USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 744 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 65 GLN : amide:sc= 0.522 K(o=1.1,f=0.031) USER MOD Set 1.2: A 70 THR OG1 : rot 152:sc= 0.57 USER MOD Set 2.1: A 62 SER OG : rot 150:sc= 0.184 USER MOD Set 2.2: A 71 SER OG : rot 126:sc= 0.0728 USER MOD Set 3.1: A 43 ASN : amide:sc= -3.17! C(o=-5.3!,f=-5.6!) USER MOD Set 3.2: A 58 THR OG1 : rot 125:sc= -2.16! USER MOD Set 4.1: A 7 THR OG1 : rot -150:sc= 0.00057 USER MOD Set 4.2: A 93 ASN : amide:sc= -0.338 K(o=-0.34,f=-7.6!) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -7.89! C(o=-7.9!,f=-16!) USER MOD Single : A 11 THR OG1 : rot -93:sc= -1.15 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot -160:sc= -1.59 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc=-0.00264 K(o=-0.0026,f=-1) USER MOD Single : A 29 GLN : amide:sc= -0.0157 X(o=-0.016,f=-0.18) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 70:sc= -1.35 USER MOD Single : A 34 LYS NZ :NH3+ 140:sc= -0.0278 (180deg=-0.396) USER MOD Single : A 36 ASN : amide:sc= -3.23! C(o=-3.2!,f=-12!) USER MOD Single : A 40 HIS : no HD1:sc= -2.14 X(o=-2.1,f=-2) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.0807 X(o=-0.081,f=-0.56) USER MOD Single : A 53 SER OG : rot 161:sc= -1.75 USER MOD Single : A 54 ASN : amide:sc= -2.95 X(o=-2.9,f=-3.2!) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc=-0.00756 X(o=-0.0076,f=-0.49) USER MOD Single : A 60 TYR OH : rot -57:sc= 1.24 USER MOD Single : A 61 ASN : amide:sc= -0.342 X(o=-0.34,f=0) USER MOD Single : A 67 SER OG : rot 84:sc= 0.908 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 140:sc= 1.04 USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.713 K(o=-0.71,f=-1.6!) USER MOD Single : A 82 THR OG1 : rot 47:sc= 0.798 USER MOD Single : A 83 SER OG : rot -120:sc= -0.148 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 ASN :FLIP amide:sc= -5.05! C(o=-7.7!,f=-5!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -68:sc= 0.869 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 3.356 3.365 -5.809 1.00 0.00 N ATOM 2 CA GLY A -1 2.484 2.187 -6.072 1.00 0.00 C ATOM 3 C GLY A -1 2.672 1.085 -5.046 1.00 0.00 C ATOM 4 O GLY A -1 2.413 1.282 -3.860 1.00 0.00 O ATOM 0 H1 GLY A -1 3.190 4.089 -6.537 1.00 0.00 H new ATOM 0 H2 GLY A -1 3.135 3.759 -4.872 1.00 0.00 H new ATOM 0 H3 GLY A -1 4.353 3.071 -5.834 1.00 0.00 H new ATOM 0 HA2 GLY A -1 1.441 2.504 -6.073 1.00 0.00 H new ATOM 0 HA3 GLY A -1 2.699 1.794 -7.066 1.00 0.00 H new ATOM 10 N LEU A 1 3.121 -0.079 -5.508 1.00 0.00 N ATOM 11 CA LEU A 1 3.339 -1.219 -4.625 1.00 0.00 C ATOM 12 C LEU A 1 4.318 -2.211 -5.250 1.00 0.00 C ATOM 13 O LEU A 1 4.142 -2.631 -6.394 1.00 0.00 O ATOM 14 CB LEU A 1 2.010 -1.916 -4.326 1.00 0.00 C ATOM 15 CG LEU A 1 1.197 -2.314 -5.559 1.00 0.00 C ATOM 16 CD1 LEU A 1 0.406 -3.584 -5.289 1.00 0.00 C ATOM 17 CD2 LEU A 1 0.270 -1.181 -5.976 1.00 0.00 C ATOM 0 H LEU A 1 3.341 -0.257 -6.488 1.00 0.00 H new ATOM 0 HA LEU A 1 3.768 -0.851 -3.693 1.00 0.00 H new ATOM 0 HB2 LEU A 1 2.211 -2.811 -3.737 1.00 0.00 H new ATOM 0 HB3 LEU A 1 1.403 -1.257 -3.706 1.00 0.00 H new ATOM 0 HG LEU A 1 1.888 -2.510 -6.379 1.00 0.00 H new ATOM 0 HD11 LEU A 1 -0.166 -3.852 -6.177 1.00 0.00 H new ATOM 0 HD12 LEU A 1 1.092 -4.394 -5.041 1.00 0.00 H new ATOM 0 HD13 LEU A 1 -0.276 -3.418 -4.455 1.00 0.00 H new ATOM 0 HD21 LEU A 1 -0.300 -1.482 -6.855 1.00 0.00 H new ATOM 0 HD22 LEU A 1 -0.415 -0.952 -5.160 1.00 0.00 H new ATOM 0 HD23 LEU A 1 0.861 -0.296 -6.213 1.00 0.00 H new ATOM 29 N GLY A 2 5.347 -2.581 -4.493 1.00 0.00 N ATOM 30 CA GLY A 2 6.335 -3.523 -4.995 1.00 0.00 C ATOM 31 C GLY A 2 7.686 -3.373 -4.318 1.00 0.00 C ATOM 32 O GLY A 2 8.068 -2.273 -3.921 1.00 0.00 O ATOM 0 H GLY A 2 5.515 -2.247 -3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 2 5.970 -4.539 -4.847 1.00 0.00 H new ATOM 0 HA3 GLY A 2 6.454 -3.380 -6.069 1.00 0.00 H new ATOM 36 N LYS A 3 8.412 -4.482 -4.191 1.00 0.00 N ATOM 37 CA LYS A 3 9.730 -4.466 -3.560 1.00 0.00 C ATOM 38 C LYS A 3 10.616 -5.582 -4.106 1.00 0.00 C ATOM 39 O LYS A 3 10.689 -6.668 -3.529 1.00 0.00 O ATOM 40 CB LYS A 3 9.595 -4.605 -2.042 1.00 0.00 C ATOM 41 CG LYS A 3 8.672 -5.734 -1.610 1.00 0.00 C ATOM 42 CD LYS A 3 8.072 -5.468 -0.239 1.00 0.00 C ATOM 43 CE LYS A 3 6.755 -4.718 -0.344 1.00 0.00 C ATOM 44 NZ LYS A 3 5.810 -5.100 0.740 1.00 0.00 N ATOM 0 H LYS A 3 8.111 -5.401 -4.516 1.00 0.00 H new ATOM 0 HA LYS A 3 10.200 -3.510 -3.792 1.00 0.00 H new ATOM 0 HB2 LYS A 3 10.583 -4.771 -1.612 1.00 0.00 H new ATOM 0 HB3 LYS A 3 9.222 -3.666 -1.632 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.873 -5.852 -2.342 1.00 0.00 H new ATOM 0 HG3 LYS A 3 9.227 -6.672 -1.590 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.913 -6.414 0.280 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.775 -4.890 0.361 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.944 -3.645 -0.300 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.298 -4.921 -1.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 4.924 -4.566 0.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 5.609 -6.119 0.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 6.235 -4.882 1.664 1.00 0.00 H new ATOM 58 N PHE A 4 11.298 -5.303 -5.215 1.00 0.00 N ATOM 59 CA PHE A 4 12.184 -6.287 -5.839 1.00 0.00 C ATOM 60 C PHE A 4 13.622 -6.132 -5.344 1.00 0.00 C ATOM 61 O PHE A 4 14.311 -7.120 -5.100 1.00 0.00 O ATOM 62 CB PHE A 4 12.130 -6.170 -7.371 1.00 0.00 C ATOM 63 CG PHE A 4 12.969 -5.060 -7.947 1.00 0.00 C ATOM 64 CD1 PHE A 4 12.513 -3.752 -7.946 1.00 0.00 C ATOM 65 CD2 PHE A 4 14.213 -5.331 -8.493 1.00 0.00 C ATOM 66 CE1 PHE A 4 13.282 -2.734 -8.479 1.00 0.00 C ATOM 67 CE2 PHE A 4 14.987 -4.318 -9.028 1.00 0.00 C ATOM 68 CZ PHE A 4 14.521 -3.018 -9.021 1.00 0.00 C ATOM 0 H PHE A 4 11.255 -4.407 -5.700 1.00 0.00 H new ATOM 0 HA PHE A 4 11.834 -7.278 -5.552 1.00 0.00 H new ATOM 0 HB2 PHE A 4 12.454 -7.115 -7.806 1.00 0.00 H new ATOM 0 HB3 PHE A 4 11.094 -6.019 -7.674 1.00 0.00 H new ATOM 0 HD1 PHE A 4 11.545 -3.525 -7.524 1.00 0.00 H new ATOM 0 HD2 PHE A 4 14.583 -6.346 -8.501 1.00 0.00 H new ATOM 0 HE1 PHE A 4 12.915 -1.718 -8.472 1.00 0.00 H new ATOM 0 HE2 PHE A 4 15.955 -4.543 -9.451 1.00 0.00 H new ATOM 0 HZ PHE A 4 15.124 -2.225 -9.438 1.00 0.00 H new ATOM 78 N ILE A 5 14.073 -4.891 -5.200 1.00 0.00 N ATOM 79 CA ILE A 5 15.433 -4.635 -4.744 1.00 0.00 C ATOM 80 C ILE A 5 15.656 -5.163 -3.331 1.00 0.00 C ATOM 81 O ILE A 5 16.793 -5.398 -2.922 1.00 0.00 O ATOM 82 CB ILE A 5 15.771 -3.131 -4.791 1.00 0.00 C ATOM 83 CG1 ILE A 5 17.278 -2.922 -4.630 1.00 0.00 C ATOM 84 CG2 ILE A 5 15.005 -2.368 -3.718 1.00 0.00 C ATOM 85 CD1 ILE A 5 18.072 -3.283 -5.867 1.00 0.00 C ATOM 0 H ILE A 5 13.522 -4.054 -5.391 1.00 0.00 H new ATOM 0 HA ILE A 5 16.097 -5.165 -5.426 1.00 0.00 H new ATOM 0 HB ILE A 5 15.467 -2.741 -5.762 1.00 0.00 H new ATOM 0 HG12 ILE A 5 17.467 -1.879 -4.378 1.00 0.00 H new ATOM 0 HG13 ILE A 5 17.633 -3.522 -3.792 1.00 0.00 H new ATOM 0 HG21 ILE A 5 15.260 -1.310 -3.772 1.00 0.00 H new ATOM 0 HG22 ILE A 5 13.934 -2.491 -3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 5 15.272 -2.756 -2.735 1.00 0.00 H new ATOM 0 HD11 ILE A 5 19.132 -3.110 -5.682 1.00 0.00 H new ATOM 0 HD12 ILE A 5 17.912 -4.334 -6.108 1.00 0.00 H new ATOM 0 HD13 ILE A 5 17.744 -2.665 -6.703 1.00 0.00 H new ATOM 97 N GLU A 6 14.570 -5.374 -2.594 1.00 0.00 N ATOM 98 CA GLU A 6 14.669 -5.901 -1.240 1.00 0.00 C ATOM 99 C GLU A 6 14.924 -7.408 -1.268 1.00 0.00 C ATOM 100 O GLU A 6 15.489 -7.969 -0.329 1.00 0.00 O ATOM 101 CB GLU A 6 13.393 -5.594 -0.448 1.00 0.00 C ATOM 102 CG GLU A 6 13.101 -4.106 -0.316 1.00 0.00 C ATOM 103 CD GLU A 6 13.728 -3.495 0.921 1.00 0.00 C ATOM 104 OE1 GLU A 6 14.972 -3.525 1.034 1.00 0.00 O ATOM 105 OE2 GLU A 6 12.976 -2.984 1.778 1.00 0.00 O ATOM 0 H GLU A 6 13.618 -5.189 -2.910 1.00 0.00 H new ATOM 0 HA GLU A 6 15.510 -5.415 -0.745 1.00 0.00 H new ATOM 0 HB2 GLU A 6 12.547 -6.080 -0.935 1.00 0.00 H new ATOM 0 HB3 GLU A 6 13.480 -6.028 0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 6 13.471 -3.587 -1.200 1.00 0.00 H new ATOM 0 HG3 GLU A 6 12.022 -3.953 -0.285 1.00 0.00 H new ATOM 112 N THR A 7 14.504 -8.058 -2.354 1.00 0.00 N ATOM 113 CA THR A 7 14.690 -9.498 -2.505 1.00 0.00 C ATOM 114 C THR A 7 15.566 -9.836 -3.716 1.00 0.00 C ATOM 115 O THR A 7 15.576 -10.975 -4.182 1.00 0.00 O ATOM 116 CB THR A 7 13.336 -10.200 -2.629 1.00 0.00 C ATOM 117 OG1 THR A 7 12.603 -9.689 -3.729 1.00 0.00 O ATOM 118 CG2 THR A 7 12.468 -10.054 -1.398 1.00 0.00 C ATOM 0 H THR A 7 14.034 -7.609 -3.140 1.00 0.00 H new ATOM 0 HA THR A 7 15.203 -9.855 -1.612 1.00 0.00 H new ATOM 0 HB THR A 7 13.573 -11.255 -2.765 1.00 0.00 H new ATOM 0 HG1 THR A 7 11.643 -9.756 -3.542 1.00 0.00 H new ATOM 0 HG21 THR A 7 11.524 -10.575 -1.555 1.00 0.00 H new ATOM 0 HG22 THR A 7 12.981 -10.484 -0.538 1.00 0.00 H new ATOM 0 HG23 THR A 7 12.273 -8.998 -1.214 1.00 0.00 H new ATOM 126 N CYS A 8 16.295 -8.850 -4.234 1.00 0.00 N ATOM 127 CA CYS A 8 17.150 -9.076 -5.394 1.00 0.00 C ATOM 128 C CYS A 8 18.533 -8.461 -5.194 1.00 0.00 C ATOM 129 O CYS A 8 18.702 -7.519 -4.419 1.00 0.00 O ATOM 130 CB CYS A 8 16.498 -8.506 -6.658 1.00 0.00 C ATOM 131 SG CYS A 8 14.818 -9.139 -6.980 1.00 0.00 S ATOM 0 H CYS A 8 16.311 -7.896 -3.872 1.00 0.00 H new ATOM 0 HA CYS A 8 17.273 -10.153 -5.511 1.00 0.00 H new ATOM 0 HB2 CYS A 8 16.455 -7.420 -6.574 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.131 -8.735 -7.515 1.00 0.00 H new ATOM 136 N ARG A 9 19.517 -9.002 -5.906 1.00 0.00 N ATOM 137 CA ARG A 9 20.890 -8.517 -5.816 1.00 0.00 C ATOM 138 C ARG A 9 21.488 -8.311 -7.205 1.00 0.00 C ATOM 139 O ARG A 9 20.876 -8.668 -8.211 1.00 0.00 O ATOM 140 CB ARG A 9 21.753 -9.501 -5.021 1.00 0.00 C ATOM 141 CG ARG A 9 21.624 -10.940 -5.491 1.00 0.00 C ATOM 142 CD ARG A 9 22.914 -11.718 -5.283 1.00 0.00 C ATOM 143 NE ARG A 9 22.996 -12.879 -6.166 1.00 0.00 N ATOM 144 CZ ARG A 9 24.094 -13.616 -6.327 1.00 0.00 C ATOM 145 NH1 ARG A 9 25.207 -13.316 -5.671 1.00 0.00 N ATOM 146 NH2 ARG A 9 24.077 -14.655 -7.148 1.00 0.00 N ATOM 0 H ARG A 9 19.388 -9.779 -6.554 1.00 0.00 H new ATOM 0 HA ARG A 9 20.874 -7.558 -5.299 1.00 0.00 H new ATOM 0 HB2 ARG A 9 22.797 -9.196 -5.093 1.00 0.00 H new ATOM 0 HB3 ARG A 9 21.477 -9.445 -3.968 1.00 0.00 H new ATOM 0 HG2 ARG A 9 20.813 -11.428 -4.950 1.00 0.00 H new ATOM 0 HG3 ARG A 9 21.356 -10.955 -6.548 1.00 0.00 H new ATOM 0 HD2 ARG A 9 23.766 -11.063 -5.464 1.00 0.00 H new ATOM 0 HD3 ARG A 9 22.978 -12.045 -4.245 1.00 0.00 H new ATOM 0 HE ARG A 9 22.162 -13.141 -6.691 1.00 0.00 H new ATOM 0 HH11 ARG A 9 25.226 -12.516 -5.038 1.00 0.00 H new ATOM 0 HH12 ARG A 9 26.044 -13.885 -5.799 1.00 0.00 H new ATOM 0 HH21 ARG A 9 23.224 -14.890 -7.656 1.00 0.00 H new ATOM 0 HH22 ARG A 9 24.917 -15.220 -7.273 1.00 0.00 H new ATOM 160 N ASN A 10 22.687 -7.731 -7.247 1.00 0.00 N ATOM 161 CA ASN A 10 23.393 -7.470 -8.501 1.00 0.00 C ATOM 162 C ASN A 10 22.506 -6.771 -9.529 1.00 0.00 C ATOM 163 O ASN A 10 22.321 -7.258 -10.643 1.00 0.00 O ATOM 164 CB ASN A 10 23.973 -8.770 -9.079 1.00 0.00 C ATOM 165 CG ASN A 10 22.917 -9.728 -9.597 1.00 0.00 C ATOM 166 OD1 ASN A 10 22.307 -10.472 -8.828 1.00 0.00 O ATOM 167 ND2 ASN A 10 22.706 -9.724 -10.908 1.00 0.00 N ATOM 0 H ASN A 10 23.195 -7.430 -6.415 1.00 0.00 H new ATOM 0 HA ASN A 10 24.214 -6.791 -8.271 1.00 0.00 H new ATOM 0 HB2 ASN A 10 24.657 -8.523 -9.891 1.00 0.00 H new ATOM 0 HB3 ASN A 10 24.559 -9.271 -8.309 1.00 0.00 H new ATOM 0 HD21 ASN A 10 22.015 -10.355 -11.315 1.00 0.00 H new ATOM 0 HD22 ASN A 10 23.235 -9.090 -11.508 1.00 0.00 H new ATOM 174 N THR A 11 21.974 -5.612 -9.154 1.00 0.00 N ATOM 175 CA THR A 11 21.133 -4.840 -10.058 1.00 0.00 C ATOM 176 C THR A 11 22.007 -4.081 -11.053 1.00 0.00 C ATOM 177 O THR A 11 22.985 -3.439 -10.670 1.00 0.00 O ATOM 178 CB THR A 11 20.249 -3.870 -9.273 1.00 0.00 C ATOM 179 OG1 THR A 11 21.013 -3.153 -8.319 1.00 0.00 O ATOM 180 CG2 THR A 11 19.119 -4.558 -8.534 1.00 0.00 C ATOM 0 H THR A 11 22.110 -5.190 -8.236 1.00 0.00 H new ATOM 0 HA THR A 11 20.483 -5.523 -10.606 1.00 0.00 H new ATOM 0 HB THR A 11 19.821 -3.200 -10.019 1.00 0.00 H new ATOM 0 HG1 THR A 11 20.983 -3.620 -7.458 1.00 0.00 H new ATOM 0 HG21 THR A 11 18.530 -3.815 -7.997 1.00 0.00 H new ATOM 0 HG22 THR A 11 18.482 -5.080 -9.248 1.00 0.00 H new ATOM 0 HG23 THR A 11 19.532 -5.275 -7.824 1.00 0.00 H new ATOM 188 N GLN A 12 21.654 -4.168 -12.330 1.00 0.00 N ATOM 189 CA GLN A 12 22.418 -3.500 -13.383 1.00 0.00 C ATOM 190 C GLN A 12 21.575 -3.274 -14.630 1.00 0.00 C ATOM 191 O GLN A 12 20.515 -3.877 -14.796 1.00 0.00 O ATOM 192 CB GLN A 12 23.682 -4.292 -13.726 1.00 0.00 C ATOM 193 CG GLN A 12 23.436 -5.770 -13.977 1.00 0.00 C ATOM 194 CD GLN A 12 24.627 -6.453 -14.622 1.00 0.00 C ATOM 195 OE1 GLN A 12 24.787 -6.424 -15.843 1.00 0.00 O ATOM 196 NE2 GLN A 12 25.473 -7.068 -13.804 1.00 0.00 N ATOM 0 H GLN A 12 20.846 -4.693 -12.663 1.00 0.00 H new ATOM 0 HA GLN A 12 22.714 -2.523 -13.001 1.00 0.00 H new ATOM 0 HB2 GLN A 12 24.143 -3.855 -14.612 1.00 0.00 H new ATOM 0 HB3 GLN A 12 24.397 -4.187 -12.910 1.00 0.00 H new ATOM 0 HG2 GLN A 12 23.206 -6.263 -13.032 1.00 0.00 H new ATOM 0 HG3 GLN A 12 22.563 -5.886 -14.619 1.00 0.00 H new ATOM 0 HE21 GLN A 12 25.302 -7.067 -12.798 1.00 0.00 H new ATOM 0 HE22 GLN A 12 26.294 -7.541 -14.181 1.00 0.00 H new ATOM 205 N LEU A 13 22.056 -2.396 -15.502 1.00 0.00 N ATOM 206 CA LEU A 13 21.348 -2.079 -16.732 1.00 0.00 C ATOM 207 C LEU A 13 21.898 -2.879 -17.899 1.00 0.00 C ATOM 208 O LEU A 13 23.111 -3.005 -18.069 1.00 0.00 O ATOM 209 CB LEU A 13 21.475 -0.593 -17.056 1.00 0.00 C ATOM 210 CG LEU A 13 20.772 -0.162 -18.347 1.00 0.00 C ATOM 211 CD1 LEU A 13 19.625 0.781 -18.036 1.00 0.00 C ATOM 212 CD2 LEU A 13 21.756 0.485 -19.316 1.00 0.00 C ATOM 0 H LEU A 13 22.934 -1.892 -15.378 1.00 0.00 H new ATOM 0 HA LEU A 13 20.300 -2.336 -16.580 1.00 0.00 H new ATOM 0 HB2 LEU A 13 21.067 -0.017 -16.225 1.00 0.00 H new ATOM 0 HB3 LEU A 13 22.532 -0.339 -17.131 1.00 0.00 H new ATOM 0 HG LEU A 13 20.367 -1.052 -18.827 1.00 0.00 H new ATOM 0 HD11 LEU A 13 19.136 1.078 -18.964 1.00 0.00 H new ATOM 0 HD12 LEU A 13 18.905 0.278 -17.391 1.00 0.00 H new ATOM 0 HD13 LEU A 13 20.009 1.666 -17.529 1.00 0.00 H new ATOM 0 HD21 LEU A 13 21.231 0.782 -20.224 1.00 0.00 H new ATOM 0 HD22 LEU A 13 22.200 1.365 -18.850 1.00 0.00 H new ATOM 0 HD23 LEU A 13 22.541 -0.228 -19.567 1.00 0.00 H new ATOM 224 N ALA A 14 20.992 -3.402 -18.712 1.00 0.00 N ATOM 225 CA ALA A 14 21.358 -4.175 -19.883 1.00 0.00 C ATOM 226 C ALA A 14 20.803 -3.493 -21.124 1.00 0.00 C ATOM 227 O ALA A 14 19.718 -2.915 -21.083 1.00 0.00 O ATOM 228 CB ALA A 14 20.824 -5.594 -19.761 1.00 0.00 C ATOM 0 H ALA A 14 19.986 -3.301 -18.577 1.00 0.00 H new ATOM 0 HA ALA A 14 22.444 -4.229 -19.963 1.00 0.00 H new ATOM 0 HB1 ALA A 14 21.105 -6.166 -20.646 1.00 0.00 H new ATOM 0 HB2 ALA A 14 21.247 -6.067 -18.874 1.00 0.00 H new ATOM 0 HB3 ALA A 14 19.738 -5.568 -19.675 1.00 0.00 H new ATOM 234 N GLY A 15 21.545 -3.534 -22.221 1.00 0.00 N ATOM 235 CA GLY A 15 21.081 -2.883 -23.431 1.00 0.00 C ATOM 236 C GLY A 15 20.858 -1.398 -23.214 1.00 0.00 C ATOM 237 O GLY A 15 21.529 -0.786 -22.383 1.00 0.00 O ATOM 0 H GLY A 15 22.449 -4.000 -22.297 1.00 0.00 H new ATOM 0 HA2 GLY A 15 21.811 -3.030 -24.227 1.00 0.00 H new ATOM 0 HA3 GLY A 15 20.152 -3.347 -23.761 1.00 0.00 H new ATOM 241 N SER A 16 19.947 -0.803 -23.978 1.00 0.00 N ATOM 242 CA SER A 16 19.694 0.630 -23.866 1.00 0.00 C ATOM 243 C SER A 16 18.672 0.972 -22.785 1.00 0.00 C ATOM 244 O SER A 16 18.806 1.996 -22.114 1.00 0.00 O ATOM 245 CB SER A 16 19.191 1.175 -25.201 1.00 0.00 C ATOM 246 OG SER A 16 19.882 0.585 -26.289 1.00 0.00 O ATOM 0 H SER A 16 19.377 -1.284 -24.674 1.00 0.00 H new ATOM 0 HA SER A 16 20.642 1.090 -23.587 1.00 0.00 H new ATOM 0 HB2 SER A 16 18.123 0.980 -25.297 1.00 0.00 H new ATOM 0 HB3 SER A 16 19.322 2.257 -25.228 1.00 0.00 H new ATOM 0 HG SER A 16 19.539 0.950 -27.131 1.00 0.00 H new ATOM 252 N SER A 17 17.644 0.143 -22.617 1.00 0.00 N ATOM 253 CA SER A 17 16.625 0.430 -21.619 1.00 0.00 C ATOM 254 C SER A 17 16.139 -0.826 -20.891 1.00 0.00 C ATOM 255 O SER A 17 14.966 -0.925 -20.539 1.00 0.00 O ATOM 256 CB SER A 17 15.453 1.146 -22.286 1.00 0.00 C ATOM 257 OG SER A 17 15.180 0.596 -23.563 1.00 0.00 O ATOM 0 H SER A 17 17.498 -0.715 -23.149 1.00 0.00 H new ATOM 0 HA SER A 17 17.075 1.072 -20.862 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.568 1.066 -21.655 1.00 0.00 H new ATOM 0 HB3 SER A 17 15.680 2.208 -22.385 1.00 0.00 H new ATOM 0 HG SER A 17 14.666 1.240 -24.094 1.00 0.00 H new ATOM 263 N GLU A 18 17.044 -1.773 -20.651 1.00 0.00 N ATOM 264 CA GLU A 18 16.693 -3.004 -19.940 1.00 0.00 C ATOM 265 C GLU A 18 17.425 -3.118 -18.610 1.00 0.00 C ATOM 266 O GLU A 18 18.566 -2.683 -18.473 1.00 0.00 O ATOM 267 CB GLU A 18 16.983 -4.248 -20.783 1.00 0.00 C ATOM 268 CG GLU A 18 15.896 -4.577 -21.787 1.00 0.00 C ATOM 269 CD GLU A 18 16.184 -4.037 -23.172 1.00 0.00 C ATOM 270 OE1 GLU A 18 16.102 -2.805 -23.358 1.00 0.00 O ATOM 271 OE2 GLU A 18 16.489 -4.847 -24.072 1.00 0.00 O ATOM 0 H GLU A 18 18.022 -1.714 -20.936 1.00 0.00 H new ATOM 0 HA GLU A 18 15.621 -2.949 -19.748 1.00 0.00 H new ATOM 0 HB2 GLU A 18 17.923 -4.103 -21.315 1.00 0.00 H new ATOM 0 HB3 GLU A 18 17.121 -5.101 -20.119 1.00 0.00 H new ATOM 0 HG2 GLU A 18 15.777 -5.659 -21.843 1.00 0.00 H new ATOM 0 HG3 GLU A 18 14.948 -4.170 -21.434 1.00 0.00 H new ATOM 278 N LEU A 19 16.754 -3.725 -17.637 1.00 0.00 N ATOM 279 CA LEU A 19 17.323 -3.932 -16.312 1.00 0.00 C ATOM 280 C LEU A 19 17.393 -5.427 -16.021 1.00 0.00 C ATOM 281 O LEU A 19 16.379 -6.124 -16.081 1.00 0.00 O ATOM 282 CB LEU A 19 16.471 -3.214 -15.255 1.00 0.00 C ATOM 283 CG LEU A 19 16.712 -3.637 -13.803 1.00 0.00 C ATOM 284 CD1 LEU A 19 18.184 -3.507 -13.446 1.00 0.00 C ATOM 285 CD2 LEU A 19 15.858 -2.801 -12.859 1.00 0.00 C ATOM 0 H LEU A 19 15.806 -4.085 -17.744 1.00 0.00 H new ATOM 0 HA LEU A 19 18.330 -3.517 -16.278 1.00 0.00 H new ATOM 0 HB2 LEU A 19 16.653 -2.142 -15.336 1.00 0.00 H new ATOM 0 HB3 LEU A 19 15.420 -3.378 -15.491 1.00 0.00 H new ATOM 0 HG LEU A 19 16.425 -4.683 -13.696 1.00 0.00 H new ATOM 0 HD11 LEU A 19 18.336 -3.812 -12.411 1.00 0.00 H new ATOM 0 HD12 LEU A 19 18.775 -4.145 -14.103 1.00 0.00 H new ATOM 0 HD13 LEU A 19 18.498 -2.470 -13.569 1.00 0.00 H new ATOM 0 HD21 LEU A 19 16.040 -3.113 -11.831 1.00 0.00 H new ATOM 0 HD22 LEU A 19 16.117 -1.748 -12.970 1.00 0.00 H new ATOM 0 HD23 LEU A 19 14.804 -2.942 -13.100 1.00 0.00 H new ATOM 297 N ALA A 20 18.579 -5.929 -15.701 1.00 0.00 N ATOM 298 CA ALA A 20 18.740 -7.341 -15.403 1.00 0.00 C ATOM 299 C ALA A 20 19.244 -7.519 -13.973 1.00 0.00 C ATOM 300 O ALA A 20 20.036 -6.715 -13.483 1.00 0.00 O ATOM 301 CB ALA A 20 19.682 -7.980 -16.412 1.00 0.00 C ATOM 0 H ALA A 20 19.437 -5.381 -15.642 1.00 0.00 H new ATOM 0 HA ALA A 20 17.775 -7.842 -15.481 1.00 0.00 H new ATOM 0 HB1 ALA A 20 19.798 -9.039 -16.182 1.00 0.00 H new ATOM 0 HB2 ALA A 20 19.270 -7.870 -17.415 1.00 0.00 H new ATOM 0 HB3 ALA A 20 20.654 -7.490 -16.363 1.00 0.00 H new ATOM 307 N ALA A 21 18.765 -8.559 -13.303 1.00 0.00 N ATOM 308 CA ALA A 21 19.150 -8.816 -11.920 1.00 0.00 C ATOM 309 C ALA A 21 18.864 -10.260 -11.524 1.00 0.00 C ATOM 310 O ALA A 21 18.202 -10.993 -12.258 1.00 0.00 O ATOM 311 CB ALA A 21 18.424 -7.856 -10.991 1.00 0.00 C ATOM 0 H ALA A 21 18.111 -9.237 -13.693 1.00 0.00 H new ATOM 0 HA ALA A 21 20.224 -8.655 -11.830 1.00 0.00 H new ATOM 0 HB1 ALA A 21 18.718 -8.055 -9.960 1.00 0.00 H new ATOM 0 HB2 ALA A 21 18.686 -6.830 -11.251 1.00 0.00 H new ATOM 0 HB3 ALA A 21 17.348 -7.993 -11.095 1.00 0.00 H new ATOM 317 N GLU A 22 19.320 -10.652 -10.338 1.00 0.00 N ATOM 318 CA GLU A 22 19.059 -11.989 -9.826 1.00 0.00 C ATOM 319 C GLU A 22 18.128 -11.876 -8.625 1.00 0.00 C ATOM 320 O GLU A 22 18.335 -11.028 -7.755 1.00 0.00 O ATOM 321 CB GLU A 22 20.361 -12.686 -9.424 1.00 0.00 C ATOM 322 CG GLU A 22 21.353 -12.834 -10.565 1.00 0.00 C ATOM 323 CD GLU A 22 21.960 -14.223 -10.636 1.00 0.00 C ATOM 324 OE1 GLU A 22 21.201 -15.209 -10.527 1.00 0.00 O ATOM 325 OE2 GLU A 22 23.194 -14.324 -10.800 1.00 0.00 O ATOM 0 H GLU A 22 19.872 -10.062 -9.715 1.00 0.00 H new ATOM 0 HA GLU A 22 18.591 -12.589 -10.606 1.00 0.00 H new ATOM 0 HB2 GLU A 22 20.830 -12.123 -8.617 1.00 0.00 H new ATOM 0 HB3 GLU A 22 20.126 -13.674 -9.028 1.00 0.00 H new ATOM 0 HG2 GLU A 22 20.852 -12.612 -11.507 1.00 0.00 H new ATOM 0 HG3 GLU A 22 22.149 -12.099 -10.446 1.00 0.00 H new ATOM 332 N CYS A 23 17.091 -12.705 -8.571 1.00 0.00 N ATOM 333 CA CYS A 23 16.147 -12.635 -7.464 1.00 0.00 C ATOM 334 C CYS A 23 15.874 -14.000 -6.847 1.00 0.00 C ATOM 335 O CYS A 23 15.663 -14.988 -7.552 1.00 0.00 O ATOM 336 CB CYS A 23 14.839 -12.009 -7.942 1.00 0.00 C ATOM 337 SG CYS A 23 15.033 -10.327 -8.611 1.00 0.00 S ATOM 0 H CYS A 23 16.885 -13.421 -9.268 1.00 0.00 H new ATOM 0 HA CYS A 23 16.597 -12.015 -6.689 1.00 0.00 H new ATOM 0 HB2 CYS A 23 14.400 -12.647 -8.709 1.00 0.00 H new ATOM 0 HB3 CYS A 23 14.135 -11.981 -7.110 1.00 0.00 H new ATOM 342 N LYS A 24 15.891 -14.043 -5.521 1.00 0.00 N ATOM 343 CA LYS A 24 15.649 -15.281 -4.797 1.00 0.00 C ATOM 344 C LYS A 24 14.210 -15.755 -4.978 1.00 0.00 C ATOM 345 O LYS A 24 13.265 -14.971 -4.897 1.00 0.00 O ATOM 346 CB LYS A 24 15.959 -15.102 -3.307 1.00 0.00 C ATOM 347 CG LYS A 24 15.082 -14.064 -2.621 1.00 0.00 C ATOM 348 CD LYS A 24 14.737 -14.473 -1.198 1.00 0.00 C ATOM 349 CE LYS A 24 15.579 -13.721 -0.179 1.00 0.00 C ATOM 350 NZ LYS A 24 15.314 -14.180 1.213 1.00 0.00 N ATOM 0 H LYS A 24 16.070 -13.234 -4.926 1.00 0.00 H new ATOM 0 HA LYS A 24 16.313 -16.041 -5.209 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.836 -16.060 -2.802 1.00 0.00 H new ATOM 0 HB3 LYS A 24 17.004 -14.814 -3.194 1.00 0.00 H new ATOM 0 HG2 LYS A 24 15.597 -13.103 -2.609 1.00 0.00 H new ATOM 0 HG3 LYS A 24 14.164 -13.927 -3.193 1.00 0.00 H new ATOM 0 HD2 LYS A 24 13.681 -14.282 -1.010 1.00 0.00 H new ATOM 0 HD3 LYS A 24 14.893 -15.545 -1.079 1.00 0.00 H new ATOM 0 HE2 LYS A 24 16.635 -13.857 -0.411 1.00 0.00 H new ATOM 0 HE3 LYS A 24 15.371 -12.654 -0.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 15.908 -13.642 1.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 14.312 -14.027 1.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 15.537 -15.193 1.293 1.00 0.00 H new ATOM 364 N THR A 25 14.059 -17.052 -5.216 1.00 0.00 N ATOM 365 CA THR A 25 12.743 -17.649 -5.403 1.00 0.00 C ATOM 366 C THR A 25 12.134 -18.018 -4.055 1.00 0.00 C ATOM 367 O THR A 25 12.732 -17.762 -3.009 1.00 0.00 O ATOM 368 CB THR A 25 12.845 -18.886 -6.295 1.00 0.00 C ATOM 369 OG1 THR A 25 13.722 -19.844 -5.727 1.00 0.00 O ATOM 370 CG2 THR A 25 13.345 -18.573 -7.689 1.00 0.00 C ATOM 0 H THR A 25 14.834 -17.712 -5.284 1.00 0.00 H new ATOM 0 HA THR A 25 12.095 -16.920 -5.890 1.00 0.00 H new ATOM 0 HB THR A 25 11.830 -19.277 -6.368 1.00 0.00 H new ATOM 0 HG1 THR A 25 13.773 -20.629 -6.312 1.00 0.00 H new ATOM 0 HG21 THR A 25 13.395 -19.492 -8.273 1.00 0.00 H new ATOM 0 HG22 THR A 25 12.663 -17.873 -8.172 1.00 0.00 H new ATOM 0 HG23 THR A 25 14.338 -18.128 -7.628 1.00 0.00 H new ATOM 378 N ARG A 26 10.947 -18.616 -4.076 1.00 0.00 N ATOM 379 CA ARG A 26 10.275 -19.012 -2.844 1.00 0.00 C ATOM 380 C ARG A 26 11.113 -20.027 -2.072 1.00 0.00 C ATOM 381 O ARG A 26 11.027 -20.116 -0.848 1.00 0.00 O ATOM 382 CB ARG A 26 8.896 -19.605 -3.156 1.00 0.00 C ATOM 383 CG ARG A 26 7.951 -18.631 -3.843 1.00 0.00 C ATOM 384 CD ARG A 26 7.028 -17.952 -2.844 1.00 0.00 C ATOM 385 NE ARG A 26 7.749 -17.025 -1.975 1.00 0.00 N ATOM 386 CZ ARG A 26 8.203 -15.838 -2.371 1.00 0.00 C ATOM 387 NH1 ARG A 26 8.027 -15.438 -3.625 1.00 0.00 N ATOM 388 NH2 ARG A 26 8.835 -15.048 -1.512 1.00 0.00 N ATOM 0 H ARG A 26 10.433 -18.836 -4.929 1.00 0.00 H new ATOM 0 HA ARG A 26 10.149 -18.123 -2.226 1.00 0.00 H new ATOM 0 HB2 ARG A 26 9.023 -20.482 -3.790 1.00 0.00 H new ATOM 0 HB3 ARG A 26 8.439 -19.947 -2.227 1.00 0.00 H new ATOM 0 HG2 ARG A 26 8.529 -17.877 -4.377 1.00 0.00 H new ATOM 0 HG3 ARG A 26 7.357 -19.162 -4.586 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.247 -17.413 -3.380 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.533 -18.709 -2.235 1.00 0.00 H new ATOM 0 HE ARG A 26 7.914 -17.304 -1.008 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.542 -16.041 -4.289 1.00 0.00 H new ATOM 0 HH12 ARG A 26 8.377 -14.528 -3.924 1.00 0.00 H new ATOM 0 HH21 ARG A 26 8.973 -15.350 -0.548 1.00 0.00 H new ATOM 0 HH22 ARG A 26 9.183 -14.139 -1.816 1.00 0.00 H new ATOM 402 N ALA A 27 11.900 -20.814 -2.801 1.00 0.00 N ATOM 403 CA ALA A 27 12.728 -21.846 -2.189 1.00 0.00 C ATOM 404 C ALA A 27 14.033 -21.294 -1.616 1.00 0.00 C ATOM 405 O ALA A 27 14.916 -22.061 -1.232 1.00 0.00 O ATOM 406 CB ALA A 27 13.024 -22.938 -3.203 1.00 0.00 C ATOM 0 H ALA A 27 11.981 -20.756 -3.816 1.00 0.00 H new ATOM 0 HA ALA A 27 12.163 -22.257 -1.352 1.00 0.00 H new ATOM 0 HB1 ALA A 27 13.643 -23.706 -2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 27 12.088 -23.382 -3.543 1.00 0.00 H new ATOM 0 HB3 ALA A 27 13.553 -22.510 -4.054 1.00 0.00 H new ATOM 412 N GLN A 28 14.172 -19.971 -1.578 1.00 0.00 N ATOM 413 CA GLN A 28 15.391 -19.344 -1.074 1.00 0.00 C ATOM 414 C GLN A 28 16.576 -19.639 -1.987 1.00 0.00 C ATOM 415 O GLN A 28 17.711 -19.788 -1.533 1.00 0.00 O ATOM 416 CB GLN A 28 15.697 -19.833 0.344 1.00 0.00 C ATOM 417 CG GLN A 28 14.505 -19.764 1.283 1.00 0.00 C ATOM 418 CD GLN A 28 14.906 -19.875 2.740 1.00 0.00 C ATOM 419 OE1 GLN A 28 16.067 -20.130 3.060 1.00 0.00 O ATOM 420 NE2 GLN A 28 13.943 -19.680 3.635 1.00 0.00 N ATOM 0 H GLN A 28 13.457 -19.314 -1.890 1.00 0.00 H new ATOM 0 HA GLN A 28 15.228 -18.266 -1.054 1.00 0.00 H new ATOM 0 HB2 GLN A 28 16.051 -20.863 0.295 1.00 0.00 H new ATOM 0 HB3 GLN A 28 16.509 -19.236 0.758 1.00 0.00 H new ATOM 0 HG2 GLN A 28 13.977 -18.824 1.126 1.00 0.00 H new ATOM 0 HG3 GLN A 28 13.808 -20.566 1.039 1.00 0.00 H new ATOM 0 HE21 GLN A 28 12.994 -19.471 3.326 1.00 0.00 H new ATOM 0 HE22 GLN A 28 14.153 -19.739 4.631 1.00 0.00 H new ATOM 429 N GLN A 29 16.297 -19.680 -3.284 1.00 0.00 N ATOM 430 CA GLN A 29 17.321 -19.911 -4.294 1.00 0.00 C ATOM 431 C GLN A 29 17.390 -18.696 -5.213 1.00 0.00 C ATOM 432 O GLN A 29 16.359 -18.147 -5.589 1.00 0.00 O ATOM 433 CB GLN A 29 17.010 -21.177 -5.097 1.00 0.00 C ATOM 434 CG GLN A 29 17.210 -22.460 -4.306 1.00 0.00 C ATOM 435 CD GLN A 29 17.678 -23.615 -5.169 1.00 0.00 C ATOM 436 OE1 GLN A 29 18.636 -23.487 -5.930 1.00 0.00 O ATOM 437 NE2 GLN A 29 17.001 -24.752 -5.055 1.00 0.00 N ATOM 0 H GLN A 29 15.359 -19.555 -3.664 1.00 0.00 H new ATOM 0 HA GLN A 29 18.286 -20.055 -3.808 1.00 0.00 H new ATOM 0 HB2 GLN A 29 15.979 -21.132 -5.447 1.00 0.00 H new ATOM 0 HB3 GLN A 29 17.646 -21.202 -5.982 1.00 0.00 H new ATOM 0 HG2 GLN A 29 17.940 -22.284 -3.516 1.00 0.00 H new ATOM 0 HG3 GLN A 29 16.273 -22.732 -3.820 1.00 0.00 H new ATOM 0 HE21 GLN A 29 16.212 -24.814 -4.411 1.00 0.00 H new ATOM 0 HE22 GLN A 29 17.270 -25.564 -5.612 1.00 0.00 H new ATOM 446 N PHE A 30 18.597 -18.256 -5.551 1.00 0.00 N ATOM 447 CA PHE A 30 18.759 -17.079 -6.403 1.00 0.00 C ATOM 448 C PHE A 30 18.877 -17.460 -7.874 1.00 0.00 C ATOM 449 O PHE A 30 19.739 -18.253 -8.255 1.00 0.00 O ATOM 450 CB PHE A 30 19.997 -16.287 -5.979 1.00 0.00 C ATOM 451 CG PHE A 30 19.843 -15.601 -4.651 1.00 0.00 C ATOM 452 CD1 PHE A 30 19.808 -16.337 -3.479 1.00 0.00 C ATOM 453 CD2 PHE A 30 19.732 -14.222 -4.577 1.00 0.00 C ATOM 454 CE1 PHE A 30 19.665 -15.710 -2.255 1.00 0.00 C ATOM 455 CE2 PHE A 30 19.588 -13.589 -3.357 1.00 0.00 C ATOM 456 CZ PHE A 30 19.555 -14.335 -2.195 1.00 0.00 C ATOM 0 H PHE A 30 19.471 -18.690 -5.253 1.00 0.00 H new ATOM 0 HA PHE A 30 17.868 -16.462 -6.282 1.00 0.00 H new ATOM 0 HB2 PHE A 30 20.852 -16.961 -5.934 1.00 0.00 H new ATOM 0 HB3 PHE A 30 20.220 -15.540 -6.741 1.00 0.00 H new ATOM 0 HD1 PHE A 30 19.893 -17.413 -3.521 1.00 0.00 H new ATOM 0 HD2 PHE A 30 19.758 -13.635 -5.483 1.00 0.00 H new ATOM 0 HE1 PHE A 30 19.639 -16.295 -1.347 1.00 0.00 H new ATOM 0 HE2 PHE A 30 19.501 -12.513 -3.312 1.00 0.00 H new ATOM 0 HZ PHE A 30 19.443 -13.843 -1.240 1.00 0.00 H new ATOM 466 N VAL A 31 18.007 -16.882 -8.698 1.00 0.00 N ATOM 467 CA VAL A 31 18.013 -17.147 -10.130 1.00 0.00 C ATOM 468 C VAL A 31 18.002 -15.841 -10.918 1.00 0.00 C ATOM 469 O VAL A 31 17.489 -14.826 -10.448 1.00 0.00 O ATOM 470 CB VAL A 31 16.805 -18.007 -10.551 1.00 0.00 C ATOM 471 CG1 VAL A 31 17.018 -19.460 -10.154 1.00 0.00 C ATOM 472 CG2 VAL A 31 15.522 -17.465 -9.942 1.00 0.00 C ATOM 0 H VAL A 31 17.288 -16.225 -8.395 1.00 0.00 H new ATOM 0 HA VAL A 31 18.926 -17.699 -10.352 1.00 0.00 H new ATOM 0 HB VAL A 31 16.713 -17.960 -11.636 1.00 0.00 H new ATOM 0 HG11 VAL A 31 16.155 -20.051 -10.460 1.00 0.00 H new ATOM 0 HG12 VAL A 31 17.913 -19.844 -10.645 1.00 0.00 H new ATOM 0 HG13 VAL A 31 17.140 -19.528 -9.073 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.682 -18.086 -10.252 1.00 0.00 H new ATOM 0 HG22 VAL A 31 15.602 -17.478 -8.855 1.00 0.00 H new ATOM 0 HG23 VAL A 31 15.362 -16.442 -10.282 1.00 0.00 H new ATOM 482 N SER A 32 18.605 -15.861 -12.101 1.00 0.00 N ATOM 483 CA SER A 32 18.692 -14.666 -12.934 1.00 0.00 C ATOM 484 C SER A 32 17.336 -14.284 -13.525 1.00 0.00 C ATOM 485 O SER A 32 16.602 -15.130 -14.035 1.00 0.00 O ATOM 486 CB SER A 32 19.707 -14.879 -14.058 1.00 0.00 C ATOM 487 OG SER A 32 19.153 -15.655 -15.107 1.00 0.00 O ATOM 0 H SER A 32 19.041 -16.690 -12.505 1.00 0.00 H new ATOM 0 HA SER A 32 19.020 -13.846 -12.296 1.00 0.00 H new ATOM 0 HB2 SER A 32 20.030 -13.914 -14.448 1.00 0.00 H new ATOM 0 HB3 SER A 32 20.593 -15.376 -13.663 1.00 0.00 H new ATOM 0 HG SER A 32 19.822 -15.775 -15.813 1.00 0.00 H new ATOM 493 N THR A 33 17.027 -12.992 -13.459 1.00 0.00 N ATOM 494 CA THR A 33 15.775 -12.462 -13.987 1.00 0.00 C ATOM 495 C THR A 33 16.007 -11.095 -14.624 1.00 0.00 C ATOM 496 O THR A 33 17.022 -10.450 -14.366 1.00 0.00 O ATOM 497 CB THR A 33 14.723 -12.360 -12.880 1.00 0.00 C ATOM 498 OG1 THR A 33 13.572 -11.680 -13.345 1.00 0.00 O ATOM 499 CG2 THR A 33 15.213 -11.635 -11.649 1.00 0.00 C ATOM 0 H THR A 33 17.634 -12.287 -13.040 1.00 0.00 H new ATOM 0 HA THR A 33 15.406 -13.147 -14.750 1.00 0.00 H new ATOM 0 HB THR A 33 14.494 -13.390 -12.607 1.00 0.00 H new ATOM 0 HG1 THR A 33 13.099 -12.243 -13.993 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.416 -11.600 -10.906 1.00 0.00 H new ATOM 0 HG22 THR A 33 16.073 -12.162 -11.235 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.504 -10.619 -11.917 1.00 0.00 H new ATOM 507 N LYS A 34 15.078 -10.660 -15.466 1.00 0.00 N ATOM 508 CA LYS A 34 15.229 -9.380 -16.138 1.00 0.00 C ATOM 509 C LYS A 34 13.904 -8.635 -16.273 1.00 0.00 C ATOM 510 O LYS A 34 12.827 -9.234 -16.265 1.00 0.00 O ATOM 511 CB LYS A 34 15.837 -9.597 -17.524 1.00 0.00 C ATOM 512 CG LYS A 34 16.442 -8.342 -18.132 1.00 0.00 C ATOM 513 CD LYS A 34 17.295 -8.672 -19.346 1.00 0.00 C ATOM 514 CE LYS A 34 16.475 -9.344 -20.436 1.00 0.00 C ATOM 515 NZ LYS A 34 15.377 -8.466 -20.926 1.00 0.00 N ATOM 0 H LYS A 34 14.224 -11.168 -15.696 1.00 0.00 H new ATOM 0 HA LYS A 34 15.889 -8.766 -15.526 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.608 -10.365 -17.456 1.00 0.00 H new ATOM 0 HB3 LYS A 34 15.066 -9.978 -18.193 1.00 0.00 H new ATOM 0 HG2 LYS A 34 15.646 -7.655 -18.420 1.00 0.00 H new ATOM 0 HG3 LYS A 34 17.050 -7.831 -17.386 1.00 0.00 H new ATOM 0 HD2 LYS A 34 17.743 -7.758 -19.737 1.00 0.00 H new ATOM 0 HD3 LYS A 34 18.114 -9.327 -19.049 1.00 0.00 H new ATOM 0 HE2 LYS A 34 17.126 -9.610 -21.269 1.00 0.00 H new ATOM 0 HE3 LYS A 34 16.053 -10.273 -20.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 15.293 -8.559 -21.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 14.481 -8.748 -20.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 15.589 -7.477 -20.683 1.00 0.00 H new ATOM 529 N ILE A 35 14.010 -7.318 -16.416 1.00 0.00 N ATOM 530 CA ILE A 35 12.852 -6.446 -16.573 1.00 0.00 C ATOM 531 C ILE A 35 13.167 -5.382 -17.620 1.00 0.00 C ATOM 532 O ILE A 35 14.171 -4.680 -17.509 1.00 0.00 O ATOM 533 CB ILE A 35 12.476 -5.776 -15.235 1.00 0.00 C ATOM 534 CG1 ILE A 35 11.194 -4.954 -15.377 1.00 0.00 C ATOM 535 CG2 ILE A 35 13.616 -4.907 -14.731 1.00 0.00 C ATOM 536 CD1 ILE A 35 9.958 -5.685 -14.902 1.00 0.00 C ATOM 0 H ILE A 35 14.903 -6.825 -16.426 1.00 0.00 H new ATOM 0 HA ILE A 35 12.001 -7.046 -16.897 1.00 0.00 H new ATOM 0 HB ILE A 35 12.294 -6.563 -14.503 1.00 0.00 H new ATOM 0 HG12 ILE A 35 11.300 -4.028 -14.811 1.00 0.00 H new ATOM 0 HG13 ILE A 35 11.063 -4.675 -16.423 1.00 0.00 H new ATOM 0 HG21 ILE A 35 13.330 -4.444 -13.787 1.00 0.00 H new ATOM 0 HG22 ILE A 35 14.503 -5.522 -14.580 1.00 0.00 H new ATOM 0 HG23 ILE A 35 13.834 -4.131 -15.465 1.00 0.00 H new ATOM 0 HD11 ILE A 35 9.085 -5.045 -15.031 1.00 0.00 H new ATOM 0 HD12 ILE A 35 9.828 -6.597 -15.484 1.00 0.00 H new ATOM 0 HD13 ILE A 35 10.069 -5.940 -13.848 1.00 0.00 H new ATOM 548 N ASN A 36 12.327 -5.270 -18.649 1.00 0.00 N ATOM 549 CA ASN A 36 12.558 -4.300 -19.717 1.00 0.00 C ATOM 550 C ASN A 36 11.945 -2.948 -19.378 1.00 0.00 C ATOM 551 O ASN A 36 10.737 -2.840 -19.177 1.00 0.00 O ATOM 552 CB ASN A 36 11.965 -4.815 -21.028 1.00 0.00 C ATOM 553 CG ASN A 36 12.579 -4.143 -22.240 1.00 0.00 C ATOM 554 OD1 ASN A 36 13.097 -3.030 -22.151 1.00 0.00 O ATOM 555 ND2 ASN A 36 12.522 -4.816 -23.385 1.00 0.00 N ATOM 0 H ASN A 36 11.486 -5.835 -18.765 1.00 0.00 H new ATOM 0 HA ASN A 36 13.635 -4.172 -19.826 1.00 0.00 H new ATOM 0 HB2 ASN A 36 12.119 -5.892 -21.096 1.00 0.00 H new ATOM 0 HB3 ASN A 36 10.888 -4.646 -21.028 1.00 0.00 H new ATOM 0 HD21 ASN A 36 12.917 -4.412 -24.234 1.00 0.00 H new ATOM 0 HD22 ASN A 36 12.083 -5.736 -23.414 1.00 0.00 H new ATOM 562 N LEU A 37 12.779 -1.919 -19.321 1.00 0.00 N ATOM 563 CA LEU A 37 12.309 -0.575 -19.005 1.00 0.00 C ATOM 564 C LEU A 37 11.874 0.184 -20.258 1.00 0.00 C ATOM 565 O LEU A 37 11.230 1.227 -20.158 1.00 0.00 O ATOM 566 CB LEU A 37 13.399 0.201 -18.265 1.00 0.00 C ATOM 567 CG LEU A 37 13.933 -0.494 -17.012 1.00 0.00 C ATOM 568 CD1 LEU A 37 15.051 -1.462 -17.373 1.00 0.00 C ATOM 569 CD2 LEU A 37 14.415 0.530 -15.995 1.00 0.00 C ATOM 0 H LEU A 37 13.783 -1.988 -19.489 1.00 0.00 H new ATOM 0 HA LEU A 37 11.435 -0.671 -18.361 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.229 0.378 -18.949 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.005 1.177 -17.983 1.00 0.00 H new ATOM 0 HG LEU A 37 13.120 -1.064 -16.562 1.00 0.00 H new ATOM 0 HD11 LEU A 37 15.418 -1.947 -16.469 1.00 0.00 H new ATOM 0 HD12 LEU A 37 14.670 -2.217 -18.061 1.00 0.00 H new ATOM 0 HD13 LEU A 37 15.866 -0.916 -17.848 1.00 0.00 H new ATOM 0 HD21 LEU A 37 14.791 0.015 -15.111 1.00 0.00 H new ATOM 0 HD22 LEU A 37 15.213 1.130 -16.433 1.00 0.00 H new ATOM 0 HD23 LEU A 37 13.587 1.179 -15.712 1.00 0.00 H new ATOM 581 N ASP A 38 12.257 -0.310 -21.434 1.00 0.00 N ATOM 582 CA ASP A 38 11.916 0.367 -22.679 1.00 0.00 C ATOM 583 C ASP A 38 10.400 0.543 -22.837 1.00 0.00 C ATOM 584 O ASP A 38 9.934 1.613 -23.229 1.00 0.00 O ATOM 585 CB ASP A 38 12.504 -0.388 -23.882 1.00 0.00 C ATOM 586 CG ASP A 38 11.640 -1.544 -24.358 1.00 0.00 C ATOM 587 OD1 ASP A 38 11.103 -2.278 -23.504 1.00 0.00 O ATOM 588 OD2 ASP A 38 11.506 -1.715 -25.588 1.00 0.00 O ATOM 0 H ASP A 38 12.798 -1.167 -21.549 1.00 0.00 H new ATOM 0 HA ASP A 38 12.356 1.363 -22.642 1.00 0.00 H new ATOM 0 HB2 ASP A 38 12.645 0.312 -24.706 1.00 0.00 H new ATOM 0 HB3 ASP A 38 13.490 -0.769 -23.615 1.00 0.00 H new ATOM 593 N ASP A 39 9.625 -0.493 -22.523 1.00 0.00 N ATOM 594 CA ASP A 39 8.167 -0.406 -22.630 1.00 0.00 C ATOM 595 C ASP A 39 7.526 0.028 -21.315 1.00 0.00 C ATOM 596 O ASP A 39 6.337 0.340 -21.276 1.00 0.00 O ATOM 597 CB ASP A 39 7.554 -1.729 -23.089 1.00 0.00 C ATOM 598 CG ASP A 39 8.165 -2.933 -22.398 1.00 0.00 C ATOM 599 OD1 ASP A 39 8.617 -2.789 -21.242 1.00 0.00 O ATOM 600 OD2 ASP A 39 8.188 -4.019 -23.014 1.00 0.00 O ATOM 0 H ASP A 39 9.975 -1.393 -22.196 1.00 0.00 H new ATOM 0 HA ASP A 39 7.960 0.354 -23.383 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.481 -1.712 -22.898 1.00 0.00 H new ATOM 0 HB3 ASP A 39 7.684 -1.830 -24.166 1.00 0.00 H new ATOM 605 N HIS A 40 8.306 0.051 -20.237 1.00 0.00 N ATOM 606 CA HIS A 40 7.787 0.457 -18.933 1.00 0.00 C ATOM 607 C HIS A 40 8.167 1.906 -18.662 1.00 0.00 C ATOM 608 O HIS A 40 7.304 2.776 -18.560 1.00 0.00 O ATOM 609 CB HIS A 40 8.338 -0.453 -17.830 1.00 0.00 C ATOM 610 CG HIS A 40 7.577 -1.736 -17.690 1.00 0.00 C ATOM 611 ND1 HIS A 40 6.237 -1.783 -17.366 1.00 0.00 N ATOM 612 CD2 HIS A 40 7.968 -3.023 -17.853 1.00 0.00 C ATOM 613 CE1 HIS A 40 5.837 -3.041 -17.336 1.00 0.00 C ATOM 614 NE2 HIS A 40 6.867 -3.812 -17.629 1.00 0.00 N ATOM 0 H HIS A 40 9.293 -0.205 -20.240 1.00 0.00 H new ATOM 0 HA HIS A 40 6.701 0.367 -18.939 1.00 0.00 H new ATOM 0 HB2 HIS A 40 9.383 -0.679 -18.042 1.00 0.00 H new ATOM 0 HB3 HIS A 40 8.314 0.082 -16.881 1.00 0.00 H new ATOM 0 HD2 HIS A 40 8.960 -3.364 -18.111 1.00 0.00 H new ATOM 0 HE1 HIS A 40 4.837 -3.381 -17.110 1.00 0.00 H new ATOM 0 HE2 HIS A 40 6.848 -4.831 -17.681 1.00 0.00 H new ATOM 623 N ILE A 41 9.469 2.157 -18.571 1.00 0.00 N ATOM 624 CA ILE A 41 9.970 3.502 -18.344 1.00 0.00 C ATOM 625 C ILE A 41 9.962 4.286 -19.657 1.00 0.00 C ATOM 626 O ILE A 41 10.141 3.714 -20.731 1.00 0.00 O ATOM 627 CB ILE A 41 11.396 3.483 -17.737 1.00 0.00 C ATOM 628 CG1 ILE A 41 11.366 2.903 -16.319 1.00 0.00 C ATOM 629 CG2 ILE A 41 12.003 4.882 -17.714 1.00 0.00 C ATOM 630 CD1 ILE A 41 10.845 1.483 -16.245 1.00 0.00 C ATOM 0 H ILE A 41 10.194 1.444 -18.651 1.00 0.00 H new ATOM 0 HA ILE A 41 9.313 3.992 -17.626 1.00 0.00 H new ATOM 0 HB ILE A 41 12.019 2.849 -18.368 1.00 0.00 H new ATOM 0 HG12 ILE A 41 12.374 2.931 -15.905 1.00 0.00 H new ATOM 0 HG13 ILE A 41 10.745 3.540 -15.690 1.00 0.00 H new ATOM 0 HG21 ILE A 41 13.003 4.838 -17.283 1.00 0.00 H new ATOM 0 HG22 ILE A 41 12.063 5.269 -18.731 1.00 0.00 H new ATOM 0 HG23 ILE A 41 11.377 5.540 -17.111 1.00 0.00 H new ATOM 0 HD11 ILE A 41 10.855 1.145 -15.209 1.00 0.00 H new ATOM 0 HD12 ILE A 41 9.825 1.449 -16.628 1.00 0.00 H new ATOM 0 HD13 ILE A 41 11.479 0.831 -16.845 1.00 0.00 H new ATOM 642 N ALA A 42 9.727 5.586 -19.556 1.00 0.00 N ATOM 643 CA ALA A 42 9.670 6.451 -20.739 1.00 0.00 C ATOM 644 C ALA A 42 10.335 7.802 -20.482 1.00 0.00 C ATOM 645 O ALA A 42 10.692 8.128 -19.350 1.00 0.00 O ATOM 646 CB ALA A 42 8.221 6.654 -21.156 1.00 0.00 C ATOM 0 H ALA A 42 9.572 6.070 -18.672 1.00 0.00 H new ATOM 0 HA ALA A 42 10.219 5.960 -21.543 1.00 0.00 H new ATOM 0 HB1 ALA A 42 8.182 7.297 -22.035 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.772 5.689 -21.392 1.00 0.00 H new ATOM 0 HB3 ALA A 42 7.670 7.121 -20.340 1.00 0.00 H new ATOM 652 N ASN A 43 10.515 8.573 -21.554 1.00 0.00 N ATOM 653 CA ASN A 43 11.152 9.885 -21.466 1.00 0.00 C ATOM 654 C ASN A 43 10.162 11.005 -21.784 1.00 0.00 C ATOM 655 O ASN A 43 9.727 11.155 -22.925 1.00 0.00 O ATOM 656 CB ASN A 43 12.342 9.953 -22.425 1.00 0.00 C ATOM 657 CG ASN A 43 13.025 11.305 -22.424 1.00 0.00 C ATOM 658 OD1 ASN A 43 13.721 11.659 -21.473 1.00 0.00 O ATOM 659 ND2 ASN A 43 12.828 12.064 -23.494 1.00 0.00 N ATOM 0 H ASN A 43 10.227 8.310 -22.496 1.00 0.00 H new ATOM 0 HA ASN A 43 11.502 10.023 -20.443 1.00 0.00 H new ATOM 0 HB2 ASN A 43 13.066 9.186 -22.152 1.00 0.00 H new ATOM 0 HB3 ASN A 43 12.001 9.725 -23.435 1.00 0.00 H new ATOM 0 HD21 ASN A 43 13.262 12.985 -23.553 1.00 0.00 H new ATOM 0 HD22 ASN A 43 12.242 11.727 -24.258 1.00 0.00 H new ATOM 666 N ILE A 44 9.825 11.798 -20.771 1.00 0.00 N ATOM 667 CA ILE A 44 8.904 12.915 -20.946 1.00 0.00 C ATOM 668 C ILE A 44 9.635 14.246 -20.766 1.00 0.00 C ATOM 669 O ILE A 44 9.718 14.777 -19.659 1.00 0.00 O ATOM 670 CB ILE A 44 7.717 12.831 -19.959 1.00 0.00 C ATOM 671 CG1 ILE A 44 6.885 11.576 -20.236 1.00 0.00 C ATOM 672 CG2 ILE A 44 6.843 14.077 -20.056 1.00 0.00 C ATOM 673 CD1 ILE A 44 7.599 10.286 -19.900 1.00 0.00 C ATOM 0 H ILE A 44 10.177 11.687 -19.820 1.00 0.00 H new ATOM 0 HA ILE A 44 8.508 12.857 -21.960 1.00 0.00 H new ATOM 0 HB ILE A 44 8.117 12.772 -18.947 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.961 11.630 -19.661 1.00 0.00 H new ATOM 0 HG13 ILE A 44 6.605 11.562 -21.289 1.00 0.00 H new ATOM 0 HG21 ILE A 44 6.014 13.996 -19.353 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.438 14.958 -19.816 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.451 14.169 -21.069 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.948 9.441 -20.123 1.00 0.00 H new ATOM 0 HD12 ILE A 44 8.510 10.209 -20.494 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.855 10.277 -18.841 1.00 0.00 H new ATOM 685 N ASP A 45 10.171 14.772 -21.866 1.00 0.00 N ATOM 686 CA ASP A 45 10.906 16.037 -21.844 1.00 0.00 C ATOM 687 C ASP A 45 12.223 15.892 -21.089 1.00 0.00 C ATOM 688 O ASP A 45 12.640 16.797 -20.367 1.00 0.00 O ATOM 689 CB ASP A 45 10.062 17.145 -21.207 1.00 0.00 C ATOM 690 CG ASP A 45 10.589 18.531 -21.529 1.00 0.00 C ATOM 691 OD1 ASP A 45 11.611 18.933 -20.934 1.00 0.00 O ATOM 692 OD2 ASP A 45 9.978 19.215 -22.377 1.00 0.00 O ATOM 0 H ASP A 45 10.110 14.340 -22.788 1.00 0.00 H new ATOM 0 HA ASP A 45 11.125 16.309 -22.877 1.00 0.00 H new ATOM 0 HB2 ASP A 45 9.033 17.060 -21.556 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.044 17.008 -20.126 1.00 0.00 H new ATOM 697 N GLY A 46 12.883 14.755 -21.271 1.00 0.00 N ATOM 698 CA GLY A 46 14.153 14.525 -20.612 1.00 0.00 C ATOM 699 C GLY A 46 14.011 14.027 -19.185 1.00 0.00 C ATOM 700 O GLY A 46 15.013 13.799 -18.507 1.00 0.00 O ATOM 0 H GLY A 46 12.561 13.989 -21.863 1.00 0.00 H new ATOM 0 HA2 GLY A 46 14.726 13.798 -21.187 1.00 0.00 H new ATOM 0 HA3 GLY A 46 14.726 15.452 -20.610 1.00 0.00 H new ATOM 704 N THR A 47 12.778 13.847 -18.721 1.00 0.00 N ATOM 705 CA THR A 47 12.541 13.367 -17.365 1.00 0.00 C ATOM 706 C THR A 47 12.019 11.933 -17.389 1.00 0.00 C ATOM 707 O THR A 47 11.165 11.589 -18.205 1.00 0.00 O ATOM 708 CB THR A 47 11.542 14.280 -16.651 1.00 0.00 C ATOM 709 OG1 THR A 47 11.844 15.642 -16.894 1.00 0.00 O ATOM 710 CG2 THR A 47 11.508 14.081 -15.151 1.00 0.00 C ATOM 0 H THR A 47 11.932 14.025 -19.262 1.00 0.00 H new ATOM 0 HA THR A 47 13.486 13.382 -16.821 1.00 0.00 H new ATOM 0 HB THR A 47 10.568 14.010 -17.058 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.193 16.209 -16.430 1.00 0.00 H new ATOM 0 HG21 THR A 47 10.778 14.760 -14.710 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.227 13.052 -14.927 1.00 0.00 H new ATOM 0 HG23 THR A 47 12.494 14.287 -14.734 1.00 0.00 H new ATOM 718 N LEU A 48 12.564 11.093 -16.517 1.00 0.00 N ATOM 719 CA LEU A 48 12.177 9.687 -16.478 1.00 0.00 C ATOM 720 C LEU A 48 10.834 9.491 -15.782 1.00 0.00 C ATOM 721 O LEU A 48 10.675 9.772 -14.594 1.00 0.00 O ATOM 722 CB LEU A 48 13.254 8.860 -15.772 1.00 0.00 C ATOM 723 CG LEU A 48 14.468 8.501 -16.633 1.00 0.00 C ATOM 724 CD1 LEU A 48 15.654 8.130 -15.758 1.00 0.00 C ATOM 725 CD2 LEU A 48 14.130 7.362 -17.583 1.00 0.00 C ATOM 0 H LEU A 48 13.271 11.358 -15.831 1.00 0.00 H new ATOM 0 HA LEU A 48 12.075 9.346 -17.508 1.00 0.00 H new ATOM 0 HB2 LEU A 48 13.599 9.412 -14.898 1.00 0.00 H new ATOM 0 HB3 LEU A 48 12.801 7.938 -15.408 1.00 0.00 H new ATOM 0 HG LEU A 48 14.739 9.375 -17.225 1.00 0.00 H new ATOM 0 HD11 LEU A 48 16.507 7.878 -16.389 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.912 8.974 -15.118 1.00 0.00 H new ATOM 0 HD13 LEU A 48 15.395 7.271 -15.139 1.00 0.00 H new ATOM 0 HD21 LEU A 48 15.005 7.120 -18.187 1.00 0.00 H new ATOM 0 HD22 LEU A 48 13.832 6.485 -17.008 1.00 0.00 H new ATOM 0 HD23 LEU A 48 13.311 7.663 -18.235 1.00 0.00 H new ATOM 737 N LYS A 49 9.877 8.992 -16.557 1.00 0.00 N ATOM 738 CA LYS A 49 8.530 8.726 -16.079 1.00 0.00 C ATOM 739 C LYS A 49 8.043 7.395 -16.639 1.00 0.00 C ATOM 740 O LYS A 49 8.614 6.876 -17.598 1.00 0.00 O ATOM 741 CB LYS A 49 7.579 9.854 -16.481 1.00 0.00 C ATOM 742 CG LYS A 49 8.165 11.241 -16.279 1.00 0.00 C ATOM 743 CD LYS A 49 7.111 12.230 -15.808 1.00 0.00 C ATOM 744 CE LYS A 49 7.739 13.528 -15.328 1.00 0.00 C ATOM 745 NZ LYS A 49 8.006 13.508 -13.863 1.00 0.00 N ATOM 0 H LYS A 49 10.018 8.760 -17.540 1.00 0.00 H new ATOM 0 HA LYS A 49 8.547 8.672 -14.990 1.00 0.00 H new ATOM 0 HB2 LYS A 49 7.306 9.732 -17.529 1.00 0.00 H new ATOM 0 HB3 LYS A 49 6.660 9.768 -15.901 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.972 11.193 -15.548 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.602 11.592 -17.214 1.00 0.00 H new ATOM 0 HD2 LYS A 49 6.418 12.440 -16.623 1.00 0.00 H new ATOM 0 HD3 LYS A 49 6.529 11.786 -15.000 1.00 0.00 H new ATOM 0 HE2 LYS A 49 8.672 13.700 -15.865 1.00 0.00 H new ATOM 0 HE3 LYS A 49 7.077 14.361 -15.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.434 14.411 -13.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.112 13.370 -13.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 8.658 12.729 -13.640 1.00 0.00 H new ATOM 759 N TRP A 50 6.995 6.841 -16.046 1.00 0.00 N ATOM 760 CA TRP A 50 6.459 5.561 -16.503 1.00 0.00 C ATOM 761 C TRP A 50 5.416 5.744 -17.612 1.00 0.00 C ATOM 762 O TRP A 50 4.409 6.426 -17.425 1.00 0.00 O ATOM 763 CB TRP A 50 5.861 4.793 -15.322 1.00 0.00 C ATOM 764 CG TRP A 50 6.915 4.177 -14.456 1.00 0.00 C ATOM 765 CD1 TRP A 50 7.647 3.059 -14.731 1.00 0.00 C ATOM 766 CD2 TRP A 50 7.376 4.657 -13.188 1.00 0.00 C ATOM 767 NE1 TRP A 50 8.537 2.817 -13.716 1.00 0.00 N ATOM 768 CE2 TRP A 50 8.388 3.782 -12.756 1.00 0.00 C ATOM 769 CE3 TRP A 50 7.034 5.741 -12.377 1.00 0.00 C ATOM 770 CZ2 TRP A 50 9.061 3.959 -11.551 1.00 0.00 C ATOM 771 CZ3 TRP A 50 7.704 5.913 -11.180 1.00 0.00 C ATOM 772 CH2 TRP A 50 8.706 5.027 -10.778 1.00 0.00 C ATOM 0 H TRP A 50 6.501 7.251 -15.254 1.00 0.00 H new ATOM 0 HA TRP A 50 7.282 4.984 -16.925 1.00 0.00 H new ATOM 0 HB2 TRP A 50 5.250 5.469 -14.723 1.00 0.00 H new ATOM 0 HB3 TRP A 50 5.199 4.012 -15.696 1.00 0.00 H new ATOM 0 HD1 TRP A 50 7.541 2.453 -15.619 1.00 0.00 H new ATOM 0 HE1 TRP A 50 9.202 2.044 -13.682 1.00 0.00 H new ATOM 0 HE3 TRP A 50 6.261 6.432 -12.679 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 9.837 3.276 -11.238 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 7.448 6.748 -10.544 1.00 0.00 H new ATOM 0 HH2 TRP A 50 9.210 5.190 -9.837 1.00 0.00 H new ATOM 783 N GLN A 51 5.678 5.116 -18.761 1.00 0.00 N ATOM 784 CA GLN A 51 4.787 5.179 -19.928 1.00 0.00 C ATOM 785 C GLN A 51 5.259 4.186 -20.989 1.00 0.00 C ATOM 786 O GLN A 51 6.454 3.910 -21.089 1.00 0.00 O ATOM 787 CB GLN A 51 4.780 6.586 -20.542 1.00 0.00 C ATOM 788 CG GLN A 51 4.022 7.625 -19.736 1.00 0.00 C ATOM 789 CD GLN A 51 3.403 8.699 -20.612 1.00 0.00 C ATOM 790 OE1 GLN A 51 2.811 8.403 -21.650 1.00 0.00 O ATOM 791 NE2 GLN A 51 3.541 9.955 -20.201 1.00 0.00 N ATOM 0 H GLN A 51 6.513 4.549 -18.911 1.00 0.00 H new ATOM 0 HA GLN A 51 3.779 4.931 -19.596 1.00 0.00 H new ATOM 0 HB2 GLN A 51 5.810 6.920 -20.663 1.00 0.00 H new ATOM 0 HB3 GLN A 51 4.344 6.530 -21.539 1.00 0.00 H new ATOM 0 HG2 GLN A 51 3.238 7.133 -19.160 1.00 0.00 H new ATOM 0 HG3 GLN A 51 4.699 8.090 -19.020 1.00 0.00 H new ATOM 0 HE21 GLN A 51 4.039 10.156 -19.334 1.00 0.00 H new ATOM 0 HE22 GLN A 51 3.149 10.718 -20.752 1.00 0.00 H new ATOM 800 N PRO A 52 4.339 3.632 -21.803 1.00 0.00 N ATOM 801 CA PRO A 52 4.708 2.672 -22.845 1.00 0.00 C ATOM 802 C PRO A 52 5.483 3.330 -23.980 1.00 0.00 C ATOM 803 O PRO A 52 5.014 3.411 -25.116 1.00 0.00 O ATOM 804 CB PRO A 52 3.370 2.125 -23.336 1.00 0.00 C ATOM 805 CG PRO A 52 2.373 3.184 -23.004 1.00 0.00 C ATOM 806 CD PRO A 52 2.888 3.894 -21.776 1.00 0.00 C ATOM 0 HA PRO A 52 5.370 1.893 -22.466 1.00 0.00 H new ATOM 0 HB2 PRO A 52 3.394 1.928 -24.408 1.00 0.00 H new ATOM 0 HB3 PRO A 52 3.124 1.184 -22.844 1.00 0.00 H new ATOM 0 HG2 PRO A 52 2.258 3.881 -23.834 1.00 0.00 H new ATOM 0 HG3 PRO A 52 1.392 2.747 -22.816 1.00 0.00 H new ATOM 0 HD2 PRO A 52 2.673 4.962 -21.811 1.00 0.00 H new ATOM 0 HD3 PRO A 52 2.428 3.506 -20.867 1.00 0.00 H new ATOM 814 N SER A 53 6.683 3.788 -23.647 1.00 0.00 N ATOM 815 CA SER A 53 7.573 4.438 -24.597 1.00 0.00 C ATOM 816 C SER A 53 9.004 4.334 -24.078 1.00 0.00 C ATOM 817 O SER A 53 9.251 4.542 -22.892 1.00 0.00 O ATOM 818 CB SER A 53 7.177 5.905 -24.787 1.00 0.00 C ATOM 819 OG SER A 53 6.801 6.496 -23.555 1.00 0.00 O ATOM 0 H SER A 53 7.067 3.718 -22.705 1.00 0.00 H new ATOM 0 HA SER A 53 7.498 3.944 -25.566 1.00 0.00 H new ATOM 0 HB2 SER A 53 8.012 6.457 -25.219 1.00 0.00 H new ATOM 0 HB3 SER A 53 6.350 5.973 -25.494 1.00 0.00 H new ATOM 0 HG SER A 53 6.848 7.472 -23.632 1.00 0.00 H new ATOM 825 N ASN A 54 9.938 3.974 -24.949 1.00 0.00 N ATOM 826 CA ASN A 54 11.335 3.808 -24.538 1.00 0.00 C ATOM 827 C ASN A 54 12.080 5.134 -24.473 1.00 0.00 C ATOM 828 O ASN A 54 12.389 5.741 -25.498 1.00 0.00 O ATOM 829 CB ASN A 54 12.083 2.860 -25.485 1.00 0.00 C ATOM 830 CG ASN A 54 11.177 1.854 -26.175 1.00 0.00 C ATOM 831 OD1 ASN A 54 10.111 1.508 -25.669 1.00 0.00 O ATOM 832 ND2 ASN A 54 11.603 1.379 -27.340 1.00 0.00 N ATOM 0 H ASN A 54 9.761 3.792 -25.937 1.00 0.00 H new ATOM 0 HA ASN A 54 11.307 3.379 -23.537 1.00 0.00 H new ATOM 0 HB2 ASN A 54 12.601 3.449 -26.242 1.00 0.00 H new ATOM 0 HB3 ASN A 54 12.846 2.323 -24.921 1.00 0.00 H new ATOM 0 HD21 ASN A 54 11.039 0.700 -27.851 1.00 0.00 H new ATOM 0 HD22 ASN A 54 12.494 1.693 -27.724 1.00 0.00 H new ATOM 839 N PHE A 55 12.395 5.555 -23.253 1.00 0.00 N ATOM 840 CA PHE A 55 13.139 6.788 -23.027 1.00 0.00 C ATOM 841 C PHE A 55 14.375 6.845 -23.932 1.00 0.00 C ATOM 842 O PHE A 55 14.829 7.918 -24.324 1.00 0.00 O ATOM 843 CB PHE A 55 13.559 6.878 -21.557 1.00 0.00 C ATOM 844 CG PHE A 55 14.300 5.666 -21.070 1.00 0.00 C ATOM 845 CD1 PHE A 55 13.614 4.590 -20.530 1.00 0.00 C ATOM 846 CD2 PHE A 55 15.680 5.600 -21.159 1.00 0.00 C ATOM 847 CE1 PHE A 55 14.291 3.471 -20.089 1.00 0.00 C ATOM 848 CE2 PHE A 55 16.363 4.483 -20.719 1.00 0.00 C ATOM 849 CZ PHE A 55 15.668 3.416 -20.183 1.00 0.00 C ATOM 0 H PHE A 55 12.144 5.056 -22.400 1.00 0.00 H new ATOM 0 HA PHE A 55 12.496 7.634 -23.269 1.00 0.00 H new ATOM 0 HB2 PHE A 55 14.188 7.758 -21.420 1.00 0.00 H new ATOM 0 HB3 PHE A 55 12.671 7.022 -20.942 1.00 0.00 H new ATOM 0 HD1 PHE A 55 12.537 4.627 -20.453 1.00 0.00 H new ATOM 0 HD2 PHE A 55 16.229 6.431 -21.577 1.00 0.00 H new ATOM 0 HE1 PHE A 55 13.744 2.639 -19.671 1.00 0.00 H new ATOM 0 HE2 PHE A 55 17.440 4.444 -20.794 1.00 0.00 H new ATOM 0 HZ PHE A 55 16.200 2.541 -19.838 1.00 0.00 H new ATOM 859 N SER A 56 14.908 5.665 -24.254 1.00 0.00 N ATOM 860 CA SER A 56 16.100 5.535 -25.093 1.00 0.00 C ATOM 861 C SER A 56 16.027 6.373 -26.373 1.00 0.00 C ATOM 862 O SER A 56 17.053 6.638 -26.998 1.00 0.00 O ATOM 863 CB SER A 56 16.320 4.069 -25.465 1.00 0.00 C ATOM 864 OG SER A 56 15.341 3.626 -26.387 1.00 0.00 O ATOM 0 H SER A 56 14.525 4.773 -23.940 1.00 0.00 H new ATOM 0 HA SER A 56 16.936 5.911 -24.504 1.00 0.00 H new ATOM 0 HB2 SER A 56 17.313 3.945 -25.896 1.00 0.00 H new ATOM 0 HB3 SER A 56 16.283 3.453 -24.567 1.00 0.00 H new ATOM 0 HG SER A 56 15.504 2.686 -26.611 1.00 0.00 H new ATOM 870 N GLN A 57 14.825 6.774 -26.775 1.00 0.00 N ATOM 871 CA GLN A 57 14.665 7.554 -27.998 1.00 0.00 C ATOM 872 C GLN A 57 15.387 8.897 -27.904 1.00 0.00 C ATOM 873 O GLN A 57 15.764 9.476 -28.923 1.00 0.00 O ATOM 874 CB GLN A 57 13.182 7.782 -28.297 1.00 0.00 C ATOM 875 CG GLN A 57 12.430 6.510 -28.656 1.00 0.00 C ATOM 876 CD GLN A 57 11.042 6.787 -29.202 1.00 0.00 C ATOM 877 OE1 GLN A 57 10.850 7.698 -30.008 1.00 0.00 O ATOM 878 NE2 GLN A 57 10.066 5.998 -28.768 1.00 0.00 N ATOM 0 H GLN A 57 13.956 6.575 -26.279 1.00 0.00 H new ATOM 0 HA GLN A 57 15.112 6.983 -28.812 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.711 8.239 -27.427 1.00 0.00 H new ATOM 0 HB3 GLN A 57 13.091 8.492 -29.119 1.00 0.00 H new ATOM 0 HG2 GLN A 57 13.002 5.951 -29.396 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.349 5.878 -27.771 1.00 0.00 H new ATOM 0 HE21 GLN A 57 10.270 5.255 -28.100 1.00 0.00 H new ATOM 0 HE22 GLN A 57 9.112 6.135 -29.103 1.00 0.00 H new ATOM 887 N THR A 58 15.587 9.389 -26.684 1.00 0.00 N ATOM 888 CA THR A 58 16.272 10.665 -26.488 1.00 0.00 C ATOM 889 C THR A 58 17.340 10.574 -25.397 1.00 0.00 C ATOM 890 O THR A 58 17.963 11.578 -25.052 1.00 0.00 O ATOM 891 CB THR A 58 15.272 11.760 -26.104 1.00 0.00 C ATOM 892 OG1 THR A 58 14.963 11.687 -24.726 1.00 0.00 O ATOM 893 CG2 THR A 58 13.963 11.690 -26.860 1.00 0.00 C ATOM 0 H THR A 58 15.288 8.930 -25.824 1.00 0.00 H new ATOM 0 HA THR A 58 16.754 10.913 -27.434 1.00 0.00 H new ATOM 0 HB THR A 58 15.768 12.696 -26.362 1.00 0.00 H new ATOM 0 HG1 THR A 58 15.140 12.554 -24.305 1.00 0.00 H new ATOM 0 HG21 THR A 58 13.309 12.498 -26.532 1.00 0.00 H new ATOM 0 HG22 THR A 58 14.154 11.789 -27.928 1.00 0.00 H new ATOM 0 HG23 THR A 58 13.481 10.732 -26.665 1.00 0.00 H new ATOM 901 N CYS A 59 17.533 9.387 -24.830 1.00 0.00 N ATOM 902 CA CYS A 59 18.509 9.220 -23.761 1.00 0.00 C ATOM 903 C CYS A 59 19.691 8.356 -24.186 1.00 0.00 C ATOM 904 O CYS A 59 19.555 7.453 -25.012 1.00 0.00 O ATOM 905 CB CYS A 59 17.838 8.601 -22.533 1.00 0.00 C ATOM 906 SG CYS A 59 16.202 9.304 -22.144 1.00 0.00 S ATOM 0 H CYS A 59 17.033 8.537 -25.089 1.00 0.00 H new ATOM 0 HA CYS A 59 18.894 10.210 -23.518 1.00 0.00 H new ATOM 0 HB2 CYS A 59 17.732 7.528 -22.693 1.00 0.00 H new ATOM 0 HB3 CYS A 59 18.492 8.732 -21.671 1.00 0.00 H new ATOM 911 N TYR A 60 20.855 8.656 -23.612 1.00 0.00 N ATOM 912 CA TYR A 60 22.086 7.923 -23.905 1.00 0.00 C ATOM 913 C TYR A 60 22.888 7.717 -22.621 1.00 0.00 C ATOM 914 O TYR A 60 22.730 8.467 -21.656 1.00 0.00 O ATOM 915 CB TYR A 60 22.929 8.679 -24.937 1.00 0.00 C ATOM 916 CG TYR A 60 23.302 10.083 -24.511 1.00 0.00 C ATOM 917 CD1 TYR A 60 22.330 11.061 -24.345 1.00 0.00 C ATOM 918 CD2 TYR A 60 24.626 10.429 -24.273 1.00 0.00 C ATOM 919 CE1 TYR A 60 22.667 12.343 -23.956 1.00 0.00 C ATOM 920 CE2 TYR A 60 24.970 11.709 -23.883 1.00 0.00 C ATOM 921 CZ TYR A 60 23.987 12.662 -23.726 1.00 0.00 C ATOM 922 OH TYR A 60 24.326 13.938 -23.338 1.00 0.00 O ATOM 0 H TYR A 60 20.972 9.410 -22.935 1.00 0.00 H new ATOM 0 HA TYR A 60 21.822 6.950 -24.320 1.00 0.00 H new ATOM 0 HB2 TYR A 60 23.841 8.114 -25.132 1.00 0.00 H new ATOM 0 HB3 TYR A 60 22.378 8.729 -25.876 1.00 0.00 H new ATOM 0 HD1 TYR A 60 21.294 10.815 -24.523 1.00 0.00 H new ATOM 0 HD2 TYR A 60 25.399 9.685 -24.395 1.00 0.00 H new ATOM 0 HE1 TYR A 60 21.899 13.092 -23.833 1.00 0.00 H new ATOM 0 HE2 TYR A 60 26.004 11.962 -23.702 1.00 0.00 H new ATOM 0 HH TYR A 60 24.008 14.579 -24.008 1.00 0.00 H new ATOM 932 N ASN A 61 23.729 6.685 -22.604 1.00 0.00 N ATOM 933 CA ASN A 61 24.540 6.372 -21.429 1.00 0.00 C ATOM 934 C ASN A 61 23.661 5.982 -20.242 1.00 0.00 C ATOM 935 O ASN A 61 23.819 6.504 -19.139 1.00 0.00 O ATOM 936 CB ASN A 61 25.431 7.560 -21.058 1.00 0.00 C ATOM 937 CG ASN A 61 26.679 7.637 -21.919 1.00 0.00 C ATOM 938 OD1 ASN A 61 27.800 7.568 -21.414 1.00 0.00 O ATOM 939 ND2 ASN A 61 26.492 7.777 -23.227 1.00 0.00 N ATOM 0 H ASN A 61 23.867 6.051 -23.391 1.00 0.00 H new ATOM 0 HA ASN A 61 25.174 5.521 -21.678 1.00 0.00 H new ATOM 0 HB2 ASN A 61 24.863 8.484 -21.163 1.00 0.00 H new ATOM 0 HB3 ASN A 61 25.720 7.481 -20.010 1.00 0.00 H new ATOM 0 HD21 ASN A 61 27.295 7.831 -23.854 1.00 0.00 H new ATOM 0 HD22 ASN A 61 25.546 7.830 -23.604 1.00 0.00 H new ATOM 946 N SER A 62 22.732 5.063 -20.483 1.00 0.00 N ATOM 947 CA SER A 62 21.830 4.595 -19.440 1.00 0.00 C ATOM 948 C SER A 62 22.574 3.728 -18.430 1.00 0.00 C ATOM 949 O SER A 62 23.359 2.858 -18.802 1.00 0.00 O ATOM 950 CB SER A 62 20.664 3.814 -20.051 1.00 0.00 C ATOM 951 OG SER A 62 19.779 4.677 -20.745 1.00 0.00 O ATOM 0 H SER A 62 22.585 4.628 -21.394 1.00 0.00 H new ATOM 0 HA SER A 62 21.433 5.466 -18.919 1.00 0.00 H new ATOM 0 HB2 SER A 62 21.048 3.056 -20.734 1.00 0.00 H new ATOM 0 HB3 SER A 62 20.122 3.289 -19.264 1.00 0.00 H new ATOM 0 HG SER A 62 19.359 4.189 -21.484 1.00 0.00 H new ATOM 957 N ALA A 63 22.315 3.972 -17.150 1.00 0.00 N ATOM 958 CA ALA A 63 22.956 3.211 -16.085 1.00 0.00 C ATOM 959 C ALA A 63 22.000 2.956 -14.928 1.00 0.00 C ATOM 960 O ALA A 63 21.080 3.736 -14.687 1.00 0.00 O ATOM 961 CB ALA A 63 24.200 3.933 -15.593 1.00 0.00 C ATOM 0 H ALA A 63 21.667 4.690 -16.826 1.00 0.00 H new ATOM 0 HA ALA A 63 23.247 2.244 -16.496 1.00 0.00 H new ATOM 0 HB1 ALA A 63 24.667 3.352 -14.798 1.00 0.00 H new ATOM 0 HB2 ALA A 63 24.903 4.050 -16.418 1.00 0.00 H new ATOM 0 HB3 ALA A 63 23.923 4.915 -15.210 1.00 0.00 H new ATOM 967 N ILE A 64 22.222 1.858 -14.211 1.00 0.00 N ATOM 968 CA ILE A 64 21.373 1.509 -13.082 1.00 0.00 C ATOM 969 C ILE A 64 22.191 1.191 -11.833 1.00 0.00 C ATOM 970 O ILE A 64 23.235 0.543 -11.901 1.00 0.00 O ATOM 971 CB ILE A 64 20.454 0.321 -13.432 1.00 0.00 C ATOM 972 CG1 ILE A 64 19.398 0.796 -14.428 1.00 0.00 C ATOM 973 CG2 ILE A 64 19.791 -0.252 -12.183 1.00 0.00 C ATOM 974 CD1 ILE A 64 18.400 -0.264 -14.815 1.00 0.00 C ATOM 0 H ILE A 64 22.979 1.199 -14.392 1.00 0.00 H new ATOM 0 HA ILE A 64 20.756 2.380 -12.864 1.00 0.00 H new ATOM 0 HB ILE A 64 21.052 -0.475 -13.876 1.00 0.00 H new ATOM 0 HG12 ILE A 64 18.864 1.644 -13.999 1.00 0.00 H new ATOM 0 HG13 ILE A 64 19.898 1.156 -15.327 1.00 0.00 H new ATOM 0 HG21 ILE A 64 19.150 -1.088 -12.462 1.00 0.00 H new ATOM 0 HG22 ILE A 64 20.558 -0.599 -11.491 1.00 0.00 H new ATOM 0 HG23 ILE A 64 19.191 0.521 -11.702 1.00 0.00 H new ATOM 0 HD11 ILE A 64 17.684 0.152 -15.524 1.00 0.00 H new ATOM 0 HD12 ILE A 64 18.921 -1.104 -15.275 1.00 0.00 H new ATOM 0 HD13 ILE A 64 17.871 -0.608 -13.926 1.00 0.00 H new ATOM 986 N GLN A 65 21.687 1.645 -10.691 1.00 0.00 N ATOM 987 CA GLN A 65 22.335 1.414 -9.405 1.00 0.00 C ATOM 988 C GLN A 65 21.289 1.024 -8.372 1.00 0.00 C ATOM 989 O GLN A 65 20.447 1.838 -7.991 1.00 0.00 O ATOM 990 CB GLN A 65 23.078 2.668 -8.942 1.00 0.00 C ATOM 991 CG GLN A 65 24.016 3.245 -9.989 1.00 0.00 C ATOM 992 CD GLN A 65 24.294 4.719 -9.771 1.00 0.00 C ATOM 993 OE1 GLN A 65 23.434 5.566 -10.008 1.00 0.00 O ATOM 994 NE2 GLN A 65 25.502 5.035 -9.317 1.00 0.00 N ATOM 0 H GLN A 65 20.821 2.181 -10.630 1.00 0.00 H new ATOM 0 HA GLN A 65 23.058 0.606 -9.517 1.00 0.00 H new ATOM 0 HB2 GLN A 65 22.349 3.428 -8.662 1.00 0.00 H new ATOM 0 HB3 GLN A 65 23.651 2.430 -8.046 1.00 0.00 H new ATOM 0 HG2 GLN A 65 24.957 2.695 -9.972 1.00 0.00 H new ATOM 0 HG3 GLN A 65 23.582 3.103 -10.979 1.00 0.00 H new ATOM 0 HE21 GLN A 65 26.186 4.301 -9.133 1.00 0.00 H new ATOM 0 HE22 GLN A 65 25.745 6.012 -9.152 1.00 0.00 H new ATOM 1003 N GLY A 66 21.321 -0.231 -7.942 1.00 0.00 N ATOM 1004 CA GLY A 66 20.342 -0.698 -6.984 1.00 0.00 C ATOM 1005 C GLY A 66 18.959 -0.733 -7.599 1.00 0.00 C ATOM 1006 O GLY A 66 18.742 -1.415 -8.601 1.00 0.00 O ATOM 0 H GLY A 66 22.003 -0.929 -8.238 1.00 0.00 H new ATOM 0 HA2 GLY A 66 20.615 -1.694 -6.635 1.00 0.00 H new ATOM 0 HA3 GLY A 66 20.340 -0.044 -6.112 1.00 0.00 H new ATOM 1010 N SER A 67 18.018 -0.011 -7.003 1.00 0.00 N ATOM 1011 CA SER A 67 16.653 0.016 -7.514 1.00 0.00 C ATOM 1012 C SER A 67 16.364 1.288 -8.311 1.00 0.00 C ATOM 1013 O SER A 67 15.277 1.437 -8.869 1.00 0.00 O ATOM 1014 CB SER A 67 15.657 -0.112 -6.361 1.00 0.00 C ATOM 1015 OG SER A 67 15.474 1.129 -5.701 1.00 0.00 O ATOM 0 H SER A 67 18.173 0.560 -6.172 1.00 0.00 H new ATOM 0 HA SER A 67 16.542 -0.831 -8.191 1.00 0.00 H new ATOM 0 HB2 SER A 67 14.700 -0.469 -6.742 1.00 0.00 H new ATOM 0 HB3 SER A 67 16.014 -0.856 -5.649 1.00 0.00 H new ATOM 0 HG SER A 67 14.801 1.658 -6.179 1.00 0.00 H new ATOM 1021 N VAL A 68 17.332 2.202 -8.377 1.00 0.00 N ATOM 1022 CA VAL A 68 17.147 3.449 -9.120 1.00 0.00 C ATOM 1023 C VAL A 68 17.862 3.417 -10.470 1.00 0.00 C ATOM 1024 O VAL A 68 18.971 2.894 -10.588 1.00 0.00 O ATOM 1025 CB VAL A 68 17.652 4.667 -8.325 1.00 0.00 C ATOM 1026 CG1 VAL A 68 17.166 5.956 -8.968 1.00 0.00 C ATOM 1027 CG2 VAL A 68 17.203 4.589 -6.874 1.00 0.00 C ATOM 0 H VAL A 68 18.244 2.105 -7.930 1.00 0.00 H new ATOM 0 HA VAL A 68 16.074 3.544 -9.284 1.00 0.00 H new ATOM 0 HB VAL A 68 18.742 4.661 -8.342 1.00 0.00 H new ATOM 0 HG11 VAL A 68 17.531 6.808 -8.395 1.00 0.00 H new ATOM 0 HG12 VAL A 68 17.542 6.017 -9.989 1.00 0.00 H new ATOM 0 HG13 VAL A 68 16.076 5.968 -8.981 1.00 0.00 H new ATOM 0 HG21 VAL A 68 17.571 5.460 -6.332 1.00 0.00 H new ATOM 0 HG22 VAL A 68 16.114 4.568 -6.831 1.00 0.00 H new ATOM 0 HG23 VAL A 68 17.601 3.683 -6.418 1.00 0.00 H new ATOM 1037 N LEU A 69 17.215 3.976 -11.488 1.00 0.00 N ATOM 1038 CA LEU A 69 17.779 4.020 -12.833 1.00 0.00 C ATOM 1039 C LEU A 69 18.327 5.416 -13.139 1.00 0.00 C ATOM 1040 O LEU A 69 17.619 6.417 -12.996 1.00 0.00 O ATOM 1041 CB LEU A 69 16.700 3.626 -13.855 1.00 0.00 C ATOM 1042 CG LEU A 69 16.948 4.067 -15.302 1.00 0.00 C ATOM 1043 CD1 LEU A 69 18.282 3.539 -15.803 1.00 0.00 C ATOM 1044 CD2 LEU A 69 15.813 3.594 -16.202 1.00 0.00 C ATOM 0 H LEU A 69 16.294 4.407 -11.406 1.00 0.00 H new ATOM 0 HA LEU A 69 18.605 3.312 -12.898 1.00 0.00 H new ATOM 0 HB2 LEU A 69 16.594 2.541 -13.840 1.00 0.00 H new ATOM 0 HB3 LEU A 69 15.748 4.044 -13.527 1.00 0.00 H new ATOM 0 HG LEU A 69 16.981 5.156 -15.329 1.00 0.00 H new ATOM 0 HD11 LEU A 69 18.438 3.863 -16.832 1.00 0.00 H new ATOM 0 HD12 LEU A 69 19.085 3.925 -15.175 1.00 0.00 H new ATOM 0 HD13 LEU A 69 18.281 2.450 -15.762 1.00 0.00 H new ATOM 0 HD21 LEU A 69 16.003 3.915 -17.226 1.00 0.00 H new ATOM 0 HD22 LEU A 69 15.751 2.506 -16.168 1.00 0.00 H new ATOM 0 HD23 LEU A 69 14.872 4.022 -15.857 1.00 0.00 H new ATOM 1056 N THR A 70 19.589 5.485 -13.559 1.00 0.00 N ATOM 1057 CA THR A 70 20.219 6.757 -13.888 1.00 0.00 C ATOM 1058 C THR A 70 20.558 6.798 -15.374 1.00 0.00 C ATOM 1059 O THR A 70 21.241 5.912 -15.883 1.00 0.00 O ATOM 1060 CB THR A 70 21.494 6.944 -13.063 1.00 0.00 C ATOM 1061 OG1 THR A 70 21.280 6.570 -11.715 1.00 0.00 O ATOM 1062 CG2 THR A 70 22.009 8.367 -13.068 1.00 0.00 C ATOM 0 H THR A 70 20.194 4.672 -13.679 1.00 0.00 H new ATOM 0 HA THR A 70 19.524 7.564 -13.654 1.00 0.00 H new ATOM 0 HB THR A 70 22.238 6.304 -13.537 1.00 0.00 H new ATOM 0 HG1 THR A 70 22.124 6.261 -11.323 1.00 0.00 H new ATOM 0 HG21 THR A 70 22.914 8.428 -12.464 1.00 0.00 H new ATOM 0 HG22 THR A 70 22.234 8.669 -14.091 1.00 0.00 H new ATOM 0 HG23 THR A 70 21.250 9.030 -12.652 1.00 0.00 H new ATOM 1070 N SER A 71 20.066 7.811 -16.076 1.00 0.00 N ATOM 1071 CA SER A 71 20.318 7.924 -17.511 1.00 0.00 C ATOM 1072 C SER A 71 20.298 9.378 -17.963 1.00 0.00 C ATOM 1073 O SER A 71 19.635 10.217 -17.354 1.00 0.00 O ATOM 1074 CB SER A 71 19.290 7.110 -18.300 1.00 0.00 C ATOM 1075 OG SER A 71 19.251 7.512 -19.660 1.00 0.00 O ATOM 0 H SER A 71 19.496 8.560 -15.683 1.00 0.00 H new ATOM 0 HA SER A 71 21.312 7.523 -17.708 1.00 0.00 H new ATOM 0 HB2 SER A 71 19.537 6.050 -18.238 1.00 0.00 H new ATOM 0 HB3 SER A 71 18.304 7.234 -17.853 1.00 0.00 H new ATOM 0 HG SER A 71 19.388 6.731 -20.236 1.00 0.00 H new ATOM 1081 N THR A 72 21.013 9.671 -19.047 1.00 0.00 N ATOM 1082 CA THR A 72 21.047 11.021 -19.586 1.00 0.00 C ATOM 1083 C THR A 72 19.995 11.156 -20.683 1.00 0.00 C ATOM 1084 O THR A 72 19.968 10.364 -21.624 1.00 0.00 O ATOM 1085 CB THR A 72 22.441 11.330 -20.141 1.00 0.00 C ATOM 1086 OG1 THR A 72 23.447 10.831 -19.276 1.00 0.00 O ATOM 1087 CG2 THR A 72 22.697 12.808 -20.339 1.00 0.00 C ATOM 0 H THR A 72 21.573 8.993 -19.564 1.00 0.00 H new ATOM 0 HA THR A 72 20.827 11.734 -18.792 1.00 0.00 H new ATOM 0 HB THR A 72 22.477 10.841 -21.114 1.00 0.00 H new ATOM 0 HG1 THR A 72 24.330 11.037 -19.648 1.00 0.00 H new ATOM 0 HG21 THR A 72 23.702 12.953 -20.734 1.00 0.00 H new ATOM 0 HG22 THR A 72 21.969 13.212 -21.042 1.00 0.00 H new ATOM 0 HG23 THR A 72 22.604 13.324 -19.384 1.00 0.00 H new ATOM 1095 N CYS A 73 19.117 12.148 -20.556 1.00 0.00 N ATOM 1096 CA CYS A 73 18.054 12.342 -21.539 1.00 0.00 C ATOM 1097 C CYS A 73 18.035 13.755 -22.106 1.00 0.00 C ATOM 1098 O CYS A 73 18.250 14.735 -21.394 1.00 0.00 O ATOM 1099 CB CYS A 73 16.695 12.025 -20.917 1.00 0.00 C ATOM 1100 SG CYS A 73 16.505 10.291 -20.399 1.00 0.00 S ATOM 0 H CYS A 73 19.119 12.823 -19.791 1.00 0.00 H new ATOM 0 HA CYS A 73 18.257 11.658 -22.363 1.00 0.00 H new ATOM 0 HB2 CYS A 73 16.543 12.671 -20.052 1.00 0.00 H new ATOM 0 HB3 CYS A 73 15.912 12.267 -21.636 1.00 0.00 H new ATOM 1105 N GLU A 74 17.718 13.839 -23.394 1.00 0.00 N ATOM 1106 CA GLU A 74 17.621 15.119 -24.087 1.00 0.00 C ATOM 1107 C GLU A 74 16.331 15.844 -23.713 1.00 0.00 C ATOM 1108 O GLU A 74 15.274 15.224 -23.596 1.00 0.00 O ATOM 1109 CB GLU A 74 17.687 14.910 -25.600 1.00 0.00 C ATOM 1110 CG GLU A 74 17.845 16.202 -26.384 1.00 0.00 C ATOM 1111 CD GLU A 74 17.168 16.146 -27.739 1.00 0.00 C ATOM 1112 OE1 GLU A 74 17.547 15.280 -28.557 1.00 0.00 O ATOM 1113 OE2 GLU A 74 16.259 16.967 -27.984 1.00 0.00 O ATOM 0 H GLU A 74 17.523 13.029 -23.983 1.00 0.00 H new ATOM 0 HA GLU A 74 18.464 15.737 -23.778 1.00 0.00 H new ATOM 0 HB2 GLU A 74 18.523 14.249 -25.831 1.00 0.00 H new ATOM 0 HB3 GLU A 74 16.780 14.403 -25.929 1.00 0.00 H new ATOM 0 HG2 GLU A 74 17.427 17.027 -25.807 1.00 0.00 H new ATOM 0 HG3 GLU A 74 18.906 16.413 -26.520 1.00 0.00 H new ATOM 1120 N ARG A 75 16.422 17.155 -23.526 1.00 0.00 N ATOM 1121 CA ARG A 75 15.259 17.957 -23.166 1.00 0.00 C ATOM 1122 C ARG A 75 14.599 18.544 -24.413 1.00 0.00 C ATOM 1123 O ARG A 75 15.277 18.886 -25.381 1.00 0.00 O ATOM 1124 CB ARG A 75 15.675 19.065 -22.199 1.00 0.00 C ATOM 1125 CG ARG A 75 16.504 18.550 -21.032 1.00 0.00 C ATOM 1126 CD ARG A 75 16.631 19.582 -19.925 1.00 0.00 C ATOM 1127 NE ARG A 75 15.344 19.882 -19.302 1.00 0.00 N ATOM 1128 CZ ARG A 75 14.729 19.074 -18.440 1.00 0.00 C ATOM 1129 NH1 ARG A 75 15.256 17.897 -18.128 1.00 0.00 N ATOM 1130 NH2 ARG A 75 13.576 19.439 -17.897 1.00 0.00 N ATOM 0 H ARG A 75 17.289 17.685 -23.618 1.00 0.00 H new ATOM 0 HA ARG A 75 14.528 17.316 -22.673 1.00 0.00 H new ATOM 0 HB2 ARG A 75 16.248 19.818 -22.741 1.00 0.00 H new ATOM 0 HB3 ARG A 75 14.783 19.559 -21.815 1.00 0.00 H new ATOM 0 HG2 ARG A 75 16.046 17.645 -20.633 1.00 0.00 H new ATOM 0 HG3 ARG A 75 17.497 18.275 -21.387 1.00 0.00 H new ATOM 0 HD2 ARG A 75 17.324 19.216 -19.167 1.00 0.00 H new ATOM 0 HD3 ARG A 75 17.059 20.498 -20.332 1.00 0.00 H new ATOM 0 HE ARG A 75 14.889 20.763 -19.542 1.00 0.00 H new ATOM 0 HH11 ARG A 75 16.138 17.605 -18.549 1.00 0.00 H new ATOM 0 HH12 ARG A 75 14.779 17.284 -17.467 1.00 0.00 H new ATOM 0 HH21 ARG A 75 13.160 20.338 -18.139 1.00 0.00 H new ATOM 0 HH22 ARG A 75 13.105 18.821 -17.237 1.00 0.00 H new ATOM 1144 N THR A 76 13.271 18.643 -24.390 1.00 0.00 N ATOM 1145 CA THR A 76 12.515 19.171 -25.527 1.00 0.00 C ATOM 1146 C THR A 76 13.053 20.523 -25.986 1.00 0.00 C ATOM 1147 O THR A 76 12.934 20.880 -27.158 1.00 0.00 O ATOM 1148 CB THR A 76 11.037 19.305 -25.158 1.00 0.00 C ATOM 1149 OG1 THR A 76 10.535 18.081 -24.651 1.00 0.00 O ATOM 1150 CG2 THR A 76 10.163 19.718 -26.324 1.00 0.00 C ATOM 0 H THR A 76 12.695 18.364 -23.596 1.00 0.00 H new ATOM 0 HA THR A 76 12.627 18.466 -26.351 1.00 0.00 H new ATOM 0 HB THR A 76 10.996 20.090 -24.403 1.00 0.00 H new ATOM 0 HG1 THR A 76 9.938 18.260 -23.895 1.00 0.00 H new ATOM 0 HG21 THR A 76 9.127 19.794 -25.993 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.495 20.684 -26.703 1.00 0.00 H new ATOM 0 HG23 THR A 76 10.237 18.973 -27.116 1.00 0.00 H new ATOM 1158 N ASN A 77 13.638 21.274 -25.061 1.00 0.00 N ATOM 1159 CA ASN A 77 14.186 22.587 -25.385 1.00 0.00 C ATOM 1160 C ASN A 77 15.594 22.477 -25.976 1.00 0.00 C ATOM 1161 O ASN A 77 16.227 23.489 -26.281 1.00 0.00 O ATOM 1162 CB ASN A 77 14.212 23.473 -24.140 1.00 0.00 C ATOM 1163 CG ASN A 77 13.899 24.923 -24.454 1.00 0.00 C ATOM 1164 OD1 ASN A 77 12.833 25.242 -24.983 1.00 0.00 O ATOM 1165 ND2 ASN A 77 14.831 25.812 -24.130 1.00 0.00 N ATOM 0 H ASN A 77 13.745 20.999 -24.085 1.00 0.00 H new ATOM 0 HA ASN A 77 13.538 23.039 -26.136 1.00 0.00 H new ATOM 0 HB2 ASN A 77 13.490 23.097 -23.415 1.00 0.00 H new ATOM 0 HB3 ASN A 77 15.195 23.409 -23.673 1.00 0.00 H new ATOM 0 HD21 ASN A 77 14.678 26.803 -24.318 1.00 0.00 H new ATOM 0 HD22 ASN A 77 15.700 25.504 -23.693 1.00 0.00 H new ATOM 1172 N GLY A 78 16.077 21.249 -26.141 1.00 0.00 N ATOM 1173 CA GLY A 78 17.401 21.036 -26.696 1.00 0.00 C ATOM 1174 C GLY A 78 18.472 20.939 -25.634 1.00 0.00 C ATOM 1175 O GLY A 78 18.476 21.698 -24.664 1.00 0.00 O ATOM 0 H GLY A 78 15.573 20.396 -25.899 1.00 0.00 H new ATOM 0 HA2 GLY A 78 17.399 20.121 -27.288 1.00 0.00 H new ATOM 0 HA3 GLY A 78 17.642 21.854 -27.375 1.00 0.00 H new ATOM 1179 N GLY A 79 19.359 19.979 -25.813 1.00 0.00 N ATOM 1180 CA GLY A 79 20.427 19.750 -24.859 1.00 0.00 C ATOM 1181 C GLY A 79 20.306 18.384 -24.220 1.00 0.00 C ATOM 1182 O GLY A 79 19.500 17.570 -24.668 1.00 0.00 O ATOM 0 H GLY A 79 19.361 19.344 -26.611 1.00 0.00 H new ATOM 0 HA2 GLY A 79 21.391 19.836 -25.361 1.00 0.00 H new ATOM 0 HA3 GLY A 79 20.400 20.519 -24.087 1.00 0.00 H new ATOM 1186 N TYR A 80 21.109 18.119 -23.192 1.00 0.00 N ATOM 1187 CA TYR A 80 21.072 16.824 -22.512 1.00 0.00 C ATOM 1188 C TYR A 80 20.994 17.000 -20.997 1.00 0.00 C ATOM 1189 O TYR A 80 21.614 17.902 -20.433 1.00 0.00 O ATOM 1190 CB TYR A 80 22.309 15.997 -22.870 1.00 0.00 C ATOM 1191 CG TYR A 80 22.595 15.941 -24.355 1.00 0.00 C ATOM 1192 CD1 TYR A 80 21.628 15.509 -25.252 1.00 0.00 C ATOM 1193 CD2 TYR A 80 23.832 16.324 -24.858 1.00 0.00 C ATOM 1194 CE1 TYR A 80 21.883 15.462 -26.607 1.00 0.00 C ATOM 1195 CE2 TYR A 80 24.095 16.279 -26.213 1.00 0.00 C ATOM 1196 CZ TYR A 80 23.118 15.848 -27.082 1.00 0.00 C ATOM 1197 OH TYR A 80 23.374 15.804 -28.433 1.00 0.00 O ATOM 0 H TYR A 80 21.789 18.778 -22.813 1.00 0.00 H new ATOM 0 HA TYR A 80 20.178 16.298 -22.847 1.00 0.00 H new ATOM 0 HB2 TYR A 80 23.175 16.415 -22.358 1.00 0.00 H new ATOM 0 HB3 TYR A 80 22.177 14.982 -22.496 1.00 0.00 H new ATOM 0 HD1 TYR A 80 20.660 15.205 -24.883 1.00 0.00 H new ATOM 0 HD2 TYR A 80 24.600 16.662 -24.179 1.00 0.00 H new ATOM 0 HE1 TYR A 80 21.119 15.125 -27.292 1.00 0.00 H new ATOM 0 HE2 TYR A 80 25.062 16.580 -26.589 1.00 0.00 H new ATOM 0 HH TYR A 80 24.290 16.110 -28.603 1.00 0.00 H new ATOM 1207 N ASN A 81 20.220 16.135 -20.346 1.00 0.00 N ATOM 1208 CA ASN A 81 20.052 16.185 -18.897 1.00 0.00 C ATOM 1209 C ASN A 81 19.687 14.802 -18.356 1.00 0.00 C ATOM 1210 O ASN A 81 18.778 14.144 -18.864 1.00 0.00 O ATOM 1211 CB ASN A 81 18.976 17.205 -18.515 1.00 0.00 C ATOM 1212 CG ASN A 81 19.036 17.589 -17.049 1.00 0.00 C ATOM 1213 OD1 ASN A 81 19.993 17.260 -16.347 1.00 0.00 O ATOM 1214 ND2 ASN A 81 18.012 18.291 -16.578 1.00 0.00 N ATOM 0 H ASN A 81 19.697 15.388 -20.802 1.00 0.00 H new ATOM 0 HA ASN A 81 20.997 16.496 -18.452 1.00 0.00 H new ATOM 0 HB2 ASN A 81 19.094 18.099 -19.127 1.00 0.00 H new ATOM 0 HB3 ASN A 81 17.992 16.792 -18.740 1.00 0.00 H new ATOM 0 HD21 ASN A 81 17.998 18.579 -15.600 1.00 0.00 H new ATOM 0 HD22 ASN A 81 17.239 18.542 -17.195 1.00 0.00 H new ATOM 1221 N THR A 82 20.416 14.364 -17.335 1.00 0.00 N ATOM 1222 CA THR A 82 20.193 13.053 -16.724 1.00 0.00 C ATOM 1223 C THR A 82 19.236 13.138 -15.539 1.00 0.00 C ATOM 1224 O THR A 82 19.356 14.023 -14.691 1.00 0.00 O ATOM 1225 CB THR A 82 21.520 12.429 -16.286 1.00 0.00 C ATOM 1226 OG1 THR A 82 21.297 11.329 -15.422 1.00 0.00 O ATOM 1227 CG2 THR A 82 22.434 13.397 -15.570 1.00 0.00 C ATOM 0 H THR A 82 21.172 14.900 -16.909 1.00 0.00 H new ATOM 0 HA THR A 82 19.734 12.416 -17.480 1.00 0.00 H new ATOM 0 HB THR A 82 22.006 12.115 -17.209 1.00 0.00 H new ATOM 0 HG1 THR A 82 20.605 10.749 -15.803 1.00 0.00 H new ATOM 0 HG21 THR A 82 23.355 12.887 -15.289 1.00 0.00 H new ATOM 0 HG22 THR A 82 22.668 14.232 -16.230 1.00 0.00 H new ATOM 0 HG23 THR A 82 21.938 13.771 -14.674 1.00 0.00 H new ATOM 1235 N SER A 83 18.283 12.208 -15.487 1.00 0.00 N ATOM 1236 CA SER A 83 17.300 12.162 -14.413 1.00 0.00 C ATOM 1237 C SER A 83 17.359 10.815 -13.688 1.00 0.00 C ATOM 1238 O SER A 83 17.854 9.823 -14.234 1.00 0.00 O ATOM 1239 CB SER A 83 15.894 12.397 -14.967 1.00 0.00 C ATOM 1240 OG SER A 83 15.402 11.239 -15.617 1.00 0.00 O ATOM 0 H SER A 83 18.173 11.472 -16.184 1.00 0.00 H new ATOM 0 HA SER A 83 17.534 12.953 -13.700 1.00 0.00 H new ATOM 0 HB2 SER A 83 15.222 12.675 -14.155 1.00 0.00 H new ATOM 0 HB3 SER A 83 15.911 13.232 -15.668 1.00 0.00 H new ATOM 0 HG SER A 83 15.208 11.448 -16.555 1.00 0.00 H new ATOM 1246 N SER A 84 16.862 10.788 -12.454 1.00 0.00 N ATOM 1247 CA SER A 84 16.865 9.570 -11.654 1.00 0.00 C ATOM 1248 C SER A 84 15.450 9.181 -11.227 1.00 0.00 C ATOM 1249 O SER A 84 14.619 10.043 -10.939 1.00 0.00 O ATOM 1250 CB SER A 84 17.745 9.753 -10.417 1.00 0.00 C ATOM 1251 OG SER A 84 19.071 10.100 -10.778 1.00 0.00 O ATOM 0 H SER A 84 16.452 11.597 -11.988 1.00 0.00 H new ATOM 0 HA SER A 84 17.268 8.767 -12.272 1.00 0.00 H new ATOM 0 HB2 SER A 84 17.324 10.530 -9.780 1.00 0.00 H new ATOM 0 HB3 SER A 84 17.753 8.832 -9.834 1.00 0.00 H new ATOM 0 HG SER A 84 19.612 10.213 -9.968 1.00 0.00 H new ATOM 1257 N ILE A 85 15.186 7.874 -11.183 1.00 0.00 N ATOM 1258 CA ILE A 85 13.872 7.367 -10.788 1.00 0.00 C ATOM 1259 C ILE A 85 13.979 6.054 -10.008 1.00 0.00 C ATOM 1260 O ILE A 85 14.817 5.208 -10.317 1.00 0.00 O ATOM 1261 CB ILE A 85 12.969 7.146 -12.017 1.00 0.00 C ATOM 1262 CG1 ILE A 85 11.551 6.783 -11.574 1.00 0.00 C ATOM 1263 CG2 ILE A 85 13.544 6.061 -12.918 1.00 0.00 C ATOM 1264 CD1 ILE A 85 10.593 6.569 -12.726 1.00 0.00 C ATOM 0 H ILE A 85 15.864 7.149 -11.416 1.00 0.00 H new ATOM 0 HA ILE A 85 13.429 8.125 -10.142 1.00 0.00 H new ATOM 0 HB ILE A 85 12.927 8.074 -12.587 1.00 0.00 H new ATOM 0 HG12 ILE A 85 11.589 5.876 -10.970 1.00 0.00 H new ATOM 0 HG13 ILE A 85 11.165 7.576 -10.934 1.00 0.00 H new ATOM 0 HG21 ILE A 85 12.892 5.920 -13.780 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.536 6.359 -13.258 1.00 0.00 H new ATOM 0 HG23 ILE A 85 13.617 5.127 -12.361 1.00 0.00 H new ATOM 0 HD11 ILE A 85 9.607 6.315 -12.337 1.00 0.00 H new ATOM 0 HD12 ILE A 85 10.525 7.482 -13.317 1.00 0.00 H new ATOM 0 HD13 ILE A 85 10.956 5.756 -13.355 1.00 0.00 H new ATOM 1276 N ASP A 86 13.110 5.889 -9.009 1.00 0.00 N ATOM 1277 CA ASP A 86 13.088 4.677 -8.185 1.00 0.00 C ATOM 1278 C ASP A 86 12.026 3.692 -8.684 1.00 0.00 C ATOM 1279 O ASP A 86 10.833 3.994 -8.662 1.00 0.00 O ATOM 1280 CB ASP A 86 12.807 5.041 -6.724 1.00 0.00 C ATOM 1281 CG ASP A 86 13.101 3.896 -5.774 1.00 0.00 C ATOM 1282 OD1 ASP A 86 14.225 3.355 -5.828 1.00 0.00 O ATOM 1283 OD2 ASP A 86 12.207 3.544 -4.976 1.00 0.00 O ATOM 0 H ASP A 86 12.409 6.583 -8.749 1.00 0.00 H new ATOM 0 HA ASP A 86 14.065 4.199 -8.260 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.411 5.904 -6.445 1.00 0.00 H new ATOM 0 HB3 ASP A 86 11.763 5.336 -6.621 1.00 0.00 H new ATOM 1288 N LEU A 87 12.465 2.520 -9.140 1.00 0.00 N ATOM 1289 CA LEU A 87 11.540 1.504 -9.658 1.00 0.00 C ATOM 1290 C LEU A 87 11.187 0.439 -8.619 1.00 0.00 C ATOM 1291 O LEU A 87 10.340 -0.415 -8.875 1.00 0.00 O ATOM 1292 CB LEU A 87 12.117 0.838 -10.905 1.00 0.00 C ATOM 1293 CG LEU A 87 12.821 1.786 -11.876 1.00 0.00 C ATOM 1294 CD1 LEU A 87 13.624 1.001 -12.902 1.00 0.00 C ATOM 1295 CD2 LEU A 87 11.805 2.686 -12.563 1.00 0.00 C ATOM 0 H LEU A 87 13.448 2.248 -9.163 1.00 0.00 H new ATOM 0 HA LEU A 87 10.618 2.027 -9.914 1.00 0.00 H new ATOM 0 HB2 LEU A 87 12.825 0.069 -10.594 1.00 0.00 H new ATOM 0 HB3 LEU A 87 11.310 0.332 -11.435 1.00 0.00 H new ATOM 0 HG LEU A 87 13.512 2.412 -11.311 1.00 0.00 H new ATOM 0 HD11 LEU A 87 14.118 1.693 -13.584 1.00 0.00 H new ATOM 0 HD12 LEU A 87 14.374 0.397 -12.392 1.00 0.00 H new ATOM 0 HD13 LEU A 87 12.956 0.350 -13.466 1.00 0.00 H new ATOM 0 HD21 LEU A 87 12.320 3.356 -13.252 1.00 0.00 H new ATOM 0 HD22 LEU A 87 11.092 2.074 -13.116 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.274 3.273 -11.814 1.00 0.00 H new ATOM 1307 N ASN A 88 11.839 0.467 -7.460 1.00 0.00 N ATOM 1308 CA ASN A 88 11.589 -0.529 -6.414 1.00 0.00 C ATOM 1309 C ASN A 88 10.092 -0.775 -6.200 1.00 0.00 C ATOM 1310 O ASN A 88 9.693 -1.859 -5.775 1.00 0.00 O ATOM 1311 CB ASN A 88 12.225 -0.057 -5.103 1.00 0.00 C ATOM 1312 CG ASN A 88 11.990 -1.016 -3.953 1.00 0.00 C ATOM 1313 OD1 ASN A 88 12.159 -2.306 -4.214 1.00 0.00 O flip ATOM 1314 ND2 ASN A 88 11.661 -0.601 -2.841 1.00 0.00 N flip ATOM 0 H ASN A 88 12.543 1.165 -7.219 1.00 0.00 H new ATOM 0 HA ASN A 88 12.034 -1.471 -6.735 1.00 0.00 H new ATOM 0 HB2 ASN A 88 13.298 0.069 -5.250 1.00 0.00 H new ATOM 0 HB3 ASN A 88 11.822 0.921 -4.841 1.00 0.00 H new ATOM 0 HD21 ASN A 88 11.542 0.400 -2.685 1.00 0.00 H new ATOM 0 HD22 ASN A 88 11.507 -1.258 -2.076 1.00 0.00 H new ATOM 1321 N SER A 89 9.270 0.227 -6.489 1.00 0.00 N ATOM 1322 CA SER A 89 7.825 0.100 -6.320 1.00 0.00 C ATOM 1323 C SER A 89 7.156 -0.609 -7.500 1.00 0.00 C ATOM 1324 O SER A 89 6.235 -1.403 -7.311 1.00 0.00 O ATOM 1325 CB SER A 89 7.190 1.477 -6.126 1.00 0.00 C ATOM 1326 OG SER A 89 7.576 2.046 -4.887 1.00 0.00 O ATOM 0 H SER A 89 9.577 1.134 -6.840 1.00 0.00 H new ATOM 0 HA SER A 89 7.665 -0.513 -5.433 1.00 0.00 H new ATOM 0 HB2 SER A 89 7.488 2.136 -6.941 1.00 0.00 H new ATOM 0 HB3 SER A 89 6.104 1.389 -6.167 1.00 0.00 H new ATOM 0 HG SER A 89 7.158 2.927 -4.787 1.00 0.00 H new ATOM 1332 N VAL A 90 7.589 -0.285 -8.715 1.00 0.00 N ATOM 1333 CA VAL A 90 6.996 -0.866 -9.916 1.00 0.00 C ATOM 1334 C VAL A 90 7.356 -2.341 -10.111 1.00 0.00 C ATOM 1335 O VAL A 90 6.477 -3.172 -10.333 1.00 0.00 O ATOM 1336 CB VAL A 90 7.371 -0.061 -11.184 1.00 0.00 C ATOM 1337 CG1 VAL A 90 7.248 1.430 -10.923 1.00 0.00 C ATOM 1338 CG2 VAL A 90 8.776 -0.393 -11.668 1.00 0.00 C ATOM 0 H VAL A 90 8.346 0.375 -8.894 1.00 0.00 H new ATOM 0 HA VAL A 90 5.918 -0.810 -9.765 1.00 0.00 H new ATOM 0 HB VAL A 90 6.671 -0.346 -11.970 1.00 0.00 H new ATOM 0 HG11 VAL A 90 7.515 1.981 -11.825 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.221 1.667 -10.644 1.00 0.00 H new ATOM 0 HG13 VAL A 90 7.919 1.714 -10.112 1.00 0.00 H new ATOM 0 HG21 VAL A 90 9.002 0.192 -12.559 1.00 0.00 H new ATOM 0 HG22 VAL A 90 9.496 -0.154 -10.885 1.00 0.00 H new ATOM 0 HG23 VAL A 90 8.837 -1.455 -11.906 1.00 0.00 H new ATOM 1348 N ILE A 91 8.642 -2.661 -10.051 1.00 0.00 N ATOM 1349 CA ILE A 91 9.083 -4.035 -10.242 1.00 0.00 C ATOM 1350 C ILE A 91 8.958 -4.841 -8.947 1.00 0.00 C ATOM 1351 O ILE A 91 9.095 -4.301 -7.849 1.00 0.00 O ATOM 1352 CB ILE A 91 10.532 -4.086 -10.790 1.00 0.00 C ATOM 1353 CG1 ILE A 91 10.587 -3.465 -12.196 1.00 0.00 C ATOM 1354 CG2 ILE A 91 11.053 -5.517 -10.818 1.00 0.00 C ATOM 1355 CD1 ILE A 91 11.296 -2.124 -12.242 1.00 0.00 C ATOM 0 H ILE A 91 9.392 -1.993 -9.873 1.00 0.00 H new ATOM 0 HA ILE A 91 8.429 -4.492 -10.984 1.00 0.00 H new ATOM 0 HB ILE A 91 11.173 -3.508 -10.124 1.00 0.00 H new ATOM 0 HG12 ILE A 91 11.092 -4.157 -12.870 1.00 0.00 H new ATOM 0 HG13 ILE A 91 9.570 -3.342 -12.569 1.00 0.00 H new ATOM 0 HG21 ILE A 91 12.071 -5.526 -11.206 1.00 0.00 H new ATOM 0 HG22 ILE A 91 11.046 -5.926 -9.808 1.00 0.00 H new ATOM 0 HG23 ILE A 91 10.415 -6.124 -11.460 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.296 -1.747 -13.265 1.00 0.00 H new ATOM 0 HD12 ILE A 91 10.778 -1.416 -11.595 1.00 0.00 H new ATOM 0 HD13 ILE A 91 12.324 -2.244 -11.900 1.00 0.00 H new ATOM 1367 N GLU A 92 8.672 -6.134 -9.089 1.00 0.00 N ATOM 1368 CA GLU A 92 8.494 -7.023 -7.945 1.00 0.00 C ATOM 1369 C GLU A 92 9.169 -8.361 -8.214 1.00 0.00 C ATOM 1370 O GLU A 92 9.544 -8.646 -9.351 1.00 0.00 O ATOM 1371 CB GLU A 92 6.999 -7.248 -7.696 1.00 0.00 C ATOM 1372 CG GLU A 92 6.657 -7.549 -6.246 1.00 0.00 C ATOM 1373 CD GLU A 92 5.320 -6.968 -5.830 1.00 0.00 C ATOM 1374 OE1 GLU A 92 4.959 -5.885 -6.337 1.00 0.00 O ATOM 1375 OE2 GLU A 92 4.633 -7.596 -4.996 1.00 0.00 O ATOM 0 H GLU A 92 8.558 -6.591 -9.994 1.00 0.00 H new ATOM 0 HA GLU A 92 8.946 -6.564 -7.066 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.450 -6.361 -8.012 1.00 0.00 H new ATOM 0 HB3 GLU A 92 6.657 -8.074 -8.319 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.642 -8.629 -6.097 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.439 -7.149 -5.601 1.00 0.00 H new ATOM 1382 N ASN A 93 9.340 -9.185 -7.180 1.00 0.00 N ATOM 1383 CA ASN A 93 9.985 -10.483 -7.353 1.00 0.00 C ATOM 1384 C ASN A 93 8.962 -11.610 -7.247 1.00 0.00 C ATOM 1385 O ASN A 93 8.584 -12.024 -6.151 1.00 0.00 O ATOM 1386 CB ASN A 93 11.078 -10.666 -6.296 1.00 0.00 C ATOM 1387 CG ASN A 93 11.767 -12.015 -6.388 1.00 0.00 C ATOM 1388 OD1 ASN A 93 11.830 -12.624 -7.456 1.00 0.00 O ATOM 1389 ND2 ASN A 93 12.288 -12.490 -5.261 1.00 0.00 N ATOM 0 H ASN A 93 9.044 -8.979 -6.226 1.00 0.00 H new ATOM 0 HA ASN A 93 10.435 -10.518 -8.345 1.00 0.00 H new ATOM 0 HB2 ASN A 93 11.821 -9.876 -6.408 1.00 0.00 H new ATOM 0 HB3 ASN A 93 10.640 -10.554 -5.304 1.00 0.00 H new ATOM 0 HD21 ASN A 93 12.763 -13.393 -5.259 1.00 0.00 H new ATOM 0 HD22 ASN A 93 12.213 -11.952 -4.398 1.00 0.00 H new ATOM 1396 N VAL A 94 8.536 -12.109 -8.399 1.00 0.00 N ATOM 1397 CA VAL A 94 7.572 -13.201 -8.457 1.00 0.00 C ATOM 1398 C VAL A 94 8.276 -14.536 -8.672 1.00 0.00 C ATOM 1399 O VAL A 94 8.596 -14.894 -9.805 1.00 0.00 O ATOM 1400 CB VAL A 94 6.543 -12.987 -9.584 1.00 0.00 C ATOM 1401 CG1 VAL A 94 5.508 -14.102 -9.585 1.00 0.00 C ATOM 1402 CG2 VAL A 94 5.871 -11.629 -9.442 1.00 0.00 C ATOM 0 H VAL A 94 8.844 -11.773 -9.311 1.00 0.00 H new ATOM 0 HA VAL A 94 7.049 -13.215 -7.501 1.00 0.00 H new ATOM 0 HB VAL A 94 7.069 -13.011 -10.538 1.00 0.00 H new ATOM 0 HG11 VAL A 94 4.791 -13.932 -10.388 1.00 0.00 H new ATOM 0 HG12 VAL A 94 6.005 -15.060 -9.739 1.00 0.00 H new ATOM 0 HG13 VAL A 94 4.985 -14.114 -8.629 1.00 0.00 H new ATOM 0 HG21 VAL A 94 5.148 -11.495 -10.246 1.00 0.00 H new ATOM 0 HG22 VAL A 94 5.359 -11.575 -8.481 1.00 0.00 H new ATOM 0 HG23 VAL A 94 6.624 -10.843 -9.497 1.00 0.00 H new ATOM 1412 N ASP A 95 8.515 -15.275 -7.592 1.00 0.00 N ATOM 1413 CA ASP A 95 9.181 -16.571 -7.687 1.00 0.00 C ATOM 1414 C ASP A 95 10.500 -16.474 -8.449 1.00 0.00 C ATOM 1415 O ASP A 95 10.894 -17.412 -9.141 1.00 0.00 O ATOM 1416 CB ASP A 95 8.262 -17.593 -8.357 1.00 0.00 C ATOM 1417 CG ASP A 95 8.727 -19.019 -8.132 1.00 0.00 C ATOM 1418 OD1 ASP A 95 9.425 -19.264 -7.126 1.00 0.00 O ATOM 1419 OD2 ASP A 95 8.393 -19.892 -8.961 1.00 0.00 O ATOM 0 H ASP A 95 8.258 -15.000 -6.644 1.00 0.00 H new ATOM 0 HA ASP A 95 9.405 -16.900 -6.672 1.00 0.00 H new ATOM 0 HB2 ASP A 95 7.250 -17.478 -7.969 1.00 0.00 H new ATOM 0 HB3 ASP A 95 8.218 -17.392 -9.427 1.00 0.00 H new ATOM 1424 N GLY A 96 11.182 -15.339 -8.316 1.00 0.00 N ATOM 1425 CA GLY A 96 12.458 -15.158 -8.993 1.00 0.00 C ATOM 1426 C GLY A 96 12.331 -14.485 -10.346 1.00 0.00 C ATOM 1427 O GLY A 96 13.148 -14.718 -11.239 1.00 0.00 O ATOM 0 H GLY A 96 10.877 -14.544 -7.755 1.00 0.00 H new ATOM 0 HA2 GLY A 96 13.116 -14.563 -8.360 1.00 0.00 H new ATOM 0 HA3 GLY A 96 12.934 -16.130 -9.122 1.00 0.00 H new ATOM 1431 N SER A 97 11.309 -13.650 -10.508 1.00 0.00 N ATOM 1432 CA SER A 97 11.096 -12.952 -11.770 1.00 0.00 C ATOM 1433 C SER A 97 10.625 -11.519 -11.538 1.00 0.00 C ATOM 1434 O SER A 97 9.744 -11.268 -10.716 1.00 0.00 O ATOM 1435 CB SER A 97 10.073 -13.704 -12.624 1.00 0.00 C ATOM 1436 OG SER A 97 8.761 -13.535 -12.116 1.00 0.00 O ATOM 0 H SER A 97 10.620 -13.442 -9.786 1.00 0.00 H new ATOM 0 HA SER A 97 12.049 -12.916 -12.297 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.118 -13.344 -13.652 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.323 -14.765 -12.647 1.00 0.00 H new ATOM 0 HG SER A 97 8.682 -13.996 -11.255 1.00 0.00 H new ATOM 1442 N LEU A 98 11.218 -10.581 -12.275 1.00 0.00 N ATOM 1443 CA LEU A 98 10.861 -9.172 -12.151 1.00 0.00 C ATOM 1444 C LEU A 98 9.502 -8.904 -12.783 1.00 0.00 C ATOM 1445 O LEU A 98 9.303 -9.132 -13.975 1.00 0.00 O ATOM 1446 CB LEU A 98 11.919 -8.288 -12.816 1.00 0.00 C ATOM 1447 CG LEU A 98 13.360 -8.533 -12.364 1.00 0.00 C ATOM 1448 CD1 LEU A 98 14.294 -7.515 -13.000 1.00 0.00 C ATOM 1449 CD2 LEU A 98 13.459 -8.475 -10.847 1.00 0.00 C ATOM 0 H LEU A 98 11.947 -10.773 -12.963 1.00 0.00 H new ATOM 0 HA LEU A 98 10.812 -8.931 -11.089 1.00 0.00 H new ATOM 0 HB2 LEU A 98 11.865 -8.435 -13.895 1.00 0.00 H new ATOM 0 HB3 LEU A 98 11.669 -7.245 -12.624 1.00 0.00 H new ATOM 0 HG LEU A 98 13.661 -9.529 -12.689 1.00 0.00 H new ATOM 0 HD11 LEU A 98 15.316 -7.702 -12.669 1.00 0.00 H new ATOM 0 HD12 LEU A 98 14.242 -7.602 -14.085 1.00 0.00 H new ATOM 0 HD13 LEU A 98 13.994 -6.510 -12.702 1.00 0.00 H new ATOM 0 HD21 LEU A 98 14.491 -8.651 -10.543 1.00 0.00 H new ATOM 0 HD22 LEU A 98 13.141 -7.492 -10.499 1.00 0.00 H new ATOM 0 HD23 LEU A 98 12.816 -9.240 -10.411 1.00 0.00 H new ATOM 1461 N LYS A 99 8.560 -8.437 -11.970 1.00 0.00 N ATOM 1462 CA LYS A 99 7.210 -8.159 -12.445 1.00 0.00 C ATOM 1463 C LYS A 99 6.789 -6.726 -12.136 1.00 0.00 C ATOM 1464 O LYS A 99 7.068 -6.204 -11.059 1.00 0.00 O ATOM 1465 CB LYS A 99 6.233 -9.140 -11.796 1.00 0.00 C ATOM 1466 CG LYS A 99 6.206 -10.502 -12.474 1.00 0.00 C ATOM 1467 CD LYS A 99 4.797 -10.909 -12.871 1.00 0.00 C ATOM 1468 CE LYS A 99 4.767 -12.317 -13.446 1.00 0.00 C ATOM 1469 NZ LYS A 99 4.993 -12.321 -14.918 1.00 0.00 N ATOM 0 H LYS A 99 8.707 -8.243 -10.979 1.00 0.00 H new ATOM 0 HA LYS A 99 7.197 -8.281 -13.528 1.00 0.00 H new ATOM 0 HB2 LYS A 99 6.502 -9.269 -10.748 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.231 -8.711 -11.818 1.00 0.00 H new ATOM 0 HG2 LYS A 99 6.841 -10.479 -13.360 1.00 0.00 H new ATOM 0 HG3 LYS A 99 6.624 -11.251 -11.801 1.00 0.00 H new ATOM 0 HD2 LYS A 99 4.143 -10.856 -12.001 1.00 0.00 H new ATOM 0 HD3 LYS A 99 4.407 -10.206 -13.607 1.00 0.00 H new ATOM 0 HE2 LYS A 99 5.531 -12.924 -12.960 1.00 0.00 H new ATOM 0 HE3 LYS A 99 3.805 -12.779 -13.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.965 -13.299 -15.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 4.250 -11.763 -15.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 5.922 -11.904 -15.128 1.00 0.00 H new ATOM 1483 N TYR A 100 6.113 -6.094 -13.091 1.00 0.00 N ATOM 1484 CA TYR A 100 5.648 -4.722 -12.920 1.00 0.00 C ATOM 1485 C TYR A 100 4.360 -4.690 -12.104 1.00 0.00 C ATOM 1486 O TYR A 100 4.270 -3.992 -11.093 1.00 0.00 O ATOM 1487 CB TYR A 100 5.418 -4.060 -14.281 1.00 0.00 C ATOM 1488 CG TYR A 100 4.970 -2.618 -14.182 1.00 0.00 C ATOM 1489 CD1 TYR A 100 3.643 -2.300 -13.923 1.00 0.00 C ATOM 1490 CD2 TYR A 100 5.875 -1.577 -14.344 1.00 0.00 C ATOM 1491 CE1 TYR A 100 3.230 -0.985 -13.828 1.00 0.00 C ATOM 1492 CE2 TYR A 100 5.469 -0.259 -14.249 1.00 0.00 C ATOM 1493 CZ TYR A 100 4.146 0.031 -13.992 1.00 0.00 C ATOM 1494 OH TYR A 100 3.740 1.341 -13.895 1.00 0.00 O ATOM 0 H TYR A 100 5.875 -6.510 -13.991 1.00 0.00 H new ATOM 0 HA TYR A 100 6.418 -4.167 -12.383 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.341 -4.107 -14.860 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.668 -4.628 -14.831 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.922 -3.094 -13.794 1.00 0.00 H new ATOM 0 HD2 TYR A 100 6.912 -1.801 -14.547 1.00 0.00 H new ATOM 0 HE1 TYR A 100 2.194 -0.755 -13.626 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.185 0.540 -14.376 1.00 0.00 H new ATOM 0 HH TYR A 100 4.508 1.933 -14.035 1.00 0.00 H new ATOM 1504 N GLU A 101 3.367 -5.454 -12.547 1.00 0.00 N ATOM 1505 CA GLU A 101 2.084 -5.519 -11.856 1.00 0.00 C ATOM 1506 C GLU A 101 2.013 -6.753 -10.962 1.00 0.00 C ATOM 1507 O GLU A 101 2.081 -6.591 -9.726 1.00 0.00 O ATOM 1508 CB GLU A 101 0.934 -5.534 -12.867 1.00 0.00 C ATOM 1509 CG GLU A 101 -0.074 -4.416 -12.657 1.00 0.00 C ATOM 1510 CD GLU A 101 -0.975 -4.663 -11.463 1.00 0.00 C ATOM 1511 OE1 GLU A 101 -1.543 -5.771 -11.367 1.00 0.00 O ATOM 1512 OE2 GLU A 101 -1.111 -3.748 -10.623 1.00 0.00 O ATOM 1513 OXT GLU A 101 1.893 -7.871 -11.505 1.00 0.00 O ATOM 0 H GLU A 101 3.426 -6.037 -13.382 1.00 0.00 H new ATOM 0 HA GLU A 101 1.990 -4.633 -11.229 1.00 0.00 H new ATOM 0 HB2 GLU A 101 1.345 -5.457 -13.874 1.00 0.00 H new ATOM 0 HB3 GLU A 101 0.419 -6.493 -12.805 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.457 -3.474 -12.519 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -0.685 -4.309 -13.553 1.00 0.00 H new TER 1520 GLU A 101