USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1075 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 117 ASN :FLIP amide:sc= -0.583 F(o=-1.5,f=-0.64) USER MOD Set 1.2: A 121 LYS NZ :NH3+ -157:sc= -0.0614 (180deg=-0.219) USER MOD Set 2.1: A 107 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 111 ASN : amide:sc= 1.65 K(o=3.5,f=-3.4) USER MOD Set 2.3: A 114 LYS NZ :NH3+ 174:sc= 1.83 (180deg=0.479) USER MOD Set 3.1: A 74 GLN : amide:sc= 0.425 K(o=1.7,f=-10!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 173:sc= 1.24 (180deg=-0.0551) USER MOD Set 4.1: A 65 ASN : amide:sc= -0.625 K(o=-1.4,f=-2.8!) USER MOD Set 4.2: A 69 GLN : amide:sc= -0.744 K(o=-1.4,f=-11!) USER MOD Set 5.1: A 19 GLN : amide:sc= -0.187 K(o=1.3,f=-0.52!) USER MOD Set 5.2: A 23 SER OG : rot 77:sc= -0.138 USER MOD Set 5.3: A 26 SER OG : rot 141:sc= -0.0461 USER MOD Set 5.4: A 27 LYS NZ :NH3+ -161:sc= 1.06 (180deg=-0.0693) USER MOD Set 5.5: A 66 HIS : no HE2:sc= 0.157 K(o=1.3,f=-1.1) USER MOD Set 5.6: A 70 GLN : amide:sc= 0.445 K(o=1.3,f=-5.9!) USER MOD Set 6.1: A 62 TYR OH : rot 180:sc= 0.0835 USER MOD Set 6.2: A 105 LYS NZ :NH3+ -168:sc= 0.245 (180deg=0) USER MOD Single : A 7 GLN : amide:sc=-0.00137 X(o=-0.0014,f=-0.14) USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.0414 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN :FLIP amide:sc= -1.47 F(o=-2.6,f=-1.5) USER MOD Single : A 14 THR OG1 : rot 83:sc= 0.793 USER MOD Single : A 18 SER OG : rot 180:sc= 0.00363 USER MOD Single : A 21 SER OG : rot -37:sc= 1.25 USER MOD Single : A 24 SER OG : rot 76:sc= 0.382 USER MOD Single : A 32 GLN : amide:sc= 1.83 K(o=1.8,f=-7.7!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -160:sc= 1.05 (180deg=0.602) USER MOD Single : A 42 MET CE :methyl -146:sc= -0.806 (180deg=-1.97) USER MOD Single : A 44 LYS NZ :NH3+ 162:sc= 0.463 (180deg=-0.343!) USER MOD Single : A 46 TYR OH : rot -1:sc= 0.875 USER MOD Single : A 47 MET CE :methyl -155:sc= -2.49! (180deg=-3.95!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN :FLIP amide:sc= -0.0357 F(o=-5!,f=-0.036) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 177:sc= 0.247 (180deg=0.0359) USER MOD Single : A 64 MET CE :methyl -136:sc= -0.326 (180deg=-1.42) USER MOD Single : A 72 LYS NZ :NH3+ 155:sc= -0.0831 (180deg=-0.61) USER MOD Single : A 78 GLN : amide:sc= -0.397! C(o=-0.4!,f=-5.3!) USER MOD Single : A 80 GLN : amide:sc= 0.562 K(o=0.56,f=-3.3!) USER MOD Single : A 82 SER OG : rot 59:sc= 1.16 USER MOD Single : A 85 LYS NZ :NH3+ 153:sc= 2.17 (180deg=1.31) USER MOD Single : A 95 ASN : amide:sc= -0.519 K(o=-0.52,f=-2.9!) USER MOD Single : A 96 GLN : amide:sc= 1.44 K(o=1.4,f=-4.9!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 168:sc= 1.34 (180deg=1.13) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0.628 K(o=0.63,f=-0.081) USER MOD Single : A 125 ASN : amide:sc= 1.26 K(o=1.3,f=-0.2) USER MOD Single : A 130 SER OG : rot -175:sc= 0.127 USER MOD ----------------------------------------------------------------- ATOM 87 N GLN A 7 16.488 -2.792 -2.159 1.00 0.00 N ATOM 88 CA GLN A 7 15.813 -4.085 -2.215 1.00 0.00 C ATOM 89 C GLN A 7 16.406 -4.953 -3.325 1.00 0.00 C ATOM 90 O GLN A 7 16.463 -6.174 -3.195 1.00 0.00 O ATOM 91 CB GLN A 7 14.306 -3.905 -2.443 1.00 0.00 C ATOM 92 CG GLN A 7 13.954 -3.137 -3.712 1.00 0.00 C ATOM 93 CD GLN A 7 12.574 -2.511 -3.564 1.00 0.00 C ATOM 94 OE1 GLN A 7 12.338 -1.691 -2.681 1.00 0.00 O ATOM 95 NE2 GLN A 7 11.648 -2.896 -4.434 1.00 0.00 N ATOM 0 HA GLN A 7 15.964 -4.583 -1.257 1.00 0.00 H new ATOM 0 HB2 GLN A 7 13.836 -4.888 -2.484 1.00 0.00 H new ATOM 0 HB3 GLN A 7 13.880 -3.384 -1.586 1.00 0.00 H new ATOM 0 HG2 GLN A 7 14.698 -2.362 -3.898 1.00 0.00 H new ATOM 0 HG3 GLN A 7 13.970 -3.808 -4.571 1.00 0.00 H new ATOM 0 HE21 GLN A 7 11.879 -3.579 -5.155 1.00 0.00 H new ATOM 0 HE22 GLN A 7 10.706 -2.508 -4.381 1.00 0.00 H new ATOM 104 N PHE A 8 16.846 -4.327 -4.420 1.00 0.00 N ATOM 105 CA PHE A 8 17.411 -5.040 -5.554 1.00 0.00 C ATOM 106 C PHE A 8 18.794 -5.582 -5.200 1.00 0.00 C ATOM 107 O PHE A 8 19.119 -6.724 -5.518 1.00 0.00 O ATOM 108 CB PHE A 8 17.466 -4.075 -6.743 1.00 0.00 C ATOM 109 CG PHE A 8 17.443 -4.701 -8.118 1.00 0.00 C ATOM 110 CD1 PHE A 8 17.064 -3.908 -9.208 1.00 0.00 C ATOM 111 CD2 PHE A 8 17.787 -6.044 -8.324 1.00 0.00 C ATOM 112 CE1 PHE A 8 16.998 -4.457 -10.494 1.00 0.00 C ATOM 113 CE2 PHE A 8 17.761 -6.581 -9.617 1.00 0.00 C ATOM 114 CZ PHE A 8 17.359 -5.791 -10.703 1.00 0.00 C ATOM 0 H PHE A 8 16.818 -3.314 -4.539 1.00 0.00 H new ATOM 0 HA PHE A 8 16.792 -5.897 -5.818 1.00 0.00 H new ATOM 0 HB2 PHE A 8 16.622 -3.389 -6.666 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.373 -3.476 -6.655 1.00 0.00 H new ATOM 0 HD1 PHE A 8 16.821 -2.867 -9.056 1.00 0.00 H new ATOM 0 HD2 PHE A 8 18.072 -6.664 -7.487 1.00 0.00 H new ATOM 0 HE1 PHE A 8 16.668 -3.850 -11.324 1.00 0.00 H new ATOM 0 HE2 PHE A 8 18.052 -7.608 -9.778 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.328 -6.212 -11.697 1.00 0.00 H new ATOM 124 N THR A 9 19.618 -4.766 -4.540 1.00 0.00 N ATOM 125 CA THR A 9 20.960 -5.183 -4.175 1.00 0.00 C ATOM 126 C THR A 9 20.899 -6.322 -3.169 1.00 0.00 C ATOM 127 O THR A 9 21.594 -7.315 -3.350 1.00 0.00 O ATOM 128 CB THR A 9 21.761 -4.004 -3.615 1.00 0.00 C ATOM 129 OG1 THR A 9 22.010 -3.071 -4.637 1.00 0.00 O ATOM 130 CG2 THR A 9 23.098 -4.472 -3.047 1.00 0.00 C ATOM 0 H THR A 9 19.375 -3.818 -4.251 1.00 0.00 H new ATOM 0 HA THR A 9 21.470 -5.539 -5.071 1.00 0.00 H new ATOM 0 HB THR A 9 21.174 -3.547 -2.818 1.00 0.00 H new ATOM 0 HG1 THR A 9 22.521 -2.318 -4.275 1.00 0.00 H new ATOM 0 HG21 THR A 9 23.647 -3.615 -2.656 1.00 0.00 H new ATOM 0 HG22 THR A 9 22.922 -5.187 -2.244 1.00 0.00 H new ATOM 0 HG23 THR A 9 23.682 -4.948 -3.835 1.00 0.00 H new ATOM 138 N THR A 10 20.083 -6.203 -2.113 1.00 0.00 N ATOM 139 CA THR A 10 20.049 -7.256 -1.109 1.00 0.00 C ATOM 140 C THR A 10 19.553 -8.542 -1.761 1.00 0.00 C ATOM 141 O THR A 10 19.912 -9.640 -1.334 1.00 0.00 O ATOM 142 CB THR A 10 19.203 -6.843 0.097 1.00 0.00 C ATOM 143 OG1 THR A 10 19.286 -7.837 1.091 1.00 0.00 O ATOM 144 CG2 THR A 10 17.732 -6.674 -0.270 1.00 0.00 C ATOM 0 H THR A 10 19.460 -5.414 -1.941 1.00 0.00 H new ATOM 0 HA THR A 10 21.053 -7.432 -0.722 1.00 0.00 H new ATOM 0 HB THR A 10 19.592 -5.889 0.453 1.00 0.00 H new ATOM 0 HG1 THR A 10 18.745 -7.572 1.864 1.00 0.00 H new ATOM 0 HG21 THR A 10 17.168 -6.381 0.615 1.00 0.00 H new ATOM 0 HG22 THR A 10 17.634 -5.904 -1.035 1.00 0.00 H new ATOM 0 HG23 THR A 10 17.342 -7.617 -0.653 1.00 0.00 H new ATOM 152 N LYS A 11 18.722 -8.406 -2.804 1.00 0.00 N ATOM 153 CA LYS A 11 18.319 -9.547 -3.604 1.00 0.00 C ATOM 154 C LYS A 11 19.545 -10.182 -4.252 1.00 0.00 C ATOM 155 O LYS A 11 19.790 -11.372 -4.070 1.00 0.00 O ATOM 156 CB LYS A 11 17.312 -9.099 -4.673 1.00 0.00 C ATOM 157 CG LYS A 11 16.144 -10.087 -4.718 1.00 0.00 C ATOM 158 CD LYS A 11 15.248 -9.862 -3.496 1.00 0.00 C ATOM 159 CE LYS A 11 14.327 -8.675 -3.768 1.00 0.00 C ATOM 160 NZ LYS A 11 13.460 -8.396 -2.612 1.00 0.00 N1+ ATOM 0 H LYS A 11 18.323 -7.517 -3.104 1.00 0.00 H new ATOM 0 HA LYS A 11 17.841 -10.290 -2.965 1.00 0.00 H new ATOM 0 HB2 LYS A 11 16.947 -8.097 -4.447 1.00 0.00 H new ATOM 0 HB3 LYS A 11 17.798 -9.049 -5.647 1.00 0.00 H new ATOM 0 HG2 LYS A 11 15.571 -9.950 -5.635 1.00 0.00 H new ATOM 0 HG3 LYS A 11 16.518 -11.111 -4.726 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.659 -10.756 -3.291 1.00 0.00 H new ATOM 0 HD3 LYS A 11 15.857 -9.671 -2.612 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.925 -7.793 -3.998 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.713 -8.882 -4.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 12.846 -7.585 -2.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 12.873 -9.230 -2.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.047 -8.176 -1.783 1.00 0.00 H new ATOM 174 N LEU A 12 20.309 -9.386 -5.005 1.00 0.00 N ATOM 175 CA LEU A 12 21.457 -9.850 -5.769 1.00 0.00 C ATOM 176 C LEU A 12 22.587 -10.332 -4.870 1.00 0.00 C ATOM 177 O LEU A 12 23.406 -11.145 -5.292 1.00 0.00 O ATOM 178 CB LEU A 12 21.930 -8.696 -6.646 1.00 0.00 C ATOM 179 CG LEU A 12 21.176 -8.767 -7.970 1.00 0.00 C ATOM 180 CD1 LEU A 12 20.949 -7.374 -8.541 1.00 0.00 C ATOM 181 CD2 LEU A 12 21.979 -9.642 -8.920 1.00 0.00 C ATOM 0 H LEU A 12 20.139 -8.385 -5.099 1.00 0.00 H new ATOM 0 HA LEU A 12 21.160 -10.704 -6.377 1.00 0.00 H new ATOM 0 HB2 LEU A 12 21.744 -7.742 -6.153 1.00 0.00 H new ATOM 0 HB3 LEU A 12 23.005 -8.763 -6.816 1.00 0.00 H new ATOM 0 HG LEU A 12 20.188 -9.204 -7.821 1.00 0.00 H new ATOM 0 HD11 LEU A 12 20.410 -7.451 -9.485 1.00 0.00 H new ATOM 0 HD12 LEU A 12 20.364 -6.783 -7.836 1.00 0.00 H new ATOM 0 HD13 LEU A 12 21.910 -6.889 -8.711 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.462 -9.710 -9.877 1.00 0.00 H new ATOM 0 HD22 LEU A 12 22.966 -9.204 -9.071 1.00 0.00 H new ATOM 0 HD23 LEU A 12 22.086 -10.639 -8.493 1.00 0.00 H new ATOM 193 N ASN A 13 22.625 -9.831 -3.636 1.00 0.00 N ATOM 194 CA ASN A 13 23.569 -10.290 -2.629 1.00 0.00 C ATOM 195 C ASN A 13 23.210 -11.709 -2.188 1.00 0.00 C ATOM 196 O ASN A 13 24.032 -12.386 -1.576 1.00 0.00 O ATOM 197 CB ASN A 13 23.545 -9.333 -1.431 1.00 0.00 C ATOM 198 CG ASN A 13 23.947 -7.903 -1.782 1.00 0.00 C ATOM 199 OD1 ASN A 13 24.320 -7.643 -3.033 1.00 0.00 O flip ATOM 200 ND2 ASN A 13 23.920 -7.031 -0.920 1.00 0.00 N flip ATOM 0 H ASN A 13 21.999 -9.094 -3.310 1.00 0.00 H new ATOM 0 HA ASN A 13 24.574 -10.303 -3.051 1.00 0.00 H new ATOM 0 HB2 ASN A 13 22.542 -9.325 -1.003 1.00 0.00 H new ATOM 0 HB3 ASN A 13 24.217 -9.712 -0.661 1.00 0.00 H new ATOM 0 HD21 ASN A 13 23.629 -7.262 0.030 1.00 0.00 H new ATOM 0 HD22 ASN A 13 24.188 -6.075 -1.153 1.00 0.00 H new ATOM 207 N THR A 14 21.987 -12.152 -2.501 1.00 0.00 N ATOM 208 CA THR A 14 21.499 -13.470 -2.136 1.00 0.00 C ATOM 209 C THR A 14 21.490 -14.403 -3.348 1.00 0.00 C ATOM 210 O THR A 14 21.453 -15.621 -3.185 1.00 0.00 O ATOM 211 CB THR A 14 20.096 -13.327 -1.538 1.00 0.00 C ATOM 212 OG1 THR A 14 20.115 -12.391 -0.482 1.00 0.00 O ATOM 213 CG2 THR A 14 19.585 -14.656 -0.995 1.00 0.00 C ATOM 0 H THR A 14 21.309 -11.594 -3.020 1.00 0.00 H new ATOM 0 HA THR A 14 22.164 -13.914 -1.395 1.00 0.00 H new ATOM 0 HB THR A 14 19.433 -12.990 -2.335 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.044 -11.484 -0.847 1.00 0.00 H new ATOM 0 HG21 THR A 14 18.587 -14.519 -0.578 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.544 -15.387 -1.802 1.00 0.00 H new ATOM 0 HG23 THR A 14 20.258 -15.014 -0.216 1.00 0.00 H new ATOM 221 N LEU A 15 21.522 -13.853 -4.570 1.00 0.00 N ATOM 222 CA LEU A 15 21.488 -14.672 -5.776 1.00 0.00 C ATOM 223 C LEU A 15 22.802 -15.422 -5.985 1.00 0.00 C ATOM 224 O LEU A 15 23.838 -15.075 -5.419 1.00 0.00 O ATOM 225 CB LEU A 15 21.129 -13.834 -7.015 1.00 0.00 C ATOM 226 CG LEU A 15 19.792 -13.110 -6.842 1.00 0.00 C ATOM 227 CD1 LEU A 15 19.394 -12.444 -8.154 1.00 0.00 C ATOM 228 CD2 LEU A 15 18.677 -14.059 -6.409 1.00 0.00 C ATOM 0 H LEU A 15 21.571 -12.849 -4.743 1.00 0.00 H new ATOM 0 HA LEU A 15 20.703 -15.415 -5.637 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.917 -13.104 -7.201 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.081 -14.481 -7.891 1.00 0.00 H new ATOM 0 HG LEU A 15 19.925 -12.364 -6.059 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.441 -11.930 -8.027 1.00 0.00 H new ATOM 0 HD12 LEU A 15 20.159 -11.724 -8.443 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.296 -13.202 -8.932 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.747 -13.501 -6.299 1.00 0.00 H new ATOM 0 HD22 LEU A 15 18.547 -14.836 -7.163 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.940 -14.518 -5.456 1.00 0.00 H new ATOM 240 N GLU A 16 22.723 -16.464 -6.820 1.00 0.00 N ATOM 241 CA GLU A 16 23.853 -17.258 -7.270 1.00 0.00 C ATOM 242 C GLU A 16 23.894 -17.200 -8.793 1.00 0.00 C ATOM 243 O GLU A 16 22.924 -16.779 -9.423 1.00 0.00 O ATOM 244 CB GLU A 16 23.725 -18.709 -6.793 1.00 0.00 C ATOM 245 CG GLU A 16 23.761 -18.812 -5.267 1.00 0.00 C ATOM 246 CD GLU A 16 23.889 -20.259 -4.794 1.00 0.00 C ATOM 247 OE1 GLU A 16 24.095 -20.452 -3.576 1.00 0.00 O ATOM 248 OE2 GLU A 16 23.782 -21.173 -5.643 1.00 0.00 O1- ATOM 0 H GLU A 16 21.836 -16.782 -7.210 1.00 0.00 H new ATOM 0 HA GLU A 16 24.776 -16.857 -6.852 1.00 0.00 H new ATOM 0 HB2 GLU A 16 22.791 -19.132 -7.164 1.00 0.00 H new ATOM 0 HB3 GLU A 16 24.535 -19.303 -7.216 1.00 0.00 H new ATOM 0 HG2 GLU A 16 24.599 -18.230 -4.884 1.00 0.00 H new ATOM 0 HG3 GLU A 16 22.853 -18.374 -4.853 1.00 0.00 H new ATOM 255 N ASP A 17 25.015 -17.620 -9.385 1.00 0.00 N ATOM 256 CA ASP A 17 25.261 -17.582 -10.818 1.00 0.00 C ATOM 257 C ASP A 17 24.355 -18.532 -11.609 1.00 0.00 C ATOM 258 O ASP A 17 24.695 -18.925 -12.723 1.00 0.00 O ATOM 259 CB ASP A 17 26.740 -17.873 -11.085 1.00 0.00 C ATOM 260 CG ASP A 17 27.686 -17.191 -10.092 1.00 0.00 C ATOM 261 OD1 ASP A 17 28.520 -16.386 -10.563 1.00 0.00 O ATOM 262 OD2 ASP A 17 27.568 -17.476 -8.880 1.00 0.00 O1- ATOM 0 H ASP A 17 25.798 -18.007 -8.858 1.00 0.00 H new ATOM 0 HA ASP A 17 25.014 -16.581 -11.171 1.00 0.00 H new ATOM 0 HB2 ASP A 17 26.903 -18.950 -11.048 1.00 0.00 H new ATOM 0 HB3 ASP A 17 26.990 -17.547 -12.095 1.00 0.00 H new ATOM 267 N SER A 18 23.204 -18.906 -11.039 1.00 0.00 N ATOM 268 CA SER A 18 22.324 -19.913 -11.609 1.00 0.00 C ATOM 269 C SER A 18 20.902 -19.397 -11.785 1.00 0.00 C ATOM 270 O SER A 18 20.434 -18.576 -11.004 1.00 0.00 O ATOM 271 CB SER A 18 22.285 -21.113 -10.674 1.00 0.00 C ATOM 272 OG SER A 18 21.467 -22.118 -11.223 1.00 0.00 O ATOM 0 H SER A 18 22.861 -18.511 -10.163 1.00 0.00 H new ATOM 0 HA SER A 18 22.714 -20.181 -12.591 1.00 0.00 H new ATOM 0 HB2 SER A 18 23.293 -21.497 -10.518 1.00 0.00 H new ATOM 0 HB3 SER A 18 21.903 -20.813 -9.698 1.00 0.00 H new ATOM 0 HG SER A 18 21.446 -22.889 -10.619 1.00 0.00 H new ATOM 278 N GLN A 19 20.222 -19.893 -12.823 1.00 0.00 N ATOM 279 CA GLN A 19 18.829 -19.584 -13.101 1.00 0.00 C ATOM 280 C GLN A 19 17.920 -19.935 -11.928 1.00 0.00 C ATOM 281 O GLN A 19 16.761 -19.539 -11.928 1.00 0.00 O ATOM 282 CB GLN A 19 18.405 -20.356 -14.344 1.00 0.00 C ATOM 283 CG GLN A 19 18.829 -19.570 -15.578 1.00 0.00 C ATOM 284 CD GLN A 19 17.924 -18.371 -15.832 1.00 0.00 C ATOM 285 OE1 GLN A 19 18.395 -17.245 -15.963 1.00 0.00 O ATOM 286 NE2 GLN A 19 16.615 -18.605 -15.904 1.00 0.00 N ATOM 0 H GLN A 19 20.638 -20.531 -13.502 1.00 0.00 H new ATOM 0 HA GLN A 19 18.734 -18.510 -13.264 1.00 0.00 H new ATOM 0 HB2 GLN A 19 18.865 -21.344 -14.350 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.325 -20.507 -14.345 1.00 0.00 H new ATOM 0 HG2 GLN A 19 19.857 -19.228 -15.454 1.00 0.00 H new ATOM 0 HG3 GLN A 19 18.814 -20.226 -16.448 1.00 0.00 H new ATOM 0 HE21 GLN A 19 16.260 -19.554 -15.790 1.00 0.00 H new ATOM 0 HE22 GLN A 19 15.968 -17.835 -16.073 1.00 0.00 H new ATOM 295 N GLU A 20 18.431 -20.668 -10.938 1.00 0.00 N ATOM 296 CA GLU A 20 17.677 -21.051 -9.756 1.00 0.00 C ATOM 297 C GLU A 20 17.107 -19.805 -9.065 1.00 0.00 C ATOM 298 O GLU A 20 15.947 -19.422 -9.262 1.00 0.00 O ATOM 299 CB GLU A 20 18.621 -21.865 -8.854 1.00 0.00 C ATOM 300 CG GLU A 20 17.939 -22.642 -7.730 1.00 0.00 C ATOM 301 CD GLU A 20 17.032 -21.777 -6.858 1.00 0.00 C ATOM 302 OE1 GLU A 20 15.804 -22.001 -6.924 1.00 0.00 O ATOM 303 OE2 GLU A 20 17.580 -20.907 -6.142 1.00 0.00 O1- ATOM 0 H GLU A 20 19.391 -21.013 -10.940 1.00 0.00 H new ATOM 0 HA GLU A 20 16.816 -21.669 -10.009 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.175 -22.568 -9.476 1.00 0.00 H new ATOM 0 HB3 GLU A 20 19.351 -21.186 -8.413 1.00 0.00 H new ATOM 0 HG2 GLU A 20 17.350 -23.451 -8.163 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.702 -23.103 -7.102 1.00 0.00 H new ATOM 310 N SER A 21 17.938 -19.165 -8.244 1.00 0.00 N ATOM 311 CA SER A 21 17.531 -18.004 -7.478 1.00 0.00 C ATOM 312 C SER A 21 17.288 -16.822 -8.408 1.00 0.00 C ATOM 313 O SER A 21 16.461 -15.961 -8.121 1.00 0.00 O ATOM 314 CB SER A 21 18.623 -17.685 -6.462 1.00 0.00 C ATOM 315 OG SER A 21 19.055 -18.866 -5.819 1.00 0.00 O ATOM 0 H SER A 21 18.909 -19.441 -8.096 1.00 0.00 H new ATOM 0 HA SER A 21 16.599 -18.209 -6.952 1.00 0.00 H new ATOM 0 HB2 SER A 21 19.465 -17.206 -6.962 1.00 0.00 H new ATOM 0 HB3 SER A 21 18.246 -16.978 -5.723 1.00 0.00 H new ATOM 0 HG SER A 21 18.287 -19.456 -5.669 1.00 0.00 H new ATOM 321 N ILE A 22 18.016 -16.786 -9.526 1.00 0.00 N ATOM 322 CA ILE A 22 17.894 -15.738 -10.524 1.00 0.00 C ATOM 323 C ILE A 22 16.500 -15.723 -11.140 1.00 0.00 C ATOM 324 O ILE A 22 15.870 -14.670 -11.189 1.00 0.00 O ATOM 325 CB ILE A 22 18.980 -15.917 -11.572 1.00 0.00 C ATOM 326 CG1 ILE A 22 20.281 -15.545 -10.854 1.00 0.00 C ATOM 327 CG2 ILE A 22 18.709 -14.994 -12.762 1.00 0.00 C ATOM 328 CD1 ILE A 22 21.397 -15.274 -11.843 1.00 0.00 C ATOM 0 H ILE A 22 18.712 -17.494 -9.760 1.00 0.00 H new ATOM 0 HA ILE A 22 18.030 -14.767 -10.048 1.00 0.00 H new ATOM 0 HB ILE A 22 19.025 -16.930 -11.972 1.00 0.00 H new ATOM 0 HG12 ILE A 22 20.118 -14.662 -10.235 1.00 0.00 H new ATOM 0 HG13 ILE A 22 20.574 -16.354 -10.185 1.00 0.00 H new ATOM 0 HG21 ILE A 22 19.490 -15.126 -13.510 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.742 -15.240 -13.200 1.00 0.00 H new ATOM 0 HG23 ILE A 22 18.702 -13.958 -12.424 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.307 -15.013 -11.302 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.575 -16.166 -12.444 1.00 0.00 H new ATOM 0 HD13 ILE A 22 21.113 -14.448 -12.495 1.00 0.00 H new ATOM 340 N SER A 23 16.005 -16.870 -11.611 1.00 0.00 N ATOM 341 CA SER A 23 14.673 -16.916 -12.195 1.00 0.00 C ATOM 342 C SER A 23 13.631 -16.567 -11.137 1.00 0.00 C ATOM 343 O SER A 23 12.620 -15.945 -11.453 1.00 0.00 O ATOM 344 CB SER A 23 14.403 -18.293 -12.801 1.00 0.00 C ATOM 345 OG SER A 23 13.113 -18.346 -13.371 1.00 0.00 O ATOM 0 H SER A 23 16.500 -17.762 -11.598 1.00 0.00 H new ATOM 0 HA SER A 23 14.609 -16.181 -12.997 1.00 0.00 H new ATOM 0 HB2 SER A 23 15.151 -18.513 -13.563 1.00 0.00 H new ATOM 0 HB3 SER A 23 14.497 -19.059 -12.031 1.00 0.00 H new ATOM 0 HG SER A 23 13.117 -17.879 -14.233 1.00 0.00 H new ATOM 351 N SER A 24 13.864 -16.962 -9.882 1.00 0.00 N ATOM 352 CA SER A 24 12.941 -16.606 -8.811 1.00 0.00 C ATOM 353 C SER A 24 12.894 -15.083 -8.623 1.00 0.00 C ATOM 354 O SER A 24 11.815 -14.486 -8.625 1.00 0.00 O ATOM 355 CB SER A 24 13.360 -17.313 -7.519 1.00 0.00 C ATOM 356 OG SER A 24 13.418 -18.706 -7.727 1.00 0.00 O ATOM 0 H SER A 24 14.668 -17.517 -9.590 1.00 0.00 H new ATOM 0 HA SER A 24 11.936 -16.934 -9.077 1.00 0.00 H new ATOM 0 HB2 SER A 24 14.333 -16.945 -7.193 1.00 0.00 H new ATOM 0 HB3 SER A 24 12.650 -17.085 -6.724 1.00 0.00 H new ATOM 0 HG SER A 24 14.233 -18.929 -8.223 1.00 0.00 H new ATOM 362 N ALA A 25 14.062 -14.450 -8.462 1.00 0.00 N ATOM 363 CA ALA A 25 14.145 -13.007 -8.289 1.00 0.00 C ATOM 364 C ALA A 25 13.714 -12.275 -9.560 1.00 0.00 C ATOM 365 O ALA A 25 13.272 -11.131 -9.494 1.00 0.00 O ATOM 366 CB ALA A 25 15.580 -12.639 -7.922 1.00 0.00 C ATOM 0 H ALA A 25 14.965 -14.924 -8.449 1.00 0.00 H new ATOM 0 HA ALA A 25 13.469 -12.702 -7.491 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.656 -11.560 -7.789 1.00 0.00 H new ATOM 0 HB2 ALA A 25 15.858 -13.139 -6.994 1.00 0.00 H new ATOM 0 HB3 ALA A 25 16.252 -12.955 -8.720 1.00 0.00 H new ATOM 372 N SER A 26 13.841 -12.927 -10.721 1.00 0.00 N ATOM 373 CA SER A 26 13.383 -12.362 -11.976 1.00 0.00 C ATOM 374 C SER A 26 11.871 -12.205 -11.956 1.00 0.00 C ATOM 375 O SER A 26 11.356 -11.151 -12.313 1.00 0.00 O ATOM 376 CB SER A 26 13.801 -13.272 -13.127 1.00 0.00 C ATOM 377 OG SER A 26 13.313 -12.751 -14.341 1.00 0.00 O ATOM 0 H SER A 26 14.261 -13.852 -10.808 1.00 0.00 H new ATOM 0 HA SER A 26 13.834 -11.379 -12.114 1.00 0.00 H new ATOM 0 HB2 SER A 26 14.887 -13.352 -13.164 1.00 0.00 H new ATOM 0 HB3 SER A 26 13.412 -14.278 -12.969 1.00 0.00 H new ATOM 0 HG SER A 26 13.987 -12.871 -15.043 1.00 0.00 H new ATOM 383 N LYS A 27 11.157 -13.255 -11.538 1.00 0.00 N ATOM 384 CA LYS A 27 9.709 -13.214 -11.464 1.00 0.00 C ATOM 385 C LYS A 27 9.260 -12.124 -10.498 1.00 0.00 C ATOM 386 O LYS A 27 8.241 -11.475 -10.737 1.00 0.00 O ATOM 387 CB LYS A 27 9.198 -14.592 -11.052 1.00 0.00 C ATOM 388 CG LYS A 27 9.505 -15.586 -12.173 1.00 0.00 C ATOM 389 CD LYS A 27 9.213 -17.017 -11.717 1.00 0.00 C ATOM 390 CE LYS A 27 9.840 -18.013 -12.692 1.00 0.00 C ATOM 391 NZ LYS A 27 9.351 -17.822 -14.070 1.00 0.00 N1+ ATOM 0 H LYS A 27 11.568 -14.142 -11.247 1.00 0.00 H new ATOM 0 HA LYS A 27 9.287 -12.967 -12.438 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.675 -14.910 -10.125 1.00 0.00 H new ATOM 0 HB3 LYS A 27 8.125 -14.556 -10.863 1.00 0.00 H new ATOM 0 HG2 LYS A 27 8.905 -15.349 -13.052 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.551 -15.499 -12.468 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.611 -17.177 -10.715 1.00 0.00 H new ATOM 0 HD3 LYS A 27 8.136 -17.178 -11.662 1.00 0.00 H new ATOM 0 HE2 LYS A 27 10.924 -17.904 -12.674 1.00 0.00 H new ATOM 0 HE3 LYS A 27 9.617 -19.029 -12.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 9.533 -18.682 -14.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.329 -17.631 -14.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 9.846 -17.018 -14.506 1.00 0.00 H new ATOM 405 N TRP A 28 10.006 -11.915 -9.407 1.00 0.00 N ATOM 406 CA TRP A 28 9.721 -10.794 -8.524 1.00 0.00 C ATOM 407 C TRP A 28 9.797 -9.483 -9.304 1.00 0.00 C ATOM 408 O TRP A 28 8.862 -8.682 -9.248 1.00 0.00 O ATOM 409 CB TRP A 28 10.693 -10.779 -7.343 1.00 0.00 C ATOM 410 CG TRP A 28 10.754 -9.477 -6.607 1.00 0.00 C ATOM 411 CD1 TRP A 28 9.753 -8.935 -5.882 1.00 0.00 C ATOM 412 CD2 TRP A 28 11.867 -8.530 -6.515 1.00 0.00 C ATOM 413 NE1 TRP A 28 10.161 -7.725 -5.362 1.00 0.00 N ATOM 414 CE2 TRP A 28 11.463 -7.428 -5.710 1.00 0.00 C ATOM 415 CE3 TRP A 28 13.177 -8.495 -7.032 1.00 0.00 C ATOM 416 CZ2 TRP A 28 12.314 -6.352 -5.427 1.00 0.00 C ATOM 417 CZ3 TRP A 28 14.032 -7.416 -6.766 1.00 0.00 C ATOM 418 CH2 TRP A 28 13.608 -6.348 -5.965 1.00 0.00 C ATOM 0 H TRP A 28 10.794 -12.497 -9.124 1.00 0.00 H new ATOM 0 HA TRP A 28 8.712 -10.906 -8.128 1.00 0.00 H new ATOM 0 HB2 TRP A 28 10.407 -11.565 -6.643 1.00 0.00 H new ATOM 0 HB3 TRP A 28 11.691 -11.024 -7.707 1.00 0.00 H new ATOM 0 HD1 TRP A 28 8.781 -9.381 -5.732 1.00 0.00 H new ATOM 0 HE1 TRP A 28 9.571 -7.122 -4.789 1.00 0.00 H new ATOM 0 HE3 TRP A 28 13.529 -9.313 -7.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 11.978 -5.537 -4.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 15.028 -7.408 -7.183 1.00 0.00 H new ATOM 0 HH2 TRP A 28 14.276 -5.524 -5.763 1.00 0.00 H new ATOM 429 N LEU A 29 10.895 -9.257 -10.032 1.00 0.00 N ATOM 430 CA LEU A 29 11.043 -8.037 -10.811 1.00 0.00 C ATOM 431 C LEU A 29 9.940 -7.939 -11.860 1.00 0.00 C ATOM 432 O LEU A 29 9.403 -6.856 -12.079 1.00 0.00 O ATOM 433 CB LEU A 29 12.402 -8.031 -11.510 1.00 0.00 C ATOM 434 CG LEU A 29 13.555 -7.654 -10.586 1.00 0.00 C ATOM 435 CD1 LEU A 29 14.871 -7.990 -11.281 1.00 0.00 C ATOM 436 CD2 LEU A 29 13.523 -6.168 -10.229 1.00 0.00 C ATOM 0 H LEU A 29 11.684 -9.900 -10.094 1.00 0.00 H new ATOM 0 HA LEU A 29 10.972 -7.184 -10.136 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.591 -9.019 -11.930 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.370 -7.330 -12.344 1.00 0.00 H new ATOM 0 HG LEU A 29 13.459 -8.219 -9.659 1.00 0.00 H new ATOM 0 HD11 LEU A 29 15.704 -7.725 -10.630 1.00 0.00 H new ATOM 0 HD12 LEU A 29 14.906 -9.058 -11.498 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.945 -7.428 -12.212 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.359 -5.934 -9.569 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.602 -5.573 -11.139 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.586 -5.935 -9.724 1.00 0.00 H new ATOM 448 N LEU A 30 9.594 -9.054 -12.510 1.00 0.00 N ATOM 449 CA LEU A 30 8.558 -9.054 -13.526 1.00 0.00 C ATOM 450 C LEU A 30 7.193 -8.724 -12.921 1.00 0.00 C ATOM 451 O LEU A 30 6.280 -8.373 -13.664 1.00 0.00 O ATOM 452 CB LEU A 30 8.538 -10.421 -14.218 1.00 0.00 C ATOM 453 CG LEU A 30 9.384 -10.482 -15.483 1.00 0.00 C ATOM 454 CD1 LEU A 30 8.882 -9.503 -16.545 1.00 0.00 C ATOM 455 CD2 LEU A 30 10.849 -10.183 -15.213 1.00 0.00 C ATOM 0 H LEU A 30 10.022 -9.965 -12.345 1.00 0.00 H new ATOM 0 HA LEU A 30 8.777 -8.281 -14.262 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.893 -11.177 -13.518 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.508 -10.676 -14.468 1.00 0.00 H new ATOM 0 HG LEU A 30 9.290 -11.504 -15.849 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.510 -9.575 -17.433 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.853 -9.748 -16.808 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.924 -8.487 -16.152 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.410 -10.239 -16.146 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.944 -9.182 -14.792 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.245 -10.913 -14.507 1.00 0.00 H new ATOM 467 N LEU A 31 7.045 -8.829 -11.595 1.00 0.00 N ATOM 468 CA LEU A 31 5.862 -8.336 -10.899 1.00 0.00 C ATOM 469 C LEU A 31 6.013 -6.868 -10.504 1.00 0.00 C ATOM 470 O LEU A 31 5.013 -6.198 -10.247 1.00 0.00 O ATOM 471 CB LEU A 31 5.596 -9.198 -9.661 1.00 0.00 C ATOM 472 CG LEU A 31 5.071 -10.576 -10.066 1.00 0.00 C ATOM 473 CD1 LEU A 31 5.258 -11.542 -8.899 1.00 0.00 C ATOM 474 CD2 LEU A 31 3.590 -10.495 -10.429 1.00 0.00 C ATOM 0 H LEU A 31 7.740 -9.256 -10.982 1.00 0.00 H new ATOM 0 HA LEU A 31 5.013 -8.405 -11.579 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.514 -9.308 -9.084 1.00 0.00 H new ATOM 0 HB3 LEU A 31 4.871 -8.702 -9.015 1.00 0.00 H new ATOM 0 HG LEU A 31 5.625 -10.929 -10.936 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.886 -12.528 -9.179 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.317 -11.611 -8.650 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.705 -11.178 -8.033 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.231 -11.484 -10.715 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.024 -10.138 -9.569 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.457 -9.805 -11.263 1.00 0.00 H new ATOM 486 N GLN A 32 7.246 -6.350 -10.450 1.00 0.00 N ATOM 487 CA GLN A 32 7.487 -4.934 -10.186 1.00 0.00 C ATOM 488 C GLN A 32 7.397 -4.105 -11.470 1.00 0.00 C ATOM 489 O GLN A 32 8.047 -3.067 -11.586 1.00 0.00 O ATOM 490 CB GLN A 32 8.833 -4.702 -9.489 1.00 0.00 C ATOM 491 CG GLN A 32 9.066 -5.622 -8.291 1.00 0.00 C ATOM 492 CD GLN A 32 7.783 -5.923 -7.528 1.00 0.00 C ATOM 493 OE1 GLN A 32 7.178 -5.041 -6.921 1.00 0.00 O ATOM 494 NE2 GLN A 32 7.361 -7.182 -7.559 1.00 0.00 N ATOM 0 H GLN A 32 8.095 -6.898 -10.587 1.00 0.00 H new ATOM 0 HA GLN A 32 6.701 -4.601 -9.507 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.637 -4.848 -10.211 1.00 0.00 H new ATOM 0 HB3 GLN A 32 8.887 -3.665 -9.157 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.508 -6.557 -8.636 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.786 -5.159 -7.616 1.00 0.00 H new ATOM 0 HE21 GLN A 32 7.891 -7.885 -8.074 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.507 -7.446 -7.068 1.00 0.00 H new ATOM 503 N TYR A 33 6.592 -4.556 -12.440 1.00 0.00 N ATOM 504 CA TYR A 33 6.485 -3.929 -13.755 1.00 0.00 C ATOM 505 C TYR A 33 6.142 -2.441 -13.663 1.00 0.00 C ATOM 506 O TYR A 33 6.551 -1.655 -14.514 1.00 0.00 O ATOM 507 CB TYR A 33 5.400 -4.665 -14.544 1.00 0.00 C ATOM 508 CG TYR A 33 4.113 -4.890 -13.777 1.00 0.00 C ATOM 509 CD1 TYR A 33 3.883 -6.128 -13.159 1.00 0.00 C ATOM 510 CD2 TYR A 33 3.151 -3.872 -13.677 1.00 0.00 C ATOM 511 CE1 TYR A 33 2.711 -6.352 -12.425 1.00 0.00 C ATOM 512 CE2 TYR A 33 1.971 -4.089 -12.953 1.00 0.00 C ATOM 513 CZ TYR A 33 1.750 -5.327 -12.321 1.00 0.00 C ATOM 514 OH TYR A 33 0.604 -5.531 -11.612 1.00 0.00 O ATOM 0 H TYR A 33 5.993 -5.374 -12.329 1.00 0.00 H new ATOM 0 HA TYR A 33 7.451 -3.999 -14.255 1.00 0.00 H new ATOM 0 HB2 TYR A 33 5.176 -4.097 -15.447 1.00 0.00 H new ATOM 0 HB3 TYR A 33 5.792 -5.631 -14.864 1.00 0.00 H new ATOM 0 HD1 TYR A 33 4.616 -6.916 -13.250 1.00 0.00 H new ATOM 0 HD2 TYR A 33 3.321 -2.920 -14.159 1.00 0.00 H new ATOM 0 HE1 TYR A 33 2.545 -7.304 -11.942 1.00 0.00 H new ATOM 0 HE2 TYR A 33 1.231 -3.306 -12.880 1.00 0.00 H new ATOM 0 HH TYR A 33 0.052 -4.721 -11.642 1.00 0.00 H new ATOM 524 N ARG A 34 5.394 -2.072 -12.624 1.00 0.00 N ATOM 525 CA ARG A 34 4.972 -0.701 -12.354 1.00 0.00 C ATOM 526 C ARG A 34 6.142 0.192 -11.941 1.00 0.00 C ATOM 527 O ARG A 34 6.035 1.414 -12.004 1.00 0.00 O ATOM 528 CB ARG A 34 3.911 -0.711 -11.248 1.00 0.00 C ATOM 529 CG ARG A 34 4.243 -1.760 -10.183 1.00 0.00 C ATOM 530 CD ARG A 34 3.420 -1.568 -8.908 1.00 0.00 C ATOM 531 NE ARG A 34 3.416 -2.802 -8.111 1.00 0.00 N ATOM 532 CZ ARG A 34 4.502 -3.364 -7.566 1.00 0.00 C ATOM 533 NH1 ARG A 34 5.699 -2.781 -7.623 1.00 0.00 N1+ ATOM 534 NH2 ARG A 34 4.398 -4.540 -6.949 1.00 0.00 N ATOM 0 H ARG A 34 5.056 -2.738 -11.929 1.00 0.00 H new ATOM 0 HA ARG A 34 4.559 -0.288 -13.274 1.00 0.00 H new ATOM 0 HB2 ARG A 34 3.851 0.275 -10.787 1.00 0.00 H new ATOM 0 HB3 ARG A 34 2.932 -0.921 -11.679 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.059 -2.756 -10.586 1.00 0.00 H new ATOM 0 HG3 ARG A 34 5.304 -1.706 -9.940 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.834 -0.749 -8.320 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.398 -1.290 -9.166 1.00 0.00 H new ATOM 0 HE ARG A 34 2.519 -3.265 -7.962 1.00 0.00 H new ATOM 0 HH11 ARG A 34 5.806 -1.881 -8.092 1.00 0.00 H new ATOM 0 HH12 ARG A 34 6.508 -3.234 -7.198 1.00 0.00 H new ATOM 0 HH21 ARG A 34 3.494 -5.008 -6.893 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.223 -4.972 -6.532 1.00 0.00 H new ATOM 548 N ASP A 35 7.254 -0.412 -11.518 1.00 0.00 N ATOM 549 CA ASP A 35 8.411 0.296 -11.004 1.00 0.00 C ATOM 550 C ASP A 35 9.675 -0.010 -11.801 1.00 0.00 C ATOM 551 O ASP A 35 10.777 0.310 -11.372 1.00 0.00 O ATOM 552 CB ASP A 35 8.558 -0.027 -9.522 1.00 0.00 C ATOM 553 CG ASP A 35 7.345 0.480 -8.756 1.00 0.00 C ATOM 554 OD1 ASP A 35 6.590 -0.376 -8.242 1.00 0.00 O ATOM 555 OD2 ASP A 35 7.197 1.721 -8.699 1.00 0.00 O1- ATOM 0 H ASP A 35 7.370 -1.425 -11.526 1.00 0.00 H new ATOM 0 HA ASP A 35 8.259 1.369 -11.118 1.00 0.00 H new ATOM 0 HB2 ASP A 35 8.661 -1.103 -9.384 1.00 0.00 H new ATOM 0 HB3 ASP A 35 9.465 0.433 -9.129 1.00 0.00 H new ATOM 560 N ALA A 36 9.525 -0.634 -12.968 1.00 0.00 N ATOM 561 CA ALA A 36 10.644 -1.069 -13.796 1.00 0.00 C ATOM 562 C ALA A 36 11.692 0.026 -14.027 1.00 0.00 C ATOM 563 O ALA A 36 12.881 -0.290 -14.000 1.00 0.00 O ATOM 564 CB ALA A 36 10.098 -1.569 -15.132 1.00 0.00 C ATOM 0 H ALA A 36 8.613 -0.853 -13.368 1.00 0.00 H new ATOM 0 HA ALA A 36 11.159 -1.868 -13.262 1.00 0.00 H new ATOM 0 HB1 ALA A 36 10.924 -1.898 -15.762 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.419 -2.404 -14.958 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.560 -0.762 -15.630 1.00 0.00 H new ATOM 570 N PRO A 37 11.318 1.295 -14.251 1.00 0.00 N ATOM 571 CA PRO A 37 12.295 2.362 -14.397 1.00 0.00 C ATOM 572 C PRO A 37 13.102 2.537 -13.116 1.00 0.00 C ATOM 573 O PRO A 37 14.310 2.767 -13.173 1.00 0.00 O ATOM 574 CB PRO A 37 11.487 3.626 -14.704 1.00 0.00 C ATOM 575 CG PRO A 37 10.146 3.096 -15.208 1.00 0.00 C ATOM 576 CD PRO A 37 9.972 1.814 -14.398 1.00 0.00 C ATOM 0 HA PRO A 37 13.011 2.141 -15.188 1.00 0.00 H new ATOM 0 HB2 PRO A 37 11.363 4.245 -13.816 1.00 0.00 H new ATOM 0 HB3 PRO A 37 11.980 4.242 -15.456 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.336 3.803 -15.027 1.00 0.00 H new ATOM 0 HG3 PRO A 37 10.164 2.899 -16.280 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.516 2.015 -13.429 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.326 1.103 -14.913 1.00 0.00 H new ATOM 584 N LYS A 38 12.437 2.430 -11.959 1.00 0.00 N ATOM 585 CA LYS A 38 13.086 2.597 -10.666 1.00 0.00 C ATOM 586 C LYS A 38 14.152 1.527 -10.506 1.00 0.00 C ATOM 587 O LYS A 38 15.325 1.841 -10.312 1.00 0.00 O ATOM 588 CB LYS A 38 12.074 2.458 -9.521 1.00 0.00 C ATOM 589 CG LYS A 38 11.148 3.663 -9.344 1.00 0.00 C ATOM 590 CD LYS A 38 10.099 3.732 -10.457 1.00 0.00 C ATOM 591 CE LYS A 38 8.956 4.669 -10.072 1.00 0.00 C ATOM 592 NZ LYS A 38 8.209 4.167 -8.904 1.00 0.00 N1+ ATOM 0 H LYS A 38 11.439 2.226 -11.899 1.00 0.00 H new ATOM 0 HA LYS A 38 13.527 3.593 -10.626 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.466 1.571 -9.696 1.00 0.00 H new ATOM 0 HB3 LYS A 38 12.617 2.293 -8.591 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.650 3.602 -8.376 1.00 0.00 H new ATOM 0 HG3 LYS A 38 11.738 4.579 -9.341 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.564 4.079 -11.379 1.00 0.00 H new ATOM 0 HD3 LYS A 38 9.706 2.735 -10.654 1.00 0.00 H new ATOM 0 HE2 LYS A 38 9.356 5.659 -9.850 1.00 0.00 H new ATOM 0 HE3 LYS A 38 8.277 4.781 -10.917 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 7.270 4.614 -8.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.099 3.136 -8.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.730 4.397 -8.034 1.00 0.00 H new ATOM 606 N VAL A 39 13.734 0.260 -10.589 1.00 0.00 N ATOM 607 CA VAL A 39 14.629 -0.868 -10.391 1.00 0.00 C ATOM 608 C VAL A 39 15.733 -0.881 -11.448 1.00 0.00 C ATOM 609 O VAL A 39 16.813 -1.400 -11.185 1.00 0.00 O ATOM 610 CB VAL A 39 13.842 -2.191 -10.380 1.00 0.00 C ATOM 611 CG1 VAL A 39 13.788 -2.745 -8.956 1.00 0.00 C ATOM 612 CG2 VAL A 39 12.401 -2.044 -10.852 1.00 0.00 C ATOM 0 H VAL A 39 12.770 -0.004 -10.794 1.00 0.00 H new ATOM 0 HA VAL A 39 15.109 -0.759 -9.418 1.00 0.00 H new ATOM 0 HB VAL A 39 14.367 -2.855 -11.067 1.00 0.00 H new ATOM 0 HG11 VAL A 39 13.230 -3.682 -8.951 1.00 0.00 H new ATOM 0 HG12 VAL A 39 14.801 -2.924 -8.597 1.00 0.00 H new ATOM 0 HG13 VAL A 39 13.294 -2.025 -8.304 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.906 -3.015 -10.818 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.874 -1.346 -10.201 1.00 0.00 H new ATOM 0 HG23 VAL A 39 12.390 -1.666 -11.874 1.00 0.00 H new ATOM 622 N ALA A 40 15.484 -0.319 -12.635 1.00 0.00 N ATOM 623 CA ALA A 40 16.496 -0.268 -13.680 1.00 0.00 C ATOM 624 C ALA A 40 17.656 0.641 -13.307 1.00 0.00 C ATOM 625 O ALA A 40 18.812 0.272 -13.513 1.00 0.00 O ATOM 626 CB ALA A 40 15.853 0.204 -14.979 1.00 0.00 C ATOM 0 H ALA A 40 14.592 0.104 -12.890 1.00 0.00 H new ATOM 0 HA ALA A 40 16.903 -1.271 -13.808 1.00 0.00 H new ATOM 0 HB1 ALA A 40 16.607 0.244 -15.765 1.00 0.00 H new ATOM 0 HB2 ALA A 40 15.064 -0.491 -15.268 1.00 0.00 H new ATOM 0 HB3 ALA A 40 15.427 1.197 -14.834 1.00 0.00 H new ATOM 632 N GLU A 41 17.369 1.827 -12.760 1.00 0.00 N ATOM 633 CA GLU A 41 18.452 2.701 -12.348 1.00 0.00 C ATOM 634 C GLU A 41 19.181 2.112 -11.137 1.00 0.00 C ATOM 635 O GLU A 41 20.384 2.327 -10.982 1.00 0.00 O ATOM 636 CB GLU A 41 17.930 4.112 -12.066 1.00 0.00 C ATOM 637 CG GLU A 41 17.146 4.698 -13.248 1.00 0.00 C ATOM 638 CD GLU A 41 17.753 4.369 -14.611 1.00 0.00 C ATOM 639 OE1 GLU A 41 18.995 4.462 -14.732 1.00 0.00 O ATOM 640 OE2 GLU A 41 16.961 4.024 -15.520 1.00 0.00 O1- ATOM 0 H GLU A 41 16.428 2.187 -12.600 1.00 0.00 H new ATOM 0 HA GLU A 41 19.172 2.778 -13.163 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.289 4.089 -11.185 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.770 4.766 -11.832 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.123 4.323 -13.216 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.092 5.781 -13.136 1.00 0.00 H new ATOM 647 N MET A 42 18.478 1.368 -10.272 1.00 0.00 N ATOM 648 CA MET A 42 19.146 0.701 -9.162 1.00 0.00 C ATOM 649 C MET A 42 19.973 -0.475 -9.669 1.00 0.00 C ATOM 650 O MET A 42 21.032 -0.769 -9.118 1.00 0.00 O ATOM 651 CB MET A 42 18.148 0.179 -8.130 1.00 0.00 C ATOM 652 CG MET A 42 17.142 1.233 -7.674 1.00 0.00 C ATOM 653 SD MET A 42 16.541 0.966 -5.987 1.00 0.00 S ATOM 654 CE MET A 42 16.172 -0.804 -6.070 1.00 0.00 C ATOM 0 H MET A 42 17.470 1.219 -10.322 1.00 0.00 H new ATOM 0 HA MET A 42 19.790 1.442 -8.688 1.00 0.00 H new ATOM 0 HB2 MET A 42 17.609 -0.669 -8.553 1.00 0.00 H new ATOM 0 HB3 MET A 42 18.694 -0.191 -7.262 1.00 0.00 H new ATOM 0 HG2 MET A 42 17.605 2.218 -7.736 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.294 1.236 -8.358 1.00 0.00 H new ATOM 0 HE1 MET A 42 15.306 -1.025 -5.447 1.00 0.00 H new ATOM 0 HE2 MET A 42 15.957 -1.083 -7.102 1.00 0.00 H new ATOM 0 HE3 MET A 42 17.031 -1.372 -5.712 1.00 0.00 H new ATOM 664 N TRP A 43 19.497 -1.157 -10.719 1.00 0.00 N ATOM 665 CA TRP A 43 20.194 -2.299 -11.283 1.00 0.00 C ATOM 666 C TRP A 43 21.584 -1.885 -11.736 1.00 0.00 C ATOM 667 O TRP A 43 22.569 -2.518 -11.356 1.00 0.00 O ATOM 668 CB TRP A 43 19.407 -2.865 -12.464 1.00 0.00 C ATOM 669 CG TRP A 43 20.055 -4.021 -13.153 1.00 0.00 C ATOM 670 CD1 TRP A 43 20.305 -5.225 -12.591 1.00 0.00 C ATOM 671 CD2 TRP A 43 20.547 -4.113 -14.526 1.00 0.00 C ATOM 672 NE1 TRP A 43 20.912 -6.051 -13.515 1.00 0.00 N ATOM 673 CE2 TRP A 43 21.108 -5.405 -14.719 1.00 0.00 C ATOM 674 CE3 TRP A 43 20.570 -3.238 -15.628 1.00 0.00 C ATOM 675 CZ2 TRP A 43 21.689 -5.795 -15.932 1.00 0.00 C ATOM 676 CZ3 TRP A 43 21.134 -3.624 -16.851 1.00 0.00 C ATOM 677 CH2 TRP A 43 21.702 -4.897 -17.005 1.00 0.00 C ATOM 0 H TRP A 43 18.623 -0.927 -11.192 1.00 0.00 H new ATOM 0 HA TRP A 43 20.284 -3.070 -10.518 1.00 0.00 H new ATOM 0 HB2 TRP A 43 18.423 -3.175 -12.112 1.00 0.00 H new ATOM 0 HB3 TRP A 43 19.248 -2.069 -13.192 1.00 0.00 H new ATOM 0 HD1 TRP A 43 20.066 -5.499 -11.574 1.00 0.00 H new ATOM 0 HE1 TRP A 43 21.182 -7.017 -13.331 1.00 0.00 H new ATOM 0 HE3 TRP A 43 20.145 -2.250 -15.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 22.122 -6.778 -16.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 21.131 -2.935 -17.683 1.00 0.00 H new ATOM 0 HH2 TRP A 43 22.147 -5.183 -17.947 1.00 0.00 H new ATOM 688 N LYS A 44 21.661 -0.824 -12.546 1.00 0.00 N ATOM 689 CA LYS A 44 22.958 -0.362 -13.003 1.00 0.00 C ATOM 690 C LYS A 44 23.802 0.092 -11.817 1.00 0.00 C ATOM 691 O LYS A 44 24.984 -0.226 -11.760 1.00 0.00 O ATOM 692 CB LYS A 44 22.816 0.711 -14.081 1.00 0.00 C ATOM 693 CG LYS A 44 22.362 2.077 -13.575 1.00 0.00 C ATOM 694 CD LYS A 44 22.398 3.028 -14.769 1.00 0.00 C ATOM 695 CE LYS A 44 22.333 4.484 -14.320 1.00 0.00 C ATOM 696 NZ LYS A 44 22.690 5.382 -15.435 1.00 0.00 N1+ ATOM 0 H LYS A 44 20.862 -0.289 -12.886 1.00 0.00 H new ATOM 0 HA LYS A 44 23.485 -1.191 -13.474 1.00 0.00 H new ATOM 0 HB2 LYS A 44 23.775 0.827 -14.585 1.00 0.00 H new ATOM 0 HB3 LYS A 44 22.103 0.362 -14.828 1.00 0.00 H new ATOM 0 HG2 LYS A 44 21.357 2.019 -13.158 1.00 0.00 H new ATOM 0 HG3 LYS A 44 23.018 2.431 -12.779 1.00 0.00 H new ATOM 0 HD2 LYS A 44 23.311 2.862 -15.341 1.00 0.00 H new ATOM 0 HD3 LYS A 44 21.561 2.812 -15.434 1.00 0.00 H new ATOM 0 HE2 LYS A 44 21.330 4.717 -13.964 1.00 0.00 H new ATOM 0 HE3 LYS A 44 23.013 4.644 -13.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 22.357 6.345 -15.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 23.723 5.392 -15.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 22.242 5.043 -16.310 1.00 0.00 H new ATOM 710 N GLU A 45 23.216 0.829 -10.870 1.00 0.00 N ATOM 711 CA GLU A 45 23.963 1.292 -9.710 1.00 0.00 C ATOM 712 C GLU A 45 24.603 0.113 -8.989 1.00 0.00 C ATOM 713 O GLU A 45 25.789 0.165 -8.679 1.00 0.00 O ATOM 714 CB GLU A 45 23.022 2.044 -8.766 1.00 0.00 C ATOM 715 CG GLU A 45 22.845 3.492 -9.221 1.00 0.00 C ATOM 716 CD GLU A 45 24.101 4.312 -8.948 1.00 0.00 C ATOM 717 OE1 GLU A 45 24.476 5.102 -9.843 1.00 0.00 O ATOM 718 OE2 GLU A 45 24.667 4.132 -7.846 1.00 0.00 O1- ATOM 0 H GLU A 45 22.236 1.113 -10.887 1.00 0.00 H new ATOM 0 HA GLU A 45 24.755 1.965 -10.038 1.00 0.00 H new ATOM 0 HB2 GLU A 45 22.053 1.546 -8.737 1.00 0.00 H new ATOM 0 HB3 GLU A 45 23.422 2.022 -7.752 1.00 0.00 H new ATOM 0 HG2 GLU A 45 22.616 3.516 -10.286 1.00 0.00 H new ATOM 0 HG3 GLU A 45 21.996 3.938 -8.702 1.00 0.00 H new ATOM 725 N TYR A 46 23.828 -0.941 -8.723 1.00 0.00 N ATOM 726 CA TYR A 46 24.310 -2.107 -8.005 1.00 0.00 C ATOM 727 C TYR A 46 25.547 -2.704 -8.670 1.00 0.00 C ATOM 728 O TYR A 46 26.599 -2.816 -8.040 1.00 0.00 O ATOM 729 CB TYR A 46 23.195 -3.155 -7.950 1.00 0.00 C ATOM 730 CG TYR A 46 23.723 -4.570 -7.912 1.00 0.00 C ATOM 731 CD1 TYR A 46 23.771 -5.317 -9.097 1.00 0.00 C ATOM 732 CD2 TYR A 46 24.171 -5.130 -6.710 1.00 0.00 C ATOM 733 CE1 TYR A 46 24.307 -6.611 -9.096 1.00 0.00 C ATOM 734 CE2 TYR A 46 24.688 -6.433 -6.696 1.00 0.00 C ATOM 735 CZ TYR A 46 24.759 -7.179 -7.890 1.00 0.00 C ATOM 736 OH TYR A 46 25.266 -8.443 -7.869 1.00 0.00 O ATOM 0 H TYR A 46 22.849 -1.003 -9.003 1.00 0.00 H new ATOM 0 HA TYR A 46 24.591 -1.800 -6.998 1.00 0.00 H new ATOM 0 HB2 TYR A 46 22.579 -2.978 -7.068 1.00 0.00 H new ATOM 0 HB3 TYR A 46 22.548 -3.037 -8.819 1.00 0.00 H new ATOM 0 HD1 TYR A 46 23.393 -4.893 -10.015 1.00 0.00 H new ATOM 0 HD2 TYR A 46 24.118 -4.559 -5.795 1.00 0.00 H new ATOM 0 HE1 TYR A 46 24.373 -7.171 -10.017 1.00 0.00 H new ATOM 0 HE2 TYR A 46 25.033 -6.866 -5.769 1.00 0.00 H new ATOM 0 HH TYR A 46 25.230 -8.825 -8.771 1.00 0.00 H new ATOM 746 N MET A 47 25.422 -3.087 -9.941 1.00 0.00 N ATOM 747 CA MET A 47 26.500 -3.746 -10.654 1.00 0.00 C ATOM 748 C MET A 47 27.648 -2.791 -10.971 1.00 0.00 C ATOM 749 O MET A 47 28.779 -3.231 -11.150 1.00 0.00 O ATOM 750 CB MET A 47 25.918 -4.368 -11.915 1.00 0.00 C ATOM 751 CG MET A 47 25.318 -3.308 -12.837 1.00 0.00 C ATOM 752 SD MET A 47 24.080 -3.992 -13.955 1.00 0.00 S ATOM 753 CE MET A 47 25.087 -5.346 -14.592 1.00 0.00 C ATOM 0 H MET A 47 24.577 -2.948 -10.495 1.00 0.00 H new ATOM 0 HA MET A 47 26.932 -4.523 -10.023 1.00 0.00 H new ATOM 0 HB2 MET A 47 26.698 -4.914 -12.446 1.00 0.00 H new ATOM 0 HB3 MET A 47 25.150 -5.092 -11.644 1.00 0.00 H new ATOM 0 HG2 MET A 47 24.864 -2.521 -12.235 1.00 0.00 H new ATOM 0 HG3 MET A 47 26.114 -2.845 -13.420 1.00 0.00 H new ATOM 0 HE1 MET A 47 24.728 -5.633 -15.580 1.00 0.00 H new ATOM 0 HE2 MET A 47 26.126 -5.025 -14.662 1.00 0.00 H new ATOM 0 HE3 MET A 47 25.016 -6.200 -13.919 1.00 0.00 H new ATOM 763 N LEU A 48 27.373 -1.488 -11.043 1.00 0.00 N ATOM 764 CA LEU A 48 28.433 -0.500 -11.181 1.00 0.00 C ATOM 765 C LEU A 48 29.246 -0.358 -9.891 1.00 0.00 C ATOM 766 O LEU A 48 30.386 0.094 -9.963 1.00 0.00 O ATOM 767 CB LEU A 48 27.836 0.840 -11.610 1.00 0.00 C ATOM 768 CG LEU A 48 27.365 0.797 -13.068 1.00 0.00 C ATOM 769 CD1 LEU A 48 26.515 2.030 -13.381 1.00 0.00 C ATOM 770 CD2 LEU A 48 28.548 0.769 -14.037 1.00 0.00 C ATOM 0 H LEU A 48 26.431 -1.098 -11.008 1.00 0.00 H new ATOM 0 HA LEU A 48 29.124 -0.841 -11.952 1.00 0.00 H new ATOM 0 HB2 LEU A 48 26.997 1.091 -10.961 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.580 1.628 -11.489 1.00 0.00 H new ATOM 0 HG LEU A 48 26.779 -0.113 -13.194 1.00 0.00 H new ATOM 0 HD11 LEU A 48 26.185 1.990 -14.419 1.00 0.00 H new ATOM 0 HD12 LEU A 48 25.645 2.049 -12.724 1.00 0.00 H new ATOM 0 HD13 LEU A 48 27.108 2.931 -13.223 1.00 0.00 H new ATOM 0 HD21 LEU A 48 28.178 0.739 -15.062 1.00 0.00 H new ATOM 0 HD22 LEU A 48 29.155 1.664 -13.896 1.00 0.00 H new ATOM 0 HD23 LEU A 48 29.155 -0.115 -13.844 1.00 0.00 H new ATOM 782 N ARG A 49 28.704 -0.723 -8.719 1.00 0.00 N ATOM 783 CA ARG A 49 29.501 -0.668 -7.498 1.00 0.00 C ATOM 784 C ARG A 49 30.609 -1.715 -7.553 1.00 0.00 C ATOM 785 O ARG A 49 30.331 -2.874 -7.842 1.00 0.00 O ATOM 786 CB ARG A 49 28.661 -0.907 -6.236 1.00 0.00 C ATOM 787 CG ARG A 49 27.355 -0.120 -6.224 1.00 0.00 C ATOM 788 CD ARG A 49 26.856 0.084 -4.793 1.00 0.00 C ATOM 789 NE ARG A 49 25.462 0.557 -4.739 1.00 0.00 N ATOM 790 CZ ARG A 49 24.964 1.636 -5.358 1.00 0.00 C ATOM 791 NH1 ARG A 49 25.720 2.409 -6.135 1.00 0.00 N1+ ATOM 792 NH2 ARG A 49 23.678 1.943 -5.195 1.00 0.00 N ATOM 0 H ARG A 49 27.745 -1.049 -8.597 1.00 0.00 H new ATOM 0 HA ARG A 49 29.920 0.336 -7.440 1.00 0.00 H new ATOM 0 HB2 ARG A 49 28.437 -1.971 -6.153 1.00 0.00 H new ATOM 0 HB3 ARG A 49 29.249 -0.635 -5.359 1.00 0.00 H new ATOM 0 HG2 ARG A 49 27.504 0.848 -6.703 1.00 0.00 H new ATOM 0 HG3 ARG A 49 26.600 -0.650 -6.805 1.00 0.00 H new ATOM 0 HD2 ARG A 49 26.938 -0.856 -4.247 1.00 0.00 H new ATOM 0 HD3 ARG A 49 27.499 0.804 -4.287 1.00 0.00 H new ATOM 0 HE ARG A 49 24.812 0.009 -4.175 1.00 0.00 H new ATOM 0 HH11 ARG A 49 26.706 2.186 -6.272 1.00 0.00 H new ATOM 0 HH12 ARG A 49 25.313 3.224 -6.594 1.00 0.00 H new ATOM 0 HH21 ARG A 49 23.085 1.359 -4.605 1.00 0.00 H new ATOM 0 HH22 ARG A 49 23.286 2.762 -5.660 1.00 0.00 H new ATOM 806 N PRO A 50 31.861 -1.335 -7.280 1.00 0.00 N ATOM 807 CA PRO A 50 32.955 -2.271 -7.138 1.00 0.00 C ATOM 808 C PRO A 50 32.998 -2.864 -5.732 1.00 0.00 C ATOM 809 O PRO A 50 33.898 -3.644 -5.424 1.00 0.00 O ATOM 810 CB PRO A 50 34.206 -1.435 -7.391 1.00 0.00 C ATOM 811 CG PRO A 50 33.817 -0.087 -6.779 1.00 0.00 C ATOM 812 CD PRO A 50 32.324 0.026 -7.095 1.00 0.00 C ATOM 0 HA PRO A 50 32.859 -3.113 -7.824 1.00 0.00 H new ATOM 0 HB2 PRO A 50 35.086 -1.862 -6.911 1.00 0.00 H new ATOM 0 HB3 PRO A 50 34.432 -1.350 -8.454 1.00 0.00 H new ATOM 0 HG2 PRO A 50 34.004 -0.064 -5.705 1.00 0.00 H new ATOM 0 HG3 PRO A 50 34.384 0.733 -7.219 1.00 0.00 H new ATOM 0 HD2 PRO A 50 31.787 0.516 -6.282 1.00 0.00 H new ATOM 0 HD3 PRO A 50 32.157 0.622 -7.992 1.00 0.00 H new ATOM 820 N SER A 51 32.038 -2.504 -4.874 1.00 0.00 N ATOM 821 CA SER A 51 31.928 -3.124 -3.564 1.00 0.00 C ATOM 822 C SER A 51 31.535 -4.589 -3.733 1.00 0.00 C ATOM 823 O SER A 51 31.504 -5.344 -2.763 1.00 0.00 O ATOM 824 CB SER A 51 30.892 -2.379 -2.728 1.00 0.00 C ATOM 825 OG SER A 51 29.628 -2.448 -3.355 1.00 0.00 O ATOM 0 H SER A 51 31.334 -1.791 -5.067 1.00 0.00 H new ATOM 0 HA SER A 51 32.887 -3.074 -3.047 1.00 0.00 H new ATOM 0 HB2 SER A 51 30.837 -2.814 -1.730 1.00 0.00 H new ATOM 0 HB3 SER A 51 31.191 -1.338 -2.606 1.00 0.00 H new ATOM 0 HG SER A 51 28.967 -1.969 -2.812 1.00 0.00 H new ATOM 831 N VAL A 52 31.237 -4.983 -4.976 1.00 0.00 N ATOM 832 CA VAL A 52 30.922 -6.352 -5.345 1.00 0.00 C ATOM 833 C VAL A 52 31.828 -6.783 -6.505 1.00 0.00 C ATOM 834 O VAL A 52 32.217 -5.964 -7.333 1.00 0.00 O ATOM 835 CB VAL A 52 29.436 -6.457 -5.694 1.00 0.00 C ATOM 836 CG1 VAL A 52 28.599 -6.583 -4.418 1.00 0.00 C ATOM 837 CG2 VAL A 52 28.921 -5.273 -6.508 1.00 0.00 C ATOM 0 H VAL A 52 31.210 -4.338 -5.766 1.00 0.00 H new ATOM 0 HA VAL A 52 31.109 -7.029 -4.511 1.00 0.00 H new ATOM 0 HB VAL A 52 29.334 -7.349 -6.312 1.00 0.00 H new ATOM 0 HG11 VAL A 52 27.544 -6.657 -4.681 1.00 0.00 H new ATOM 0 HG12 VAL A 52 28.900 -7.477 -3.872 1.00 0.00 H new ATOM 0 HG13 VAL A 52 28.756 -5.705 -3.792 1.00 0.00 H new ATOM 0 HG21 VAL A 52 27.861 -5.411 -6.721 1.00 0.00 H new ATOM 0 HG22 VAL A 52 29.060 -4.353 -5.940 1.00 0.00 H new ATOM 0 HG23 VAL A 52 29.474 -5.208 -7.445 1.00 0.00 H new ATOM 847 N ASN A 53 32.166 -8.078 -6.561 1.00 0.00 N ATOM 848 CA ASN A 53 33.072 -8.623 -7.571 1.00 0.00 C ATOM 849 C ASN A 53 32.376 -8.910 -8.905 1.00 0.00 C ATOM 850 O ASN A 53 31.153 -8.839 -9.006 1.00 0.00 O ATOM 851 CB ASN A 53 33.751 -9.891 -7.041 1.00 0.00 C ATOM 852 CG ASN A 53 32.812 -11.066 -6.802 1.00 0.00 C ATOM 853 OD1 ASN A 53 31.503 -10.854 -6.928 1.00 0.00 O flip ATOM 854 ND2 ASN A 53 33.261 -12.166 -6.505 1.00 0.00 N flip ATOM 0 H ASN A 53 31.816 -8.776 -5.904 1.00 0.00 H new ATOM 0 HA ASN A 53 33.824 -7.859 -7.768 1.00 0.00 H new ATOM 0 HB2 ASN A 53 34.521 -10.197 -7.750 1.00 0.00 H new ATOM 0 HB3 ASN A 53 34.256 -9.652 -6.105 1.00 0.00 H new ATOM 0 HD21 ASN A 53 34.268 -12.298 -6.416 1.00 0.00 H new ATOM 0 HD22 ASN A 53 32.628 -12.950 -6.347 1.00 0.00 H new ATOM 861 N THR A 54 33.172 -9.238 -9.930 1.00 0.00 N ATOM 862 CA THR A 54 32.681 -9.513 -11.272 1.00 0.00 C ATOM 863 C THR A 54 31.618 -10.607 -11.272 1.00 0.00 C ATOM 864 O THR A 54 30.718 -10.580 -12.106 1.00 0.00 O ATOM 865 CB THR A 54 33.856 -9.947 -12.152 1.00 0.00 C ATOM 866 OG1 THR A 54 34.433 -11.130 -11.645 1.00 0.00 O ATOM 867 CG2 THR A 54 34.919 -8.854 -12.220 1.00 0.00 C ATOM 0 H THR A 54 34.185 -9.319 -9.843 1.00 0.00 H new ATOM 0 HA THR A 54 32.224 -8.603 -11.661 1.00 0.00 H new ATOM 0 HB THR A 54 33.474 -10.129 -13.157 1.00 0.00 H new ATOM 0 HG1 THR A 54 35.182 -11.399 -12.216 1.00 0.00 H new ATOM 0 HG21 THR A 54 35.743 -9.187 -12.851 1.00 0.00 H new ATOM 0 HG22 THR A 54 34.483 -7.948 -12.641 1.00 0.00 H new ATOM 0 HG23 THR A 54 35.291 -8.646 -11.217 1.00 0.00 H new ATOM 875 N ARG A 55 31.709 -11.570 -10.349 1.00 0.00 N ATOM 876 CA ARG A 55 30.714 -12.628 -10.261 1.00 0.00 C ATOM 877 C ARG A 55 29.350 -12.061 -9.864 1.00 0.00 C ATOM 878 O ARG A 55 28.331 -12.531 -10.354 1.00 0.00 O ATOM 879 CB ARG A 55 31.174 -13.695 -9.266 1.00 0.00 C ATOM 880 CG ARG A 55 32.435 -14.436 -9.735 1.00 0.00 C ATOM 881 CD ARG A 55 32.323 -15.016 -11.149 1.00 0.00 C ATOM 882 NE ARG A 55 31.198 -15.950 -11.290 1.00 0.00 N ATOM 883 CZ ARG A 55 31.192 -17.034 -12.076 1.00 0.00 C ATOM 884 NH1 ARG A 55 32.264 -17.392 -12.781 1.00 0.00 N1+ ATOM 885 NH2 ARG A 55 30.086 -17.768 -12.153 1.00 0.00 N ATOM 0 H ARG A 55 32.458 -11.633 -9.660 1.00 0.00 H new ATOM 0 HA ARG A 55 30.607 -13.090 -11.242 1.00 0.00 H new ATOM 0 HB2 ARG A 55 31.370 -13.227 -8.301 1.00 0.00 H new ATOM 0 HB3 ARG A 55 30.370 -14.415 -9.113 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.282 -13.751 -9.700 1.00 0.00 H new ATOM 0 HG3 ARG A 55 32.650 -15.245 -9.037 1.00 0.00 H new ATOM 0 HD2 ARG A 55 32.205 -14.201 -11.863 1.00 0.00 H new ATOM 0 HD3 ARG A 55 33.251 -15.530 -11.401 1.00 0.00 H new ATOM 0 HE ARG A 55 30.356 -15.758 -10.747 1.00 0.00 H new ATOM 0 HH11 ARG A 55 33.117 -16.835 -12.730 1.00 0.00 H new ATOM 0 HH12 ARG A 55 32.232 -18.223 -13.372 1.00 0.00 H new ATOM 0 HH21 ARG A 55 29.259 -17.502 -11.618 1.00 0.00 H new ATOM 0 HH22 ARG A 55 30.064 -18.597 -12.747 1.00 0.00 H new ATOM 899 N ARG A 56 29.317 -11.055 -8.984 1.00 0.00 N ATOM 900 CA ARG A 56 28.070 -10.412 -8.570 1.00 0.00 C ATOM 901 C ARG A 56 27.471 -9.638 -9.743 1.00 0.00 C ATOM 902 O ARG A 56 26.253 -9.650 -9.940 1.00 0.00 O ATOM 903 CB ARG A 56 28.356 -9.487 -7.388 1.00 0.00 C ATOM 904 CG ARG A 56 28.539 -10.273 -6.086 1.00 0.00 C ATOM 905 CD ARG A 56 27.188 -10.617 -5.458 1.00 0.00 C ATOM 906 NE ARG A 56 27.373 -11.411 -4.238 1.00 0.00 N ATOM 907 CZ ARG A 56 26.581 -12.417 -3.842 1.00 0.00 C ATOM 908 NH1 ARG A 56 25.488 -12.752 -4.529 1.00 0.00 N1+ ATOM 909 NH2 ARG A 56 26.884 -13.097 -2.738 1.00 0.00 N ATOM 0 H ARG A 56 30.150 -10.667 -8.542 1.00 0.00 H new ATOM 0 HA ARG A 56 27.345 -11.165 -8.260 1.00 0.00 H new ATOM 0 HB2 ARG A 56 29.255 -8.904 -7.591 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.536 -8.778 -7.273 1.00 0.00 H new ATOM 0 HG2 ARG A 56 29.095 -11.189 -6.285 1.00 0.00 H new ATOM 0 HG3 ARG A 56 29.132 -9.687 -5.384 1.00 0.00 H new ATOM 0 HD2 ARG A 56 26.646 -9.701 -5.223 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.580 -11.173 -6.172 1.00 0.00 H new ATOM 0 HE ARG A 56 28.168 -11.179 -3.643 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.240 -12.239 -5.375 1.00 0.00 H new ATOM 0 HH12 ARG A 56 24.900 -13.521 -4.209 1.00 0.00 H new ATOM 0 HH21 ARG A 56 27.715 -12.851 -2.199 1.00 0.00 H new ATOM 0 HH22 ARG A 56 26.286 -13.864 -2.431 1.00 0.00 H new ATOM 923 N LYS A 57 28.326 -8.966 -10.523 1.00 0.00 N ATOM 924 CA LYS A 57 27.890 -8.298 -11.743 1.00 0.00 C ATOM 925 C LYS A 57 27.306 -9.334 -12.696 1.00 0.00 C ATOM 926 O LYS A 57 26.332 -9.052 -13.385 1.00 0.00 O ATOM 927 CB LYS A 57 29.065 -7.567 -12.401 1.00 0.00 C ATOM 928 CG LYS A 57 29.396 -6.248 -11.696 1.00 0.00 C ATOM 929 CD LYS A 57 30.213 -6.430 -10.416 1.00 0.00 C ATOM 930 CE LYS A 57 30.498 -5.078 -9.769 1.00 0.00 C ATOM 931 NZ LYS A 57 31.287 -4.197 -10.642 1.00 0.00 N1+ ATOM 0 H LYS A 57 29.323 -8.874 -10.326 1.00 0.00 H new ATOM 0 HA LYS A 57 27.127 -7.559 -11.500 1.00 0.00 H new ATOM 0 HB2 LYS A 57 29.943 -8.212 -12.391 1.00 0.00 H new ATOM 0 HB3 LYS A 57 28.827 -7.368 -13.446 1.00 0.00 H new ATOM 0 HG2 LYS A 57 29.949 -5.607 -12.383 1.00 0.00 H new ATOM 0 HG3 LYS A 57 28.467 -5.731 -11.455 1.00 0.00 H new ATOM 0 HD2 LYS A 57 29.670 -7.067 -9.718 1.00 0.00 H new ATOM 0 HD3 LYS A 57 31.151 -6.936 -10.645 1.00 0.00 H new ATOM 0 HE2 LYS A 57 29.555 -4.590 -9.521 1.00 0.00 H new ATOM 0 HE3 LYS A 57 31.033 -5.232 -8.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 31.412 -3.273 -10.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 32.218 -4.625 -10.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 30.790 -4.068 -11.546 1.00 0.00 H new ATOM 945 N LEU A 58 27.904 -10.529 -12.727 1.00 0.00 N ATOM 946 CA LEU A 58 27.448 -11.626 -13.564 1.00 0.00 C ATOM 947 C LEU A 58 26.072 -12.130 -13.123 1.00 0.00 C ATOM 948 O LEU A 58 25.296 -12.588 -13.958 1.00 0.00 O ATOM 949 CB LEU A 58 28.506 -12.733 -13.508 1.00 0.00 C ATOM 950 CG LEU A 58 28.295 -13.837 -14.544 1.00 0.00 C ATOM 951 CD1 LEU A 58 28.585 -13.314 -15.949 1.00 0.00 C ATOM 952 CD2 LEU A 58 29.257 -14.972 -14.210 1.00 0.00 C ATOM 0 H LEU A 58 28.724 -10.757 -12.165 1.00 0.00 H new ATOM 0 HA LEU A 58 27.328 -11.287 -14.593 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.491 -12.290 -13.657 1.00 0.00 H new ATOM 0 HB3 LEU A 58 28.503 -13.176 -12.512 1.00 0.00 H new ATOM 0 HG LEU A 58 27.261 -14.182 -14.519 1.00 0.00 H new ATOM 0 HD11 LEU A 58 28.430 -14.113 -16.674 1.00 0.00 H new ATOM 0 HD12 LEU A 58 27.915 -12.485 -16.174 1.00 0.00 H new ATOM 0 HD13 LEU A 58 29.618 -12.970 -16.003 1.00 0.00 H new ATOM 0 HD21 LEU A 58 29.132 -15.779 -14.932 1.00 0.00 H new ATOM 0 HD22 LEU A 58 30.282 -14.604 -14.251 1.00 0.00 H new ATOM 0 HD23 LEU A 58 29.045 -15.346 -13.208 1.00 0.00 H new ATOM 964 N LEU A 59 25.757 -12.053 -11.824 1.00 0.00 N ATOM 965 CA LEU A 59 24.444 -12.457 -11.340 1.00 0.00 C ATOM 966 C LEU A 59 23.381 -11.533 -11.905 1.00 0.00 C ATOM 967 O LEU A 59 22.496 -11.974 -12.634 1.00 0.00 O ATOM 968 CB LEU A 59 24.355 -12.414 -9.815 1.00 0.00 C ATOM 969 CG LEU A 59 25.484 -13.163 -9.120 1.00 0.00 C ATOM 970 CD1 LEU A 59 25.164 -13.230 -7.631 1.00 0.00 C ATOM 971 CD2 LEU A 59 25.630 -14.565 -9.687 1.00 0.00 C ATOM 0 H LEU A 59 26.392 -11.717 -11.100 1.00 0.00 H new ATOM 0 HA LEU A 59 24.284 -13.484 -11.669 1.00 0.00 H new ATOM 0 HB2 LEU A 59 24.364 -11.374 -9.488 1.00 0.00 H new ATOM 0 HB3 LEU A 59 23.401 -12.839 -9.502 1.00 0.00 H new ATOM 0 HG LEU A 59 26.426 -12.640 -9.282 1.00 0.00 H new ATOM 0 HD11 LEU A 59 25.960 -13.763 -7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 59 25.082 -12.220 -7.231 1.00 0.00 H new ATOM 0 HD13 LEU A 59 24.220 -13.755 -7.485 1.00 0.00 H new ATOM 0 HD21 LEU A 59 26.442 -15.081 -9.176 1.00 0.00 H new ATOM 0 HD22 LEU A 59 24.701 -15.115 -9.540 1.00 0.00 H new ATOM 0 HD23 LEU A 59 25.852 -14.505 -10.753 1.00 0.00 H new ATOM 983 N GLY A 60 23.474 -10.245 -11.561 1.00 0.00 N ATOM 984 CA GLY A 60 22.539 -9.263 -12.077 1.00 0.00 C ATOM 985 C GLY A 60 22.514 -9.236 -13.607 1.00 0.00 C ATOM 986 O GLY A 60 21.513 -8.833 -14.193 1.00 0.00 O ATOM 0 H GLY A 60 24.184 -9.868 -10.932 1.00 0.00 H new ATOM 0 HA2 GLY A 60 21.539 -9.484 -11.703 1.00 0.00 H new ATOM 0 HA3 GLY A 60 22.808 -8.275 -11.702 1.00 0.00 H new ATOM 990 N LEU A 61 23.604 -9.663 -14.257 1.00 0.00 N ATOM 991 CA LEU A 61 23.676 -9.759 -15.703 1.00 0.00 C ATOM 992 C LEU A 61 22.767 -10.880 -16.202 1.00 0.00 C ATOM 993 O LEU A 61 21.953 -10.661 -17.096 1.00 0.00 O ATOM 994 CB LEU A 61 25.146 -9.952 -16.097 1.00 0.00 C ATOM 995 CG LEU A 61 25.457 -10.026 -17.594 1.00 0.00 C ATOM 996 CD1 LEU A 61 25.055 -11.359 -18.225 1.00 0.00 C ATOM 997 CD2 LEU A 61 24.801 -8.875 -18.348 1.00 0.00 C ATOM 0 H LEU A 61 24.460 -9.951 -13.783 1.00 0.00 H new ATOM 0 HA LEU A 61 23.316 -8.846 -16.178 1.00 0.00 H new ATOM 0 HB2 LEU A 61 25.722 -9.131 -15.671 1.00 0.00 H new ATOM 0 HB3 LEU A 61 25.505 -10.869 -15.630 1.00 0.00 H new ATOM 0 HG LEU A 61 26.540 -9.943 -17.679 1.00 0.00 H new ATOM 0 HD11 LEU A 61 25.302 -11.348 -19.287 1.00 0.00 H new ATOM 0 HD12 LEU A 61 25.594 -12.170 -17.736 1.00 0.00 H new ATOM 0 HD13 LEU A 61 23.982 -11.510 -18.103 1.00 0.00 H new ATOM 0 HD21 LEU A 61 25.039 -8.953 -19.409 1.00 0.00 H new ATOM 0 HD22 LEU A 61 23.720 -8.921 -18.214 1.00 0.00 H new ATOM 0 HD23 LEU A 61 25.174 -7.927 -17.961 1.00 0.00 H new ATOM 1009 N TYR A 62 22.894 -12.084 -15.633 1.00 0.00 N ATOM 1010 CA TYR A 62 22.018 -13.196 -15.993 1.00 0.00 C ATOM 1011 C TYR A 62 20.578 -12.873 -15.614 1.00 0.00 C ATOM 1012 O TYR A 62 19.649 -13.226 -16.337 1.00 0.00 O ATOM 1013 CB TYR A 62 22.459 -14.457 -15.250 1.00 0.00 C ATOM 1014 CG TYR A 62 23.825 -14.993 -15.607 1.00 0.00 C ATOM 1015 CD1 TYR A 62 24.498 -15.812 -14.689 1.00 0.00 C ATOM 1016 CD2 TYR A 62 24.419 -14.689 -16.844 1.00 0.00 C ATOM 1017 CE1 TYR A 62 25.753 -16.345 -15.004 1.00 0.00 C ATOM 1018 CE2 TYR A 62 25.671 -15.221 -17.168 1.00 0.00 C ATOM 1019 CZ TYR A 62 26.337 -16.061 -16.256 1.00 0.00 C ATOM 1020 OH TYR A 62 27.544 -16.592 -16.598 1.00 0.00 O ATOM 0 H TYR A 62 23.593 -12.309 -14.925 1.00 0.00 H new ATOM 0 HA TYR A 62 22.080 -13.359 -17.069 1.00 0.00 H new ATOM 0 HB2 TYR A 62 22.440 -14.249 -14.180 1.00 0.00 H new ATOM 0 HB3 TYR A 62 21.724 -15.240 -15.436 1.00 0.00 H new ATOM 0 HD1 TYR A 62 24.045 -16.033 -13.734 1.00 0.00 H new ATOM 0 HD2 TYR A 62 23.908 -14.045 -17.544 1.00 0.00 H new ATOM 0 HE1 TYR A 62 26.271 -16.970 -14.292 1.00 0.00 H new ATOM 0 HE2 TYR A 62 26.127 -14.987 -18.119 1.00 0.00 H new ATOM 0 HH TYR A 62 27.791 -16.290 -17.497 1.00 0.00 H new ATOM 1030 N LEU A 63 20.397 -12.198 -14.477 1.00 0.00 N ATOM 1031 CA LEU A 63 19.083 -11.805 -14.008 1.00 0.00 C ATOM 1032 C LEU A 63 18.416 -10.887 -15.017 1.00 0.00 C ATOM 1033 O LEU A 63 17.237 -11.061 -15.319 1.00 0.00 O ATOM 1034 CB LEU A 63 19.235 -11.107 -12.663 1.00 0.00 C ATOM 1035 CG LEU A 63 17.909 -10.619 -12.083 1.00 0.00 C ATOM 1036 CD1 LEU A 63 16.955 -11.781 -11.823 1.00 0.00 C ATOM 1037 CD2 LEU A 63 18.205 -9.933 -10.755 1.00 0.00 C ATOM 0 H LEU A 63 21.160 -11.913 -13.863 1.00 0.00 H new ATOM 0 HA LEU A 63 18.452 -12.686 -13.891 1.00 0.00 H new ATOM 0 HB2 LEU A 63 19.702 -11.793 -11.956 1.00 0.00 H new ATOM 0 HB3 LEU A 63 19.909 -10.258 -12.776 1.00 0.00 H new ATOM 0 HG LEU A 63 17.439 -9.941 -12.795 1.00 0.00 H new ATOM 0 HD11 LEU A 63 16.021 -11.400 -11.410 1.00 0.00 H new ATOM 0 HD12 LEU A 63 16.752 -12.302 -12.759 1.00 0.00 H new ATOM 0 HD13 LEU A 63 17.409 -12.473 -11.114 1.00 0.00 H new ATOM 0 HD21 LEU A 63 17.274 -9.573 -10.316 1.00 0.00 H new ATOM 0 HD22 LEU A 63 18.676 -10.643 -10.075 1.00 0.00 H new ATOM 0 HD23 LEU A 63 18.877 -9.091 -10.922 1.00 0.00 H new ATOM 1049 N MET A 64 19.161 -9.912 -15.541 1.00 0.00 N ATOM 1050 CA MET A 64 18.600 -9.029 -16.537 1.00 0.00 C ATOM 1051 C MET A 64 18.143 -9.844 -17.730 1.00 0.00 C ATOM 1052 O MET A 64 17.028 -9.645 -18.208 1.00 0.00 O ATOM 1053 CB MET A 64 19.625 -7.979 -16.962 1.00 0.00 C ATOM 1054 CG MET A 64 19.236 -7.298 -18.282 1.00 0.00 C ATOM 1055 SD MET A 64 19.672 -8.157 -19.824 1.00 0.00 S ATOM 1056 CE MET A 64 21.467 -8.257 -19.638 1.00 0.00 C ATOM 0 H MET A 64 20.132 -9.724 -15.292 1.00 0.00 H new ATOM 0 HA MET A 64 17.743 -8.507 -16.112 1.00 0.00 H new ATOM 0 HB2 MET A 64 19.719 -7.226 -16.179 1.00 0.00 H new ATOM 0 HB3 MET A 64 20.602 -8.449 -17.071 1.00 0.00 H new ATOM 0 HG2 MET A 64 18.157 -7.142 -18.276 1.00 0.00 H new ATOM 0 HG3 MET A 64 19.700 -6.312 -18.302 1.00 0.00 H new ATOM 0 HE1 MET A 64 21.946 -7.996 -20.582 1.00 0.00 H new ATOM 0 HE2 MET A 64 21.792 -7.563 -18.862 1.00 0.00 H new ATOM 0 HE3 MET A 64 21.748 -9.272 -19.358 1.00 0.00 H new ATOM 1066 N ASN A 65 18.998 -10.755 -18.206 1.00 0.00 N ATOM 1067 CA ASN A 65 18.702 -11.492 -19.416 1.00 0.00 C ATOM 1068 C ASN A 65 17.369 -12.227 -19.282 1.00 0.00 C ATOM 1069 O ASN A 65 16.551 -12.178 -20.194 1.00 0.00 O ATOM 1070 CB ASN A 65 19.830 -12.480 -19.714 1.00 0.00 C ATOM 1071 CG ASN A 65 19.512 -13.293 -20.962 1.00 0.00 C ATOM 1072 OD1 ASN A 65 19.925 -12.948 -22.064 1.00 0.00 O ATOM 1073 ND2 ASN A 65 18.774 -14.388 -20.800 1.00 0.00 N ATOM 0 H ASN A 65 19.889 -10.991 -17.770 1.00 0.00 H new ATOM 0 HA ASN A 65 18.622 -10.789 -20.245 1.00 0.00 H new ATOM 0 HB2 ASN A 65 20.767 -11.940 -19.853 1.00 0.00 H new ATOM 0 HB3 ASN A 65 19.970 -13.148 -18.864 1.00 0.00 H new ATOM 0 HD21 ASN A 65 18.537 -14.967 -21.606 1.00 0.00 H new ATOM 0 HD22 ASN A 65 18.445 -14.649 -19.870 1.00 0.00 H new ATOM 1080 N HIS A 66 17.145 -12.906 -18.151 1.00 0.00 N ATOM 1081 CA HIS A 66 15.920 -13.661 -17.959 1.00 0.00 C ATOM 1082 C HIS A 66 14.731 -12.724 -17.758 1.00 0.00 C ATOM 1083 O HIS A 66 13.641 -12.999 -18.255 1.00 0.00 O ATOM 1084 CB HIS A 66 16.083 -14.616 -16.774 1.00 0.00 C ATOM 1085 CG HIS A 66 14.987 -15.650 -16.726 1.00 0.00 C ATOM 1086 ND1 HIS A 66 14.883 -16.747 -17.580 1.00 0.00 N ATOM 1087 CD2 HIS A 66 13.944 -15.665 -15.850 1.00 0.00 C ATOM 1088 CE1 HIS A 66 13.765 -17.388 -17.203 1.00 0.00 C ATOM 1089 NE2 HIS A 66 13.178 -16.759 -16.170 1.00 0.00 N ATOM 0 H HIS A 66 17.795 -12.943 -17.366 1.00 0.00 H new ATOM 0 HA HIS A 66 15.721 -14.251 -18.854 1.00 0.00 H new ATOM 0 HB2 HIS A 66 17.050 -15.115 -16.841 1.00 0.00 H new ATOM 0 HB3 HIS A 66 16.083 -14.045 -15.846 1.00 0.00 H new ATOM 0 HD1 HIS A 66 15.521 -17.008 -18.332 1.00 0.00 H new ATOM 0 HD2 HIS A 66 13.756 -14.955 -15.058 1.00 0.00 H new ATOM 0 HE1 HIS A 66 13.388 -18.287 -17.667 1.00 0.00 H new ATOM 1097 N VAL A 67 14.931 -11.616 -17.035 1.00 0.00 N ATOM 1098 CA VAL A 67 13.893 -10.620 -16.813 1.00 0.00 C ATOM 1099 C VAL A 67 13.408 -10.057 -18.146 1.00 0.00 C ATOM 1100 O VAL A 67 12.204 -10.028 -18.392 1.00 0.00 O ATOM 1101 CB VAL A 67 14.464 -9.504 -15.927 1.00 0.00 C ATOM 1102 CG1 VAL A 67 13.661 -8.211 -16.026 1.00 0.00 C ATOM 1103 CG2 VAL A 67 14.470 -9.937 -14.462 1.00 0.00 C ATOM 0 H VAL A 67 15.820 -11.391 -16.590 1.00 0.00 H new ATOM 0 HA VAL A 67 13.039 -11.078 -16.314 1.00 0.00 H new ATOM 0 HB VAL A 67 15.477 -9.320 -16.286 1.00 0.00 H new ATOM 0 HG11 VAL A 67 14.107 -7.455 -15.380 1.00 0.00 H new ATOM 0 HG12 VAL A 67 13.667 -7.857 -17.057 1.00 0.00 H new ATOM 0 HG13 VAL A 67 12.634 -8.396 -15.712 1.00 0.00 H new ATOM 0 HG21 VAL A 67 14.878 -9.135 -13.847 1.00 0.00 H new ATOM 0 HG22 VAL A 67 13.451 -10.156 -14.143 1.00 0.00 H new ATOM 0 HG23 VAL A 67 15.086 -10.829 -14.349 1.00 0.00 H new ATOM 1113 N VAL A 68 14.322 -9.609 -19.012 1.00 0.00 N ATOM 1114 CA VAL A 68 13.917 -9.008 -20.273 1.00 0.00 C ATOM 1115 C VAL A 68 13.325 -10.062 -21.208 1.00 0.00 C ATOM 1116 O VAL A 68 12.459 -9.731 -22.013 1.00 0.00 O ATOM 1117 CB VAL A 68 15.073 -8.230 -20.910 1.00 0.00 C ATOM 1118 CG1 VAL A 68 15.569 -7.151 -19.948 1.00 0.00 C ATOM 1119 CG2 VAL A 68 16.243 -9.128 -21.305 1.00 0.00 C ATOM 0 H VAL A 68 15.330 -9.652 -18.861 1.00 0.00 H new ATOM 0 HA VAL A 68 13.129 -8.281 -20.077 1.00 0.00 H new ATOM 0 HB VAL A 68 14.683 -7.778 -21.822 1.00 0.00 H new ATOM 0 HG11 VAL A 68 16.391 -6.603 -20.409 1.00 0.00 H new ATOM 0 HG12 VAL A 68 14.755 -6.462 -19.722 1.00 0.00 H new ATOM 0 HG13 VAL A 68 15.916 -7.617 -19.026 1.00 0.00 H new ATOM 0 HG21 VAL A 68 17.032 -8.522 -21.751 1.00 0.00 H new ATOM 0 HG22 VAL A 68 16.629 -9.633 -20.420 1.00 0.00 H new ATOM 0 HG23 VAL A 68 15.904 -9.871 -22.027 1.00 0.00 H new ATOM 1129 N GLN A 69 13.777 -11.319 -21.112 1.00 0.00 N ATOM 1130 CA GLN A 69 13.177 -12.418 -21.858 1.00 0.00 C ATOM 1131 C GLN A 69 11.729 -12.637 -21.414 1.00 0.00 C ATOM 1132 O GLN A 69 10.854 -12.785 -22.265 1.00 0.00 O ATOM 1133 CB GLN A 69 13.983 -13.713 -21.670 1.00 0.00 C ATOM 1134 CG GLN A 69 14.824 -14.108 -22.895 1.00 0.00 C ATOM 1135 CD GLN A 69 16.014 -13.191 -23.140 1.00 0.00 C ATOM 1136 OE1 GLN A 69 15.896 -11.976 -23.049 1.00 0.00 O ATOM 1137 NE2 GLN A 69 17.170 -13.774 -23.453 1.00 0.00 N ATOM 0 H GLN A 69 14.561 -11.595 -20.520 1.00 0.00 H new ATOM 0 HA GLN A 69 13.189 -12.153 -22.915 1.00 0.00 H new ATOM 0 HB2 GLN A 69 14.643 -13.597 -20.811 1.00 0.00 H new ATOM 0 HB3 GLN A 69 13.296 -14.526 -21.436 1.00 0.00 H new ATOM 0 HG2 GLN A 69 15.184 -15.129 -22.764 1.00 0.00 H new ATOM 0 HG3 GLN A 69 14.186 -14.105 -23.779 1.00 0.00 H new ATOM 0 HE21 GLN A 69 17.227 -14.790 -23.519 1.00 0.00 H new ATOM 0 HE22 GLN A 69 17.998 -13.204 -23.627 1.00 0.00 H new ATOM 1146 N GLN A 70 11.454 -12.661 -20.102 1.00 0.00 N ATOM 1147 CA GLN A 70 10.083 -12.826 -19.631 1.00 0.00 C ATOM 1148 C GLN A 70 9.248 -11.596 -19.971 1.00 0.00 C ATOM 1149 O GLN A 70 8.070 -11.725 -20.291 1.00 0.00 O ATOM 1150 CB GLN A 70 10.037 -13.077 -18.118 1.00 0.00 C ATOM 1151 CG GLN A 70 10.679 -14.416 -17.738 1.00 0.00 C ATOM 1152 CD GLN A 70 10.518 -14.735 -16.251 1.00 0.00 C ATOM 1153 OE1 GLN A 70 10.258 -15.873 -15.871 1.00 0.00 O ATOM 1154 NE2 GLN A 70 10.669 -13.732 -15.388 1.00 0.00 N ATOM 0 H GLN A 70 12.153 -12.570 -19.364 1.00 0.00 H new ATOM 0 HA GLN A 70 9.666 -13.696 -20.138 1.00 0.00 H new ATOM 0 HB2 GLN A 70 10.553 -12.268 -17.601 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.001 -13.063 -17.780 1.00 0.00 H new ATOM 0 HG2 GLN A 70 10.229 -15.213 -18.329 1.00 0.00 H new ATOM 0 HG3 GLN A 70 11.739 -14.393 -17.990 1.00 0.00 H new ATOM 0 HE21 GLN A 70 10.885 -12.795 -15.728 1.00 0.00 H new ATOM 0 HE22 GLN A 70 10.569 -13.901 -14.387 1.00 0.00 H new ATOM 1163 N ALA A 71 9.848 -10.404 -19.907 1.00 0.00 N ATOM 1164 CA ALA A 71 9.149 -9.166 -20.208 1.00 0.00 C ATOM 1165 C ALA A 71 8.716 -9.151 -21.671 1.00 0.00 C ATOM 1166 O ALA A 71 7.556 -8.865 -21.972 1.00 0.00 O ATOM 1167 CB ALA A 71 10.073 -7.991 -19.895 1.00 0.00 C ATOM 0 H ALA A 71 10.826 -10.277 -19.646 1.00 0.00 H new ATOM 0 HA ALA A 71 8.251 -9.085 -19.596 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.560 -7.055 -20.117 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.346 -8.014 -18.840 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.974 -8.064 -20.504 1.00 0.00 H new ATOM 1173 N LYS A 72 9.661 -9.462 -22.563 1.00 0.00 N ATOM 1174 CA LYS A 72 9.425 -9.654 -23.984 1.00 0.00 C ATOM 1175 C LYS A 72 8.346 -10.714 -24.213 1.00 0.00 C ATOM 1176 O LYS A 72 7.541 -10.582 -25.135 1.00 0.00 O ATOM 1177 CB LYS A 72 10.757 -10.125 -24.576 1.00 0.00 C ATOM 1178 CG LYS A 72 10.623 -10.851 -25.911 1.00 0.00 C ATOM 1179 CD LYS A 72 10.552 -9.908 -27.109 1.00 0.00 C ATOM 1180 CE LYS A 72 10.221 -10.753 -28.344 1.00 0.00 C ATOM 1181 NZ LYS A 72 8.848 -11.286 -28.281 1.00 0.00 N1+ ATOM 0 H LYS A 72 10.639 -9.589 -22.301 1.00 0.00 H new ATOM 0 HA LYS A 72 9.078 -8.733 -24.453 1.00 0.00 H new ATOM 0 HB2 LYS A 72 11.409 -9.262 -24.708 1.00 0.00 H new ATOM 0 HB3 LYS A 72 11.246 -10.788 -23.862 1.00 0.00 H new ATOM 0 HG2 LYS A 72 11.471 -11.524 -26.037 1.00 0.00 H new ATOM 0 HG3 LYS A 72 9.726 -11.470 -25.891 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.790 -9.145 -26.951 1.00 0.00 H new ATOM 0 HD3 LYS A 72 11.500 -9.388 -27.244 1.00 0.00 H new ATOM 0 HE2 LYS A 72 10.336 -10.147 -29.243 1.00 0.00 H new ATOM 0 HE3 LYS A 72 10.929 -11.578 -28.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.504 -11.473 -29.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 8.844 -12.170 -27.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.227 -10.591 -27.820 1.00 0.00 H new ATOM 1195 N GLY A 73 8.335 -11.757 -23.379 1.00 0.00 N ATOM 1196 CA GLY A 73 7.435 -12.889 -23.521 1.00 0.00 C ATOM 1197 C GLY A 73 5.970 -12.485 -23.426 1.00 0.00 C ATOM 1198 O GLY A 73 5.212 -12.675 -24.375 1.00 0.00 O ATOM 0 H GLY A 73 8.962 -11.834 -22.578 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.614 -13.373 -24.481 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.657 -13.624 -22.748 1.00 0.00 H new ATOM 1202 N GLN A 74 5.571 -11.926 -22.283 1.00 0.00 N ATOM 1203 CA GLN A 74 4.193 -11.531 -22.049 1.00 0.00 C ATOM 1204 C GLN A 74 3.884 -10.187 -22.706 1.00 0.00 C ATOM 1205 O GLN A 74 3.383 -10.153 -23.827 1.00 0.00 O ATOM 1206 CB GLN A 74 3.871 -11.546 -20.548 1.00 0.00 C ATOM 1207 CG GLN A 74 5.113 -11.239 -19.705 1.00 0.00 C ATOM 1208 CD GLN A 74 4.799 -10.976 -18.241 1.00 0.00 C ATOM 1209 OE1 GLN A 74 3.683 -10.603 -17.887 1.00 0.00 O ATOM 1210 NE2 GLN A 74 5.800 -11.175 -17.388 1.00 0.00 N ATOM 0 H GLN A 74 6.196 -11.737 -21.499 1.00 0.00 H new ATOM 0 HA GLN A 74 3.537 -12.262 -22.521 1.00 0.00 H new ATOM 0 HB2 GLN A 74 3.094 -10.812 -20.334 1.00 0.00 H new ATOM 0 HB3 GLN A 74 3.473 -12.522 -20.270 1.00 0.00 H new ATOM 0 HG2 GLN A 74 5.807 -12.077 -19.775 1.00 0.00 H new ATOM 0 HG3 GLN A 74 5.620 -10.369 -20.122 1.00 0.00 H new ATOM 0 HE21 GLN A 74 6.709 -11.485 -17.732 1.00 0.00 H new ATOM 0 HE22 GLN A 74 5.659 -11.017 -16.390 1.00 0.00 H new ATOM 1219 N LYS A 75 4.178 -9.085 -22.011 1.00 0.00 N ATOM 1220 CA LYS A 75 3.855 -7.745 -22.493 1.00 0.00 C ATOM 1221 C LYS A 75 4.501 -6.637 -21.655 1.00 0.00 C ATOM 1222 O LYS A 75 4.110 -5.477 -21.773 1.00 0.00 O ATOM 1223 CB LYS A 75 2.328 -7.563 -22.549 1.00 0.00 C ATOM 1224 CG LYS A 75 1.569 -8.104 -21.330 1.00 0.00 C ATOM 1225 CD LYS A 75 2.061 -7.506 -20.009 1.00 0.00 C ATOM 1226 CE LYS A 75 1.188 -7.967 -18.839 1.00 0.00 C ATOM 1227 NZ LYS A 75 1.290 -9.422 -18.616 1.00 0.00 N1+ ATOM 0 H LYS A 75 4.644 -9.099 -21.104 1.00 0.00 H new ATOM 0 HA LYS A 75 4.272 -7.654 -23.496 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.107 -6.501 -22.655 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.950 -8.058 -23.444 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.506 -7.891 -21.446 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.675 -9.188 -21.294 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.095 -7.802 -19.834 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.047 -6.418 -20.071 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.487 -7.439 -17.933 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.149 -7.702 -19.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.780 -9.676 -17.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.871 -9.927 -19.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 2.291 -9.689 -18.522 1.00 0.00 H new ATOM 1241 N ILE A 76 5.482 -6.966 -20.807 1.00 0.00 N ATOM 1242 CA ILE A 76 6.062 -5.989 -19.893 1.00 0.00 C ATOM 1243 C ILE A 76 7.121 -5.157 -20.614 1.00 0.00 C ATOM 1244 O ILE A 76 8.285 -5.151 -20.215 1.00 0.00 O ATOM 1245 CB ILE A 76 6.642 -6.669 -18.645 1.00 0.00 C ATOM 1246 CG1 ILE A 76 5.695 -7.723 -18.060 1.00 0.00 C ATOM 1247 CG2 ILE A 76 6.958 -5.620 -17.574 1.00 0.00 C ATOM 1248 CD1 ILE A 76 4.392 -7.134 -17.523 1.00 0.00 C ATOM 0 H ILE A 76 5.887 -7.900 -20.738 1.00 0.00 H new ATOM 0 HA ILE A 76 5.270 -5.320 -19.557 1.00 0.00 H new ATOM 0 HB ILE A 76 7.555 -7.178 -18.955 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.463 -8.459 -18.829 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.205 -8.253 -17.255 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.369 -6.112 -16.693 1.00 0.00 H new ATOM 0 HG22 ILE A 76 7.686 -4.909 -17.965 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.044 -5.092 -17.302 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.768 -7.934 -17.124 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.615 -6.419 -16.732 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.861 -6.629 -18.330 1.00 0.00 H new ATOM 1260 N ILE A 77 6.732 -4.445 -21.680 1.00 0.00 N ATOM 1261 CA ILE A 77 7.686 -3.658 -22.449 1.00 0.00 C ATOM 1262 C ILE A 77 8.435 -2.684 -21.547 1.00 0.00 C ATOM 1263 O ILE A 77 9.529 -2.247 -21.888 1.00 0.00 O ATOM 1264 CB ILE A 77 6.980 -2.929 -23.601 1.00 0.00 C ATOM 1265 CG1 ILE A 77 5.967 -1.878 -23.123 1.00 0.00 C ATOM 1266 CG2 ILE A 77 6.273 -3.956 -24.486 1.00 0.00 C ATOM 1267 CD1 ILE A 77 6.604 -0.492 -23.002 1.00 0.00 C ATOM 0 H ILE A 77 5.772 -4.402 -22.021 1.00 0.00 H new ATOM 0 HA ILE A 77 8.421 -4.334 -22.885 1.00 0.00 H new ATOM 0 HB ILE A 77 7.747 -2.393 -24.160 1.00 0.00 H new ATOM 0 HG12 ILE A 77 5.131 -1.835 -23.821 1.00 0.00 H new ATOM 0 HG13 ILE A 77 5.561 -2.177 -22.157 1.00 0.00 H new ATOM 0 HG21 ILE A 77 5.770 -3.444 -25.306 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.006 -4.655 -24.890 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.539 -4.502 -23.894 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.856 0.224 -22.661 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.423 -0.530 -22.284 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.987 -0.182 -23.974 1.00 0.00 H new ATOM 1279 N GLN A 78 7.855 -2.335 -20.395 1.00 0.00 N ATOM 1280 CA GLN A 78 8.477 -1.414 -19.465 1.00 0.00 C ATOM 1281 C GLN A 78 9.816 -1.963 -18.979 1.00 0.00 C ATOM 1282 O GLN A 78 10.743 -1.186 -18.780 1.00 0.00 O ATOM 1283 CB GLN A 78 7.556 -1.169 -18.267 1.00 0.00 C ATOM 1284 CG GLN A 78 6.225 -0.523 -18.674 1.00 0.00 C ATOM 1285 CD GLN A 78 5.254 -1.501 -19.332 1.00 0.00 C ATOM 1286 OE1 GLN A 78 5.407 -2.717 -19.241 1.00 0.00 O ATOM 1287 NE2 GLN A 78 4.235 -0.970 -20.006 1.00 0.00 N ATOM 0 H GLN A 78 6.947 -2.685 -20.091 1.00 0.00 H new ATOM 0 HA GLN A 78 8.651 -0.471 -19.983 1.00 0.00 H new ATOM 0 HB2 GLN A 78 7.358 -2.116 -17.765 1.00 0.00 H new ATOM 0 HB3 GLN A 78 8.064 -0.526 -17.548 1.00 0.00 H new ATOM 0 HG2 GLN A 78 5.753 -0.093 -17.791 1.00 0.00 H new ATOM 0 HG3 GLN A 78 6.424 0.299 -19.362 1.00 0.00 H new ATOM 0 HE21 GLN A 78 4.135 0.043 -20.064 1.00 0.00 H new ATOM 0 HE22 GLN A 78 3.555 -1.577 -20.464 1.00 0.00 H new ATOM 1296 N PHE A 79 9.932 -3.282 -18.783 1.00 0.00 N ATOM 1297 CA PHE A 79 11.144 -3.864 -18.223 1.00 0.00 C ATOM 1298 C PHE A 79 12.247 -4.016 -19.264 1.00 0.00 C ATOM 1299 O PHE A 79 13.398 -3.682 -18.978 1.00 0.00 O ATOM 1300 CB PHE A 79 10.821 -5.208 -17.569 1.00 0.00 C ATOM 1301 CG PHE A 79 11.011 -5.164 -16.070 1.00 0.00 C ATOM 1302 CD1 PHE A 79 9.932 -4.838 -15.231 1.00 0.00 C ATOM 1303 CD2 PHE A 79 12.266 -5.440 -15.510 1.00 0.00 C ATOM 1304 CE1 PHE A 79 10.117 -4.795 -13.843 1.00 0.00 C ATOM 1305 CE2 PHE A 79 12.442 -5.417 -14.118 1.00 0.00 C ATOM 1306 CZ PHE A 79 11.367 -5.088 -13.288 1.00 0.00 C ATOM 0 H PHE A 79 9.202 -3.958 -19.005 1.00 0.00 H new ATOM 0 HA PHE A 79 11.523 -3.178 -17.465 1.00 0.00 H new ATOM 0 HB2 PHE A 79 9.792 -5.485 -17.797 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.461 -5.982 -17.994 1.00 0.00 H new ATOM 0 HD1 PHE A 79 8.963 -4.621 -15.655 1.00 0.00 H new ATOM 0 HD2 PHE A 79 13.102 -5.672 -16.153 1.00 0.00 H new ATOM 0 HE1 PHE A 79 9.291 -4.534 -13.198 1.00 0.00 H new ATOM 0 HE2 PHE A 79 13.405 -5.653 -13.690 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.502 -5.060 -12.217 1.00 0.00 H new ATOM 1316 N GLN A 80 11.919 -4.512 -20.462 1.00 0.00 N ATOM 1317 CA GLN A 80 12.926 -4.666 -21.501 1.00 0.00 C ATOM 1318 C GLN A 80 13.420 -3.293 -21.945 1.00 0.00 C ATOM 1319 O GLN A 80 14.580 -3.148 -22.328 1.00 0.00 O ATOM 1320 CB GLN A 80 12.367 -5.491 -22.663 1.00 0.00 C ATOM 1321 CG GLN A 80 11.183 -4.807 -23.349 1.00 0.00 C ATOM 1322 CD GLN A 80 10.436 -5.793 -24.243 1.00 0.00 C ATOM 1323 OE1 GLN A 80 9.318 -6.196 -23.934 1.00 0.00 O ATOM 1324 NE2 GLN A 80 11.039 -6.191 -25.360 1.00 0.00 N ATOM 0 H GLN A 80 10.979 -4.807 -20.727 1.00 0.00 H new ATOM 0 HA GLN A 80 13.783 -5.212 -21.108 1.00 0.00 H new ATOM 0 HB2 GLN A 80 13.156 -5.664 -23.394 1.00 0.00 H new ATOM 0 HB3 GLN A 80 12.054 -6.468 -22.294 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.504 -4.403 -22.598 1.00 0.00 H new ATOM 0 HG3 GLN A 80 11.537 -3.965 -23.944 1.00 0.00 H new ATOM 0 HE21 GLN A 80 11.968 -5.839 -25.591 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.572 -6.848 -25.985 1.00 0.00 H new ATOM 1333 N ASP A 81 12.549 -2.281 -21.896 1.00 0.00 N ATOM 1334 CA ASP A 81 12.945 -0.913 -22.186 1.00 0.00 C ATOM 1335 C ASP A 81 13.738 -0.308 -21.032 1.00 0.00 C ATOM 1336 O ASP A 81 14.767 0.323 -21.256 1.00 0.00 O ATOM 1337 CB ASP A 81 11.707 -0.057 -22.442 1.00 0.00 C ATOM 1338 CG ASP A 81 10.978 -0.448 -23.728 1.00 0.00 C ATOM 1339 OD1 ASP A 81 11.492 -1.337 -24.444 1.00 0.00 O ATOM 1340 OD2 ASP A 81 9.913 0.157 -23.975 1.00 0.00 O1- ATOM 0 H ASP A 81 11.564 -2.391 -21.657 1.00 0.00 H new ATOM 0 HA ASP A 81 13.579 -0.931 -23.073 1.00 0.00 H new ATOM 0 HB2 ASP A 81 11.024 -0.151 -21.598 1.00 0.00 H new ATOM 0 HB3 ASP A 81 12.000 0.991 -22.499 1.00 0.00 H new ATOM 1345 N SER A 82 13.274 -0.489 -19.791 1.00 0.00 N ATOM 1346 CA SER A 82 13.932 0.112 -18.645 1.00 0.00 C ATOM 1347 C SER A 82 15.339 -0.435 -18.471 1.00 0.00 C ATOM 1348 O SER A 82 16.241 0.324 -18.126 1.00 0.00 O ATOM 1349 CB SER A 82 13.112 -0.097 -17.378 1.00 0.00 C ATOM 1350 OG SER A 82 11.884 0.587 -17.487 1.00 0.00 O ATOM 0 H SER A 82 12.450 -1.045 -19.564 1.00 0.00 H new ATOM 0 HA SER A 82 14.009 1.184 -18.829 1.00 0.00 H new ATOM 0 HB2 SER A 82 12.934 -1.161 -17.220 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.665 0.265 -16.512 1.00 0.00 H new ATOM 0 HG SER A 82 11.395 0.259 -18.270 1.00 0.00 H new ATOM 1356 N PHE A 83 15.543 -1.736 -18.704 1.00 0.00 N ATOM 1357 CA PHE A 83 16.887 -2.284 -18.673 1.00 0.00 C ATOM 1358 C PHE A 83 17.607 -2.001 -19.988 1.00 0.00 C ATOM 1359 O PHE A 83 18.805 -1.727 -19.973 1.00 0.00 O ATOM 1360 CB PHE A 83 16.839 -3.789 -18.401 1.00 0.00 C ATOM 1361 CG PHE A 83 16.533 -4.199 -16.973 1.00 0.00 C ATOM 1362 CD1 PHE A 83 16.464 -5.564 -16.656 1.00 0.00 C ATOM 1363 CD2 PHE A 83 16.322 -3.247 -15.962 1.00 0.00 C ATOM 1364 CE1 PHE A 83 16.223 -5.979 -15.340 1.00 0.00 C ATOM 1365 CE2 PHE A 83 16.074 -3.663 -14.645 1.00 0.00 C ATOM 1366 CZ PHE A 83 16.025 -5.027 -14.333 1.00 0.00 C ATOM 0 H PHE A 83 14.806 -2.410 -18.911 1.00 0.00 H new ATOM 0 HA PHE A 83 17.441 -1.803 -17.867 1.00 0.00 H new ATOM 0 HB2 PHE A 83 16.087 -4.232 -19.054 1.00 0.00 H new ATOM 0 HB3 PHE A 83 17.800 -4.220 -18.683 1.00 0.00 H new ATOM 0 HD1 PHE A 83 16.598 -6.301 -17.434 1.00 0.00 H new ATOM 0 HD2 PHE A 83 16.351 -2.194 -16.199 1.00 0.00 H new ATOM 0 HE1 PHE A 83 16.190 -7.032 -15.103 1.00 0.00 H new ATOM 0 HE2 PHE A 83 15.920 -2.928 -13.869 1.00 0.00 H new ATOM 0 HZ PHE A 83 15.835 -5.344 -13.318 1.00 0.00 H new ATOM 1376 N GLY A 84 16.902 -2.060 -21.120 1.00 0.00 N ATOM 1377 CA GLY A 84 17.499 -1.742 -22.402 1.00 0.00 C ATOM 1378 C GLY A 84 18.093 -0.334 -22.418 1.00 0.00 C ATOM 1379 O GLY A 84 19.165 -0.130 -22.982 1.00 0.00 O ATOM 0 H GLY A 84 15.918 -2.326 -21.166 1.00 0.00 H new ATOM 0 HA2 GLY A 84 18.279 -2.468 -22.630 1.00 0.00 H new ATOM 0 HA3 GLY A 84 16.746 -1.828 -23.185 1.00 0.00 H new ATOM 1383 N LYS A 85 17.410 0.642 -21.807 1.00 0.00 N ATOM 1384 CA LYS A 85 17.866 2.024 -21.836 1.00 0.00 C ATOM 1385 C LYS A 85 19.248 2.176 -21.201 1.00 0.00 C ATOM 1386 O LYS A 85 20.058 2.974 -21.668 1.00 0.00 O ATOM 1387 CB LYS A 85 16.823 2.948 -21.197 1.00 0.00 C ATOM 1388 CG LYS A 85 17.104 3.196 -19.718 1.00 0.00 C ATOM 1389 CD LYS A 85 16.184 4.267 -19.141 1.00 0.00 C ATOM 1390 CE LYS A 85 14.951 3.608 -18.542 1.00 0.00 C ATOM 1391 NZ LYS A 85 15.307 2.864 -17.316 1.00 0.00 N1+ ATOM 0 H LYS A 85 16.543 0.494 -21.290 1.00 0.00 H new ATOM 0 HA LYS A 85 17.975 2.326 -22.878 1.00 0.00 H new ATOM 0 HB2 LYS A 85 16.810 3.900 -21.727 1.00 0.00 H new ATOM 0 HB3 LYS A 85 15.832 2.507 -21.308 1.00 0.00 H new ATOM 0 HG2 LYS A 85 16.975 2.267 -19.162 1.00 0.00 H new ATOM 0 HG3 LYS A 85 18.143 3.501 -19.591 1.00 0.00 H new ATOM 0 HD2 LYS A 85 16.710 4.840 -18.378 1.00 0.00 H new ATOM 0 HD3 LYS A 85 15.891 4.969 -19.922 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.202 4.366 -18.310 1.00 0.00 H new ATOM 0 HE3 LYS A 85 14.504 2.930 -19.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 14.480 2.814 -16.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 15.608 1.901 -17.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 16.084 3.352 -16.827 1.00 0.00 H new ATOM 1405 N VAL A 86 19.517 1.410 -20.137 1.00 0.00 N ATOM 1406 CA VAL A 86 20.785 1.468 -19.416 1.00 0.00 C ATOM 1407 C VAL A 86 21.765 0.410 -19.915 1.00 0.00 C ATOM 1408 O VAL A 86 22.950 0.492 -19.608 1.00 0.00 O ATOM 1409 CB VAL A 86 20.549 1.293 -17.910 1.00 0.00 C ATOM 1410 CG1 VAL A 86 19.674 2.413 -17.350 1.00 0.00 C ATOM 1411 CG2 VAL A 86 19.880 -0.038 -17.588 1.00 0.00 C ATOM 0 H VAL A 86 18.857 0.733 -19.754 1.00 0.00 H new ATOM 0 HA VAL A 86 21.225 2.448 -19.602 1.00 0.00 H new ATOM 0 HB VAL A 86 21.535 1.323 -17.446 1.00 0.00 H new ATOM 0 HG11 VAL A 86 19.526 2.259 -16.281 1.00 0.00 H new ATOM 0 HG12 VAL A 86 20.163 3.373 -17.514 1.00 0.00 H new ATOM 0 HG13 VAL A 86 18.708 2.407 -17.855 1.00 0.00 H new ATOM 0 HG21 VAL A 86 19.732 -0.120 -16.511 1.00 0.00 H new ATOM 0 HG22 VAL A 86 18.915 -0.092 -18.092 1.00 0.00 H new ATOM 0 HG23 VAL A 86 20.514 -0.856 -17.930 1.00 0.00 H new ATOM 1421 N ALA A 87 21.290 -0.578 -20.675 1.00 0.00 N ATOM 1422 CA ALA A 87 22.096 -1.707 -21.112 1.00 0.00 C ATOM 1423 C ALA A 87 23.370 -1.286 -21.840 1.00 0.00 C ATOM 1424 O ALA A 87 24.406 -1.909 -21.621 1.00 0.00 O ATOM 1425 CB ALA A 87 21.228 -2.588 -22.005 1.00 0.00 C ATOM 0 H ALA A 87 20.325 -0.612 -21.005 1.00 0.00 H new ATOM 0 HA ALA A 87 22.430 -2.256 -20.231 1.00 0.00 H new ATOM 0 HB1 ALA A 87 21.810 -3.444 -22.347 1.00 0.00 H new ATOM 0 HB2 ALA A 87 20.364 -2.939 -21.441 1.00 0.00 H new ATOM 0 HB3 ALA A 87 20.889 -2.012 -22.866 1.00 0.00 H new ATOM 1431 N ALA A 88 23.329 -0.257 -22.692 1.00 0.00 N ATOM 1432 CA ALA A 88 24.539 0.177 -23.377 1.00 0.00 C ATOM 1433 C ALA A 88 25.580 0.656 -22.366 1.00 0.00 C ATOM 1434 O ALA A 88 26.748 0.276 -22.448 1.00 0.00 O ATOM 1435 CB ALA A 88 24.190 1.280 -24.372 1.00 0.00 C ATOM 0 H ALA A 88 22.490 0.277 -22.917 1.00 0.00 H new ATOM 0 HA ALA A 88 24.969 -0.663 -23.923 1.00 0.00 H new ATOM 0 HB1 ALA A 88 25.094 1.606 -24.886 1.00 0.00 H new ATOM 0 HB2 ALA A 88 23.476 0.899 -25.102 1.00 0.00 H new ATOM 0 HB3 ALA A 88 23.750 2.124 -23.840 1.00 0.00 H new ATOM 1441 N GLU A 89 25.157 1.490 -21.414 1.00 0.00 N ATOM 1442 CA GLU A 89 26.019 1.998 -20.359 1.00 0.00 C ATOM 1443 C GLU A 89 26.489 0.846 -19.477 1.00 0.00 C ATOM 1444 O GLU A 89 27.677 0.722 -19.192 1.00 0.00 O ATOM 1445 CB GLU A 89 25.220 3.020 -19.546 1.00 0.00 C ATOM 1446 CG GLU A 89 25.774 3.240 -18.133 1.00 0.00 C ATOM 1447 CD GLU A 89 24.928 4.246 -17.347 1.00 0.00 C ATOM 1448 OE1 GLU A 89 23.947 4.766 -17.921 1.00 0.00 O ATOM 1449 OE2 GLU A 89 25.268 4.490 -16.171 1.00 0.00 O1- ATOM 0 H GLU A 89 24.197 1.831 -21.358 1.00 0.00 H new ATOM 0 HA GLU A 89 26.903 2.477 -20.780 1.00 0.00 H new ATOM 0 HB2 GLU A 89 25.213 3.971 -20.078 1.00 0.00 H new ATOM 0 HB3 GLU A 89 24.184 2.687 -19.475 1.00 0.00 H new ATOM 0 HG2 GLU A 89 25.800 2.290 -17.599 1.00 0.00 H new ATOM 0 HG3 GLU A 89 26.802 3.598 -18.196 1.00 0.00 H new ATOM 1456 N VAL A 90 25.543 0.008 -19.052 1.00 0.00 N ATOM 1457 CA VAL A 90 25.804 -1.102 -18.158 1.00 0.00 C ATOM 1458 C VAL A 90 26.731 -2.120 -18.796 1.00 0.00 C ATOM 1459 O VAL A 90 27.863 -2.271 -18.353 1.00 0.00 O ATOM 1460 CB VAL A 90 24.478 -1.726 -17.715 1.00 0.00 C ATOM 1461 CG1 VAL A 90 24.721 -3.080 -17.050 1.00 0.00 C ATOM 1462 CG2 VAL A 90 23.828 -0.799 -16.692 1.00 0.00 C ATOM 0 H VAL A 90 24.564 0.089 -19.327 1.00 0.00 H new ATOM 0 HA VAL A 90 26.320 -0.732 -17.272 1.00 0.00 H new ATOM 0 HB VAL A 90 23.838 -1.864 -18.587 1.00 0.00 H new ATOM 0 HG11 VAL A 90 23.768 -3.510 -16.741 1.00 0.00 H new ATOM 0 HG12 VAL A 90 25.209 -3.750 -17.757 1.00 0.00 H new ATOM 0 HG13 VAL A 90 25.359 -2.947 -16.176 1.00 0.00 H new ATOM 0 HG21 VAL A 90 22.881 -1.227 -16.364 1.00 0.00 H new ATOM 0 HG22 VAL A 90 24.490 -0.682 -15.834 1.00 0.00 H new ATOM 0 HG23 VAL A 90 23.648 0.175 -17.146 1.00 0.00 H new ATOM 1472 N LEU A 91 26.263 -2.817 -19.834 1.00 0.00 N ATOM 1473 CA LEU A 91 27.033 -3.884 -20.461 1.00 0.00 C ATOM 1474 C LEU A 91 28.386 -3.350 -20.915 1.00 0.00 C ATOM 1475 O LEU A 91 29.382 -4.072 -20.881 1.00 0.00 O ATOM 1476 CB LEU A 91 26.241 -4.444 -21.645 1.00 0.00 C ATOM 1477 CG LEU A 91 24.877 -4.997 -21.223 1.00 0.00 C ATOM 1478 CD1 LEU A 91 23.964 -5.088 -22.442 1.00 0.00 C ATOM 1479 CD2 LEU A 91 25.009 -6.388 -20.613 1.00 0.00 C ATOM 0 H LEU A 91 25.349 -2.657 -20.257 1.00 0.00 H new ATOM 0 HA LEU A 91 27.209 -4.686 -19.744 1.00 0.00 H new ATOM 0 HB2 LEU A 91 26.098 -3.659 -22.387 1.00 0.00 H new ATOM 0 HB3 LEU A 91 26.819 -5.235 -22.124 1.00 0.00 H new ATOM 0 HG LEU A 91 24.458 -4.322 -20.477 1.00 0.00 H new ATOM 0 HD11 LEU A 91 22.993 -5.482 -22.141 1.00 0.00 H new ATOM 0 HD12 LEU A 91 23.835 -4.096 -22.875 1.00 0.00 H new ATOM 0 HD13 LEU A 91 24.411 -5.751 -23.182 1.00 0.00 H new ATOM 0 HD21 LEU A 91 24.024 -6.753 -20.324 1.00 0.00 H new ATOM 0 HD22 LEU A 91 25.447 -7.066 -21.345 1.00 0.00 H new ATOM 0 HD23 LEU A 91 25.651 -6.340 -19.733 1.00 0.00 H new ATOM 1491 N GLY A 92 28.423 -2.083 -21.339 1.00 0.00 N ATOM 1492 CA GLY A 92 29.660 -1.431 -21.725 1.00 0.00 C ATOM 1493 C GLY A 92 30.641 -1.363 -20.564 1.00 0.00 C ATOM 1494 O GLY A 92 31.827 -1.611 -20.763 1.00 0.00 O ATOM 0 H GLY A 92 27.597 -1.491 -21.421 1.00 0.00 H new ATOM 0 HA2 GLY A 92 30.114 -1.972 -22.555 1.00 0.00 H new ATOM 0 HA3 GLY A 92 29.446 -0.423 -22.081 1.00 0.00 H new ATOM 1498 N ARG A 93 30.158 -1.031 -19.359 1.00 0.00 N ATOM 1499 CA ARG A 93 30.973 -1.000 -18.152 1.00 0.00 C ATOM 1500 C ARG A 93 31.409 -2.392 -17.700 1.00 0.00 C ATOM 1501 O ARG A 93 32.548 -2.554 -17.268 1.00 0.00 O ATOM 1502 CB ARG A 93 30.160 -0.327 -17.051 1.00 0.00 C ATOM 1503 CG ARG A 93 30.074 1.175 -17.316 1.00 0.00 C ATOM 1504 CD ARG A 93 31.116 1.917 -16.487 1.00 0.00 C ATOM 1505 NE ARG A 93 32.495 1.531 -16.809 1.00 0.00 N ATOM 1506 CZ ARG A 93 33.361 1.026 -15.921 1.00 0.00 C ATOM 1507 NH1 ARG A 93 32.992 0.774 -14.665 1.00 0.00 N1+ ATOM 1508 NH2 ARG A 93 34.615 0.771 -16.292 1.00 0.00 N ATOM 0 H ARG A 93 29.183 -0.776 -19.201 1.00 0.00 H new ATOM 0 HA ARG A 93 31.886 -0.444 -18.366 1.00 0.00 H new ATOM 0 HB2 ARG A 93 29.159 -0.756 -17.011 1.00 0.00 H new ATOM 0 HB3 ARG A 93 30.623 -0.509 -16.081 1.00 0.00 H new ATOM 0 HG2 ARG A 93 30.233 1.374 -18.376 1.00 0.00 H new ATOM 0 HG3 ARG A 93 29.076 1.539 -17.069 1.00 0.00 H new ATOM 0 HD2 ARG A 93 31.000 2.989 -16.645 1.00 0.00 H new ATOM 0 HD3 ARG A 93 30.931 1.729 -15.430 1.00 0.00 H new ATOM 0 HE ARG A 93 32.814 1.655 -17.770 1.00 0.00 H new ATOM 0 HH11 ARG A 93 32.036 0.966 -14.366 1.00 0.00 H new ATOM 0 HH12 ARG A 93 33.666 0.389 -14.003 1.00 0.00 H new ATOM 0 HH21 ARG A 93 34.912 0.960 -17.249 1.00 0.00 H new ATOM 0 HH22 ARG A 93 35.278 0.386 -15.619 1.00 0.00 H new ATOM 1522 N ILE A 94 30.533 -3.401 -17.788 1.00 0.00 N ATOM 1523 CA ILE A 94 30.869 -4.761 -17.362 1.00 0.00 C ATOM 1524 C ILE A 94 32.052 -5.302 -18.157 1.00 0.00 C ATOM 1525 O ILE A 94 32.922 -5.976 -17.609 1.00 0.00 O ATOM 1526 CB ILE A 94 29.666 -5.696 -17.539 1.00 0.00 C ATOM 1527 CG1 ILE A 94 28.417 -5.134 -16.858 1.00 0.00 C ATOM 1528 CG2 ILE A 94 29.986 -7.051 -16.908 1.00 0.00 C ATOM 1529 CD1 ILE A 94 27.209 -6.029 -17.125 1.00 0.00 C ATOM 0 H ILE A 94 29.585 -3.298 -18.151 1.00 0.00 H new ATOM 0 HA ILE A 94 31.139 -4.720 -16.307 1.00 0.00 H new ATOM 0 HB ILE A 94 29.472 -5.795 -18.607 1.00 0.00 H new ATOM 0 HG12 ILE A 94 28.587 -5.054 -15.784 1.00 0.00 H new ATOM 0 HG13 ILE A 94 28.218 -4.127 -17.225 1.00 0.00 H new ATOM 0 HG21 ILE A 94 29.134 -7.720 -17.031 1.00 0.00 H new ATOM 0 HG22 ILE A 94 30.860 -7.483 -17.396 1.00 0.00 H new ATOM 0 HG23 ILE A 94 30.193 -6.918 -15.846 1.00 0.00 H new ATOM 0 HD11 ILE A 94 26.331 -5.612 -16.632 1.00 0.00 H new ATOM 0 HD12 ILE A 94 27.029 -6.087 -18.199 1.00 0.00 H new ATOM 0 HD13 ILE A 94 27.403 -7.028 -16.735 1.00 0.00 H new ATOM 1541 N ASN A 95 32.084 -5.003 -19.459 1.00 0.00 N ATOM 1542 CA ASN A 95 33.193 -5.401 -20.314 1.00 0.00 C ATOM 1543 C ASN A 95 34.523 -4.832 -19.807 1.00 0.00 C ATOM 1544 O ASN A 95 35.580 -5.300 -20.221 1.00 0.00 O ATOM 1545 CB ASN A 95 32.962 -4.855 -21.730 1.00 0.00 C ATOM 1546 CG ASN A 95 32.244 -5.820 -22.658 1.00 0.00 C ATOM 1547 OD1 ASN A 95 31.436 -6.636 -22.236 1.00 0.00 O ATOM 1548 ND2 ASN A 95 32.553 -5.717 -23.950 1.00 0.00 N ATOM 0 H ASN A 95 31.349 -4.485 -19.940 1.00 0.00 H new ATOM 0 HA ASN A 95 33.242 -6.490 -20.309 1.00 0.00 H new ATOM 0 HB2 ASN A 95 32.383 -3.934 -21.663 1.00 0.00 H new ATOM 0 HB3 ASN A 95 33.925 -4.595 -22.169 1.00 0.00 H new ATOM 0 HD21 ASN A 95 32.110 -6.333 -24.631 1.00 0.00 H new ATOM 0 HD22 ASN A 95 33.233 -5.022 -24.258 1.00 0.00 H new ATOM 1555 N GLN A 96 34.492 -3.830 -18.922 1.00 0.00 N ATOM 1556 CA GLN A 96 35.705 -3.147 -18.490 1.00 0.00 C ATOM 1557 C GLN A 96 36.241 -3.700 -17.174 1.00 0.00 C ATOM 1558 O GLN A 96 37.271 -3.248 -16.683 1.00 0.00 O ATOM 1559 CB GLN A 96 35.435 -1.647 -18.388 1.00 0.00 C ATOM 1560 CG GLN A 96 34.738 -1.176 -19.657 1.00 0.00 C ATOM 1561 CD GLN A 96 34.431 0.315 -19.650 1.00 0.00 C ATOM 1562 OE1 GLN A 96 35.058 1.095 -18.937 1.00 0.00 O ATOM 1563 NE2 GLN A 96 33.453 0.721 -20.456 1.00 0.00 N ATOM 0 H GLN A 96 33.636 -3.477 -18.493 1.00 0.00 H new ATOM 0 HA GLN A 96 36.479 -3.325 -19.236 1.00 0.00 H new ATOM 0 HB2 GLN A 96 34.814 -1.436 -17.518 1.00 0.00 H new ATOM 0 HB3 GLN A 96 36.371 -1.105 -18.251 1.00 0.00 H new ATOM 0 HG2 GLN A 96 35.366 -1.408 -20.517 1.00 0.00 H new ATOM 0 HG3 GLN A 96 33.809 -1.732 -19.782 1.00 0.00 H new ATOM 0 HE21 GLN A 96 32.954 0.044 -21.034 1.00 0.00 H new ATOM 0 HE22 GLN A 96 33.202 1.709 -20.496 1.00 0.00 H new ATOM 1572 N GLU A 97 35.539 -4.681 -16.601 1.00 0.00 N ATOM 1573 CA GLU A 97 35.987 -5.337 -15.381 1.00 0.00 C ATOM 1574 C GLU A 97 35.949 -6.860 -15.503 1.00 0.00 C ATOM 1575 O GLU A 97 36.525 -7.553 -14.666 1.00 0.00 O ATOM 1576 CB GLU A 97 35.124 -4.843 -14.223 1.00 0.00 C ATOM 1577 CG GLU A 97 33.669 -5.293 -14.364 1.00 0.00 C ATOM 1578 CD GLU A 97 32.848 -4.882 -13.148 1.00 0.00 C ATOM 1579 OE1 GLU A 97 31.768 -4.284 -13.354 1.00 0.00 O ATOM 1580 OE2 GLU A 97 33.311 -5.170 -12.023 1.00 0.00 O1- ATOM 0 H GLU A 97 34.656 -5.036 -16.968 1.00 0.00 H new ATOM 0 HA GLU A 97 37.030 -5.079 -15.196 1.00 0.00 H new ATOM 0 HB2 GLU A 97 35.530 -5.216 -13.283 1.00 0.00 H new ATOM 0 HB3 GLU A 97 35.165 -3.755 -14.178 1.00 0.00 H new ATOM 0 HG2 GLU A 97 33.236 -4.856 -15.264 1.00 0.00 H new ATOM 0 HG3 GLU A 97 33.630 -6.376 -14.484 1.00 0.00 H new ATOM 1587 N PHE A 98 35.283 -7.394 -16.528 1.00 0.00 N ATOM 1588 CA PHE A 98 35.226 -8.828 -16.737 1.00 0.00 C ATOM 1589 C PHE A 98 36.521 -9.342 -17.359 1.00 0.00 C ATOM 1590 O PHE A 98 37.113 -8.677 -18.209 1.00 0.00 O ATOM 1591 CB PHE A 98 34.043 -9.182 -17.639 1.00 0.00 C ATOM 1592 CG PHE A 98 32.726 -9.398 -16.923 1.00 0.00 C ATOM 1593 CD1 PHE A 98 32.542 -8.971 -15.599 1.00 0.00 C ATOM 1594 CD2 PHE A 98 31.681 -10.046 -17.597 1.00 0.00 C ATOM 1595 CE1 PHE A 98 31.327 -9.212 -14.949 1.00 0.00 C ATOM 1596 CE2 PHE A 98 30.469 -10.299 -16.941 1.00 0.00 C ATOM 1597 CZ PHE A 98 30.294 -9.883 -15.615 1.00 0.00 C ATOM 0 H PHE A 98 34.777 -6.847 -17.224 1.00 0.00 H new ATOM 0 HA PHE A 98 35.096 -9.306 -15.766 1.00 0.00 H new ATOM 0 HB2 PHE A 98 33.914 -8.384 -18.371 1.00 0.00 H new ATOM 0 HB3 PHE A 98 34.289 -10.087 -18.194 1.00 0.00 H new ATOM 0 HD1 PHE A 98 33.338 -8.456 -15.082 1.00 0.00 H new ATOM 0 HD2 PHE A 98 31.811 -10.351 -18.625 1.00 0.00 H new ATOM 0 HE1 PHE A 98 31.185 -8.880 -13.931 1.00 0.00 H new ATOM 0 HE2 PHE A 98 29.672 -10.814 -17.457 1.00 0.00 H new ATOM 0 HZ PHE A 98 29.362 -10.080 -15.106 1.00 0.00 H new ATOM 1607 N PRO A 99 36.968 -10.534 -16.940 1.00 0.00 N ATOM 1608 CA PRO A 99 38.070 -11.247 -17.557 1.00 0.00 C ATOM 1609 C PRO A 99 37.611 -11.779 -18.910 1.00 0.00 C ATOM 1610 O PRO A 99 36.428 -11.707 -19.248 1.00 0.00 O ATOM 1611 CB PRO A 99 38.392 -12.394 -16.596 1.00 0.00 C ATOM 1612 CG PRO A 99 37.027 -12.696 -15.982 1.00 0.00 C ATOM 1613 CD PRO A 99 36.425 -11.301 -15.835 1.00 0.00 C ATOM 0 HA PRO A 99 38.946 -10.622 -17.728 1.00 0.00 H new ATOM 0 HB2 PRO A 99 38.804 -13.258 -17.117 1.00 0.00 H new ATOM 0 HB3 PRO A 99 39.121 -12.100 -15.841 1.00 0.00 H new ATOM 0 HG2 PRO A 99 36.423 -13.335 -16.626 1.00 0.00 H new ATOM 0 HG3 PRO A 99 37.116 -13.205 -15.022 1.00 0.00 H new ATOM 0 HD2 PRO A 99 35.336 -11.336 -15.877 1.00 0.00 H new ATOM 0 HD3 PRO A 99 36.693 -10.855 -14.877 1.00 0.00 H new ATOM 1621 N ARG A 100 38.552 -12.317 -19.688 1.00 0.00 N ATOM 1622 CA ARG A 100 38.278 -12.774 -21.041 1.00 0.00 C ATOM 1623 C ARG A 100 37.128 -13.776 -21.037 1.00 0.00 C ATOM 1624 O ARG A 100 36.316 -13.813 -21.958 1.00 0.00 O ATOM 1625 CB ARG A 100 39.512 -13.463 -21.635 1.00 0.00 C ATOM 1626 CG ARG A 100 40.856 -12.779 -21.343 1.00 0.00 C ATOM 1627 CD ARG A 100 41.378 -12.935 -19.906 1.00 0.00 C ATOM 1628 NE ARG A 100 41.031 -14.235 -19.312 1.00 0.00 N ATOM 1629 CZ ARG A 100 41.599 -14.731 -18.208 1.00 0.00 C ATOM 1630 NH1 ARG A 100 42.593 -14.083 -17.602 1.00 0.00 N1+ ATOM 1631 NH2 ARG A 100 41.174 -15.887 -17.698 1.00 0.00 N ATOM 0 H ARG A 100 39.520 -12.445 -19.394 1.00 0.00 H new ATOM 0 HA ARG A 100 38.015 -11.903 -21.641 1.00 0.00 H new ATOM 0 HB2 ARG A 100 39.554 -14.484 -21.256 1.00 0.00 H new ATOM 0 HB3 ARG A 100 39.385 -13.529 -22.716 1.00 0.00 H new ATOM 0 HG2 ARG A 100 41.604 -13.178 -22.028 1.00 0.00 H new ATOM 0 HG3 ARG A 100 40.758 -11.716 -21.562 1.00 0.00 H new ATOM 0 HD2 ARG A 100 42.462 -12.817 -19.903 1.00 0.00 H new ATOM 0 HD3 ARG A 100 40.969 -12.137 -19.287 1.00 0.00 H new ATOM 0 HE ARG A 100 40.312 -14.793 -19.771 1.00 0.00 H new ATOM 0 HH11 ARG A 100 42.929 -13.197 -17.980 1.00 0.00 H new ATOM 0 HH12 ARG A 100 43.017 -14.473 -16.760 1.00 0.00 H new ATOM 0 HH21 ARG A 100 40.414 -16.395 -18.150 1.00 0.00 H new ATOM 0 HH22 ARG A 100 41.609 -16.263 -16.856 1.00 0.00 H new ATOM 1645 N ASP A 101 37.068 -14.593 -19.983 1.00 0.00 N ATOM 1646 CA ASP A 101 36.086 -15.659 -19.853 1.00 0.00 C ATOM 1647 C ASP A 101 34.684 -15.131 -19.568 1.00 0.00 C ATOM 1648 O ASP A 101 33.720 -15.608 -20.169 1.00 0.00 O ATOM 1649 CB ASP A 101 36.598 -16.626 -18.791 1.00 0.00 C ATOM 1650 CG ASP A 101 37.980 -17.133 -19.203 1.00 0.00 C ATOM 1651 OD1 ASP A 101 38.892 -17.095 -18.348 1.00 0.00 O ATOM 1652 OD2 ASP A 101 38.100 -17.552 -20.375 1.00 0.00 O1- ATOM 0 H ASP A 101 37.708 -14.528 -19.191 1.00 0.00 H new ATOM 0 HA ASP A 101 35.977 -16.189 -20.799 1.00 0.00 H new ATOM 0 HB2 ASP A 101 36.653 -16.127 -17.823 1.00 0.00 H new ATOM 0 HB3 ASP A 101 35.908 -17.462 -18.680 1.00 0.00 H new ATOM 1657 N LEU A 102 34.545 -14.156 -18.666 1.00 0.00 N ATOM 1658 CA LEU A 102 33.231 -13.596 -18.401 1.00 0.00 C ATOM 1659 C LEU A 102 32.809 -12.695 -19.558 1.00 0.00 C ATOM 1660 O LEU A 102 31.620 -12.618 -19.854 1.00 0.00 O ATOM 1661 CB LEU A 102 33.219 -12.870 -17.058 1.00 0.00 C ATOM 1662 CG LEU A 102 33.529 -13.805 -15.884 1.00 0.00 C ATOM 1663 CD1 LEU A 102 33.305 -13.050 -14.573 1.00 0.00 C ATOM 1664 CD2 LEU A 102 32.617 -15.035 -15.891 1.00 0.00 C ATOM 0 H LEU A 102 35.308 -13.751 -18.123 1.00 0.00 H new ATOM 0 HA LEU A 102 32.498 -14.400 -18.329 1.00 0.00 H new ATOM 0 HB2 LEU A 102 33.951 -12.062 -17.078 1.00 0.00 H new ATOM 0 HB3 LEU A 102 32.242 -12.411 -16.905 1.00 0.00 H new ATOM 0 HG LEU A 102 34.564 -14.134 -15.979 1.00 0.00 H new ATOM 0 HD11 LEU A 102 33.523 -13.708 -13.732 1.00 0.00 H new ATOM 0 HD12 LEU A 102 33.964 -12.183 -14.535 1.00 0.00 H new ATOM 0 HD13 LEU A 102 32.268 -12.720 -14.516 1.00 0.00 H new ATOM 0 HD21 LEU A 102 32.864 -15.676 -15.045 1.00 0.00 H new ATOM 0 HD22 LEU A 102 31.577 -14.717 -15.814 1.00 0.00 H new ATOM 0 HD23 LEU A 102 32.759 -15.588 -16.819 1.00 0.00 H new ATOM 1676 N LYS A 103 33.755 -12.015 -20.220 1.00 0.00 N ATOM 1677 CA LYS A 103 33.458 -11.301 -21.456 1.00 0.00 C ATOM 1678 C LYS A 103 32.824 -12.234 -22.486 1.00 0.00 C ATOM 1679 O LYS A 103 31.887 -11.826 -23.169 1.00 0.00 O ATOM 1680 CB LYS A 103 34.742 -10.720 -22.054 1.00 0.00 C ATOM 1681 CG LYS A 103 35.229 -9.477 -21.307 1.00 0.00 C ATOM 1682 CD LYS A 103 36.479 -8.929 -21.999 1.00 0.00 C ATOM 1683 CE LYS A 103 36.931 -7.654 -21.292 1.00 0.00 C ATOM 1684 NZ LYS A 103 38.051 -7.003 -22.000 1.00 0.00 N1+ ATOM 0 H LYS A 103 34.727 -11.948 -19.917 1.00 0.00 H new ATOM 0 HA LYS A 103 32.760 -10.499 -21.214 1.00 0.00 H new ATOM 0 HB2 LYS A 103 35.523 -11.480 -22.035 1.00 0.00 H new ATOM 0 HB3 LYS A 103 34.569 -10.466 -23.100 1.00 0.00 H new ATOM 0 HG2 LYS A 103 34.446 -8.719 -21.291 1.00 0.00 H new ATOM 0 HG3 LYS A 103 35.453 -9.726 -20.270 1.00 0.00 H new ATOM 0 HD2 LYS A 103 37.276 -9.672 -21.977 1.00 0.00 H new ATOM 0 HD3 LYS A 103 36.266 -8.721 -23.048 1.00 0.00 H new ATOM 0 HE2 LYS A 103 36.093 -6.961 -21.222 1.00 0.00 H new ATOM 0 HE3 LYS A 103 37.234 -7.892 -20.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 38.330 -6.141 -21.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 38.860 -7.656 -22.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 37.754 -6.753 -22.965 1.00 0.00 H new ATOM 1698 N LYS A 104 33.314 -13.476 -22.612 1.00 0.00 N ATOM 1699 CA LYS A 104 32.720 -14.435 -23.532 1.00 0.00 C ATOM 1700 C LYS A 104 31.284 -14.769 -23.134 1.00 0.00 C ATOM 1701 O LYS A 104 30.400 -14.738 -23.991 1.00 0.00 O ATOM 1702 CB LYS A 104 33.583 -15.696 -23.607 1.00 0.00 C ATOM 1703 CG LYS A 104 34.849 -15.398 -24.415 1.00 0.00 C ATOM 1704 CD LYS A 104 35.807 -16.590 -24.438 1.00 0.00 C ATOM 1705 CE LYS A 104 36.339 -16.832 -23.028 1.00 0.00 C ATOM 1706 NZ LYS A 104 37.371 -17.885 -22.983 1.00 0.00 N1+ ATOM 0 H LYS A 104 34.115 -13.831 -22.089 1.00 0.00 H new ATOM 0 HA LYS A 104 32.683 -13.984 -24.523 1.00 0.00 H new ATOM 0 HB2 LYS A 104 33.849 -16.029 -22.604 1.00 0.00 H new ATOM 0 HB3 LYS A 104 33.023 -16.506 -24.074 1.00 0.00 H new ATOM 0 HG2 LYS A 104 34.574 -15.134 -25.436 1.00 0.00 H new ATOM 0 HG3 LYS A 104 35.357 -14.533 -23.988 1.00 0.00 H new ATOM 0 HD2 LYS A 104 35.292 -17.479 -24.803 1.00 0.00 H new ATOM 0 HD3 LYS A 104 36.632 -16.396 -25.123 1.00 0.00 H new ATOM 0 HE2 LYS A 104 36.755 -15.904 -22.637 1.00 0.00 H new ATOM 0 HE3 LYS A 104 35.512 -17.111 -22.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 37.841 -17.871 -22.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 36.927 -18.813 -23.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 38.075 -17.714 -23.730 1.00 0.00 H new ATOM 1720 N LYS A 105 31.025 -15.084 -21.861 1.00 0.00 N ATOM 1721 CA LYS A 105 29.659 -15.384 -21.439 1.00 0.00 C ATOM 1722 C LYS A 105 28.761 -14.166 -21.632 1.00 0.00 C ATOM 1723 O LYS A 105 27.626 -14.291 -22.093 1.00 0.00 O ATOM 1724 CB LYS A 105 29.639 -15.820 -19.975 1.00 0.00 C ATOM 1725 CG LYS A 105 30.465 -17.095 -19.782 1.00 0.00 C ATOM 1726 CD LYS A 105 29.938 -17.925 -18.609 1.00 0.00 C ATOM 1727 CE LYS A 105 28.577 -18.508 -18.992 1.00 0.00 C ATOM 1728 NZ LYS A 105 27.978 -19.292 -17.894 1.00 0.00 N1+ ATOM 0 H LYS A 105 31.727 -15.137 -21.122 1.00 0.00 H new ATOM 0 HA LYS A 105 29.281 -16.200 -22.055 1.00 0.00 H new ATOM 0 HB2 LYS A 105 30.038 -15.023 -19.347 1.00 0.00 H new ATOM 0 HB3 LYS A 105 28.611 -15.994 -19.656 1.00 0.00 H new ATOM 0 HG2 LYS A 105 30.437 -17.691 -20.694 1.00 0.00 H new ATOM 0 HG3 LYS A 105 31.508 -16.832 -19.605 1.00 0.00 H new ATOM 0 HD2 LYS A 105 30.638 -18.725 -18.368 1.00 0.00 H new ATOM 0 HD3 LYS A 105 29.846 -17.304 -17.718 1.00 0.00 H new ATOM 0 HE2 LYS A 105 27.902 -17.698 -19.269 1.00 0.00 H new ATOM 0 HE3 LYS A 105 28.690 -19.143 -19.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 27.166 -19.832 -18.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 28.687 -19.949 -17.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 27.659 -18.648 -17.142 1.00 0.00 H new ATOM 1742 N LEU A 106 29.279 -12.989 -21.279 1.00 0.00 N ATOM 1743 CA LEU A 106 28.569 -11.729 -21.416 1.00 0.00 C ATOM 1744 C LEU A 106 28.264 -11.446 -22.883 1.00 0.00 C ATOM 1745 O LEU A 106 27.154 -11.032 -23.215 1.00 0.00 O ATOM 1746 CB LEU A 106 29.444 -10.632 -20.801 1.00 0.00 C ATOM 1747 CG LEU A 106 28.925 -9.215 -21.043 1.00 0.00 C ATOM 1748 CD1 LEU A 106 27.518 -9.044 -20.489 1.00 0.00 C ATOM 1749 CD2 LEU A 106 29.844 -8.244 -20.313 1.00 0.00 C ATOM 0 H LEU A 106 30.215 -12.889 -20.886 1.00 0.00 H new ATOM 0 HA LEU A 106 27.611 -11.767 -20.897 1.00 0.00 H new ATOM 0 HB2 LEU A 106 29.520 -10.802 -19.727 1.00 0.00 H new ATOM 0 HB3 LEU A 106 30.452 -10.714 -21.209 1.00 0.00 H new ATOM 0 HG LEU A 106 28.905 -9.025 -22.116 1.00 0.00 H new ATOM 0 HD11 LEU A 106 27.175 -8.026 -20.676 1.00 0.00 H new ATOM 0 HD12 LEU A 106 26.846 -9.749 -20.978 1.00 0.00 H new ATOM 0 HD13 LEU A 106 27.524 -9.234 -19.416 1.00 0.00 H new ATOM 0 HD21 LEU A 106 29.494 -7.224 -20.470 1.00 0.00 H new ATOM 0 HD22 LEU A 106 29.838 -8.469 -19.247 1.00 0.00 H new ATOM 0 HD23 LEU A 106 30.859 -8.343 -20.699 1.00 0.00 H new ATOM 1761 N SER A 107 29.240 -11.665 -23.766 1.00 0.00 N ATOM 1762 CA SER A 107 29.067 -11.416 -25.185 1.00 0.00 C ATOM 1763 C SER A 107 27.970 -12.299 -25.763 1.00 0.00 C ATOM 1764 O SER A 107 27.183 -11.830 -26.583 1.00 0.00 O ATOM 1765 CB SER A 107 30.394 -11.653 -25.908 1.00 0.00 C ATOM 1766 OG SER A 107 30.223 -11.471 -27.294 1.00 0.00 O ATOM 0 H SER A 107 30.163 -12.017 -23.513 1.00 0.00 H new ATOM 0 HA SER A 107 28.763 -10.379 -25.329 1.00 0.00 H new ATOM 0 HB2 SER A 107 31.151 -10.964 -25.532 1.00 0.00 H new ATOM 0 HB3 SER A 107 30.753 -12.662 -25.706 1.00 0.00 H new ATOM 0 HG SER A 107 31.076 -11.623 -27.752 1.00 0.00 H new ATOM 1772 N ARG A 108 27.896 -13.573 -25.352 1.00 0.00 N ATOM 1773 CA ARG A 108 26.817 -14.425 -25.818 1.00 0.00 C ATOM 1774 C ARG A 108 25.473 -13.893 -25.335 1.00 0.00 C ATOM 1775 O ARG A 108 24.523 -13.899 -26.110 1.00 0.00 O ATOM 1776 CB ARG A 108 27.036 -15.869 -25.370 1.00 0.00 C ATOM 1777 CG ARG A 108 28.289 -16.427 -26.045 1.00 0.00 C ATOM 1778 CD ARG A 108 28.302 -17.952 -25.983 1.00 0.00 C ATOM 1779 NE ARG A 108 28.263 -18.454 -24.605 1.00 0.00 N ATOM 1780 CZ ARG A 108 27.452 -19.428 -24.182 1.00 0.00 C ATOM 1781 NH1 ARG A 108 26.578 -20.003 -25.012 1.00 0.00 N1+ ATOM 1782 NH2 ARG A 108 27.510 -19.836 -22.916 1.00 0.00 N ATOM 0 H ARG A 108 28.556 -14.018 -24.715 1.00 0.00 H new ATOM 0 HA ARG A 108 26.811 -14.414 -26.908 1.00 0.00 H new ATOM 0 HB2 ARG A 108 27.144 -15.912 -24.286 1.00 0.00 H new ATOM 0 HB3 ARG A 108 26.169 -16.477 -25.629 1.00 0.00 H new ATOM 0 HG2 ARG A 108 28.324 -16.100 -27.084 1.00 0.00 H new ATOM 0 HG3 ARG A 108 29.179 -16.031 -25.556 1.00 0.00 H new ATOM 0 HD2 ARG A 108 27.447 -18.343 -26.534 1.00 0.00 H new ATOM 0 HD3 ARG A 108 29.198 -18.326 -26.478 1.00 0.00 H new ATOM 0 HE ARG A 108 28.896 -18.032 -23.926 1.00 0.00 H new ATOM 0 HH11 ARG A 108 26.523 -19.700 -25.984 1.00 0.00 H new ATOM 0 HH12 ARG A 108 25.966 -20.745 -24.674 1.00 0.00 H new ATOM 0 HH21 ARG A 108 28.173 -19.405 -22.271 1.00 0.00 H new ATOM 0 HH22 ARG A 108 26.892 -20.579 -22.591 1.00 0.00 H new ATOM 1796 N VAL A 109 25.379 -13.437 -24.081 1.00 0.00 N ATOM 1797 CA VAL A 109 24.130 -12.872 -23.590 1.00 0.00 C ATOM 1798 C VAL A 109 23.698 -11.720 -24.487 1.00 0.00 C ATOM 1799 O VAL A 109 22.545 -11.667 -24.907 1.00 0.00 O ATOM 1800 CB VAL A 109 24.273 -12.409 -22.130 1.00 0.00 C ATOM 1801 CG1 VAL A 109 23.096 -11.529 -21.702 1.00 0.00 C ATOM 1802 CG2 VAL A 109 24.331 -13.609 -21.190 1.00 0.00 C ATOM 0 H VAL A 109 26.141 -13.450 -23.403 1.00 0.00 H new ATOM 0 HA VAL A 109 23.361 -13.644 -23.616 1.00 0.00 H new ATOM 0 HB VAL A 109 25.197 -11.834 -22.070 1.00 0.00 H new ATOM 0 HG11 VAL A 109 23.231 -11.220 -20.665 1.00 0.00 H new ATOM 0 HG12 VAL A 109 23.050 -10.647 -22.340 1.00 0.00 H new ATOM 0 HG13 VAL A 109 22.168 -12.092 -21.795 1.00 0.00 H new ATOM 0 HG21 VAL A 109 24.432 -13.261 -20.162 1.00 0.00 H new ATOM 0 HG22 VAL A 109 23.415 -14.192 -21.287 1.00 0.00 H new ATOM 0 HG23 VAL A 109 25.187 -14.232 -21.448 1.00 0.00 H new ATOM 1812 N VAL A 110 24.614 -10.796 -24.786 1.00 0.00 N ATOM 1813 CA VAL A 110 24.293 -9.644 -25.614 1.00 0.00 C ATOM 1814 C VAL A 110 23.830 -10.087 -26.996 1.00 0.00 C ATOM 1815 O VAL A 110 22.838 -9.568 -27.507 1.00 0.00 O ATOM 1816 CB VAL A 110 25.517 -8.729 -25.710 1.00 0.00 C ATOM 1817 CG1 VAL A 110 25.246 -7.562 -26.660 1.00 0.00 C ATOM 1818 CG2 VAL A 110 25.856 -8.171 -24.330 1.00 0.00 C ATOM 0 H VAL A 110 25.582 -10.828 -24.465 1.00 0.00 H new ATOM 0 HA VAL A 110 23.474 -9.089 -25.156 1.00 0.00 H new ATOM 0 HB VAL A 110 26.352 -9.317 -26.092 1.00 0.00 H new ATOM 0 HG11 VAL A 110 26.128 -6.924 -26.714 1.00 0.00 H new ATOM 0 HG12 VAL A 110 25.016 -7.947 -27.653 1.00 0.00 H new ATOM 0 HG13 VAL A 110 24.400 -6.981 -26.291 1.00 0.00 H new ATOM 0 HG21 VAL A 110 26.728 -7.521 -24.405 1.00 0.00 H new ATOM 0 HG22 VAL A 110 25.009 -7.600 -23.950 1.00 0.00 H new ATOM 0 HG23 VAL A 110 26.074 -8.993 -23.649 1.00 0.00 H new ATOM 1828 N ASN A 111 24.533 -11.043 -27.609 1.00 0.00 N ATOM 1829 CA ASN A 111 24.177 -11.510 -28.939 1.00 0.00 C ATOM 1830 C ASN A 111 22.844 -12.249 -28.935 1.00 0.00 C ATOM 1831 O ASN A 111 22.041 -12.058 -29.840 1.00 0.00 O ATOM 1832 CB ASN A 111 25.307 -12.381 -29.478 1.00 0.00 C ATOM 1833 CG ASN A 111 26.426 -11.486 -29.991 1.00 0.00 C ATOM 1834 OD1 ASN A 111 26.268 -10.824 -31.016 1.00 0.00 O ATOM 1835 ND2 ASN A 111 27.560 -11.455 -29.295 1.00 0.00 N ATOM 0 H ASN A 111 25.348 -11.503 -27.203 1.00 0.00 H new ATOM 0 HA ASN A 111 24.047 -10.652 -29.598 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.682 -13.039 -28.694 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.939 -13.020 -30.281 1.00 0.00 H new ATOM 0 HD21 ASN A 111 28.334 -10.869 -29.607 1.00 0.00 H new ATOM 0 HD22 ASN A 111 27.655 -12.018 -28.449 1.00 0.00 H new ATOM 1842 N ILE A 112 22.597 -13.089 -27.930 1.00 0.00 N ATOM 1843 CA ILE A 112 21.352 -13.832 -27.853 1.00 0.00 C ATOM 1844 C ILE A 112 20.186 -12.876 -27.591 1.00 0.00 C ATOM 1845 O ILE A 112 19.074 -13.123 -28.052 1.00 0.00 O ATOM 1846 CB ILE A 112 21.497 -14.924 -26.786 1.00 0.00 C ATOM 1847 CG1 ILE A 112 22.434 -16.009 -27.336 1.00 0.00 C ATOM 1848 CG2 ILE A 112 20.138 -15.537 -26.434 1.00 0.00 C ATOM 1849 CD1 ILE A 112 23.117 -16.777 -26.207 1.00 0.00 C ATOM 0 H ILE A 112 23.245 -13.268 -27.162 1.00 0.00 H new ATOM 0 HA ILE A 112 21.131 -14.325 -28.799 1.00 0.00 H new ATOM 0 HB ILE A 112 21.907 -14.488 -25.875 1.00 0.00 H new ATOM 0 HG12 ILE A 112 21.867 -16.701 -27.958 1.00 0.00 H new ATOM 0 HG13 ILE A 112 23.189 -15.551 -27.975 1.00 0.00 H new ATOM 0 HG21 ILE A 112 20.272 -16.308 -25.675 1.00 0.00 H new ATOM 0 HG22 ILE A 112 19.477 -14.760 -26.049 1.00 0.00 H new ATOM 0 HG23 ILE A 112 19.696 -15.980 -27.327 1.00 0.00 H new ATOM 0 HD11 ILE A 112 23.773 -17.538 -26.630 1.00 0.00 H new ATOM 0 HD12 ILE A 112 23.704 -16.087 -25.601 1.00 0.00 H new ATOM 0 HD13 ILE A 112 22.362 -17.255 -25.583 1.00 0.00 H new ATOM 1861 N LEU A 113 20.423 -11.784 -26.856 1.00 0.00 N ATOM 1862 CA LEU A 113 19.404 -10.764 -26.644 1.00 0.00 C ATOM 1863 C LEU A 113 19.099 -10.038 -27.953 1.00 0.00 C ATOM 1864 O LEU A 113 17.938 -9.783 -28.268 1.00 0.00 O ATOM 1865 CB LEU A 113 19.911 -9.770 -25.599 1.00 0.00 C ATOM 1866 CG LEU A 113 19.859 -10.371 -24.189 1.00 0.00 C ATOM 1867 CD1 LEU A 113 20.648 -9.493 -23.223 1.00 0.00 C ATOM 1868 CD2 LEU A 113 18.416 -10.461 -23.703 1.00 0.00 C ATOM 0 H LEU A 113 21.314 -11.589 -26.400 1.00 0.00 H new ATOM 0 HA LEU A 113 18.486 -11.234 -26.292 1.00 0.00 H new ATOM 0 HB2 LEU A 113 20.935 -9.480 -25.836 1.00 0.00 H new ATOM 0 HB3 LEU A 113 19.307 -8.863 -25.633 1.00 0.00 H new ATOM 0 HG LEU A 113 20.293 -11.370 -24.225 1.00 0.00 H new ATOM 0 HD11 LEU A 113 20.608 -9.925 -22.223 1.00 0.00 H new ATOM 0 HD12 LEU A 113 21.686 -9.433 -23.551 1.00 0.00 H new ATOM 0 HD13 LEU A 113 20.215 -8.493 -23.204 1.00 0.00 H new ATOM 0 HD21 LEU A 113 18.396 -10.889 -22.701 1.00 0.00 H new ATOM 0 HD22 LEU A 113 17.977 -9.464 -23.680 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.843 -11.094 -24.380 1.00 0.00 H new ATOM 1880 N LYS A 114 20.148 -9.709 -28.712 1.00 0.00 N ATOM 1881 CA LYS A 114 20.022 -9.128 -30.042 1.00 0.00 C ATOM 1882 C LYS A 114 19.248 -10.056 -30.971 1.00 0.00 C ATOM 1883 O LYS A 114 18.305 -9.622 -31.626 1.00 0.00 O ATOM 1884 CB LYS A 114 21.413 -8.887 -30.632 1.00 0.00 C ATOM 1885 CG LYS A 114 22.144 -7.727 -29.959 1.00 0.00 C ATOM 1886 CD LYS A 114 23.647 -7.812 -30.250 1.00 0.00 C ATOM 1887 CE LYS A 114 23.934 -7.968 -31.742 1.00 0.00 C ATOM 1888 NZ LYS A 114 25.334 -8.367 -31.983 1.00 0.00 N1+ ATOM 0 H LYS A 114 21.114 -9.841 -28.414 1.00 0.00 H new ATOM 0 HA LYS A 114 19.481 -8.186 -29.951 1.00 0.00 H new ATOM 0 HB2 LYS A 114 22.009 -9.794 -30.531 1.00 0.00 H new ATOM 0 HB3 LYS A 114 21.321 -8.683 -31.699 1.00 0.00 H new ATOM 0 HG2 LYS A 114 21.748 -6.778 -30.322 1.00 0.00 H new ATOM 0 HG3 LYS A 114 21.972 -7.754 -28.883 1.00 0.00 H new ATOM 0 HD2 LYS A 114 24.139 -6.913 -29.878 1.00 0.00 H new ATOM 0 HD3 LYS A 114 24.074 -8.656 -29.709 1.00 0.00 H new ATOM 0 HE2 LYS A 114 23.263 -8.715 -32.167 1.00 0.00 H new ATOM 0 HE3 LYS A 114 23.729 -7.028 -32.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 25.470 -8.563 -32.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 25.970 -7.597 -31.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 25.551 -9.222 -31.433 1.00 0.00 H new ATOM 1902 N GLU A 115 19.645 -11.330 -31.029 1.00 0.00 N ATOM 1903 CA GLU A 115 18.999 -12.323 -31.877 1.00 0.00 C ATOM 1904 C GLU A 115 17.523 -12.459 -31.524 1.00 0.00 C ATOM 1905 O GLU A 115 16.685 -12.639 -32.406 1.00 0.00 O ATOM 1906 CB GLU A 115 19.700 -13.672 -31.694 1.00 0.00 C ATOM 1907 CG GLU A 115 21.121 -13.649 -32.262 1.00 0.00 C ATOM 1908 CD GLU A 115 22.028 -14.665 -31.570 1.00 0.00 C ATOM 1909 OE1 GLU A 115 21.488 -15.632 -30.989 1.00 0.00 O ATOM 1910 OE2 GLU A 115 23.260 -14.454 -31.634 1.00 0.00 O1- ATOM 0 H GLU A 115 20.426 -11.698 -30.486 1.00 0.00 H new ATOM 0 HA GLU A 115 19.074 -12.002 -32.916 1.00 0.00 H new ATOM 0 HB2 GLU A 115 19.735 -13.924 -30.634 1.00 0.00 H new ATOM 0 HB3 GLU A 115 19.122 -14.453 -32.188 1.00 0.00 H new ATOM 0 HG2 GLU A 115 21.088 -13.861 -33.331 1.00 0.00 H new ATOM 0 HG3 GLU A 115 21.542 -12.650 -32.148 1.00 0.00 H new ATOM 1917 N ARG A 116 17.205 -12.371 -30.229 1.00 0.00 N ATOM 1918 CA ARG A 116 15.833 -12.422 -29.752 1.00 0.00 C ATOM 1919 C ARG A 116 15.115 -11.074 -29.890 1.00 0.00 C ATOM 1920 O ARG A 116 13.941 -10.968 -29.544 1.00 0.00 O ATOM 1921 CB ARG A 116 15.836 -12.893 -28.306 1.00 0.00 C ATOM 1922 CG ARG A 116 16.278 -14.348 -28.261 1.00 0.00 C ATOM 1923 CD ARG A 116 16.446 -14.773 -26.809 1.00 0.00 C ATOM 1924 NE ARG A 116 16.971 -16.134 -26.763 1.00 0.00 N ATOM 1925 CZ ARG A 116 16.550 -17.082 -25.917 1.00 0.00 C ATOM 1926 NH1 ARG A 116 15.588 -16.839 -25.028 1.00 0.00 N1+ ATOM 1927 NH2 ARG A 116 17.092 -18.298 -25.951 1.00 0.00 N ATOM 0 H ARG A 116 17.897 -12.263 -29.487 1.00 0.00 H new ATOM 0 HA ARG A 116 15.277 -13.125 -30.372 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.509 -12.276 -27.710 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.841 -12.788 -27.874 1.00 0.00 H new ATOM 0 HG2 ARG A 116 15.540 -14.980 -28.755 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.217 -14.473 -28.800 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.124 -14.092 -26.295 1.00 0.00 H new ATOM 0 HD3 ARG A 116 15.489 -14.722 -26.290 1.00 0.00 H new ATOM 0 HE ARG A 116 17.710 -16.380 -27.421 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.157 -15.916 -24.983 1.00 0.00 H new ATOM 0 HH12 ARG A 116 15.283 -17.576 -24.393 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.830 -18.509 -26.623 1.00 0.00 H new ATOM 0 HH22 ARG A 116 16.769 -19.018 -25.305 1.00 0.00 H new ATOM 1941 N ASN A 117 15.792 -10.037 -30.391 1.00 0.00 N ATOM 1942 CA ASN A 117 15.187 -8.730 -30.641 1.00 0.00 C ATOM 1943 C ASN A 117 14.558 -8.128 -29.382 1.00 0.00 C ATOM 1944 O ASN A 117 13.602 -7.363 -29.473 1.00 0.00 O ATOM 1945 CB ASN A 117 14.160 -8.821 -31.778 1.00 0.00 C ATOM 1946 CG ASN A 117 14.519 -9.875 -32.798 1.00 0.00 C ATOM 1947 OD1 ASN A 117 14.004 -11.078 -32.559 1.00 0.00 O flip ATOM 1948 ND2 ASN A 117 15.233 -9.610 -33.763 1.00 0.00 N flip ATOM 0 H ASN A 117 16.781 -10.083 -30.635 1.00 0.00 H new ATOM 0 HA ASN A 117 15.988 -8.056 -30.945 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.178 -9.044 -31.360 1.00 0.00 H new ATOM 0 HB3 ASN A 117 14.083 -7.853 -32.272 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.595 -8.664 -33.885 1.00 0.00 H new ATOM 0 HD22 ASN A 117 15.464 -10.336 -34.441 1.00 0.00 H new ATOM 1955 N ILE A 118 15.094 -8.472 -28.210 1.00 0.00 N ATOM 1956 CA ILE A 118 14.528 -8.063 -26.934 1.00 0.00 C ATOM 1957 C ILE A 118 14.500 -6.543 -26.797 1.00 0.00 C ATOM 1958 O ILE A 118 13.431 -5.955 -26.635 1.00 0.00 O ATOM 1959 CB ILE A 118 15.339 -8.714 -25.812 1.00 0.00 C ATOM 1960 CG1 ILE A 118 15.430 -10.231 -26.020 1.00 0.00 C ATOM 1961 CG2 ILE A 118 14.702 -8.377 -24.468 1.00 0.00 C ATOM 1962 CD1 ILE A 118 14.075 -10.906 -26.221 1.00 0.00 C ATOM 0 H ILE A 118 15.935 -9.043 -28.124 1.00 0.00 H new ATOM 0 HA ILE A 118 13.492 -8.395 -26.872 1.00 0.00 H new ATOM 0 HB ILE A 118 16.356 -8.322 -25.826 1.00 0.00 H new ATOM 0 HG12 ILE A 118 16.059 -10.433 -26.887 1.00 0.00 H new ATOM 0 HG13 ILE A 118 15.924 -10.678 -25.157 1.00 0.00 H new ATOM 0 HG21 ILE A 118 15.278 -8.840 -23.666 1.00 0.00 H new ATOM 0 HG22 ILE A 118 14.693 -7.296 -24.331 1.00 0.00 H new ATOM 0 HG23 ILE A 118 13.680 -8.755 -24.445 1.00 0.00 H new ATOM 0 HD11 ILE A 118 14.219 -11.977 -26.362 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.450 -10.736 -25.344 1.00 0.00 H new ATOM 0 HD13 ILE A 118 13.587 -10.487 -27.101 1.00 0.00 H new ATOM 1974 N PHE A 119 15.670 -5.903 -26.860 1.00 0.00 N ATOM 1975 CA PHE A 119 15.755 -4.452 -26.913 1.00 0.00 C ATOM 1976 C PHE A 119 15.406 -3.917 -28.299 1.00 0.00 C ATOM 1977 O PHE A 119 15.306 -4.676 -29.261 1.00 0.00 O ATOM 1978 CB PHE A 119 17.174 -4.016 -26.563 1.00 0.00 C ATOM 1979 CG PHE A 119 17.742 -4.744 -25.375 1.00 0.00 C ATOM 1980 CD1 PHE A 119 18.880 -5.542 -25.539 1.00 0.00 C ATOM 1981 CD2 PHE A 119 17.134 -4.628 -24.118 1.00 0.00 C ATOM 1982 CE1 PHE A 119 19.411 -6.232 -24.444 1.00 0.00 C ATOM 1983 CE2 PHE A 119 17.672 -5.313 -23.020 1.00 0.00 C ATOM 1984 CZ PHE A 119 18.811 -6.116 -23.181 1.00 0.00 C ATOM 0 H PHE A 119 16.574 -6.376 -26.875 1.00 0.00 H new ATOM 0 HA PHE A 119 15.038 -4.049 -26.197 1.00 0.00 H new ATOM 0 HB2 PHE A 119 17.821 -4.180 -27.425 1.00 0.00 H new ATOM 0 HB3 PHE A 119 17.179 -2.945 -26.361 1.00 0.00 H new ATOM 0 HD1 PHE A 119 19.347 -5.625 -26.509 1.00 0.00 H new ATOM 0 HD2 PHE A 119 16.254 -4.013 -23.996 1.00 0.00 H new ATOM 0 HE1 PHE A 119 20.284 -6.855 -24.571 1.00 0.00 H new ATOM 0 HE2 PHE A 119 17.209 -5.223 -22.048 1.00 0.00 H new ATOM 0 HZ PHE A 119 19.225 -6.644 -22.335 1.00 0.00 H new ATOM 1994 N SER A 120 15.221 -2.597 -28.396 1.00 0.00 N ATOM 1995 CA SER A 120 14.978 -1.957 -29.677 1.00 0.00 C ATOM 1996 C SER A 120 16.273 -1.997 -30.481 1.00 0.00 C ATOM 1997 O SER A 120 17.358 -1.969 -29.903 1.00 0.00 O ATOM 1998 CB SER A 120 14.523 -0.514 -29.458 1.00 0.00 C ATOM 1999 OG SER A 120 14.398 0.146 -30.698 1.00 0.00 O ATOM 0 H SER A 120 15.236 -1.959 -27.601 1.00 0.00 H new ATOM 0 HA SER A 120 14.191 -2.479 -30.222 1.00 0.00 H new ATOM 0 HB2 SER A 120 13.568 -0.501 -28.932 1.00 0.00 H new ATOM 0 HB3 SER A 120 15.241 0.011 -28.828 1.00 0.00 H new ATOM 0 HG SER A 120 14.105 1.069 -30.549 1.00 0.00 H new ATOM 2005 N LYS A 121 16.176 -2.061 -31.810 1.00 0.00 N ATOM 2006 CA LYS A 121 17.369 -2.109 -32.637 1.00 0.00 C ATOM 2007 C LYS A 121 18.208 -0.845 -32.444 1.00 0.00 C ATOM 2008 O LYS A 121 19.414 -0.869 -32.682 1.00 0.00 O ATOM 2009 CB LYS A 121 16.977 -2.362 -34.094 1.00 0.00 C ATOM 2010 CG LYS A 121 16.315 -3.741 -34.184 1.00 0.00 C ATOM 2011 CD LYS A 121 16.024 -4.132 -35.637 1.00 0.00 C ATOM 2012 CE LYS A 121 15.279 -5.471 -35.678 1.00 0.00 C ATOM 2013 NZ LYS A 121 16.082 -6.567 -35.098 1.00 0.00 N1+ ATOM 0 H LYS A 121 15.296 -2.080 -32.325 1.00 0.00 H new ATOM 0 HA LYS A 121 18.003 -2.941 -32.329 1.00 0.00 H new ATOM 0 HB2 LYS A 121 16.292 -1.589 -34.442 1.00 0.00 H new ATOM 0 HB3 LYS A 121 17.857 -2.321 -34.736 1.00 0.00 H new ATOM 0 HG2 LYS A 121 16.965 -4.488 -33.729 1.00 0.00 H new ATOM 0 HG3 LYS A 121 15.386 -3.737 -33.614 1.00 0.00 H new ATOM 0 HD2 LYS A 121 15.426 -3.358 -36.118 1.00 0.00 H new ATOM 0 HD3 LYS A 121 16.957 -4.208 -36.196 1.00 0.00 H new ATOM 0 HE2 LYS A 121 14.340 -5.381 -35.132 1.00 0.00 H new ATOM 0 HE3 LYS A 121 15.025 -5.714 -36.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 15.750 -7.478 -35.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 17.083 -6.433 -35.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 15.979 -6.563 -34.063 1.00 0.00 H new ATOM 2027 N GLN A 122 17.589 0.260 -32.013 1.00 0.00 N ATOM 2028 CA GLN A 122 18.331 1.454 -31.644 1.00 0.00 C ATOM 2029 C GLN A 122 19.230 1.139 -30.451 1.00 0.00 C ATOM 2030 O GLN A 122 20.435 1.370 -30.494 1.00 0.00 O ATOM 2031 CB GLN A 122 17.344 2.581 -31.310 1.00 0.00 C ATOM 2032 CG GLN A 122 18.015 3.740 -30.570 1.00 0.00 C ATOM 2033 CD GLN A 122 19.179 4.304 -31.366 1.00 0.00 C ATOM 2034 OE1 GLN A 122 19.049 4.613 -32.547 1.00 0.00 O ATOM 2035 NE2 GLN A 122 20.329 4.440 -30.715 1.00 0.00 N ATOM 0 H GLN A 122 16.577 0.345 -31.914 1.00 0.00 H new ATOM 0 HA GLN A 122 18.959 1.781 -32.473 1.00 0.00 H new ATOM 0 HB2 GLN A 122 16.895 2.952 -32.231 1.00 0.00 H new ATOM 0 HB3 GLN A 122 16.534 2.183 -30.699 1.00 0.00 H new ATOM 0 HG2 GLN A 122 17.284 4.527 -30.384 1.00 0.00 H new ATOM 0 HG3 GLN A 122 18.369 3.397 -29.598 1.00 0.00 H new ATOM 0 HE21 GLN A 122 20.394 4.171 -29.733 1.00 0.00 H new ATOM 0 HE22 GLN A 122 21.147 4.813 -31.197 1.00 0.00 H new ATOM 2044 N VAL A 123 18.630 0.608 -29.382 1.00 0.00 N ATOM 2045 CA VAL A 123 19.350 0.263 -28.166 1.00 0.00 C ATOM 2046 C VAL A 123 20.428 -0.772 -28.473 1.00 0.00 C ATOM 2047 O VAL A 123 21.512 -0.722 -27.897 1.00 0.00 O ATOM 2048 CB VAL A 123 18.351 -0.260 -27.128 1.00 0.00 C ATOM 2049 CG1 VAL A 123 19.078 -0.846 -25.915 1.00 0.00 C ATOM 2050 CG2 VAL A 123 17.446 0.874 -26.654 1.00 0.00 C ATOM 0 H VAL A 123 17.631 0.407 -29.341 1.00 0.00 H new ATOM 0 HA VAL A 123 19.846 1.145 -27.760 1.00 0.00 H new ATOM 0 HB VAL A 123 17.757 -1.041 -27.602 1.00 0.00 H new ATOM 0 HG11 VAL A 123 18.347 -1.210 -25.193 1.00 0.00 H new ATOM 0 HG12 VAL A 123 19.714 -1.672 -26.236 1.00 0.00 H new ATOM 0 HG13 VAL A 123 19.692 -0.074 -25.451 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.740 0.492 -25.917 1.00 0.00 H new ATOM 0 HG22 VAL A 123 18.053 1.659 -26.203 1.00 0.00 H new ATOM 0 HG23 VAL A 123 16.898 1.282 -27.504 1.00 0.00 H new ATOM 2060 N VAL A 124 20.144 -1.712 -29.378 1.00 0.00 N ATOM 2061 CA VAL A 124 21.135 -2.699 -29.786 1.00 0.00 C ATOM 2062 C VAL A 124 22.396 -2.019 -30.307 1.00 0.00 C ATOM 2063 O VAL A 124 23.496 -2.372 -29.891 1.00 0.00 O ATOM 2064 CB VAL A 124 20.539 -3.637 -30.840 1.00 0.00 C ATOM 2065 CG1 VAL A 124 21.642 -4.415 -31.560 1.00 0.00 C ATOM 2066 CG2 VAL A 124 19.585 -4.622 -30.165 1.00 0.00 C ATOM 0 H VAL A 124 19.239 -1.807 -29.838 1.00 0.00 H new ATOM 0 HA VAL A 124 21.416 -3.292 -28.916 1.00 0.00 H new ATOM 0 HB VAL A 124 19.999 -3.036 -31.572 1.00 0.00 H new ATOM 0 HG11 VAL A 124 21.196 -5.075 -32.304 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.317 -3.716 -32.053 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.200 -5.009 -30.836 1.00 0.00 H new ATOM 0 HG21 VAL A 124 19.161 -5.290 -30.915 1.00 0.00 H new ATOM 0 HG22 VAL A 124 20.130 -5.208 -29.425 1.00 0.00 H new ATOM 0 HG23 VAL A 124 18.783 -4.072 -29.673 1.00 0.00 H new ATOM 2076 N ASN A 125 22.261 -1.046 -31.213 1.00 0.00 N ATOM 2077 CA ASN A 125 23.431 -0.373 -31.760 1.00 0.00 C ATOM 2078 C ASN A 125 24.183 0.399 -30.676 1.00 0.00 C ATOM 2079 O ASN A 125 25.407 0.493 -30.736 1.00 0.00 O ATOM 2080 CB ASN A 125 23.017 0.539 -32.916 1.00 0.00 C ATOM 2081 CG ASN A 125 22.724 -0.268 -34.175 1.00 0.00 C ATOM 2082 OD1 ASN A 125 23.610 -0.483 -34.993 1.00 0.00 O ATOM 2083 ND2 ASN A 125 21.486 -0.722 -34.343 1.00 0.00 N ATOM 0 H ASN A 125 21.367 -0.715 -31.575 1.00 0.00 H new ATOM 0 HA ASN A 125 24.117 -1.126 -32.148 1.00 0.00 H new ATOM 0 HB2 ASN A 125 22.133 1.111 -32.633 1.00 0.00 H new ATOM 0 HB3 ASN A 125 23.811 1.258 -33.118 1.00 0.00 H new ATOM 0 HD21 ASN A 125 21.251 -1.267 -35.172 1.00 0.00 H new ATOM 0 HD22 ASN A 125 20.771 -0.525 -33.642 1.00 0.00 H new ATOM 2090 N ASP A 126 23.470 0.949 -29.688 1.00 0.00 N ATOM 2091 CA ASP A 126 24.107 1.617 -28.558 1.00 0.00 C ATOM 2092 C ASP A 126 24.904 0.622 -27.722 1.00 0.00 C ATOM 2093 O ASP A 126 26.018 0.932 -27.298 1.00 0.00 O ATOM 2094 CB ASP A 126 23.025 2.294 -27.704 1.00 0.00 C ATOM 2095 CG ASP A 126 22.251 3.362 -28.477 1.00 0.00 C ATOM 2096 OD1 ASP A 126 22.882 4.026 -29.329 1.00 0.00 O ATOM 2097 OD2 ASP A 126 21.038 3.504 -28.206 1.00 0.00 O1- ATOM 0 H ASP A 126 22.451 0.943 -29.652 1.00 0.00 H new ATOM 0 HA ASP A 126 24.802 2.370 -28.929 1.00 0.00 H new ATOM 0 HB2 ASP A 126 22.329 1.538 -27.339 1.00 0.00 H new ATOM 0 HB3 ASP A 126 23.489 2.749 -26.829 1.00 0.00 H new ATOM 2102 N ILE A 127 24.345 -0.568 -27.486 1.00 0.00 N ATOM 2103 CA ILE A 127 25.045 -1.611 -26.750 1.00 0.00 C ATOM 2104 C ILE A 127 26.296 -2.036 -27.508 1.00 0.00 C ATOM 2105 O ILE A 127 27.391 -2.008 -26.948 1.00 0.00 O ATOM 2106 CB ILE A 127 24.107 -2.798 -26.493 1.00 0.00 C ATOM 2107 CG1 ILE A 127 22.990 -2.382 -25.530 1.00 0.00 C ATOM 2108 CG2 ILE A 127 24.888 -3.974 -25.900 1.00 0.00 C ATOM 2109 CD1 ILE A 127 21.860 -3.410 -25.515 1.00 0.00 C ATOM 0 H ILE A 127 23.409 -0.828 -27.796 1.00 0.00 H new ATOM 0 HA ILE A 127 25.359 -1.221 -25.782 1.00 0.00 H new ATOM 0 HB ILE A 127 23.668 -3.108 -27.442 1.00 0.00 H new ATOM 0 HG12 ILE A 127 23.396 -2.270 -24.525 1.00 0.00 H new ATOM 0 HG13 ILE A 127 22.596 -1.409 -25.825 1.00 0.00 H new ATOM 0 HG21 ILE A 127 24.210 -4.809 -25.723 1.00 0.00 H new ATOM 0 HG22 ILE A 127 25.668 -4.281 -26.597 1.00 0.00 H new ATOM 0 HG23 ILE A 127 25.343 -3.670 -24.957 1.00 0.00 H new ATOM 0 HD11 ILE A 127 21.083 -3.086 -24.822 1.00 0.00 H new ATOM 0 HD12 ILE A 127 21.439 -3.502 -26.516 1.00 0.00 H new ATOM 0 HD13 ILE A 127 22.251 -4.376 -25.196 1.00 0.00 H new ATOM 2121 N GLU A 128 26.149 -2.430 -28.777 1.00 0.00 N ATOM 2122 CA GLU A 128 27.276 -2.901 -29.571 1.00 0.00 C ATOM 2123 C GLU A 128 28.380 -1.855 -29.618 1.00 0.00 C ATOM 2124 O GLU A 128 29.555 -2.192 -29.488 1.00 0.00 O ATOM 2125 CB GLU A 128 26.796 -3.220 -30.986 1.00 0.00 C ATOM 2126 CG GLU A 128 25.833 -4.405 -30.992 1.00 0.00 C ATOM 2127 CD GLU A 128 26.509 -5.684 -30.511 1.00 0.00 C ATOM 2128 OE1 GLU A 128 27.008 -6.424 -31.384 1.00 0.00 O ATOM 2129 OE2 GLU A 128 26.519 -5.901 -29.281 1.00 0.00 O1- ATOM 0 H GLU A 128 25.257 -2.430 -29.272 1.00 0.00 H new ATOM 0 HA GLU A 128 27.682 -3.801 -29.109 1.00 0.00 H new ATOM 0 HB2 GLU A 128 26.303 -2.346 -31.411 1.00 0.00 H new ATOM 0 HB3 GLU A 128 27.653 -3.442 -31.622 1.00 0.00 H new ATOM 0 HG2 GLU A 128 24.979 -4.183 -30.353 1.00 0.00 H new ATOM 0 HG3 GLU A 128 25.447 -4.555 -32.000 1.00 0.00 H new ATOM 2136 N ARG A 129 28.005 -0.589 -29.802 1.00 0.00 N ATOM 2137 CA ARG A 129 28.940 0.520 -29.812 1.00 0.00 C ATOM 2138 C ARG A 129 29.716 0.584 -28.504 1.00 0.00 C ATOM 2139 O ARG A 129 30.945 0.643 -28.498 1.00 0.00 O ATOM 2140 CB ARG A 129 28.126 1.797 -30.023 1.00 0.00 C ATOM 2141 CG ARG A 129 28.884 3.006 -29.493 1.00 0.00 C ATOM 2142 CD ARG A 129 28.175 4.285 -29.924 1.00 0.00 C ATOM 2143 NE ARG A 129 27.206 4.722 -28.915 1.00 0.00 N ATOM 2144 CZ ARG A 129 25.880 4.711 -29.090 1.00 0.00 C ATOM 2145 NH1 ARG A 129 25.335 4.301 -30.235 1.00 0.00 N1+ ATOM 2146 NH2 ARG A 129 25.071 5.113 -28.111 1.00 0.00 N ATOM 0 H ARG A 129 27.035 -0.309 -29.949 1.00 0.00 H new ATOM 0 HA ARG A 129 29.672 0.396 -30.610 1.00 0.00 H new ATOM 0 HB2 ARG A 129 27.915 1.929 -31.084 1.00 0.00 H new ATOM 0 HB3 ARG A 129 27.165 1.711 -29.515 1.00 0.00 H new ATOM 0 HG2 ARG A 129 28.945 2.961 -28.406 1.00 0.00 H new ATOM 0 HG3 ARG A 129 29.907 3.001 -29.870 1.00 0.00 H new ATOM 0 HD2 ARG A 129 28.910 5.072 -30.091 1.00 0.00 H new ATOM 0 HD3 ARG A 129 27.665 4.119 -30.873 1.00 0.00 H new ATOM 0 HE ARG A 129 27.566 5.056 -28.021 1.00 0.00 H new ATOM 0 HH11 ARG A 129 25.932 3.987 -31.000 1.00 0.00 H new ATOM 0 HH12 ARG A 129 24.321 4.301 -30.346 1.00 0.00 H new ATOM 0 HH21 ARG A 129 25.462 5.431 -27.224 1.00 0.00 H new ATOM 0 HH22 ARG A 129 24.060 5.103 -28.248 1.00 0.00 H new ATOM 2160 N SER A 130 28.982 0.572 -27.393 1.00 0.00 N ATOM 2161 CA SER A 130 29.553 0.643 -26.064 1.00 0.00 C ATOM 2162 C SER A 130 30.551 -0.491 -25.807 1.00 0.00 C ATOM 2163 O SER A 130 31.688 -0.228 -25.420 1.00 0.00 O ATOM 2164 CB SER A 130 28.412 0.623 -25.056 1.00 0.00 C ATOM 2165 OG SER A 130 28.900 0.894 -23.764 1.00 0.00 O ATOM 0 H SER A 130 27.964 0.512 -27.398 1.00 0.00 H new ATOM 0 HA SER A 130 30.121 1.568 -25.963 1.00 0.00 H new ATOM 0 HB2 SER A 130 27.661 1.363 -25.331 1.00 0.00 H new ATOM 0 HB3 SER A 130 27.921 -0.350 -25.071 1.00 0.00 H new ATOM 0 HG SER A 130 28.172 0.805 -23.114 1.00 0.00 H new ATOM 2171 N LEU A 131 30.144 -1.749 -26.014 1.00 0.00 N ATOM 2172 CA LEU A 131 31.033 -2.882 -25.855 1.00 0.00 C ATOM 2173 C LEU A 131 32.181 -2.848 -26.859 1.00 0.00 C ATOM 2174 O LEU A 131 33.262 -3.339 -26.536 1.00 0.00 O ATOM 2175 CB LEU A 131 30.261 -4.194 -26.001 1.00 0.00 C ATOM 2176 CG LEU A 131 29.463 -4.526 -24.736 1.00 0.00 C ATOM 2177 CD1 LEU A 131 28.169 -3.724 -24.646 1.00 0.00 C ATOM 2178 CD2 LEU A 131 29.107 -6.012 -24.739 1.00 0.00 C ATOM 0 H LEU A 131 29.195 -1.998 -26.294 1.00 0.00 H new ATOM 0 HA LEU A 131 31.458 -2.820 -24.853 1.00 0.00 H new ATOM 0 HB2 LEU A 131 29.583 -4.124 -26.851 1.00 0.00 H new ATOM 0 HB3 LEU A 131 30.958 -5.004 -26.215 1.00 0.00 H new ATOM 0 HG LEU A 131 30.087 -4.270 -23.880 1.00 0.00 H new ATOM 0 HD11 LEU A 131 27.637 -3.993 -23.733 1.00 0.00 H new ATOM 0 HD12 LEU A 131 28.401 -2.659 -24.630 1.00 0.00 H new ATOM 0 HD13 LEU A 131 27.542 -3.946 -25.510 1.00 0.00 H new ATOM 0 HD21 LEU A 131 28.539 -6.252 -23.840 1.00 0.00 H new ATOM 0 HD22 LEU A 131 28.506 -6.240 -25.619 1.00 0.00 H new ATOM 0 HD23 LEU A 131 30.021 -6.605 -24.760 1.00 0.00 H new