATOM 1490 C THR A 90 21.996 0.343 -7.767 1.00 0.00 C ATOM 1491 O THR A 90 22.478 1.468 -7.627 1.00 0.00 O ATOM 1492 CB THR A 90 23.216 -1.823 -7.475 1.00 0.00 C ATOM 1493 OG1 THR A 90 23.528 -2.880 -6.587 1.00 0.00 O ATOM 1494 CG2 THR A 90 24.522 -1.256 -7.991 1.00 0.00 C ATOM 0 H THR A 90 21.056 -2.407 -6.444 1.00 0.00 H new ATOM 0 HA THR A 90 22.876 -0.351 -5.946 1.00 0.00 H new ATOM 0 HB THR A 90 22.633 -2.180 -8.324 1.00 0.00 H new ATOM 0 HG1 THR A 90 24.092 -3.537 -7.046 1.00 0.00 H new ATOM 0 HG21 THR A 90 25.100 -2.048 -8.467 1.00 0.00 H new ATOM 0 HG22 THR A 90 24.316 -0.471 -8.718 1.00 0.00 H new ATOM 0 HG23 THR A 90 25.092 -0.840 -7.160 1.00 0.00 H new ATOM 1502 N ALA A 91 21.167 0.027 -8.754 1.00 0.00 N ATOM 1503 CA ALA A 91 20.762 1.006 -9.756 1.00 0.00 C ATOM 1504 C ALA A 91 19.963 2.139 -9.123 1.00 0.00 C ATOM 1505 O ALA A 91 19.994 3.276 -9.596 1.00 0.00 O ATOM 1506 CB ALA A 91 19.944 0.331 -10.846 1.00 0.00 C ATOM 0 H ALA A 91 20.762 -0.900 -8.882 1.00 0.00 H new ATOM 0 HA ALA A 91 21.662 1.433 -10.199 1.00 0.00 H new ATOM 0 HB1 ALA A 91 19.647 1.071 -11.589 1.00 0.00 H new ATOM 0 HB2 ALA A 91 20.544 -0.443 -11.325 1.00 0.00 H new ATOM 0 HB3 ALA A 91 19.054 -0.120 -10.407 1.00 0.00 H new ATOM 1512 N SER A 92 19.244 1.820 -8.053 1.00 0.00 N ATOM 1513 CA SER A 92 18.431 2.806 -7.351 1.00 0.00 C ATOM 1514 C SER A 92 17.329 3.345 -8.258 1.00 0.00 C ATOM 1515 O SER A 92 17.379 4.494 -8.696 1.00 0.00 O ATOM 1516 CB SER A 92 19.305 3.957 -6.848 1.00 0.00 C ATOM 1517 OG SER A 92 18.810 4.477 -5.627 1.00 0.00 O ATOM 0 H SER A 92 19.208 0.883 -7.652 1.00 0.00 H new ATOM 0 HA SER A 92 17.966 2.315 -6.496 1.00 0.00 H new ATOM 0 HB2 SER A 92 20.328 3.607 -6.710 1.00 0.00 H new ATOM 0 HB3 SER A 92 19.337 4.748 -7.597 1.00 0.00 H new ATOM 0 HG SER A 92 19.387 5.210 -5.326 1.00 0.00 H new ATOM 1523 N GLN A 93 16.333 2.507 -8.538 1.00 0.00 N ATOM 1524 CA GLN A 93 15.221 2.907 -9.395 1.00 0.00 C ATOM 1525 C GLN A 93 14.536 4.151 -8.842 1.00 0.00 C ATOM 1526 O GLN A 93 14.376 5.147 -9.547 1.00 0.00 O ATOM 1527 CB GLN A 93 14.211 1.766 -9.524 1.00 0.00 C ATOM 1528 CG GLN A 93 13.042 2.089 -10.441 1.00 0.00 C ATOM 1529 CD GLN A 93 12.502 0.864 -11.152 1.00 0.00 C ATOM 1530 OE1 GLN A 93 12.904 -0.263 -10.863 1.00 0.00 O ATOM 1531 NE2 GLN A 93 11.587 1.079 -12.090 1.00 0.00 N ATOM 0 H GLN A 93 16.274 1.552 -8.186 1.00 0.00 H new ATOM 0 HA GLN A 93 15.618 3.140 -10.383 1.00 0.00 H new ATOM 0 HB2 GLN A 93 14.723 0.880 -9.900 1.00 0.00 H new ATOM 0 HB3 GLN A 93 13.828 1.517 -8.534 1.00 0.00 H new ATOM 0 HG2 GLN A 93 12.243 2.547 -9.858 1.00 0.00 H new ATOM 0 HG3 GLN A 93 13.358 2.824 -11.181 1.00 0.00 H new ATOM 0 HE21 GLN A 93 11.283 2.030 -12.297 1.00 0.00 H new ATOM 0 HE22 GLN A 93 11.188 0.293 -12.603 1.00 0.00 H new ATOM 1540 N ASP A 94 14.139 4.093 -7.574 1.00 0.00 N ATOM 1541 CA ASP A 94 13.480 5.221 -6.932 1.00 0.00 C ATOM 1542 C ASP A 94 14.001 5.418 -5.511 1.00 0.00 C ATOM 1543 O ASP A 94 13.418 6.168 -4.727 1.00 0.00 O ATOM 1544 CB ASP A 94 11.972 4.989 -6.906 1.00 0.00 C ATOM 1545 CG ASP A 94 11.256 5.688 -8.045 1.00 0.00 C ATOM 1546 OD1 ASP A 94 11.309 5.175 -9.183 1.00 0.00 O ATOM 1547 OD2 ASP A 94 10.642 6.748 -7.801 1.00 0.00 O ATOM 0 H ASP A 94 14.263 3.278 -6.974 1.00 0.00 H new ATOM 0 HA ASP A 94 13.699 6.122 -7.505 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.772 3.919 -6.958 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.570 5.343 -5.957 1.00 0.00 H new ATOM 1552 N LYS A 95 15.092 4.726 -5.175 1.00 0.00 N ATOM 1553 CA LYS A 95 15.682 4.805 -3.841 1.00 0.00 C ATOM 1554 C LYS A 95 14.874 3.979 -2.840 1.00 0.00 C ATOM 1555 O LYS A 95 15.319 3.747 -1.717 1.00 0.00 O ATOM 1556 CB LYS A 95 15.778 6.262 -3.371 1.00 0.00 C ATOM 1557 CG LYS A 95 17.181 6.673 -2.953 1.00 0.00 C ATOM 1558 CD LYS A 95 17.191 8.058 -2.322 1.00 0.00 C ATOM 1559 CE LYS A 95 18.376 8.880 -2.803 1.00 0.00 C ATOM 1560 NZ LYS A 95 19.652 8.116 -2.728 1.00 0.00 N ATOM 0 H LYS A 95 15.585 4.102 -5.814 1.00 0.00 H new ATOM 0 HA LYS A 95 16.690 4.393 -3.897 1.00 0.00 H new ATOM 0 HB2 LYS A 95 15.440 6.917 -4.174 1.00 0.00 H new ATOM 0 HB3 LYS A 95 15.099 6.410 -2.531 1.00 0.00 H new ATOM 0 HG2 LYS A 95 17.578 5.946 -2.245 1.00 0.00 H new ATOM 0 HG3 LYS A 95 17.838 6.663 -3.822 1.00 0.00 H new ATOM 0 HD2 LYS A 95 16.264 8.577 -2.566 1.00 0.00 H new ATOM 0 HD3 LYS A 95 17.228 7.964 -1.237 1.00 0.00 H new ATOM 0 HE2 LYS A 95 18.203 9.198 -3.831 1.00 0.00 H new ATOM 0 HE3 LYS A 95 18.459 9.784 -2.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 20.449 8.779 -2.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 19.634 7.491 -1.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 19.765 7.544 -3.589 1.00 0.00 H new ATOM 1574 N ILE A 96 13.685 3.536 -3.256 1.00 0.00 N ATOM 1575 CA ILE A 96 12.816 2.736 -2.405 1.00 0.00 C ATOM 1576 C ILE A 96 11.821 1.937 -3.245 1.00 0.00 C ATOM 1577 O ILE A 96 11.204 2.466 -4.169 1.00 0.00 O ATOM 1578 CB ILE A 96 12.020 3.613 -1.425 1.00 0.00 C ATOM 1579 CG1 ILE A 96 12.929 4.625 -0.722 1.00 0.00 C ATOM 1580 CG2 ILE A 96 11.280 2.742 -0.418 1.00 0.00 C ATOM 1581 CD1 ILE A 96 12.227 5.433 0.344 1.00 0.00 C ATOM 0 H ILE A 96 13.305 3.722 -4.184 1.00 0.00 H new ATOM 0 HA ILE A 96 13.462 2.061 -1.844 1.00 0.00 H new ATOM 0 HB ILE A 96 11.283 4.180 -1.994 1.00 0.00 H new ATOM 0 HG12 ILE A 96 13.767 4.095 -0.270 1.00 0.00 H new ATOM 0 HG13 ILE A 96 13.345 5.305 -1.466 1.00 0.00 H new ATOM 0 HG21 ILE A 96 10.721 3.376 0.270 1.00 0.00 H new ATOM 0 HG22 ILE A 96 10.591 2.082 -0.945 1.00 0.00 H new ATOM 0 HG23 ILE A 96 11.998 2.144 0.143 1.00 0.00 H new ATOM 0 HD11 ILE A 96 12.933 6.128 0.798 1.00 0.00 H new ATOM 0 HD12 ILE A 96 11.406 5.992 -0.105 1.00 0.00 H new ATOM 0 HD13 ILE A 96 11.835 4.763 1.109 1.00 0.00 H new ATOM 1593 N LEU A 97 11.676 0.661 -2.915 1.00 0.00 N ATOM 1594 CA LEU A 97 10.766 -0.234 -3.624 1.00 0.00 C ATOM 1595 C LEU A 97 9.384 0.392 -3.850 1.00 0.00 C ATOM 1596 O LEU A 97 9.035 0.734 -4.980 1.00 0.00 O ATOM 1597 CB LEU A 97 10.633 -1.545 -2.847 1.00 0.00 C ATOM 1598 CG LEU A 97 11.956 -2.274 -2.615 1.00 0.00 C ATOM 1599 CD1 LEU A 97 12.301 -2.321 -1.141 1.00 0.00 C ATOM 1600 CD2 LEU A 97 11.934 -3.679 -3.202 1.00 0.00 C ATOM 0 H LEU A 97 12.184 0.216 -2.150 1.00 0.00 H new ATOM 0 HA LEU A 97 11.191 -0.425 -4.610 1.00 0.00 H new ATOM 0 HB2 LEU A 97 10.172 -1.337 -1.882 1.00 0.00 H new ATOM 0 HB3 LEU A 97 9.956 -2.207 -3.387 1.00 0.00 H new ATOM 0 HG LEU A 97 12.731 -1.708 -3.133 1.00 0.00 H new ATOM 0 HD11 LEU A 97 13.247 -2.845 -1.005 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.391 -1.305 -0.756 1.00 0.00 H new ATOM 0 HD13 LEU A 97 11.514 -2.846 -0.600 1.00 0.00 H new ATOM 0 HD21 LEU A 97 12.892 -4.166 -3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 97 11.137 -4.257 -2.734 1.00 0.00 H new ATOM 0 HD23 LEU A 97 11.757 -3.622 -4.276 1.00 0.00 H new ATOM 1612 N PHE A 98 8.587 0.519 -2.786 1.00 0.00 N ATOM 1613 CA PHE A 98 7.238 1.078 -2.914 1.00 0.00 C ATOM 1614 C PHE A 98 7.124 2.485 -2.319 1.00 0.00 C ATOM 1615 O PHE A 98 6.161 2.795 -1.618 1.00 0.00 O ATOM 1616 CB PHE A 98 6.209 0.136 -2.271 1.00 0.00 C ATOM 1617 CG PHE A 98 6.098 0.253 -0.774 1.00 0.00 C ATOM 1618 CD1 PHE A 98 7.093 -0.242 0.052 1.00 0.00 C ATOM 1619 CD2 PHE A 98 4.990 0.854 -0.197 1.00 0.00 C ATOM 1620 CE1 PHE A 98 6.986 -0.137 1.427 1.00 0.00 C ATOM 1621 CE2 PHE A 98 4.877 0.959 1.176 1.00 0.00 C ATOM 1622 CZ PHE A 98 5.876 0.464 1.989 1.00 0.00 C ATOM 0 H PHE A 98 8.847 0.247 -1.838 1.00 0.00 H new ATOM 0 HA PHE A 98 7.028 1.169 -3.980 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.231 0.333 -2.711 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.470 -0.892 -2.523 1.00 0.00 H new ATOM 0 HD1 PHE A 98 7.962 -0.715 -0.382 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.206 1.245 -0.828 1.00 0.00 H new ATOM 0 HE1 PHE A 98 7.770 -0.525 2.061 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.008 1.428 1.612 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.790 0.546 3.062 1.00 0.00 H new ATOM 1632 N LYS A 99 8.095 3.341 -2.615 1.00 0.00 N ATOM 1633 CA LYS A 99 8.076 4.710 -2.118 1.00 0.00 C ATOM 1634 C LYS A 99 6.957 5.508 -2.782 1.00 0.00 C ATOM 1635 O LYS A 99 6.179 6.187 -2.113 1.00 0.00 O ATOM 1636 CB LYS A 99 9.439 5.373 -2.364 1.00 0.00 C ATOM 1637 CG LYS A 99 9.381 6.819 -2.831 1.00 0.00 C ATOM 1638 CD LYS A 99 9.040 7.764 -1.689 1.00 0.00 C ATOM 1639 CE LYS A 99 9.013 9.211 -2.153 1.00 0.00 C ATOM 1640 NZ LYS A 99 8.645 10.143 -1.051 1.00 0.00 N ATOM 0 H LYS A 99 8.902 3.112 -3.195 1.00 0.00 H new ATOM 0 HA LYS A 99 7.884 4.693 -1.045 1.00 0.00 H new ATOM 0 HB2 LYS A 99 10.018 5.329 -1.442 1.00 0.00 H new ATOM 0 HB3 LYS A 99 9.980 4.789 -3.108 1.00 0.00 H new ATOM 0 HG2 LYS A 99 10.341 7.101 -3.263 1.00 0.00 H new ATOM 0 HG3 LYS A 99 8.635 6.917 -3.620 1.00 0.00 H new ATOM 0 HD2 LYS A 99 8.069 7.496 -1.271 1.00 0.00 H new ATOM 0 HD3 LYS A 99 9.773 7.651 -0.890 1.00 0.00 H new ATOM 0 HE2 LYS A 99 9.992 9.484 -2.547 1.00 0.00 H new ATOM 0 HE3 LYS A 99 8.300 9.316 -2.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 8.374 11.064 -1.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 7.845 9.749 -0.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 9.459 10.268 -0.415 1.00 0.00 H new ATOM 1654 N ASP A 100 6.891 5.426 -4.106 1.00 0.00 N ATOM 1655 CA ASP A 100 5.877 6.144 -4.868 1.00 0.00 C ATOM 1656 C ASP A 100 4.475 5.722 -4.445 1.00 0.00 C ATOM 1657 O ASP A 100 3.546 6.526 -4.457 1.00 0.00 O ATOM 1658 CB ASP A 100 6.066 5.901 -6.368 1.00 0.00 C ATOM 1659 CG ASP A 100 7.516 6.017 -6.797 1.00 0.00 C ATOM 1660 OD1 ASP A 100 8.217 6.912 -6.282 1.00 0.00 O ATOM 1661 OD2 ASP A 100 7.949 5.212 -7.649 1.00 0.00 O ATOM 0 H ASP A 100 7.529 4.869 -4.674 1.00 0.00 H new ATOM 0 HA ASP A 100 5.993 7.208 -4.663 1.00 0.00 H new ATOM 0 HB2 ASP A 100 5.694 4.908 -6.622 1.00 0.00 H new ATOM 0 HB3 ASP A 100 5.466 6.619 -6.927 1.00 0.00 H new ATOM 1666 N VAL A 101 4.326 4.457 -4.073 1.00 0.00 N ATOM 1667 CA VAL A 101 3.034 3.932 -3.651 1.00 0.00 C ATOM 1668 C VAL A 101 2.657 4.451 -2.280 1.00 0.00 C ATOM 1669 O VAL A 101 1.625 5.100 -2.127 1.00 0.00 O ATOM 1670 CB VAL A 101 3.038 2.403 -3.672 1.00 0.00 C ATOM 1671 CG1 VAL A 101 1.664 1.845 -3.329 1.00 0.00 C ATOM 1672 CG2 VAL A 101 3.483 1.955 -5.044 1.00 0.00 C ATOM 0 H VAL A 101 5.084 3.775 -4.055 1.00 0.00 H new ATOM 0 HA VAL A 101 2.282 4.281 -4.359 1.00 0.00 H new ATOM 0 HB VAL A 101 3.727 2.023 -2.917 1.00 0.00 H new ATOM 0 HG11 VAL A 101 1.698 0.756 -3.352 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.374 2.178 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.935 2.201 -4.057 1.00 0.00 H new ATOM 0 HG21 VAL A 101 3.494 0.866 -5.085 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.792 2.339 -5.794 1.00 0.00 H new ATOM 0 HG23 VAL A 101 4.484 2.336 -5.244 1.00 0.00 H new ATOM 1682 N ASN A 102 3.506 4.214 -1.285 1.00 0.00 N ATOM 1683 CA ASN A 102 3.233 4.733 0.047 1.00 0.00 C ATOM 1684 C ASN A 102 2.958 6.230 -0.068 1.00 0.00 C ATOM 1685 O ASN A 102 2.245 6.813 0.742 1.00 0.00 O ATOM 1686 CB ASN A 102 4.407 4.456 1.000 1.00 0.00 C ATOM 1687 CG ASN A 102 5.652 5.272 0.698 1.00 0.00 C ATOM 1688 OD1 ASN A 102 5.575 6.415 0.251 1.00 0.00 O ATOM 1689 ND2 ASN A 102 6.814 4.686 0.960 1.00 0.00 N ATOM 0 H ASN A 102 4.369 3.678 -1.373 1.00 0.00 H new ATOM 0 HA ASN A 102 2.361 4.231 0.466 1.00 0.00 H new ATOM 0 HB2 ASN A 102 4.089 4.662 2.022 1.00 0.00 H new ATOM 0 HB3 ASN A 102 4.659 3.397 0.952 1.00 0.00 H new ATOM 0 HD21 ASN A 102 7.687 5.186 0.791 1.00 0.00 H new ATOM 0 HD22 ASN A 102 6.834 3.736 1.330 1.00 0.00 H new ATOM 1696 N ARG A 103 3.520 6.830 -1.122 1.00 0.00 N ATOM 1697 CA ARG A 103 3.334 8.240 -1.407 1.00 0.00 C ATOM 1698 C ARG A 103 1.942 8.482 -1.980 1.00 0.00 C ATOM 1699 O ARG A 103 1.192 9.309 -1.462 1.00 0.00 O ATOM 1700 CB ARG A 103 4.387 8.723 -2.397 1.00 0.00 C ATOM 1701 CG ARG A 103 5.676 9.183 -1.737 1.00 0.00 C ATOM 1702 CD ARG A 103 5.995 10.633 -2.075 1.00 0.00 C ATOM 1703 NE ARG A 103 6.183 11.448 -0.877 1.00 0.00 N ATOM 1704 CZ ARG A 103 6.364 12.766 -0.898 1.00 0.00 C ATOM 1705 NH1 ARG A 103 6.383 13.420 -2.053 1.00 0.00 N ATOM 1706 NH2 ARG A 103 6.527 13.431 0.237 1.00 0.00 N ATOM 0 H ARG A 103 4.114 6.346 -1.795 1.00 0.00 H new ATOM 0 HA ARG A 103 3.439 8.797 -0.476 1.00 0.00 H new ATOM 0 HB2 ARG A 103 4.614 7.918 -3.096 1.00 0.00 H new ATOM 0 HB3 ARG A 103 3.974 9.545 -2.982 1.00 0.00 H new ATOM 0 HG2 ARG A 103 5.591 9.071 -0.656 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.498 8.545 -2.060 1.00 0.00 H new ATOM 0 HD2 ARG A 103 6.897 10.672 -2.685 1.00 0.00 H new ATOM 0 HD3 ARG A 103 5.186 11.051 -2.674 1.00 0.00 H new ATOM 0 HE ARG A 103 6.175 10.979 0.029 1.00 0.00 H new ATOM 0 HH11 ARG A 103 6.259 12.912 -2.929 1.00 0.00 H new ATOM 0 HH12 ARG A 103 6.522 14.430 -2.065 1.00 0.00 H new ATOM 0 HH21 ARG A 103 6.514 12.932 1.127 1.00 0.00 H new ATOM 0 HH22 ARG A 103 6.666 14.441 0.221 1.00 0.00 H new ATOM 1720 N LYS A 104 1.580 7.747 -3.041 1.00 0.00 N ATOM 1721 CA LYS A 104 0.251 7.914 -3.622 1.00 0.00 C ATOM 1722 C LYS A 104 -0.771 7.268 -2.712 1.00 0.00 C ATOM 1723 O LYS A 104 -1.648 7.931 -2.161 1.00 0.00 O ATOM 1724 CB LYS A 104 0.148 7.272 -5.006 1.00 0.00 C ATOM 1725 CG LYS A 104 1.285 7.613 -5.947 1.00 0.00 C ATOM 1726 CD LYS A 104 1.570 6.451 -6.884 1.00 0.00 C ATOM 1727 CE LYS A 104 3.050 6.348 -7.220 1.00 0.00 C ATOM 1728 NZ LYS A 104 3.313 6.626 -8.658 1.00 0.00 N ATOM 0 H LYS A 104 2.171 7.053 -3.499 1.00 0.00 H new ATOM 0 HA LYS A 104 0.065 8.983 -3.727 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.105 6.189 -4.887 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -0.791 7.580 -5.466 1.00 0.00 H new ATOM 0 HG2 LYS A 104 1.031 8.501 -6.526 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.180 7.852 -5.373 1.00 0.00 H new ATOM 0 HD2 LYS A 104 1.236 5.522 -6.423 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.996 6.575 -7.802 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.612 7.052 -6.606 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.410 5.350 -6.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.333 6.546 -8.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.798 5.939 -9.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 2.993 7.588 -8.890 1.00 0.00 H new ATOM 1742 N LEU A 105 -0.620 5.958 -2.560 1.00 0.00 N ATOM 1743 CA LEU A 105 -1.489 5.146 -1.726 1.00 0.00 C ATOM 1744 C LEU A 105 -1.839 5.851 -0.412 1.00 0.00 C ATOM 1745 O LEU A 105 -2.953 5.714 0.095 1.00 0.00 O ATOM 1746 CB LEU A 105 -0.800 3.810 -1.455 1.00 0.00 C ATOM 1747 CG LEU A 105 -1.677 2.737 -0.827 1.00 0.00 C ATOM 1748 CD1 LEU A 105 -1.055 1.362 -1.008 1.00 0.00 C ATOM 1749 CD2 LEU A 105 -1.884 3.046 0.641 1.00 0.00 C ATOM 0 H LEU A 105 0.119 5.426 -3.019 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.428 4.981 -2.254 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -0.405 3.427 -2.396 1.00 0.00 H new ATOM 0 HB3 LEU A 105 0.053 3.987 -0.800 1.00 0.00 H new ATOM 0 HG LEU A 105 -2.646 2.732 -1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -1.698 0.609 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.945 1.149 -2.071 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -0.075 1.340 -0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -2.512 2.277 1.090 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -0.919 3.068 1.148 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.370 4.016 0.744 1.00 0.00 H new ATOM 1761 N SER A 106 -0.895 6.618 0.128 1.00 0.00 N ATOM 1762 CA SER A 106 -1.135 7.343 1.373 1.00 0.00 C ATOM 1763 C SER A 106 -2.157 8.452 1.160 1.00 0.00 C ATOM 1764 O SER A 106 -3.189 8.502 1.829 1.00 0.00 O ATOM 1765 CB SER A 106 0.165 7.944 1.909 1.00 0.00 C ATOM 1766 OG SER A 106 -0.094 8.942 2.881 1.00 0.00 O ATOM 0 H SER A 106 0.034 6.753 -0.272 1.00 0.00 H new ATOM 0 HA SER A 106 -1.525 6.633 2.102 1.00 0.00 H new ATOM 0 HB2 SER A 106 0.779 7.157 2.347 1.00 0.00 H new ATOM 0 HB3 SER A 106 0.736 8.374 1.086 1.00 0.00 H new ATOM 0 HG SER A 106 0.754 9.308 3.208 1.00 0.00 H new ATOM 1772 N ASP A 107 -1.855 9.341 0.222 1.00 0.00 N ATOM 1773 CA ASP A 107 -2.733 10.461 -0.092 1.00 0.00 C ATOM 1774 C ASP A 107 -4.117 9.983 -0.513 1.00 0.00 C ATOM 1775 O ASP A 107 -5.105 10.700 -0.354 1.00 0.00 O ATOM 1776 CB ASP A 107 -2.124 11.297 -1.212 1.00 0.00 C ATOM 1777 CG ASP A 107 -2.299 12.785 -0.987 1.00 0.00 C ATOM 1778 OD1 ASP A 107 -3.334 13.334 -1.421 1.00 0.00 O ATOM 1779 OD2 ASP A 107 -1.403 13.403 -0.376 1.00 0.00 O ATOM 0 H ASP A 107 -1.003 9.307 -0.338 1.00 0.00 H new ATOM 0 HA ASP A 107 -2.839 11.066 0.809 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -1.062 11.068 -1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -2.585 11.020 -2.160 1.00 0.00 H new ATOM 1784 N VAL A 108 -4.186 8.774 -1.058 1.00 0.00 N ATOM 1785 CA VAL A 108 -5.451 8.218 -1.505 1.00 0.00 C ATOM 1786 C VAL A 108 -6.388 8.025 -0.330 1.00 0.00 C ATOM 1787 O VAL A 108 -7.553 8.415 -0.386 1.00 0.00 O ATOM 1788 CB VAL A 108 -5.270 6.874 -2.224 1.00 0.00 C ATOM 1789 CG1 VAL A 108 -6.442 6.595 -3.142 1.00 0.00 C ATOM 1790 CG2 VAL A 108 -3.974 6.851 -3.008 1.00 0.00 C ATOM 0 H VAL A 108 -3.381 8.164 -1.199 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.877 8.931 -2.211 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.228 6.092 -1.466 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -6.293 5.638 -3.641 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -7.362 6.560 -2.558 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.516 7.386 -3.888 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.869 5.888 -3.508 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -3.985 7.648 -3.752 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.135 7.000 -2.328 1.00 0.00 H new ATOM 1800 N TRP A 109 -5.874 7.436 0.745 1.00 0.00 N ATOM 1801 CA TRP A 109 -6.699 7.224 1.927 1.00 0.00 C ATOM 1802 C TRP A 109 -7.123 8.568 2.503 1.00 0.00 C ATOM 1803 O TRP A 109 -8.214 8.705 3.052 1.00 0.00 O ATOM 1804 CB TRP A 109 -5.981 6.404 3.005 1.00 0.00 C ATOM 1805 CG TRP A 109 -6.830 6.232 4.233 1.00 0.00 C ATOM 1806 CD1 TRP A 109 -6.490 6.514 5.524 1.00 0.00 C ATOM 1807 CD2 TRP A 109 -8.182 5.761 4.269 1.00 0.00 C ATOM 1808 NE1 TRP A 109 -7.552 6.251 6.361 1.00 0.00 N ATOM 1809 CE2 TRP A 109 -8.602 5.786 5.612 1.00 0.00 C ATOM 1810 CE3 TRP A 109 -9.076 5.323 3.293 1.00 0.00 C ATOM 1811 CZ2 TRP A 109 -9.885 5.391 5.996 1.00 0.00 C ATOM 1812 CZ3 TRP A 109 -10.342 4.932 3.673 1.00 0.00 C ATOM 1813 CH2 TRP A 109 -10.738 4.969 5.013 1.00 0.00 C ATOM 0 H TRP A 109 -4.913 7.104 0.822 1.00 0.00 H new ATOM 0 HA TRP A 109 -7.574 6.653 1.614 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -5.720 5.425 2.603 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -5.047 6.897 3.275 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -5.529 6.889 5.843 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -7.556 6.381 7.373 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -8.781 5.291 2.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -10.193 5.418 7.031 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -11.040 4.591 2.923 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -11.738 4.658 5.278 1.00 0.00 H new ATOM 1824 N LYS A 110 -6.258 9.562 2.360 1.00 0.00 N ATOM 1825 CA LYS A 110 -6.552 10.896 2.851 1.00 0.00 C ATOM 1826 C LYS A 110 -7.753 11.469 2.108 1.00 0.00 C ATOM 1827 O LYS A 110 -8.628 12.088 2.706 1.00 0.00 O ATOM 1828 CB LYS A 110 -5.337 11.806 2.671 1.00 0.00 C ATOM 1829 CG LYS A 110 -4.070 11.266 3.317 1.00 0.00 C ATOM 1830 CD LYS A 110 -3.072 12.377 3.600 1.00 0.00 C ATOM 1831 CE LYS A 110 -1.969 11.908 4.534 1.00 0.00 C ATOM 1832 NZ LYS A 110 -2.260 12.249 5.955 1.00 0.00 N ATOM 0 H LYS A 110 -5.348 9.468 1.908 1.00 0.00 H new ATOM 0 HA LYS A 110 -6.788 10.837 3.914 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -5.158 11.952 1.606 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.561 12.785 3.094 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -4.323 10.757 4.247 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -3.614 10.524 2.662 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -2.635 12.723 2.663 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -3.589 13.228 4.044 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -1.846 10.829 4.438 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.024 12.364 4.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.483 11.912 6.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.352 13.280 6.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -3.148 11.793 6.247 1.00 0.00 H new ATOM 1846 N GLU A 111 -7.780 11.242 0.798 1.00 0.00 N ATOM 1847 CA GLU A 111 -8.862 11.718 -0.057 1.00 0.00 C ATOM 1848 C GLU A 111 -10.061 10.776 -0.011 1.00 0.00 C ATOM 1849 O GLU A 111 -11.201 11.174 -0.255 1.00 0.00 O ATOM 1850 CB GLU A 111 -8.361 11.814 -1.494 1.00 0.00 C ATOM 1851 CG GLU A 111 -8.460 13.211 -2.082 1.00 0.00 C ATOM 1852 CD GLU A 111 -7.815 13.317 -3.450 1.00 0.00 C ATOM 1853 OE1 GLU A 111 -8.292 12.639 -4.384 1.00 0.00 O ATOM 1854 OE2 GLU A 111 -6.835 14.078 -3.587 1.00 0.00 O ATOM 0 H GLU A 111 -7.055 10.725 0.301 1.00 0.00 H new ATOM 0 HA GLU A 111 -9.178 12.696 0.305 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.322 11.487 -1.530 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -8.934 11.126 -2.116 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.509 13.496 -2.157 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -7.985 13.920 -1.405 1.00 0.00 H new ATOM 1861 N LEU A 112 -9.775 9.522 0.285 1.00 0.00 N ATOM 1862 CA LEU A 112 -10.791 8.479 0.347 1.00 0.00 C ATOM 1863 C LEU A 112 -11.508 8.487 1.689 1.00 0.00 C ATOM 1864 O LEU A 112 -12.738 8.496 1.749 1.00 0.00 O ATOM 1865 CB LEU A 112 -10.137 7.115 0.097 1.00 0.00 C ATOM 1866 CG LEU A 112 -11.085 5.913 0.104 1.00 0.00 C ATOM 1867 CD1 LEU A 112 -12.295 6.169 -0.770 1.00 0.00 C ATOM 1868 CD2 LEU A 112 -10.363 4.672 -0.375 1.00 0.00 C ATOM 0 H LEU A 112 -8.831 9.194 0.490 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.536 8.672 -0.425 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.628 7.148 -0.867 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.371 6.955 0.856 1.00 0.00 H new ATOM 0 HG LEU A 112 -11.424 5.760 1.129 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -12.951 5.299 -0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -12.834 7.040 -0.399 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -11.972 6.352 -1.795 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.049 3.825 -0.365 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.999 4.832 -1.390 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.520 4.464 0.284 1.00 0.00 H new ATOM 1880 N SER A 113 -10.732 8.494 2.761 1.00 0.00 N ATOM 1881 CA SER A 113 -11.290 8.513 4.107 1.00 0.00 C ATOM 1882 C SER A 113 -12.120 9.770 4.312 1.00 0.00 C ATOM 1883 O SER A 113 -13.234 9.716 4.834 1.00 0.00 O ATOM 1884 CB SER A 113 -10.170 8.448 5.149 1.00 0.00 C ATOM 1885 OG SER A 113 -9.742 9.744 5.527 1.00 0.00 O ATOM 0 H SER A 113 -9.713 8.487 2.727 1.00 0.00 H new ATOM 0 HA SER A 113 -11.933 7.641 4.229 1.00 0.00 H new ATOM 0 HB2 SER A 113 -10.520 7.907 6.029 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.327 7.888 4.745 1.00 0.00 H new ATOM 0 HG SER A 113 -9.028 9.671 6.194 1.00 0.00 H new ATOM 1891 N LEU A 114 -11.568 10.902 3.890 1.00 0.00 N ATOM 1892 CA LEU A 114 -12.252 12.180 4.018 1.00 0.00 C ATOM 1893 C LEU A 114 -13.591 12.143 3.291 1.00 0.00 C ATOM 1894 O LEU A 114 -14.598 12.633 3.800 1.00 0.00 O ATOM 1895 CB LEU A 114 -11.367 13.307 3.469 1.00 0.00 C ATOM 1896 CG LEU A 114 -11.572 13.659 1.993 1.00 0.00 C ATOM 1897 CD1 LEU A 114 -12.758 14.596 1.822 1.00 0.00 C ATOM 1898 CD2 LEU A 114 -10.312 14.281 1.418 1.00 0.00 C ATOM 0 H LEU A 114 -10.647 10.959 3.456 1.00 0.00 H new ATOM 0 HA LEU A 114 -12.444 12.372 5.074 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -11.542 14.203 4.064 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -10.324 13.027 3.614 1.00 0.00 H new ATOM 0 HG LEU A 114 -11.785 12.740 1.447 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -12.885 14.833 0.766 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -13.660 14.113 2.197 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -12.579 15.515 2.381 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -10.473 14.526 0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -10.071 15.190 1.969 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -9.486 13.575 1.503 1.00 0.00 H new ATOM 1910 N LEU A 115 -13.592 11.553 2.101 1.00 0.00 N ATOM 1911 CA LEU A 115 -14.805 11.446 1.305 1.00 0.00 C ATOM 1912 C LEU A 115 -15.804 10.516 1.979 1.00 0.00 C ATOM 1913 O LEU A 115 -17.016 10.711 1.878 1.00 0.00 O ATOM 1914 CB LEU A 115 -14.471 10.944 -0.099 1.00 0.00 C ATOM 1915 CG LEU A 115 -13.953 12.017 -1.059 1.00 0.00 C ATOM 1916 CD1 LEU A 115 -13.496 11.394 -2.371 1.00 0.00 C ATOM 1917 CD2 LEU A 115 -15.026 13.068 -1.306 1.00 0.00 C ATOM 0 H LEU A 115 -12.765 11.142 1.668 1.00 0.00 H new ATOM 0 HA LEU A 115 -15.257 12.434 1.224 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.722 10.156 -0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -15.364 10.492 -0.530 1.00 0.00 H new ATOM 0 HG LEU A 115 -13.092 12.503 -0.600 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -13.132 12.176 -3.038 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.695 10.681 -2.176 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -14.334 10.878 -2.840 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -14.643 13.825 -1.991 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.905 12.595 -1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -15.299 13.538 -0.361 1.00 0.00 H new ATOM 1929 N LEU A 116 -15.289 9.509 2.674 1.00 0.00 N ATOM 1930 CA LEU A 116 -16.138 8.557 3.371 1.00 0.00 C ATOM 1931 C LEU A 116 -16.799 9.213 4.575 1.00 0.00 C ATOM 1932 O LEU A 116 -17.985 9.006 4.833 1.00 0.00 O ATOM 1933 CB LEU A 116 -15.324 7.339 3.801 1.00 0.00 C ATOM 1934 CG LEU A 116 -15.142 6.288 2.708 1.00 0.00 C ATOM 1935 CD1 LEU A 116 -14.162 5.212 3.149 1.00 0.00 C ATOM 1936 CD2 LEU A 116 -16.485 5.676 2.343 1.00 0.00 C ATOM 0 H LEU A 116 -14.289 9.333 2.769 1.00 0.00 H new ATOM 0 HA LEU A 116 -16.922 8.226 2.690 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -14.342 7.673 4.135 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -15.812 6.875 4.658 1.00 0.00 H new ATOM 0 HG LEU A 116 -14.729 6.775 1.825 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -14.049 4.475 2.354 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -13.195 5.666 3.363 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -14.539 4.722 4.047 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -16.344 4.928 1.563 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -16.921 5.204 3.223 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -17.154 6.456 1.981 1.00 0.00 H new ATOM 1948 N GLN A 117 -16.034 10.027 5.295 1.00 0.00 N ATOM 1949 CA GLN A 117 -16.565 10.734 6.453 1.00 0.00 C ATOM 1950 C GLN A 117 -17.702 11.657 6.026 1.00 0.00 C ATOM 1951 O GLN A 117 -18.520 12.073 6.843 1.00 0.00 O ATOM 1952 CB GLN A 117 -15.467 11.549 7.137 1.00 0.00 C ATOM 1953 CG GLN A 117 -14.241 10.735 7.512 1.00 0.00 C ATOM 1954 CD GLN A 117 -12.955 11.518 7.352 1.00 0.00 C ATOM 1955 OE1 GLN A 117 -12.914 12.724 7.599 1.00 0.00 O ATOM 1956 NE2 GLN A 117 -11.895 10.837 6.936 1.00 0.00 N ATOM 0 H GLN A 117 -15.050 10.212 5.098 1.00 0.00 H new ATOM 0 HA GLN A 117 -16.945 9.997 7.161 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -15.164 12.360 6.475 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -15.876 12.008 8.037 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -14.333 10.400 8.545 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -14.198 9.841 6.890 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -11.974 9.839 6.743 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -11.001 11.312 6.809 1.00 0.00 H new ATOM 1965 N VAL A 118 -17.738 11.980 4.735 1.00 0.00 N ATOM 1966 CA VAL A 118 -18.764 12.855 4.187 1.00 0.00 C ATOM 1967 C VAL A 118 -19.970 12.065 3.696 1.00 0.00 C ATOM 1968 O VAL A 118 -21.098 12.284 4.137 1.00 0.00 O ATOM 1969 CB VAL A 118 -18.223 13.675 3.003 1.00 0.00 C ATOM 1970 CG1 VAL A 118 -19.152 14.833 2.690 1.00 0.00 C ATOM 1971 CG2 VAL A 118 -16.809 14.161 3.281 1.00 0.00 C ATOM 0 H VAL A 118 -17.063 11.645 4.048 1.00 0.00 H new ATOM 0 HA VAL A 118 -19.064 13.520 4.997 1.00 0.00 H new ATOM 0 HB VAL A 118 -18.183 13.029 2.126 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -18.754 15.402 1.850 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -20.139 14.448 2.432 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -19.232 15.482 3.562 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -16.449 14.738 2.429 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -16.809 14.790 4.172 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -16.155 13.304 3.442 1.00 0.00 H new ATOM 1981 N GLU A 119 -19.718 11.163 2.755 1.00 0.00 N ATOM 1982 CA GLU A 119 -20.774 10.349 2.159 1.00 0.00 C ATOM 1983 C GLU A 119 -21.406 9.385 3.161 1.00 0.00 C ATOM 1984 O GLU A 119 -22.630 9.282 3.240 1.00 0.00 O ATOM 1985 CB GLU A 119 -20.221 9.565 0.967 1.00 0.00 C ATOM 1986 CG GLU A 119 -19.532 10.440 -0.070 1.00 0.00 C ATOM 1987 CD GLU A 119 -20.501 11.339 -0.810 1.00 0.00 C ATOM 1988 OE1 GLU A 119 -21.685 10.961 -0.936 1.00 0.00 O ATOM 1989 OE2 GLU A 119 -20.077 12.422 -1.265 1.00 0.00 O ATOM 0 H GLU A 119 -18.786 10.975 2.385 1.00 0.00 H new ATOM 0 HA GLU A 119 -21.556 11.032 1.827 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -19.513 8.820 1.330 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -21.037 9.023 0.489 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -18.776 11.053 0.421 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -19.011 9.806 -0.787 1.00 0.00 H new ATOM 1996 N GLN A 120 -20.578 8.664 3.909 1.00 0.00 N ATOM 1997 CA GLN A 120 -21.085 7.698 4.881 1.00 0.00 C ATOM 1998 C GLN A 120 -21.148 8.280 6.291 1.00 0.00 C ATOM 1999 O GLN A 120 -21.701 7.655 7.198 1.00 0.00 O ATOM 2000 CB GLN A 120 -20.223 6.436 4.876 1.00 0.00 C ATOM 2001 CG GLN A 120 -21.027 5.155 5.035 1.00 0.00 C ATOM 2002 CD GLN A 120 -20.246 3.919 4.633 1.00 0.00 C ATOM 2003 OE1 GLN A 120 -20.134 2.966 5.403 1.00 0.00 O ATOM 2004 NE2 GLN A 120 -19.703 3.930 3.422 1.00 0.00 N ATOM 0 H GLN A 120 -19.561 8.728 3.863 1.00 0.00 H new ATOM 0 HA GLN A 120 -22.102 7.445 4.583 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -19.663 6.391 3.942 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -19.493 6.500 5.683 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -21.345 5.057 6.073 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -21.931 5.221 4.430 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -19.822 4.743 2.817 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -19.167 3.126 3.096 1.00 0.00 H new ATOM 2013 N ARG A 121 -20.585 9.468 6.482 1.00 0.00 N ATOM 2014 CA ARG A 121 -20.593 10.106 7.792 1.00 0.00 C ATOM 2015 C ARG A 121 -19.864 9.246 8.821 1.00 0.00 C ATOM 2016 O ARG A 121 -20.127 9.341 10.020 1.00 0.00 O ATOM 2017 CB ARG A 121 -22.030 10.360 8.250 1.00 0.00 C ATOM 2018 CG ARG A 121 -22.609 11.665 7.731 1.00 0.00 C ATOM 2019 CD ARG A 121 -22.457 12.788 8.746 1.00 0.00 C ATOM 2020 NE ARG A 121 -21.834 13.973 8.162 1.00 0.00 N ATOM 2021 CZ ARG A 121 -21.274 14.945 8.879 1.00 0.00 C ATOM 2022 NH1 ARG A 121 -21.255 14.875 10.204 1.00 0.00 N ATOM 2023 NH2 ARG A 121 -20.729 15.988 8.268 1.00 0.00 N ATOM 0 H ARG A 121 -20.120 10.006 5.751 1.00 0.00 H new ATOM 0 HA ARG A 121 -20.072 11.060 7.707 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -22.660 9.535 7.918 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -22.060 10.366 9.340 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -22.109 11.942 6.803 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -23.664 11.527 7.495 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -23.437 13.052 9.144 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -21.856 12.439 9.586 1.00 0.00 H new ATOM 0 HE ARG A 121 -21.828 14.061 7.146 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -21.671 14.073 10.678 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -20.825 15.623 10.748 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -20.739 16.045 7.250 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -20.300 16.733 8.816 1.00 0.00 H new ATOM 2037 N MET A 122 -18.950 8.405 8.346 1.00 0.00 N ATOM 2038 CA MET A 122 -18.190 7.529 9.228 1.00 0.00 C ATOM 2039 C MET A 122 -16.988 8.262 9.827 1.00 0.00 C ATOM 2040 O MET A 122 -16.192 8.856 9.101 1.00 0.00 O ATOM 2041 CB MET A 122 -17.731 6.277 8.468 1.00 0.00 C ATOM 2042 CG MET A 122 -16.590 6.517 7.486 1.00 0.00 C ATOM 2043 SD MET A 122 -15.156 5.469 7.816 1.00 0.00 S ATOM 2044 CE MET A 122 -14.066 5.934 6.469 1.00 0.00 C ATOM 0 H MET A 122 -18.719 8.313 7.357 1.00 0.00 H new ATOM 0 HA MET A 122 -18.841 7.223 10.047 1.00 0.00 H new ATOM 0 HB2 MET A 122 -17.419 5.523 9.190 1.00 0.00 H new ATOM 0 HB3 MET A 122 -18.581 5.865 7.924 1.00 0.00 H new ATOM 0 HG2 MET A 122 -16.944 6.333 6.472 1.00 0.00 H new ATOM 0 HG3 MET A 122 -16.289 7.564 7.533 1.00 0.00 H new ATOM 0 HE1 MET A 122 -13.029 5.827 6.787 1.00 0.00 H new ATOM 0 HE2 MET A 122 -14.252 5.288 5.611 1.00 0.00 H new ATOM 0 HE3 MET A 122 -14.254 6.971 6.190 1.00 0.00 H new ATOM 2054 N PRO A 123 -16.836 8.241 11.164 1.00 0.00 N ATOM 2055 CA PRO A 123 -15.720 8.913 11.832 1.00 0.00 C ATOM 2056 C PRO A 123 -14.389 8.242 11.523 1.00 0.00 C ATOM 2057 O PRO A 123 -14.233 7.034 11.703 1.00 0.00 O ATOM 2058 CB PRO A 123 -16.047 8.789 13.329 1.00 0.00 C ATOM 2059 CG PRO A 123 -17.470 8.340 13.394 1.00 0.00 C ATOM 2060 CD PRO A 123 -17.726 7.578 12.127 1.00 0.00 C ATOM 0 HA PRO A 123 -15.614 9.946 11.501 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -15.387 8.071 13.816 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -15.913 9.743 13.840 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -17.640 7.711 14.268 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -18.144 9.193 13.479 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -17.488 6.520 12.236 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -18.771 7.640 11.822 1.00 0.00 H new ATOM 2068 N VAL A 124 -13.434 9.031 11.045 1.00 0.00 N ATOM 2069 CA VAL A 124 -12.120 8.509 10.698 1.00 0.00 C ATOM 2070 C VAL A 124 -11.008 9.319 11.346 1.00 0.00 C ATOM 2071 O VAL A 124 -11.204 10.472 11.729 1.00 0.00 O ATOM 2072 CB VAL A 124 -11.907 8.510 9.176 1.00 0.00 C ATOM 2073 CG1 VAL A 124 -10.676 7.695 8.806 1.00 0.00 C ATOM 2074 CG2 VAL A 124 -13.139 7.977 8.467 1.00 0.00 C ATOM 0 H VAL A 124 -13.546 10.033 10.889 1.00 0.00 H new ATOM 0 HA VAL A 124 -12.082 7.486 11.072 1.00 0.00 H new ATOM 0 HB VAL A 124 -11.743 9.538 8.851 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -10.543 7.708 7.724 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -9.797 8.126 9.285 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -10.806 6.667 9.143 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -12.971 7.985 7.390 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -13.335 6.957 8.796 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -13.997 8.606 8.705 1.00 0.00 H new ATOM 2084 N SER A 125 -9.835 8.707 11.457 1.00 0.00 N ATOM 2085 CA SER A 125 -8.680 9.371 12.050 1.00 0.00 C ATOM 2086 C SER A 125 -7.611 9.624 10.992 1.00 0.00 C ATOM 2087 O SER A 125 -7.686 9.082 9.890 1.00 0.00 O ATOM 2088 CB SER A 125 -8.107 8.521 13.187 1.00 0.00 C ATOM 2089 OG SER A 125 -8.515 9.016 14.450 1.00 0.00 O ATOM 0 H SER A 125 -9.658 7.752 11.144 1.00 0.00 H new ATOM 0 HA SER A 125 -9.002 10.330 12.456 1.00 0.00 H new ATOM 0 HB2 SER A 125 -8.436 7.488 13.074 1.00 0.00 H new ATOM 0 HB3 SER A 125 -7.019 8.517 13.129 1.00 0.00 H new ATOM 0 HG SER A 125 -8.137 8.455 15.159 1.00 0.00 H new ATOM 2095 N PRO A 126 -6.595 10.448 11.310 1.00 0.00 N ATOM 2096 CA PRO A 126 -5.509 10.755 10.371 1.00 0.00 C ATOM 2097 C PRO A 126 -4.699 9.510 10.028 1.00 0.00 C ATOM 2098 O PRO A 126 -3.558 9.354 10.463 1.00 0.00 O ATOM 2099 CB PRO A 126 -4.645 11.768 11.131 1.00 0.00 C ATOM 2100 CG PRO A 126 -4.979 11.559 12.568 1.00 0.00 C ATOM 2101 CD PRO A 126 -6.420 11.136 12.601 1.00 0.00 C ATOM 0 HA PRO A 126 -5.880 11.136 9.420 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -3.584 11.601 10.944 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -4.867 12.789 10.819 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -4.338 10.796 13.011 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -4.828 12.474 13.141 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -6.627 10.474 13.442 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -7.089 11.991 12.696 1.00 0.00 H new ATOM 2109 N ILE A 127 -5.311 8.617 9.259 1.00 0.00 N ATOM 2110 CA ILE A 127 -4.671 7.367 8.865 1.00 0.00 C ATOM 2111 C ILE A 127 -4.169 6.605 10.087 1.00 0.00 C ATOM 2112 O ILE A 127 -2.966 6.403 10.254 1.00 0.00 O ATOM 2113 CB ILE A 127 -3.491 7.588 7.894 1.00 0.00 C ATOM 2114 CG1 ILE A 127 -3.783 8.742 6.930 1.00 0.00 C ATOM 2115 CG2 ILE A 127 -3.200 6.304 7.123 1.00 0.00 C ATOM 2116 CD1 ILE A 127 -2.702 8.949 5.889 1.00 0.00 C ATOM 0 H ILE A 127 -6.256 8.737 8.894 1.00 0.00 H new ATOM 0 HA ILE A 127 -5.434 6.784 8.349 1.00 0.00 H new ATOM 0 HB ILE A 127 -2.610 7.855 8.477 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -4.730 8.552 6.425 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -3.905 9.661 7.503 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -2.366 6.470 6.441 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -2.943 5.509 7.823 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -4.083 6.014 6.553 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -2.975 9.782 5.241 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -1.757 9.170 6.385 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -2.595 8.044 5.291 1.00 0.00 H new ATOM 2128 N SER A 128 -5.100 6.174 10.939 1.00 0.00 N ATOM 2129 CA SER A 128 -4.743 5.421 12.141 1.00 0.00 C ATOM 2130 C SER A 128 -3.777 4.293 11.792 1.00 0.00 C ATOM 2131 O SER A 128 -2.970 3.868 12.618 1.00 0.00 O ATOM 2132 CB SER A 128 -5.999 4.851 12.805 1.00 0.00 C ATOM 2133 OG SER A 128 -6.391 5.639 13.916 1.00 0.00 O ATOM 0 H SER A 128 -6.101 6.332 10.820 1.00 0.00 H new ATOM 0 HA SER A 128 -4.254 6.098 12.841 1.00 0.00 H new ATOM 0 HB2 SER A 128 -6.811 4.810 12.079 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.810 3.828 13.130 1.00 0.00 H new ATOM 0 HG SER A 128 -7.196 5.255 14.322 1.00 0.00 H new ATOM 2139 N GLN A 129 -3.863 3.829 10.551 1.00 0.00 N ATOM 2140 CA GLN A 129 -3.002 2.766 10.057 1.00 0.00 C ATOM 2141 C GLN A 129 -1.528 3.144 10.203 1.00 0.00 C ATOM 2142 O GLN A 129 -0.652 2.280 10.196 1.00 0.00 O ATOM 2143 CB GLN A 129 -3.317 2.485 8.587 1.00 0.00 C ATOM 2144 CG GLN A 129 -4.791 2.226 8.316 1.00 0.00 C ATOM 2145 CD GLN A 129 -5.550 3.480 7.924 1.00 0.00 C ATOM 2146 OE1 GLN A 129 -5.055 4.592 8.088 1.00 0.00 O ATOM 2147 NE2 GLN A 129 -6.766 3.306 7.416 1.00 0.00 N ATOM 0 H GLN A 129 -4.529 4.179 9.863 1.00 0.00 H new ATOM 0 HA GLN A 129 -3.189 1.871 10.650 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -2.990 3.333 7.986 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -2.739 1.621 8.260 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -4.884 1.487 7.520 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -5.248 1.794 9.206 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -7.139 2.364 7.297 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -7.326 4.114 7.145 1.00 0.00 H new ATOM 2156 N GLY A 130 -1.263 4.443 10.323 1.00 0.00 N ATOM 2157 CA GLY A 130 0.102 4.915 10.454 1.00 0.00 C ATOM 2158 C GLY A 130 0.708 5.252 9.108 1.00 0.00 C ATOM 2159 O GLY A 130 1.374 4.420 8.499 1.00 0.00 O ATOM 0 H GLY A 130 -1.972 5.177 10.332 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.122 5.797 11.094 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.706 4.152 10.944 1.00 0.00 H new ATOM 2163 N ALA A 131 0.465 6.473 8.639 1.00 0.00 N ATOM 2164 CA ALA A 131 0.974 6.921 7.343 1.00 0.00 C ATOM 2165 C ALA A 131 2.480 7.192 7.361 1.00 0.00 C ATOM 2166 O ALA A 131 2.991 7.914 6.505 1.00 0.00 O ATOM 2167 CB ALA A 131 0.223 8.164 6.892 1.00 0.00 C ATOM 0 H ALA A 131 -0.083 7.173 9.138 1.00 0.00 H new ATOM 0 HA ALA A 131 0.806 6.110 6.634 1.00 0.00 H new ATOM 0 HB1 ALA A 131 0.608 8.491 5.926 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -0.839 7.935 6.801 1.00 0.00 H new ATOM 0 HB3 ALA A 131 0.361 8.958 7.626 1.00 0.00 H new ATOM 2173 N SER A 132 3.190 6.613 8.325 1.00 0.00 N ATOM 2174 CA SER A 132 4.632 6.802 8.425 1.00 0.00 C ATOM 2175 C SER A 132 5.387 5.803 7.547 1.00 0.00 C ATOM 2176 O SER A 132 6.608 5.684 7.644 1.00 0.00 O ATOM 2177 CB SER A 132 5.082 6.649 9.877 1.00 0.00 C ATOM 2178 OG SER A 132 4.151 7.242 10.765 1.00 0.00 O ATOM 0 H SER A 132 2.791 6.011 9.045 1.00 0.00 H new ATOM 0 HA SER A 132 4.861 7.808 8.074 1.00 0.00 H new ATOM 0 HB2 SER A 132 5.195 5.592 10.116 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.060 7.112 10.008 1.00 0.00 H new ATOM 0 HG SER A 132 4.461 7.129 11.688 1.00 0.00 H new ATOM 2184 N TRP A 133 4.658 5.082 6.694 1.00 0.00 N ATOM 2185 CA TRP A 133 5.269 4.091 5.805 1.00 0.00 C ATOM 2186 C TRP A 133 6.517 4.651 5.127 1.00 0.00 C ATOM 2187 O TRP A 133 7.564 4.003 5.092 1.00 0.00 O ATOM 2188 CB TRP A 133 4.285 3.633 4.719 1.00 0.00 C ATOM 2189 CG TRP A 133 2.848 3.580 5.150 1.00 0.00 C ATOM 2190 CD1 TRP A 133 2.359 3.139 6.344 1.00 0.00 C ATOM 2191 CD2 TRP A 133 1.711 3.974 4.372 1.00 0.00 C ATOM 2192 NE1 TRP A 133 0.986 3.238 6.357 1.00 0.00 N ATOM 2193 CE2 TRP A 133 0.566 3.747 5.159 1.00 0.00 C ATOM 2194 CE3 TRP A 133 1.549 4.498 3.088 1.00 0.00 C ATOM 2195 CZ2 TRP A 133 -0.720 4.024 4.702 1.00 0.00 C ATOM 2196 CZ3 TRP A 133 0.274 4.772 2.636 1.00 0.00 C ATOM 2197 CH2 TRP A 133 -0.847 4.535 3.439 1.00 0.00 C ATOM 0 H TRP A 133 3.646 5.165 6.599 1.00 0.00 H new ATOM 0 HA TRP A 133 5.544 3.239 6.427 1.00 0.00 H new ATOM 0 HB2 TRP A 133 4.369 4.306 3.866 1.00 0.00 H new ATOM 0 HB3 TRP A 133 4.582 2.643 4.374 1.00 0.00 H new ATOM 0 HD1 TRP A 133 2.961 2.767 7.160 1.00 0.00 H new ATOM 0 HE1 TRP A 133 0.380 2.974 7.134 1.00 0.00 H new ATOM 0 HE3 TRP A 133 2.407 4.686 2.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -1.586 3.842 5.322 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 0.139 5.177 1.644 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -1.831 4.760 3.055 1.00 0.00 H new ATOM 2208 N ALA A 134 6.388 5.851 4.573 1.00 0.00 N ATOM 2209 CA ALA A 134 7.490 6.503 3.874 1.00 0.00 C ATOM 2210 C ALA A 134 8.741 6.604 4.743 1.00 0.00 C ATOM 2211 O ALA A 134 9.861 6.557 4.235 1.00 0.00 O ATOM 2212 CB ALA A 134 7.061 7.883 3.402 1.00 0.00 C ATOM 0 H ALA A 134 5.526 6.395 4.595 1.00 0.00 H new ATOM 0 HA ALA A 134 7.745 5.887 3.012 1.00 0.00 H new ATOM 0 HB1 ALA A 134 7.889 8.363 2.881 1.00 0.00 H new ATOM 0 HB2 ALA A 134 6.212 7.788 2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 134 6.773 8.488 4.262 1.00 0.00 H new ATOM 2218 N GLN A 135 8.552 6.748 6.051 1.00 0.00 N ATOM 2219 CA GLN A 135 9.679 6.862 6.971 1.00 0.00 C ATOM 2220 C GLN A 135 10.388 5.517 7.142 1.00 0.00 C ATOM 2221 O GLN A 135 11.611 5.462 7.274 1.00 0.00 O ATOM 2222 CB GLN A 135 9.210 7.409 8.328 1.00 0.00 C ATOM 2223 CG GLN A 135 8.814 6.340 9.339 1.00 0.00 C ATOM 2224 CD GLN A 135 9.967 5.936 10.238 1.00 0.00 C ATOM 2225 OE1 GLN A 135 11.111 6.332 10.015 1.00 0.00 O ATOM 2226 NE2 GLN A 135 9.671 5.143 11.261 1.00 0.00 N ATOM 0 H GLN A 135 7.635 6.788 6.496 1.00 0.00 H new ATOM 0 HA GLN A 135 10.396 7.564 6.545 1.00 0.00 H new ATOM 0 HB2 GLN A 135 10.007 8.017 8.755 1.00 0.00 H new ATOM 0 HB3 GLN A 135 8.358 8.069 8.164 1.00 0.00 H new ATOM 0 HG2 GLN A 135 7.992 6.710 9.952 1.00 0.00 H new ATOM 0 HG3 GLN A 135 8.446 5.462 8.809 1.00 0.00 H new ATOM 0 HE21 GLN A 135 8.709 4.839 11.409 1.00 0.00 H new ATOM 0 HE22 GLN A 135 10.406 4.838 11.899 1.00 0.00 H new ATOM 2235 N GLU A 136 9.612 4.439 7.139 1.00 0.00 N ATOM 2236 CA GLU A 136 10.164 3.098 7.299 1.00 0.00 C ATOM 2237 C GLU A 136 10.612 2.524 5.959 1.00 0.00 C ATOM 2238 O GLU A 136 11.575 1.760 5.892 1.00 0.00 O ATOM 2239 CB GLU A 136 9.125 2.173 7.933 1.00 0.00 C ATOM 2240 CG GLU A 136 8.560 2.698 9.243 1.00 0.00 C ATOM 2241 CD GLU A 136 8.313 1.594 10.253 1.00 0.00 C ATOM 2242 OE1 GLU A 136 7.702 0.572 9.877 1.00 0.00 O ATOM 2243 OE2 GLU A 136 8.729 1.753 11.421 1.00 0.00 O ATOM 0 H GLU A 136 8.598 4.467 7.028 1.00 0.00 H new ATOM 0 HA GLU A 136 11.034 3.169 7.952 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.307 2.023 7.229 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.578 1.197 8.108 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.251 3.426 9.667 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.625 3.223 9.047 1.00 0.00 H new ATOM 2250 N ASP A 137 9.905 2.893 4.897 1.00 0.00 N ATOM 2251 CA ASP A 137 10.229 2.412 3.562 1.00 0.00 C ATOM 2252 C ASP A 137 11.644 2.811 3.173 1.00 0.00 C ATOM 2253 O ASP A 137 12.424 1.986 2.698 1.00 0.00 O ATOM 2254 CB ASP A 137 9.237 2.973 2.548 1.00 0.00 C ATOM 2255 CG ASP A 137 9.008 2.039 1.377 1.00 0.00 C ATOM 2256 OD1 ASP A 137 9.785 1.071 1.227 1.00 0.00 O ATOM 2257 OD2 ASP A 137 8.052 2.273 0.608 1.00 0.00 O ATOM 0 H ASP A 137 9.104 3.524 4.936 1.00 0.00 H new ATOM 0 HA ASP A 137 10.164 1.324 3.566 1.00 0.00 H new ATOM 0 HB2 ASP A 137 8.286 3.167 3.045 1.00 0.00 H new ATOM 0 HB3 ASP A 137 9.604 3.930 2.178 1.00 0.00 H new ATOM 2262 N GLN A 138 11.970 4.082 3.377 1.00 0.00 N ATOM 2263 CA GLN A 138 13.295 4.585 3.044 1.00 0.00 C ATOM 2264 C GLN A 138 14.333 4.032 4.009 1.00 0.00 C ATOM 2265 O GLN A 138 15.395 3.571 3.592 1.00 0.00 O ATOM 2266 CB GLN A 138 13.311 6.115 3.048 1.00 0.00 C ATOM 2267 CG GLN A 138 13.324 6.735 4.431 1.00 0.00 C ATOM 2268 CD GLN A 138 13.237 8.253 4.400 1.00 0.00 C ATOM 2269 OE1 GLN A 138 12.752 8.874 5.348 1.00 0.00 O ATOM 2270 NE2 GLN A 138 13.704 8.864 3.312 1.00 0.00 N ATOM 0 H GLN A 138 11.338 4.779 3.770 1.00 0.00 H new ATOM 0 HA GLN A 138 13.547 4.247 2.039 1.00 0.00 H new ATOM 0 HB2 GLN A 138 14.188 6.459 2.500 1.00 0.00 H new ATOM 0 HB3 GLN A 138 12.436 6.477 2.508 1.00 0.00 H new ATOM 0 HG2 GLN A 138 12.488 6.340 5.009 1.00 0.00 H new ATOM 0 HG3 GLN A 138 14.237 6.439 4.948 1.00 0.00 H new ATOM 0 HE21 GLN A 138 14.098 8.315 2.548 1.00 0.00 H new ATOM 0 HE22 GLN A 138 13.667 9.881 3.243 1.00 0.00 H new ATOM 2279 N GLN A 139 14.017 4.062 5.299 1.00 0.00 N ATOM 2280 CA GLN A 139 14.926 3.536 6.306 1.00 0.00 C ATOM 2281 C GLN A 139 15.292 2.099 5.963 1.00 0.00 C ATOM 2282 O GLN A 139 16.428 1.667 6.157 1.00 0.00 O ATOM 2283 CB GLN A 139 14.284 3.600 7.692 1.00 0.00 C ATOM 2284 CG GLN A 139 14.152 5.013 8.235 1.00 0.00 C ATOM 2285 CD GLN A 139 15.363 5.445 9.036 1.00 0.00 C ATOM 2286 OE1 GLN A 139 16.209 6.195 8.550 1.00 0.00 O ATOM 2287 NE2 GLN A 139 15.452 4.971 10.274 1.00 0.00 N ATOM 0 H GLN A 139 13.145 4.442 5.668 1.00 0.00 H new ATOM 0 HA GLN A 139 15.830 4.144 6.318 1.00 0.00 H new ATOM 0 HB2 GLN A 139 13.296 3.143 7.647 1.00 0.00 H new ATOM 0 HB3 GLN A 139 14.878 3.007 8.387 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.004 5.705 7.406 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.264 5.075 8.864 1.00 0.00 H new ATOM 0 HE21 GLN A 139 14.727 4.352 10.636 1.00 0.00 H new ATOM 0 HE22 GLN A 139 16.245 5.227 10.862 1.00 0.00 H new ATOM 2296 N ASP A 140 14.316 1.372 5.427 1.00 0.00 N ATOM 2297 CA ASP A 140 14.523 -0.013 5.028 1.00 0.00 C ATOM 2298 C ASP A 140 15.090 -0.083 3.613 1.00 0.00 C ATOM 2299 O ASP A 140 15.775 -1.038 3.255 1.00 0.00 O ATOM 2300 CB ASP A 140 13.207 -0.785 5.103 1.00 0.00 C ATOM 2301 CG ASP A 140 12.783 -1.067 6.532 1.00 0.00 C ATOM 2302 OD1 ASP A 140 13.509 -1.805 7.232 1.00 0.00 O ATOM 2303 OD2 ASP A 140 11.727 -0.549 6.952 1.00 0.00 O ATOM 0 H ASP A 140 13.373 1.722 5.259 1.00 0.00 H new ATOM 0 HA ASP A 140 15.240 -0.466 5.713 1.00 0.00 H new ATOM 0 HB2 ASP A 140 12.425 -0.215 4.601 1.00 0.00 H new ATOM 0 HB3 ASP A 140 13.310 -1.727 4.565 1.00 0.00 H new ATOM 2308 N ALA A 141 14.808 0.948 2.821 1.00 0.00 N ATOM 2309 CA ALA A 141 15.293 1.026 1.451 1.00 0.00 C ATOM 2310 C ALA A 141 16.779 1.347 1.442 1.00 0.00 C ATOM 2311 O ALA A 141 17.590 0.574 0.933 1.00 0.00 O ATOM 2312 CB ALA A 141 14.519 2.080 0.669 1.00 0.00 C ATOM 0 H ALA A 141 14.241 1.745 3.110 1.00 0.00 H new ATOM 0 HA ALA A 141 15.138 0.060 0.971 1.00 0.00 H new ATOM 0 HB1 ALA A 141 14.895 2.124 -0.353 1.00 0.00 H new ATOM 0 HB2 ALA A 141 13.461 1.819 0.655 1.00 0.00 H new ATOM 0 HB3 ALA A 141 14.646 3.052 1.145 1.00 0.00 H new ATOM 2318 N ASP A 142 17.131 2.485 2.034 1.00 0.00 N ATOM 2319 CA ASP A 142 18.524 2.897 2.118 1.00 0.00 C ATOM 2320 C ASP A 142 19.332 1.813 2.816 1.00 0.00 C ATOM 2321 O ASP A 142 20.481 1.551 2.461 1.00 0.00 O ATOM 2322 CB ASP A 142 18.651 4.221 2.876 1.00 0.00 C ATOM 2323 CG ASP A 142 19.980 4.906 2.624 1.00 0.00 C ATOM 2324 OD1 ASP A 142 20.935 4.215 2.211 1.00 0.00 O ATOM 2325 OD2 ASP A 142 20.065 6.134 2.837 1.00 0.00 O ATOM 0 H ASP A 142 16.471 3.135 2.461 1.00 0.00 H new ATOM 0 HA ASP A 142 18.910 3.044 1.109 1.00 0.00 H new ATOM 0 HB2 ASP A 142 17.840 4.886 2.578 1.00 0.00 H new ATOM 0 HB3 ASP A 142 18.537 4.037 3.944 1.00 0.00 H new ATOM 2330 N GLU A 143 18.706 1.174 3.802 1.00 0.00 N ATOM 2331 CA GLU A 143 19.349 0.100 4.543 1.00 0.00 C ATOM 2332 C GLU A 143 19.373 -1.174 3.710 1.00 0.00 C ATOM 2333 O GLU A 143 20.312 -1.962 3.792 1.00 0.00 O ATOM 2334 CB GLU A 143 18.621 -0.156 5.864 1.00 0.00 C ATOM 2335 CG GLU A 143 18.929 0.874 6.938 1.00 0.00 C ATOM 2336 CD GLU A 143 18.231 0.575 8.251 1.00 0.00 C ATOM 2337 OE1 GLU A 143 16.989 0.439 8.245 1.00 0.00 O ATOM 2338 OE2 GLU A 143 18.925 0.476 9.285 1.00 0.00 O ATOM 0 H GLU A 143 17.754 1.384 4.104 1.00 0.00 H new ATOM 0 HA GLU A 143 20.373 0.402 4.762 1.00 0.00 H new ATOM 0 HB2 GLU A 143 17.547 -0.167 5.681 1.00 0.00 H new ATOM 0 HB3 GLU A 143 18.892 -1.145 6.233 1.00 0.00 H new ATOM 0 HG2 GLU A 143 20.006 0.910 7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 143 18.627 1.861 6.587 1.00 0.00 H new ATOM 2345 N ASP A 144 18.331 -1.372 2.904 1.00 0.00 N ATOM 2346 CA ASP A 144 18.245 -2.561 2.058 1.00 0.00 C ATOM 2347 C ASP A 144 19.406 -2.617 1.066 1.00 0.00 C ATOM 2348 O ASP A 144 20.162 -3.587 1.032 1.00 0.00 O ATOM 2349 CB ASP A 144 16.915 -2.588 1.302 1.00 0.00 C ATOM 2350 CG ASP A 144 15.917 -3.547 1.923 1.00 0.00 C ATOM 2351 OD1 ASP A 144 15.731 -3.495 3.157 1.00 0.00 O ATOM 2352 OD2 ASP A 144 15.321 -4.350 1.174 1.00 0.00 O ATOM 0 H ASP A 144 17.542 -0.731 2.819 1.00 0.00 H new ATOM 0 HA ASP A 144 18.303 -3.434 2.708 1.00 0.00 H new ATOM 0 HB2 ASP A 144 16.489 -1.585 1.285 1.00 0.00 H new ATOM 0 HB3 ASP A 144 17.095 -2.875 0.266 1.00 0.00 H new ATOM 2357 N ARG A 145 19.531 -1.572 0.254 1.00 0.00 N ATOM 2358 CA ARG A 145 20.587 -1.498 -0.750 1.00 0.00 C ATOM 2359 C ARG A 145 21.971 -1.604 -0.114 1.00 0.00 C ATOM 2360 O ARG A 145 22.840 -2.317 -0.616 1.00 0.00 O ATOM 2361 CB ARG A 145 20.477 -0.195 -1.544 1.00 0.00 C ATOM 2362 CG ARG A 145 20.420 1.047 -0.671 1.00 0.00 C ATOM 2363 CD ARG A 145 20.195 2.301 -1.500 1.00 0.00 C ATOM 2364 NE ARG A 145 20.762 3.489 -0.866 1.00 0.00 N ATOM 2365 CZ ARG A 145 20.984 4.637 -1.504 1.00 0.00 C ATOM 2366 NH1 ARG A 145 20.692 4.753 -2.793 1.00 0.00 N ATOM 2367 NH2 ARG A 145 21.499 5.670 -0.851 1.00 0.00 N ATOM 0 H ARG A 145 18.912 -0.762 0.272 1.00 0.00 H new ATOM 0 HA ARG A 145 20.459 -2.343 -1.427 1.00 0.00 H new ATOM 0 HB2 ARG A 145 21.331 -0.117 -2.217 1.00 0.00 H new ATOM 0 HB3 ARG A 145 19.583 -0.233 -2.166 1.00 0.00 H new ATOM 0 HG2 ARG A 145 19.617 0.943 0.059 1.00 0.00 H new ATOM 0 HG3 ARG A 145 21.350 1.142 -0.111 1.00 0.00 H new ATOM 0 HD2 ARG A 145 20.642 2.168 -2.485 1.00 0.00 H new ATOM 0 HD3 ARG A 145 19.126 2.447 -1.652 1.00 0.00 H new ATOM 0 HE ARG A 145 21.002 3.436 0.124 1.00 0.00 H new ATOM 0 HH11 ARG A 145 20.296 3.961 -3.299 1.00 0.00 H new ATOM 0 HH12 ARG A 145 20.864 5.634 -3.278 1.00 0.00 H new ATOM 0 HH21 ARG A 145 21.725 5.586 0.140 1.00 0.00 H new ATOM 0 HH22 ARG A 145 21.669 6.549 -1.340 1.00 0.00 H new