USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=33 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 : amide:sc= -0.581! C(o=0.68!,f=-11!) USER MOD Set 1.2: A 121 LYS NZ :NH3+ 160:sc= 1.26 (180deg=0.00635) USER MOD Set 2.1: A 111 ASN : amide:sc= 0.649 K(o=1.8,f=-7.3!) USER MOD Set 2.2: A 114 LYS NZ :NH3+ 157:sc= 1.17 (180deg=-0.466!) USER MOD Set 3.1: A 74 GLN : amide:sc= 0.932 K(o=1.8,f=-11!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ -159:sc= 0.862 (180deg=-0.505) USER MOD Set 4.1: A 19 GLN :FLIP amide:sc= 0 F(o=-2.1,f=-0.76) USER MOD Set 4.2: A 66 HIS :FLIP no HD1:sc= -0.758 X(o=-0.94,f=-0.76) USER MOD Set 5.1: A 65 ASN :FLIP amide:sc= -1.51 F(o=-2.4!,f=-1.8) USER MOD Set 5.2: A 69 GLN : amide:sc= -0.245 K(o=-1.8,f=-2.7) USER MOD Single : A 7 GLN :FLIP amide:sc= -0.0381 F(o=-0.95,f=-0.038) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 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 : amide:sc= -2.17 X(o=-2.2,f=-1.7) USER MOD Single : A 14 THR OG1 : rot 87:sc= 0.729 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 137:sc= -0.368 USER MOD Single : A 23 SER OG : rot -89:sc= 1.29 USER MOD Single : A 24 SER OG : rot 75:sc= 1.19 USER MOD Single : A 26 SER OG : rot 65:sc= 0.996 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= 1.58 K(o=1.6,f=-4.6!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -176:sc= 0.488 (180deg=0.212) USER MOD Single : A 42 MET CE :methyl -140:sc= -0.0653 (180deg=-0.514) USER MOD Single : A 44 LYS NZ :NH3+ 178:sc= 0.718 (180deg=0.661) USER MOD Single : A 46 TYR OH : rot 3:sc= 0.184 USER MOD Single : A 47 MET CE :methyl -159:sc= -2.42! (180deg=-5!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN :FLIP amide:sc= -0.15 F(o=-5.5!,f=-0.15) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -169:sc= 2.84 (180deg=1.47) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.0229 USER MOD Single : A 64 MET CE :methyl -163:sc= -0.385 (180deg=-0.756) USER MOD Single : A 70 GLN : amide:sc= -2.24 K(o=-2.2,f=-3.5) USER MOD Single : A 72 LYS NZ :NH3+ 140:sc= 0.794 (180deg=-1.16!) USER MOD Single : A 78 GLN : amide:sc= -0.242 K(o=-0.24,f=-1.7) USER MOD Single : A 80 GLN : amide:sc= 0.289 K(o=0.29,f=-5.4!) USER MOD Single : A 82 SER OG : rot 84:sc= 1.13 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -2.8! C(o=-2.8!,f=-4!) USER MOD Single : A 96 GLN : amide:sc= 0.346 K(o=0.35,f=-6.4!) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 176:sc= 1.2 (180deg=1.01) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 58:sc= 1.11 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0.377 K(o=0.38,f=-0.17) USER MOD Single : A 125 ASN : amide:sc= 1.23 K(o=1.2,f=-0.22) USER MOD Single : A 130 SER OG : rot 168:sc= 0.224 USER MOD ----------------------------------------------------------------- ATOM 87 N GLN A 7 16.594 -3.167 -1.998 1.00 0.00 N ATOM 88 CA GLN A 7 15.872 -4.432 -2.117 1.00 0.00 C ATOM 89 C GLN A 7 16.471 -5.271 -3.243 1.00 0.00 C ATOM 90 O GLN A 7 16.571 -6.493 -3.131 1.00 0.00 O ATOM 91 CB GLN A 7 14.376 -4.200 -2.368 1.00 0.00 C ATOM 92 CG GLN A 7 14.077 -3.326 -3.591 1.00 0.00 C ATOM 93 CD GLN A 7 12.584 -3.232 -3.897 1.00 0.00 C ATOM 94 OE1 GLN A 7 11.727 -3.745 -3.015 1.00 0.00 O flip ATOM 95 NE2 GLN A 7 12.203 -2.697 -4.933 1.00 0.00 N flip ATOM 0 HA GLN A 7 15.974 -4.969 -1.174 1.00 0.00 H new ATOM 0 HB2 GLN A 7 13.886 -5.165 -2.495 1.00 0.00 H new ATOM 0 HB3 GLN A 7 13.938 -3.734 -1.485 1.00 0.00 H new ATOM 0 HG2 GLN A 7 14.473 -2.325 -3.422 1.00 0.00 H new ATOM 0 HG3 GLN A 7 14.597 -3.732 -4.459 1.00 0.00 H new ATOM 0 HE21 GLN A 7 12.883 -2.313 -5.589 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.206 -2.636 -5.138 1.00 0.00 H new ATOM 104 N PHE A 8 16.871 -4.607 -4.330 1.00 0.00 N ATOM 105 CA PHE A 8 17.471 -5.260 -5.474 1.00 0.00 C ATOM 106 C PHE A 8 18.857 -5.764 -5.082 1.00 0.00 C ATOM 107 O PHE A 8 19.239 -6.884 -5.414 1.00 0.00 O ATOM 108 CB PHE A 8 17.530 -4.234 -6.606 1.00 0.00 C ATOM 109 CG PHE A 8 17.537 -4.786 -8.012 1.00 0.00 C ATOM 110 CD1 PHE A 8 17.064 -3.975 -9.050 1.00 0.00 C ATOM 111 CD2 PHE A 8 18.000 -6.077 -8.300 1.00 0.00 C ATOM 112 CE1 PHE A 8 17.030 -4.456 -10.365 1.00 0.00 C ATOM 113 CE2 PHE A 8 17.994 -6.549 -9.619 1.00 0.00 C ATOM 114 CZ PHE A 8 17.505 -5.742 -10.653 1.00 0.00 C ATOM 0 H PHE A 8 16.783 -3.596 -4.432 1.00 0.00 H new ATOM 0 HA PHE A 8 16.892 -6.121 -5.808 1.00 0.00 H new ATOM 0 HB2 PHE A 8 16.675 -3.565 -6.506 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.426 -3.628 -6.472 1.00 0.00 H new ATOM 0 HD1 PHE A 8 16.723 -2.973 -8.836 1.00 0.00 H new ATOM 0 HD2 PHE A 8 18.362 -6.710 -7.503 1.00 0.00 H new ATOM 0 HE1 PHE A 8 16.638 -3.835 -11.157 1.00 0.00 H new ATOM 0 HE2 PHE A 8 18.368 -7.538 -9.839 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.494 -6.109 -11.669 1.00 0.00 H new ATOM 124 N THR A 9 19.611 -4.924 -4.369 1.00 0.00 N ATOM 125 CA THR A 9 20.960 -5.248 -3.954 1.00 0.00 C ATOM 126 C THR A 9 20.958 -6.452 -3.023 1.00 0.00 C ATOM 127 O THR A 9 21.705 -7.393 -3.261 1.00 0.00 O ATOM 128 CB THR A 9 21.591 -4.019 -3.293 1.00 0.00 C ATOM 129 OG1 THR A 9 21.611 -2.970 -4.233 1.00 0.00 O ATOM 130 CG2 THR A 9 23.014 -4.322 -2.828 1.00 0.00 C ATOM 0 H THR A 9 19.295 -4.002 -4.068 1.00 0.00 H new ATOM 0 HA THR A 9 21.559 -5.518 -4.824 1.00 0.00 H new ATOM 0 HB THR A 9 21.004 -3.737 -2.419 1.00 0.00 H new ATOM 0 HG1 THR A 9 22.011 -2.173 -3.826 1.00 0.00 H new ATOM 0 HG21 THR A 9 23.441 -3.434 -2.362 1.00 0.00 H new ATOM 0 HG22 THR A 9 22.995 -5.138 -2.105 1.00 0.00 H new ATOM 0 HG23 THR A 9 23.623 -4.611 -3.685 1.00 0.00 H new ATOM 138 N THR A 10 20.134 -6.444 -1.968 1.00 0.00 N ATOM 139 CA THR A 10 20.133 -7.555 -1.028 1.00 0.00 C ATOM 140 C THR A 10 19.705 -8.825 -1.755 1.00 0.00 C ATOM 141 O THR A 10 20.095 -9.926 -1.368 1.00 0.00 O ATOM 142 CB THR A 10 19.249 -7.243 0.182 1.00 0.00 C ATOM 143 OG1 THR A 10 19.407 -8.265 1.144 1.00 0.00 O ATOM 144 CG2 THR A 10 17.768 -7.175 -0.184 1.00 0.00 C ATOM 0 H THR A 10 19.476 -5.695 -1.752 1.00 0.00 H new ATOM 0 HA THR A 10 21.139 -7.712 -0.638 1.00 0.00 H new ATOM 0 HB THR A 10 19.558 -6.271 0.566 1.00 0.00 H new ATOM 0 HG1 THR A 10 18.845 -8.071 1.923 1.00 0.00 H new ATOM 0 HG21 THR A 10 17.183 -6.951 0.708 1.00 0.00 H new ATOM 0 HG22 THR A 10 17.612 -6.392 -0.926 1.00 0.00 H new ATOM 0 HG23 THR A 10 17.450 -8.133 -0.595 1.00 0.00 H new ATOM 152 N LYS A 11 18.902 -8.670 -2.816 1.00 0.00 N ATOM 153 CA LYS A 11 18.578 -9.782 -3.690 1.00 0.00 C ATOM 154 C LYS A 11 19.866 -10.334 -4.296 1.00 0.00 C ATOM 155 O LYS A 11 20.181 -11.503 -4.103 1.00 0.00 O ATOM 156 CB LYS A 11 17.603 -9.322 -4.782 1.00 0.00 C ATOM 157 CG LYS A 11 16.439 -10.307 -4.903 1.00 0.00 C ATOM 158 CD LYS A 11 15.491 -10.114 -3.717 1.00 0.00 C ATOM 159 CE LYS A 11 14.610 -8.892 -3.953 1.00 0.00 C ATOM 160 NZ LYS A 11 13.748 -8.631 -2.786 1.00 0.00 N1+ ATOM 0 H LYS A 11 18.471 -7.784 -3.081 1.00 0.00 H new ATOM 0 HA LYS A 11 18.093 -10.575 -3.121 1.00 0.00 H new ATOM 0 HB2 LYS A 11 17.224 -8.328 -4.545 1.00 0.00 H new ATOM 0 HB3 LYS A 11 18.124 -9.246 -5.736 1.00 0.00 H new ATOM 0 HG2 LYS A 11 15.906 -10.145 -5.840 1.00 0.00 H new ATOM 0 HG3 LYS A 11 16.813 -11.330 -4.922 1.00 0.00 H new ATOM 0 HD2 LYS A 11 14.871 -11.001 -3.587 1.00 0.00 H new ATOM 0 HD3 LYS A 11 16.064 -9.989 -2.798 1.00 0.00 H new ATOM 0 HE2 LYS A 11 15.235 -8.021 -4.150 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.993 -9.049 -4.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 13.158 -7.795 -2.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 13.137 -9.455 -2.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 14.340 -8.459 -1.949 1.00 0.00 H new ATOM 174 N LEU A 12 20.606 -9.494 -5.027 1.00 0.00 N ATOM 175 CA LEU A 12 21.831 -9.875 -5.722 1.00 0.00 C ATOM 176 C LEU A 12 22.926 -10.321 -4.767 1.00 0.00 C ATOM 177 O LEU A 12 23.852 -11.025 -5.165 1.00 0.00 O ATOM 178 CB LEU A 12 22.308 -8.669 -6.517 1.00 0.00 C ATOM 179 CG LEU A 12 21.408 -8.458 -7.731 1.00 0.00 C ATOM 180 CD1 LEU A 12 21.229 -6.968 -8.012 1.00 0.00 C ATOM 181 CD2 LEU A 12 22.020 -9.144 -8.937 1.00 0.00 C ATOM 0 H LEU A 12 20.362 -8.512 -5.152 1.00 0.00 H new ATOM 0 HA LEU A 12 21.614 -10.723 -6.371 1.00 0.00 H new ATOM 0 HB2 LEU A 12 22.297 -7.780 -5.887 1.00 0.00 H new ATOM 0 HB3 LEU A 12 23.338 -8.819 -6.839 1.00 0.00 H new ATOM 0 HG LEU A 12 20.428 -8.889 -7.526 1.00 0.00 H new ATOM 0 HD11 LEU A 12 20.584 -6.837 -8.881 1.00 0.00 H new ATOM 0 HD12 LEU A 12 20.774 -6.487 -7.146 1.00 0.00 H new ATOM 0 HD13 LEU A 12 22.201 -6.516 -8.209 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.378 -8.994 -9.805 1.00 0.00 H new ATOM 0 HD22 LEU A 12 23.004 -8.720 -9.136 1.00 0.00 H new ATOM 0 HD23 LEU A 12 22.118 -10.211 -8.738 1.00 0.00 H new ATOM 193 N ASN A 13 22.822 -9.915 -3.502 1.00 0.00 N ATOM 194 CA ASN A 13 23.736 -10.363 -2.465 1.00 0.00 C ATOM 195 C ASN A 13 23.423 -11.812 -2.089 1.00 0.00 C ATOM 196 O ASN A 13 24.205 -12.446 -1.381 1.00 0.00 O ATOM 197 CB ASN A 13 23.625 -9.455 -1.234 1.00 0.00 C ATOM 198 CG ASN A 13 23.899 -7.982 -1.524 1.00 0.00 C ATOM 199 OD1 ASN A 13 23.666 -7.137 -0.666 1.00 0.00 O ATOM 200 ND2 ASN A 13 24.388 -7.658 -2.718 1.00 0.00 N ATOM 0 H ASN A 13 22.104 -9.269 -3.174 1.00 0.00 H new ATOM 0 HA ASN A 13 24.757 -10.310 -2.842 1.00 0.00 H new ATOM 0 HB2 ASN A 13 22.624 -9.552 -0.812 1.00 0.00 H new ATOM 0 HB3 ASN A 13 24.326 -9.802 -0.475 1.00 0.00 H new ATOM 0 HD21 ASN A 13 24.580 -6.682 -2.942 1.00 0.00 H new ATOM 0 HD22 ASN A 13 24.570 -8.386 -3.409 1.00 0.00 H new ATOM 207 N THR A 14 22.281 -12.325 -2.562 1.00 0.00 N ATOM 208 CA THR A 14 21.814 -13.664 -2.237 1.00 0.00 C ATOM 209 C THR A 14 21.675 -14.550 -3.476 1.00 0.00 C ATOM 210 O THR A 14 21.655 -15.773 -3.349 1.00 0.00 O ATOM 211 CB THR A 14 20.474 -13.551 -1.504 1.00 0.00 C ATOM 212 OG1 THR A 14 20.586 -12.639 -0.434 1.00 0.00 O ATOM 213 CG2 THR A 14 20.011 -14.900 -0.951 1.00 0.00 C ATOM 0 H THR A 14 21.656 -11.813 -3.185 1.00 0.00 H new ATOM 0 HA THR A 14 22.557 -14.142 -1.598 1.00 0.00 H new ATOM 0 HB THR A 14 19.738 -13.202 -2.228 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.405 -11.732 -0.757 1.00 0.00 H new ATOM 0 HG21 THR A 14 19.057 -14.775 -0.439 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.893 -15.608 -1.771 1.00 0.00 H new ATOM 0 HG23 THR A 14 20.753 -15.279 -0.249 1.00 0.00 H new ATOM 221 N LEU A 15 21.579 -13.960 -4.675 1.00 0.00 N ATOM 222 CA LEU A 15 21.412 -14.746 -5.888 1.00 0.00 C ATOM 223 C LEU A 15 22.626 -15.623 -6.185 1.00 0.00 C ATOM 224 O LEU A 15 23.764 -15.260 -5.887 1.00 0.00 O ATOM 225 CB LEU A 15 21.050 -13.861 -7.093 1.00 0.00 C ATOM 226 CG LEU A 15 19.737 -13.108 -6.873 1.00 0.00 C ATOM 227 CD1 LEU A 15 19.336 -12.403 -8.163 1.00 0.00 C ATOM 228 CD2 LEU A 15 18.593 -14.025 -6.434 1.00 0.00 C ATOM 0 H LEU A 15 21.614 -12.951 -4.823 1.00 0.00 H new ATOM 0 HA LEU A 15 20.573 -15.419 -5.709 1.00 0.00 H new ATOM 0 HB2 LEU A 15 21.853 -13.146 -7.273 1.00 0.00 H new ATOM 0 HB3 LEU A 15 20.968 -14.480 -7.987 1.00 0.00 H new ATOM 0 HG LEU A 15 19.911 -12.391 -6.071 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.400 -11.866 -8.008 1.00 0.00 H new ATOM 0 HD12 LEU A 15 20.116 -11.698 -8.450 1.00 0.00 H new ATOM 0 HD13 LEU A 15 19.204 -13.140 -8.955 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.687 -13.435 -6.293 1.00 0.00 H new ATOM 0 HD22 LEU A 15 18.418 -14.781 -7.200 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.857 -14.513 -5.496 1.00 0.00 H new ATOM 240 N GLU A 16 22.365 -16.793 -6.779 1.00 0.00 N ATOM 241 CA GLU A 16 23.402 -17.670 -7.299 1.00 0.00 C ATOM 242 C GLU A 16 23.550 -17.425 -8.794 1.00 0.00 C ATOM 243 O GLU A 16 22.651 -16.890 -9.439 1.00 0.00 O ATOM 244 CB GLU A 16 23.063 -19.144 -7.050 1.00 0.00 C ATOM 245 CG GLU A 16 23.039 -19.505 -5.561 1.00 0.00 C ATOM 246 CD GLU A 16 23.296 -21.000 -5.361 1.00 0.00 C ATOM 247 OE1 GLU A 16 22.712 -21.808 -6.119 1.00 0.00 O ATOM 248 OE2 GLU A 16 24.081 -21.329 -4.444 1.00 0.00 O1- ATOM 0 H GLU A 16 21.420 -17.154 -6.910 1.00 0.00 H new ATOM 0 HA GLU A 16 24.336 -17.449 -6.783 1.00 0.00 H new ATOM 0 HB2 GLU A 16 22.091 -19.368 -7.489 1.00 0.00 H new ATOM 0 HB3 GLU A 16 23.794 -19.771 -7.559 1.00 0.00 H new ATOM 0 HG2 GLU A 16 23.795 -18.927 -5.030 1.00 0.00 H new ATOM 0 HG3 GLU A 16 22.073 -19.237 -5.132 1.00 0.00 H new ATOM 255 N ASP A 17 24.700 -17.828 -9.336 1.00 0.00 N ATOM 256 CA ASP A 17 25.039 -17.729 -10.748 1.00 0.00 C ATOM 257 C ASP A 17 24.223 -18.743 -11.559 1.00 0.00 C ATOM 258 O ASP A 17 24.707 -19.296 -12.545 1.00 0.00 O ATOM 259 CB ASP A 17 26.555 -17.928 -10.951 1.00 0.00 C ATOM 260 CG ASP A 17 27.451 -17.429 -9.809 1.00 0.00 C ATOM 261 OD1 ASP A 17 27.148 -17.735 -8.633 1.00 0.00 O ATOM 262 OD2 ASP A 17 28.446 -16.736 -10.115 1.00 0.00 O1- ATOM 0 H ASP A 17 25.445 -18.247 -8.780 1.00 0.00 H new ATOM 0 HA ASP A 17 24.786 -16.732 -11.108 1.00 0.00 H new ATOM 0 HB2 ASP A 17 26.746 -18.991 -11.100 1.00 0.00 H new ATOM 0 HB3 ASP A 17 26.850 -17.419 -11.869 1.00 0.00 H new ATOM 267 N SER A 18 22.974 -18.991 -11.140 1.00 0.00 N ATOM 268 CA SER A 18 22.182 -20.107 -11.631 1.00 0.00 C ATOM 269 C SER A 18 20.746 -19.734 -11.954 1.00 0.00 C ATOM 270 O SER A 18 20.142 -18.904 -11.280 1.00 0.00 O ATOM 271 CB SER A 18 22.174 -21.180 -10.550 1.00 0.00 C ATOM 272 OG SER A 18 23.489 -21.603 -10.275 1.00 0.00 O ATOM 0 H SER A 18 22.491 -18.417 -10.449 1.00 0.00 H new ATOM 0 HA SER A 18 22.635 -20.451 -12.561 1.00 0.00 H new ATOM 0 HB2 SER A 18 21.713 -20.789 -9.643 1.00 0.00 H new ATOM 0 HB3 SER A 18 21.571 -22.029 -10.874 1.00 0.00 H new ATOM 0 HG SER A 18 23.472 -22.291 -9.578 1.00 0.00 H new ATOM 278 N GLN A 19 20.198 -20.359 -13.001 1.00 0.00 N ATOM 279 CA GLN A 19 18.843 -20.117 -13.471 1.00 0.00 C ATOM 280 C GLN A 19 17.802 -20.313 -12.376 1.00 0.00 C ATOM 281 O GLN A 19 16.750 -19.679 -12.425 1.00 0.00 O ATOM 282 CB GLN A 19 18.553 -21.078 -14.626 1.00 0.00 C ATOM 283 CG GLN A 19 18.995 -20.495 -15.965 1.00 0.00 C ATOM 284 CD GLN A 19 17.984 -19.511 -16.556 1.00 0.00 C ATOM 285 OE1 GLN A 19 17.009 -19.052 -15.772 1.00 0.00 O flip ATOM 286 NE2 GLN A 19 18.087 -19.165 -17.728 1.00 0.00 N flip ATOM 0 H GLN A 19 20.698 -21.058 -13.551 1.00 0.00 H new ATOM 0 HA GLN A 19 18.777 -19.078 -13.794 1.00 0.00 H new ATOM 0 HB2 GLN A 19 19.068 -22.023 -14.452 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.486 -21.298 -14.658 1.00 0.00 H new ATOM 0 HG2 GLN A 19 19.952 -19.989 -15.836 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.157 -21.308 -16.672 1.00 0.00 H new ATOM 0 HE21 GLN A 19 18.844 -19.533 -18.304 1.00 0.00 H new ATOM 0 HE22 GLN A 19 17.416 -18.509 -18.127 1.00 0.00 H new ATOM 295 N GLU A 20 18.071 -21.173 -11.394 1.00 0.00 N ATOM 296 CA GLU A 20 17.125 -21.430 -10.321 1.00 0.00 C ATOM 297 C GLU A 20 16.900 -20.161 -9.498 1.00 0.00 C ATOM 298 O GLU A 20 15.779 -19.656 -9.393 1.00 0.00 O ATOM 299 CB GLU A 20 17.660 -22.575 -9.449 1.00 0.00 C ATOM 300 CG GLU A 20 18.093 -23.786 -10.283 1.00 0.00 C ATOM 301 CD GLU A 20 17.032 -24.210 -11.294 1.00 0.00 C ATOM 302 OE1 GLU A 20 15.833 -24.082 -10.962 1.00 0.00 O ATOM 303 OE2 GLU A 20 17.443 -24.656 -12.385 1.00 0.00 O1- ATOM 0 H GLU A 20 18.940 -21.702 -11.324 1.00 0.00 H new ATOM 0 HA GLU A 20 16.162 -21.725 -10.737 1.00 0.00 H new ATOM 0 HB2 GLU A 20 18.507 -22.218 -8.864 1.00 0.00 H new ATOM 0 HB3 GLU A 20 16.890 -22.881 -8.741 1.00 0.00 H new ATOM 0 HG2 GLU A 20 19.017 -23.548 -10.810 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.311 -24.622 -9.618 1.00 0.00 H new ATOM 310 N SER A 21 17.976 -19.637 -8.908 1.00 0.00 N ATOM 311 CA SER A 21 17.910 -18.445 -8.079 1.00 0.00 C ATOM 312 C SER A 21 17.597 -17.213 -8.927 1.00 0.00 C ATOM 313 O SER A 21 16.815 -16.359 -8.517 1.00 0.00 O ATOM 314 CB SER A 21 19.248 -18.302 -7.353 1.00 0.00 C ATOM 315 OG SER A 21 19.238 -17.154 -6.540 1.00 0.00 O ATOM 0 H SER A 21 18.913 -20.030 -8.995 1.00 0.00 H new ATOM 0 HA SER A 21 17.106 -18.534 -7.348 1.00 0.00 H new ATOM 0 HB2 SER A 21 19.436 -19.186 -6.744 1.00 0.00 H new ATOM 0 HB3 SER A 21 20.059 -18.236 -8.079 1.00 0.00 H new ATOM 0 HG SER A 21 19.642 -17.364 -5.672 1.00 0.00 H new ATOM 321 N ILE A 22 18.211 -17.128 -10.110 1.00 0.00 N ATOM 322 CA ILE A 22 18.010 -16.023 -11.036 1.00 0.00 C ATOM 323 C ILE A 22 16.558 -15.930 -11.487 1.00 0.00 C ATOM 324 O ILE A 22 15.985 -14.843 -11.477 1.00 0.00 O ATOM 325 CB ILE A 22 18.941 -16.211 -12.243 1.00 0.00 C ATOM 326 CG1 ILE A 22 20.416 -16.019 -11.857 1.00 0.00 C ATOM 327 CG2 ILE A 22 18.563 -15.235 -13.355 1.00 0.00 C ATOM 328 CD1 ILE A 22 20.739 -14.582 -11.453 1.00 0.00 C ATOM 0 H ILE A 22 18.866 -17.832 -10.450 1.00 0.00 H new ATOM 0 HA ILE A 22 18.248 -15.088 -10.528 1.00 0.00 H new ATOM 0 HB ILE A 22 18.819 -17.234 -12.599 1.00 0.00 H new ATOM 0 HG12 ILE A 22 20.661 -16.688 -11.032 1.00 0.00 H new ATOM 0 HG13 ILE A 22 21.047 -16.306 -12.698 1.00 0.00 H new ATOM 0 HG21 ILE A 22 19.229 -15.377 -14.206 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.534 -15.418 -13.665 1.00 0.00 H new ATOM 0 HG23 ILE A 22 18.655 -14.213 -12.989 1.00 0.00 H new ATOM 0 HD11 ILE A 22 21.794 -14.506 -11.191 1.00 0.00 H new ATOM 0 HD12 ILE A 22 20.523 -13.913 -12.286 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.131 -14.300 -10.594 1.00 0.00 H new ATOM 340 N SER A 23 15.952 -17.053 -11.886 1.00 0.00 N ATOM 341 CA SER A 23 14.568 -17.040 -12.342 1.00 0.00 C ATOM 342 C SER A 23 13.632 -16.673 -11.195 1.00 0.00 C ATOM 343 O SER A 23 12.596 -16.046 -11.419 1.00 0.00 O ATOM 344 CB SER A 23 14.174 -18.393 -12.932 1.00 0.00 C ATOM 345 OG SER A 23 14.230 -19.402 -11.949 1.00 0.00 O ATOM 0 H SER A 23 16.397 -17.971 -11.901 1.00 0.00 H new ATOM 0 HA SER A 23 14.478 -16.286 -13.124 1.00 0.00 H new ATOM 0 HB2 SER A 23 13.167 -18.336 -13.344 1.00 0.00 H new ATOM 0 HB3 SER A 23 14.842 -18.644 -13.756 1.00 0.00 H new ATOM 0 HG SER A 23 15.130 -19.789 -11.928 1.00 0.00 H new ATOM 351 N SER A 24 13.978 -17.056 -9.963 1.00 0.00 N ATOM 352 CA SER A 24 13.179 -16.685 -8.804 1.00 0.00 C ATOM 353 C SER A 24 13.143 -15.165 -8.650 1.00 0.00 C ATOM 354 O SER A 24 12.079 -14.576 -8.436 1.00 0.00 O ATOM 355 CB SER A 24 13.755 -17.351 -7.554 1.00 0.00 C ATOM 356 OG SER A 24 13.768 -18.756 -7.716 1.00 0.00 O ATOM 0 H SER A 24 14.801 -17.619 -9.748 1.00 0.00 H new ATOM 0 HA SER A 24 12.155 -17.030 -8.943 1.00 0.00 H new ATOM 0 HB2 SER A 24 14.767 -16.988 -7.372 1.00 0.00 H new ATOM 0 HB3 SER A 24 13.159 -17.083 -6.682 1.00 0.00 H new ATOM 0 HG SER A 24 14.498 -19.009 -8.319 1.00 0.00 H new ATOM 362 N ALA A 25 14.311 -14.523 -8.759 1.00 0.00 N ATOM 363 CA ALA A 25 14.408 -13.073 -8.693 1.00 0.00 C ATOM 364 C ALA A 25 13.820 -12.436 -9.953 1.00 0.00 C ATOM 365 O ALA A 25 13.321 -11.314 -9.897 1.00 0.00 O ATOM 366 CB ALA A 25 15.875 -12.684 -8.538 1.00 0.00 C ATOM 0 H ALA A 25 15.205 -14.995 -8.894 1.00 0.00 H new ATOM 0 HA ALA A 25 13.839 -12.710 -7.837 1.00 0.00 H new ATOM 0 HB1 ALA A 25 15.960 -11.599 -8.487 1.00 0.00 H new ATOM 0 HB2 ALA A 25 16.273 -13.122 -7.623 1.00 0.00 H new ATOM 0 HB3 ALA A 25 16.442 -13.053 -9.393 1.00 0.00 H new ATOM 372 N SER A 26 13.880 -13.147 -11.083 1.00 0.00 N ATOM 373 CA SER A 26 13.312 -12.654 -12.327 1.00 0.00 C ATOM 374 C SER A 26 11.801 -12.551 -12.188 1.00 0.00 C ATOM 375 O SER A 26 11.203 -11.584 -12.646 1.00 0.00 O ATOM 376 CB SER A 26 13.667 -13.592 -13.479 1.00 0.00 C ATOM 377 OG SER A 26 15.067 -13.714 -13.589 1.00 0.00 O ATOM 0 H SER A 26 14.318 -14.065 -11.155 1.00 0.00 H new ATOM 0 HA SER A 26 13.724 -11.668 -12.542 1.00 0.00 H new ATOM 0 HB2 SER A 26 13.221 -14.572 -13.311 1.00 0.00 H new ATOM 0 HB3 SER A 26 13.253 -13.209 -14.412 1.00 0.00 H new ATOM 0 HG SER A 26 15.422 -14.144 -12.783 1.00 0.00 H new ATOM 383 N LYS A 27 11.181 -13.550 -11.554 1.00 0.00 N ATOM 384 CA LYS A 27 9.752 -13.562 -11.326 1.00 0.00 C ATOM 385 C LYS A 27 9.386 -12.396 -10.413 1.00 0.00 C ATOM 386 O LYS A 27 8.356 -11.756 -10.617 1.00 0.00 O ATOM 387 CB LYS A 27 9.389 -14.944 -10.779 1.00 0.00 C ATOM 388 CG LYS A 27 8.124 -14.943 -9.923 1.00 0.00 C ATOM 389 CD LYS A 27 8.534 -14.869 -8.450 1.00 0.00 C ATOM 390 CE LYS A 27 9.091 -16.219 -7.991 1.00 0.00 C ATOM 391 NZ LYS A 27 9.608 -16.140 -6.613 1.00 0.00 N1+ ATOM 0 H LYS A 27 11.665 -14.370 -11.188 1.00 0.00 H new ATOM 0 HA LYS A 27 9.171 -13.413 -12.236 1.00 0.00 H new ATOM 0 HB2 LYS A 27 9.254 -15.633 -11.613 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.221 -15.322 -10.185 1.00 0.00 H new ATOM 0 HG2 LYS A 27 7.491 -14.094 -10.183 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.540 -15.845 -10.109 1.00 0.00 H new ATOM 0 HD2 LYS A 27 9.285 -14.091 -8.312 1.00 0.00 H new ATOM 0 HD3 LYS A 27 7.674 -14.594 -7.838 1.00 0.00 H new ATOM 0 HE2 LYS A 27 8.309 -16.976 -8.046 1.00 0.00 H new ATOM 0 HE3 LYS A 27 9.888 -16.535 -8.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 9.979 -17.069 -6.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 10.370 -15.434 -6.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.840 -15.862 -5.969 1.00 0.00 H new ATOM 405 N TRP A 28 10.219 -12.112 -9.405 1.00 0.00 N ATOM 406 CA TRP A 28 9.973 -10.965 -8.550 1.00 0.00 C ATOM 407 C TRP A 28 10.002 -9.671 -9.363 1.00 0.00 C ATOM 408 O TRP A 28 9.066 -8.876 -9.286 1.00 0.00 O ATOM 409 CB TRP A 28 11.003 -10.916 -7.422 1.00 0.00 C ATOM 410 CG TRP A 28 11.046 -9.610 -6.691 1.00 0.00 C ATOM 411 CD1 TRP A 28 10.048 -9.103 -5.932 1.00 0.00 C ATOM 412 CD2 TRP A 28 12.119 -8.620 -6.634 1.00 0.00 C ATOM 413 NE1 TRP A 28 10.417 -7.872 -5.434 1.00 0.00 N ATOM 414 CE2 TRP A 28 11.692 -7.525 -5.828 1.00 0.00 C ATOM 415 CE3 TRP A 28 13.414 -8.535 -7.178 1.00 0.00 C ATOM 416 CZ2 TRP A 28 12.497 -6.407 -5.582 1.00 0.00 C ATOM 417 CZ3 TRP A 28 14.229 -7.417 -6.941 1.00 0.00 C ATOM 418 CH2 TRP A 28 13.777 -6.357 -6.146 1.00 0.00 C ATOM 0 H TRP A 28 11.051 -12.654 -9.171 1.00 0.00 H new ATOM 0 HA TRP A 28 8.981 -11.067 -8.110 1.00 0.00 H new ATOM 0 HB2 TRP A 28 10.785 -11.712 -6.710 1.00 0.00 H new ATOM 0 HB3 TRP A 28 11.990 -11.121 -7.836 1.00 0.00 H new ATOM 0 HD1 TRP A 28 9.103 -9.590 -5.744 1.00 0.00 H new ATOM 0 HE1 TRP A 28 9.820 -7.289 -4.846 1.00 0.00 H new ATOM 0 HE3 TRP A 28 13.787 -9.344 -7.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 12.136 -5.596 -4.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 15.216 -7.374 -7.377 1.00 0.00 H new ATOM 0 HH2 TRP A 28 14.414 -5.503 -5.968 1.00 0.00 H new ATOM 429 N LEU A 29 11.067 -9.450 -10.141 1.00 0.00 N ATOM 430 CA LEU A 29 11.178 -8.228 -10.921 1.00 0.00 C ATOM 431 C LEU A 29 10.051 -8.140 -11.942 1.00 0.00 C ATOM 432 O LEU A 29 9.501 -7.060 -12.137 1.00 0.00 O ATOM 433 CB LEU A 29 12.526 -8.193 -11.644 1.00 0.00 C ATOM 434 CG LEU A 29 13.688 -7.771 -10.745 1.00 0.00 C ATOM 435 CD1 LEU A 29 14.980 -7.880 -11.547 1.00 0.00 C ATOM 436 CD2 LEU A 29 13.533 -6.332 -10.250 1.00 0.00 C ATOM 0 H LEU A 29 11.850 -10.095 -10.242 1.00 0.00 H new ATOM 0 HA LEU A 29 11.105 -7.378 -10.243 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.735 -9.181 -12.055 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.460 -7.505 -12.487 1.00 0.00 H new ATOM 0 HG LEU A 29 13.704 -8.425 -9.873 1.00 0.00 H new ATOM 0 HD11 LEU A 29 15.822 -7.583 -10.922 1.00 0.00 H new ATOM 0 HD12 LEU A 29 15.118 -8.910 -11.876 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.925 -7.225 -12.417 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.380 -6.073 -9.615 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.499 -5.655 -11.104 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.609 -6.241 -9.678 1.00 0.00 H new ATOM 448 N LEU A 30 9.692 -9.249 -12.596 1.00 0.00 N ATOM 449 CA LEU A 30 8.603 -9.226 -13.556 1.00 0.00 C ATOM 450 C LEU A 30 7.297 -8.803 -12.882 1.00 0.00 C ATOM 451 O LEU A 30 6.429 -8.249 -13.549 1.00 0.00 O ATOM 452 CB LEU A 30 8.441 -10.612 -14.191 1.00 0.00 C ATOM 453 CG LEU A 30 9.507 -10.968 -15.224 1.00 0.00 C ATOM 454 CD1 LEU A 30 9.238 -12.401 -15.667 1.00 0.00 C ATOM 455 CD2 LEU A 30 9.433 -10.043 -16.441 1.00 0.00 C ATOM 0 H LEU A 30 10.137 -10.159 -12.475 1.00 0.00 H new ATOM 0 HA LEU A 30 8.840 -8.499 -14.333 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.455 -11.363 -13.401 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.461 -10.667 -14.666 1.00 0.00 H new ATOM 0 HG LEU A 30 10.498 -10.858 -14.785 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.980 -12.698 -16.409 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.300 -13.066 -14.805 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.242 -12.466 -16.104 1.00 0.00 H new ATOM 0 HD21 LEU A 30 10.205 -10.323 -17.158 1.00 0.00 H new ATOM 0 HD22 LEU A 30 8.453 -10.135 -16.909 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.588 -9.012 -16.124 1.00 0.00 H new ATOM 467 N LEU A 31 7.150 -9.055 -11.574 1.00 0.00 N ATOM 468 CA LEU A 31 6.005 -8.575 -10.811 1.00 0.00 C ATOM 469 C LEU A 31 6.160 -7.107 -10.408 1.00 0.00 C ATOM 470 O LEU A 31 5.168 -6.464 -10.067 1.00 0.00 O ATOM 471 CB LEU A 31 5.808 -9.446 -9.568 1.00 0.00 C ATOM 472 CG LEU A 31 5.215 -10.805 -9.947 1.00 0.00 C ATOM 473 CD1 LEU A 31 5.496 -11.805 -8.824 1.00 0.00 C ATOM 474 CD2 LEU A 31 3.706 -10.691 -10.160 1.00 0.00 C ATOM 0 H LEU A 31 7.820 -9.594 -11.025 1.00 0.00 H new ATOM 0 HA LEU A 31 5.126 -8.646 -11.451 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.763 -9.589 -9.063 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.148 -8.939 -8.864 1.00 0.00 H new ATOM 0 HG LEU A 31 5.674 -11.145 -10.875 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.076 -12.776 -9.088 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.573 -11.901 -8.684 1.00 0.00 H new ATOM 0 HD13 LEU A 31 5.040 -11.451 -7.899 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.302 -11.667 -10.429 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.234 -10.343 -9.241 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.504 -9.981 -10.962 1.00 0.00 H new ATOM 486 N GLN A 32 7.383 -6.559 -10.438 1.00 0.00 N ATOM 487 CA GLN A 32 7.591 -5.131 -10.207 1.00 0.00 C ATOM 488 C GLN A 32 7.416 -4.326 -11.494 1.00 0.00 C ATOM 489 O GLN A 32 8.030 -3.275 -11.656 1.00 0.00 O ATOM 490 CB GLN A 32 8.953 -4.856 -9.556 1.00 0.00 C ATOM 491 CG GLN A 32 9.214 -5.765 -8.355 1.00 0.00 C ATOM 492 CD GLN A 32 7.938 -6.089 -7.590 1.00 0.00 C ATOM 493 OE1 GLN A 32 7.254 -5.204 -7.087 1.00 0.00 O ATOM 494 NE2 GLN A 32 7.615 -7.376 -7.506 1.00 0.00 N ATOM 0 H GLN A 32 8.238 -7.085 -10.620 1.00 0.00 H new ATOM 0 HA GLN A 32 6.824 -4.801 -9.506 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.742 -4.998 -10.295 1.00 0.00 H new ATOM 0 HB3 GLN A 32 8.998 -3.815 -9.238 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.676 -6.691 -8.696 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.925 -5.283 -7.684 1.00 0.00 H new ATOM 0 HE21 GLN A 32 8.212 -8.081 -7.939 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.770 -7.658 -7.009 1.00 0.00 H new ATOM 503 N TYR A 33 6.577 -4.822 -12.409 1.00 0.00 N ATOM 504 CA TYR A 33 6.402 -4.254 -13.740 1.00 0.00 C ATOM 505 C TYR A 33 6.080 -2.760 -13.730 1.00 0.00 C ATOM 506 O TYR A 33 6.396 -2.063 -14.689 1.00 0.00 O ATOM 507 CB TYR A 33 5.276 -5.018 -14.442 1.00 0.00 C ATOM 508 CG TYR A 33 4.026 -5.184 -13.606 1.00 0.00 C ATOM 509 CD1 TYR A 33 3.846 -6.359 -12.863 1.00 0.00 C ATOM 510 CD2 TYR A 33 3.049 -4.179 -13.572 1.00 0.00 C ATOM 511 CE1 TYR A 33 2.708 -6.526 -12.065 1.00 0.00 C ATOM 512 CE2 TYR A 33 1.901 -4.339 -12.784 1.00 0.00 C ATOM 513 CZ TYR A 33 1.727 -5.514 -12.023 1.00 0.00 C ATOM 514 OH TYR A 33 0.617 -5.674 -11.246 1.00 0.00 O ATOM 0 H TYR A 33 5.994 -5.641 -12.239 1.00 0.00 H new ATOM 0 HA TYR A 33 7.350 -4.356 -14.269 1.00 0.00 H new ATOM 0 HB2 TYR A 33 5.017 -4.496 -15.363 1.00 0.00 H new ATOM 0 HB3 TYR A 33 5.643 -6.004 -14.727 1.00 0.00 H new ATOM 0 HD1 TYR A 33 4.590 -7.141 -12.906 1.00 0.00 H new ATOM 0 HD2 TYR A 33 3.181 -3.279 -14.155 1.00 0.00 H new ATOM 0 HE1 TYR A 33 2.582 -7.427 -11.483 1.00 0.00 H new ATOM 0 HE2 TYR A 33 1.150 -3.563 -12.759 1.00 0.00 H new ATOM 0 HH TYR A 33 0.042 -4.885 -11.330 1.00 0.00 H new ATOM 524 N ARG A 34 5.459 -2.265 -12.656 1.00 0.00 N ATOM 525 CA ARG A 34 5.117 -0.854 -12.522 1.00 0.00 C ATOM 526 C ARG A 34 6.375 -0.011 -12.318 1.00 0.00 C ATOM 527 O ARG A 34 6.543 1.047 -12.916 1.00 0.00 O ATOM 528 CB ARG A 34 4.262 -0.652 -11.269 1.00 0.00 C ATOM 529 CG ARG A 34 3.128 -1.668 -11.107 1.00 0.00 C ATOM 530 CD ARG A 34 2.676 -1.682 -9.645 1.00 0.00 C ATOM 531 NE ARG A 34 3.816 -1.957 -8.760 1.00 0.00 N ATOM 532 CZ ARG A 34 4.397 -3.153 -8.610 1.00 0.00 C ATOM 533 NH1 ARG A 34 3.872 -4.242 -9.171 1.00 0.00 N1+ ATOM 534 NH2 ARG A 34 5.516 -3.253 -7.890 1.00 0.00 N ATOM 0 H ARG A 34 5.181 -2.835 -11.857 1.00 0.00 H new ATOM 0 HA ARG A 34 4.591 -0.555 -13.429 1.00 0.00 H new ATOM 0 HB2 ARG A 34 4.907 -0.703 -10.392 1.00 0.00 H new ATOM 0 HB3 ARG A 34 3.835 0.350 -11.293 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.293 -1.407 -11.757 1.00 0.00 H new ATOM 0 HG3 ARG A 34 3.466 -2.660 -11.406 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.230 -0.722 -9.386 1.00 0.00 H new ATOM 0 HD3 ARG A 34 1.906 -2.440 -9.503 1.00 0.00 H new ATOM 0 HE ARG A 34 4.193 -1.178 -8.220 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.017 -4.170 -9.723 1.00 0.00 H new ATOM 0 HH12 ARG A 34 4.325 -5.148 -9.049 1.00 0.00 H new ATOM 0 HH21 ARG A 34 5.921 -2.422 -7.459 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.966 -4.161 -7.770 1.00 0.00 H new ATOM 548 N ASP A 35 7.250 -0.527 -11.452 1.00 0.00 N ATOM 549 CA ASP A 35 8.410 0.157 -10.908 1.00 0.00 C ATOM 550 C ASP A 35 9.661 -0.070 -11.755 1.00 0.00 C ATOM 551 O ASP A 35 10.757 0.301 -11.344 1.00 0.00 O ATOM 552 CB ASP A 35 8.592 -0.324 -9.462 1.00 0.00 C ATOM 553 CG ASP A 35 7.281 -0.260 -8.679 1.00 0.00 C ATOM 554 OD1 ASP A 35 7.095 -1.127 -7.797 1.00 0.00 O ATOM 555 OD2 ASP A 35 6.475 0.651 -8.966 1.00 0.00 O1- ATOM 0 H ASP A 35 7.158 -1.479 -11.098 1.00 0.00 H new ATOM 0 HA ASP A 35 8.250 1.235 -10.923 1.00 0.00 H new ATOM 0 HB2 ASP A 35 8.966 -1.348 -9.463 1.00 0.00 H new ATOM 0 HB3 ASP A 35 9.343 0.290 -8.965 1.00 0.00 H new ATOM 560 N ALA A 36 9.500 -0.677 -12.934 1.00 0.00 N ATOM 561 CA ALA A 36 10.600 -1.122 -13.780 1.00 0.00 C ATOM 562 C ALA A 36 11.692 -0.068 -13.985 1.00 0.00 C ATOM 563 O ALA A 36 12.867 -0.424 -13.911 1.00 0.00 O ATOM 564 CB ALA A 36 10.033 -1.586 -15.122 1.00 0.00 C ATOM 0 H ALA A 36 8.581 -0.875 -13.331 1.00 0.00 H new ATOM 0 HA ALA A 36 11.093 -1.947 -13.265 1.00 0.00 H new ATOM 0 HB1 ALA A 36 10.847 -1.922 -15.764 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.337 -2.409 -14.958 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.510 -0.759 -15.602 1.00 0.00 H new ATOM 570 N PRO A 37 11.370 1.213 -14.236 1.00 0.00 N ATOM 571 CA PRO A 37 12.385 2.240 -14.412 1.00 0.00 C ATOM 572 C PRO A 37 13.195 2.443 -13.137 1.00 0.00 C ATOM 573 O PRO A 37 14.398 2.695 -13.187 1.00 0.00 O ATOM 574 CB PRO A 37 11.618 3.515 -14.769 1.00 0.00 C ATOM 575 CG PRO A 37 10.254 3.018 -15.243 1.00 0.00 C ATOM 576 CD PRO A 37 10.043 1.779 -14.385 1.00 0.00 C ATOM 0 HA PRO A 37 13.099 1.961 -15.187 1.00 0.00 H new ATOM 0 HB2 PRO A 37 11.523 4.176 -13.907 1.00 0.00 H new ATOM 0 HB3 PRO A 37 12.128 4.080 -15.549 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.473 3.761 -15.083 1.00 0.00 H new ATOM 0 HG3 PRO A 37 10.255 2.780 -16.307 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.609 2.034 -13.418 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.362 1.075 -14.864 1.00 0.00 H new ATOM 584 N LYS A 38 12.526 2.330 -11.987 1.00 0.00 N ATOM 585 CA LYS A 38 13.141 2.515 -10.681 1.00 0.00 C ATOM 586 C LYS A 38 14.056 1.344 -10.341 1.00 0.00 C ATOM 587 O LYS A 38 15.181 1.558 -9.892 1.00 0.00 O ATOM 588 CB LYS A 38 12.034 2.677 -9.636 1.00 0.00 C ATOM 589 CG LYS A 38 11.790 4.134 -9.226 1.00 0.00 C ATOM 590 CD LYS A 38 11.416 5.081 -10.380 1.00 0.00 C ATOM 591 CE LYS A 38 12.614 5.511 -11.232 1.00 0.00 C ATOM 592 NZ LYS A 38 13.668 6.136 -10.410 1.00 0.00 N1+ ATOM 0 H LYS A 38 11.532 2.105 -11.942 1.00 0.00 H new ATOM 0 HA LYS A 38 13.761 3.412 -10.690 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.108 2.259 -10.031 1.00 0.00 H new ATOM 0 HB3 LYS A 38 12.293 2.097 -8.750 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.992 4.158 -8.483 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.689 4.514 -8.741 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.683 4.589 -11.020 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.935 5.969 -9.969 1.00 0.00 H new ATOM 0 HE2 LYS A 38 13.022 4.644 -11.751 1.00 0.00 H new ATOM 0 HE3 LYS A 38 12.284 6.214 -11.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 14.433 6.476 -11.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 13.267 6.937 -9.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 14.047 5.436 -9.741 1.00 0.00 H new ATOM 606 N VAL A 39 13.593 0.108 -10.548 1.00 0.00 N ATOM 607 CA VAL A 39 14.438 -1.044 -10.275 1.00 0.00 C ATOM 608 C VAL A 39 15.615 -1.058 -11.251 1.00 0.00 C ATOM 609 O VAL A 39 16.728 -1.403 -10.861 1.00 0.00 O ATOM 610 CB VAL A 39 13.650 -2.365 -10.331 1.00 0.00 C ATOM 611 CG1 VAL A 39 13.634 -3.015 -8.950 1.00 0.00 C ATOM 612 CG2 VAL A 39 12.195 -2.187 -10.742 1.00 0.00 C ATOM 0 H VAL A 39 12.660 -0.112 -10.895 1.00 0.00 H new ATOM 0 HA VAL A 39 14.819 -0.955 -9.258 1.00 0.00 H new ATOM 0 HB VAL A 39 14.156 -2.977 -11.078 1.00 0.00 H new ATOM 0 HG11 VAL A 39 13.075 -3.950 -8.994 1.00 0.00 H new ATOM 0 HG12 VAL A 39 14.656 -3.218 -8.632 1.00 0.00 H new ATOM 0 HG13 VAL A 39 13.159 -2.342 -8.236 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.701 -3.158 -10.760 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.692 -1.537 -10.026 1.00 0.00 H new ATOM 0 HG23 VAL A 39 12.150 -1.738 -11.734 1.00 0.00 H new ATOM 622 N ALA A 40 15.388 -0.685 -12.516 1.00 0.00 N ATOM 623 CA ALA A 40 16.458 -0.653 -13.502 1.00 0.00 C ATOM 624 C ALA A 40 17.506 0.401 -13.155 1.00 0.00 C ATOM 625 O ALA A 40 18.681 0.226 -13.474 1.00 0.00 O ATOM 626 CB ALA A 40 15.867 -0.380 -14.884 1.00 0.00 C ATOM 0 H ALA A 40 14.475 -0.404 -12.873 1.00 0.00 H new ATOM 0 HA ALA A 40 16.956 -1.622 -13.502 1.00 0.00 H new ATOM 0 HB1 ALA A 40 16.667 -0.356 -15.624 1.00 0.00 H new ATOM 0 HB2 ALA A 40 15.160 -1.169 -15.140 1.00 0.00 H new ATOM 0 HB3 ALA A 40 15.351 0.580 -14.876 1.00 0.00 H new ATOM 632 N GLU A 41 17.095 1.493 -12.505 1.00 0.00 N ATOM 633 CA GLU A 41 18.028 2.527 -12.088 1.00 0.00 C ATOM 634 C GLU A 41 18.927 2.007 -10.965 1.00 0.00 C ATOM 635 O GLU A 41 20.136 2.238 -10.992 1.00 0.00 O ATOM 636 CB GLU A 41 17.238 3.766 -11.667 1.00 0.00 C ATOM 637 CG GLU A 41 18.170 4.892 -11.216 1.00 0.00 C ATOM 638 CD GLU A 41 17.403 6.186 -10.957 1.00 0.00 C ATOM 639 OE1 GLU A 41 18.072 7.157 -10.546 1.00 0.00 O ATOM 640 OE2 GLU A 41 16.170 6.189 -11.168 1.00 0.00 O1- ATOM 0 H GLU A 41 16.122 1.678 -12.259 1.00 0.00 H new ATOM 0 HA GLU A 41 18.682 2.803 -12.916 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.625 4.110 -12.500 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.557 3.508 -10.856 1.00 0.00 H new ATOM 0 HG2 GLU A 41 18.693 4.591 -10.309 1.00 0.00 H new ATOM 0 HG3 GLU A 41 18.929 5.065 -11.979 1.00 0.00 H new ATOM 647 N MET A 42 18.352 1.306 -9.978 1.00 0.00 N ATOM 648 CA MET A 42 19.162 0.716 -8.920 1.00 0.00 C ATOM 649 C MET A 42 20.047 -0.387 -9.490 1.00 0.00 C ATOM 650 O MET A 42 21.151 -0.599 -8.998 1.00 0.00 O ATOM 651 CB MET A 42 18.289 0.132 -7.808 1.00 0.00 C ATOM 652 CG MET A 42 17.264 1.127 -7.281 1.00 0.00 C ATOM 653 SD MET A 42 16.776 0.854 -5.555 1.00 0.00 S ATOM 654 CE MET A 42 16.249 -0.876 -5.641 1.00 0.00 C ATOM 0 H MET A 42 17.349 1.139 -9.896 1.00 0.00 H new ATOM 0 HA MET A 42 19.780 1.509 -8.498 1.00 0.00 H new ATOM 0 HB2 MET A 42 17.772 -0.751 -8.184 1.00 0.00 H new ATOM 0 HB3 MET A 42 18.926 -0.197 -6.987 1.00 0.00 H new ATOM 0 HG2 MET A 42 17.670 2.134 -7.376 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.374 1.081 -7.909 1.00 0.00 H new ATOM 0 HE1 MET A 42 15.354 -1.014 -5.034 1.00 0.00 H new ATOM 0 HE2 MET A 42 16.029 -1.138 -6.676 1.00 0.00 H new ATOM 0 HE3 MET A 42 17.046 -1.518 -5.265 1.00 0.00 H new ATOM 664 N TRP A 43 19.565 -1.086 -10.524 1.00 0.00 N ATOM 665 CA TRP A 43 20.313 -2.169 -11.136 1.00 0.00 C ATOM 666 C TRP A 43 21.634 -1.671 -11.696 1.00 0.00 C ATOM 667 O TRP A 43 22.679 -2.221 -11.353 1.00 0.00 O ATOM 668 CB TRP A 43 19.468 -2.815 -12.230 1.00 0.00 C ATOM 669 CG TRP A 43 20.112 -3.959 -12.945 1.00 0.00 C ATOM 670 CD1 TRP A 43 20.384 -5.171 -12.409 1.00 0.00 C ATOM 671 CD2 TRP A 43 20.575 -4.030 -14.328 1.00 0.00 C ATOM 672 NE1 TRP A 43 20.971 -5.982 -13.358 1.00 0.00 N ATOM 673 CE2 TRP A 43 21.127 -5.320 -14.558 1.00 0.00 C ATOM 674 CE3 TRP A 43 20.581 -3.134 -15.412 1.00 0.00 C ATOM 675 CZ2 TRP A 43 21.656 -5.699 -15.798 1.00 0.00 C ATOM 676 CZ3 TRP A 43 21.098 -3.508 -16.665 1.00 0.00 C ATOM 677 CH2 TRP A 43 21.639 -4.786 -16.858 1.00 0.00 C ATOM 0 H TRP A 43 18.655 -0.913 -10.950 1.00 0.00 H new ATOM 0 HA TRP A 43 20.542 -2.915 -10.375 1.00 0.00 H new ATOM 0 HB2 TRP A 43 18.535 -3.164 -11.787 1.00 0.00 H new ATOM 0 HB3 TRP A 43 19.207 -2.051 -12.963 1.00 0.00 H new ATOM 0 HD1 TRP A 43 20.173 -5.460 -11.390 1.00 0.00 H new ATOM 0 HE1 TRP A 43 21.254 -6.948 -13.193 1.00 0.00 H new ATOM 0 HE3 TRP A 43 20.181 -2.140 -15.280 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 22.073 -6.686 -15.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 21.078 -2.805 -17.485 1.00 0.00 H new ATOM 0 HH2 TRP A 43 22.041 -5.065 -17.821 1.00 0.00 H new ATOM 688 N LYS A 44 21.599 -0.640 -12.549 1.00 0.00 N ATOM 689 CA LYS A 44 22.830 -0.112 -13.115 1.00 0.00 C ATOM 690 C LYS A 44 23.732 0.401 -12.004 1.00 0.00 C ATOM 691 O LYS A 44 24.921 0.103 -12.009 1.00 0.00 O ATOM 692 CB LYS A 44 22.551 0.972 -14.162 1.00 0.00 C ATOM 693 CG LYS A 44 21.682 2.118 -13.639 1.00 0.00 C ATOM 694 CD LYS A 44 21.751 3.308 -14.592 1.00 0.00 C ATOM 695 CE LYS A 44 23.107 3.999 -14.441 1.00 0.00 C ATOM 696 NZ LYS A 44 23.262 5.121 -15.386 1.00 0.00 N1+ ATOM 0 H LYS A 44 20.747 -0.168 -12.853 1.00 0.00 H new ATOM 0 HA LYS A 44 23.346 -0.920 -13.633 1.00 0.00 H new ATOM 0 HB2 LYS A 44 23.499 1.378 -14.515 1.00 0.00 H new ATOM 0 HB3 LYS A 44 22.059 0.517 -15.022 1.00 0.00 H new ATOM 0 HG2 LYS A 44 20.650 1.784 -13.537 1.00 0.00 H new ATOM 0 HG3 LYS A 44 22.020 2.417 -12.647 1.00 0.00 H new ATOM 0 HD2 LYS A 44 21.613 2.974 -15.620 1.00 0.00 H new ATOM 0 HD3 LYS A 44 20.946 4.010 -14.374 1.00 0.00 H new ATOM 0 HE2 LYS A 44 23.215 4.366 -13.421 1.00 0.00 H new ATOM 0 HE3 LYS A 44 23.904 3.274 -14.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 24.180 5.583 -15.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 23.218 4.762 -16.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 22.497 5.810 -15.236 1.00 0.00 H new ATOM 710 N GLU A 45 23.200 1.168 -11.050 1.00 0.00 N ATOM 711 CA GLU A 45 23.994 1.692 -9.972 1.00 0.00 C ATOM 712 C GLU A 45 24.693 0.577 -9.199 1.00 0.00 C ATOM 713 O GLU A 45 25.897 0.662 -8.969 1.00 0.00 O ATOM 714 CB GLU A 45 23.034 2.515 -9.122 1.00 0.00 C ATOM 715 CG GLU A 45 23.785 3.363 -8.119 1.00 0.00 C ATOM 716 CD GLU A 45 24.171 2.570 -6.877 1.00 0.00 C ATOM 717 OE1 GLU A 45 25.333 2.709 -6.436 1.00 0.00 O ATOM 718 OE2 GLU A 45 23.299 1.825 -6.376 1.00 0.00 O1- ATOM 0 H GLU A 45 22.216 1.433 -11.015 1.00 0.00 H new ATOM 0 HA GLU A 45 24.812 2.319 -10.327 1.00 0.00 H new ATOM 0 HB2 GLU A 45 22.431 3.156 -9.766 1.00 0.00 H new ATOM 0 HB3 GLU A 45 22.346 1.851 -8.599 1.00 0.00 H new ATOM 0 HG2 GLU A 45 24.684 3.766 -8.586 1.00 0.00 H new ATOM 0 HG3 GLU A 45 23.168 4.213 -7.829 1.00 0.00 H new ATOM 725 N TYR A 46 23.948 -0.460 -8.802 1.00 0.00 N ATOM 726 CA TYR A 46 24.488 -1.556 -8.008 1.00 0.00 C ATOM 727 C TYR A 46 25.690 -2.202 -8.686 1.00 0.00 C ATOM 728 O TYR A 46 26.743 -2.356 -8.071 1.00 0.00 O ATOM 729 CB TYR A 46 23.391 -2.604 -7.786 1.00 0.00 C ATOM 730 CG TYR A 46 23.896 -4.027 -7.838 1.00 0.00 C ATOM 731 CD1 TYR A 46 23.796 -4.746 -9.040 1.00 0.00 C ATOM 732 CD2 TYR A 46 24.471 -4.626 -6.706 1.00 0.00 C ATOM 733 CE1 TYR A 46 24.289 -6.054 -9.129 1.00 0.00 C ATOM 734 CE2 TYR A 46 24.948 -5.939 -6.780 1.00 0.00 C ATOM 735 CZ TYR A 46 24.859 -6.654 -7.989 1.00 0.00 C ATOM 736 OH TYR A 46 25.325 -7.929 -8.045 1.00 0.00 O ATOM 0 H TYR A 46 22.957 -0.558 -9.024 1.00 0.00 H new ATOM 0 HA TYR A 46 24.824 -1.154 -7.052 1.00 0.00 H new ATOM 0 HB2 TYR A 46 22.923 -2.428 -6.817 1.00 0.00 H new ATOM 0 HB3 TYR A 46 22.617 -2.474 -8.542 1.00 0.00 H new ATOM 0 HD1 TYR A 46 23.335 -4.287 -9.902 1.00 0.00 H new ATOM 0 HD2 TYR A 46 24.545 -4.075 -5.780 1.00 0.00 H new ATOM 0 HE1 TYR A 46 24.233 -6.596 -10.061 1.00 0.00 H new ATOM 0 HE2 TYR A 46 25.385 -6.404 -5.909 1.00 0.00 H new ATOM 0 HH TYR A 46 25.232 -8.271 -8.959 1.00 0.00 H new ATOM 746 N MET A 47 25.538 -2.585 -9.955 1.00 0.00 N ATOM 747 CA MET A 47 26.586 -3.288 -10.672 1.00 0.00 C ATOM 748 C MET A 47 27.708 -2.347 -11.098 1.00 0.00 C ATOM 749 O MET A 47 28.834 -2.793 -11.306 1.00 0.00 O ATOM 750 CB MET A 47 25.953 -3.998 -11.864 1.00 0.00 C ATOM 751 CG MET A 47 25.351 -3.007 -12.857 1.00 0.00 C ATOM 752 SD MET A 47 24.056 -3.755 -13.870 1.00 0.00 S ATOM 753 CE MET A 47 24.952 -5.264 -14.288 1.00 0.00 C ATOM 0 H MET A 47 24.694 -2.416 -10.503 1.00 0.00 H new ATOM 0 HA MET A 47 27.051 -4.024 -10.016 1.00 0.00 H new ATOM 0 HB2 MET A 47 26.705 -4.606 -12.367 1.00 0.00 H new ATOM 0 HB3 MET A 47 25.177 -4.678 -11.512 1.00 0.00 H new ATOM 0 HG2 MET A 47 24.939 -2.157 -12.314 1.00 0.00 H new ATOM 0 HG3 MET A 47 26.138 -2.621 -13.504 1.00 0.00 H new ATOM 0 HE1 MET A 47 24.521 -5.706 -15.186 1.00 0.00 H new ATOM 0 HE2 MET A 47 26.000 -5.027 -14.468 1.00 0.00 H new ATOM 0 HE3 MET A 47 24.877 -5.972 -13.463 1.00 0.00 H new ATOM 763 N LEU A 48 27.419 -1.051 -11.229 1.00 0.00 N ATOM 764 CA LEU A 48 28.460 -0.057 -11.441 1.00 0.00 C ATOM 765 C LEU A 48 29.329 0.137 -10.197 1.00 0.00 C ATOM 766 O LEU A 48 30.459 0.597 -10.331 1.00 0.00 O ATOM 767 CB LEU A 48 27.837 1.265 -11.892 1.00 0.00 C ATOM 768 CG LEU A 48 27.302 1.175 -13.329 1.00 0.00 C ATOM 769 CD1 LEU A 48 26.424 2.386 -13.642 1.00 0.00 C ATOM 770 CD2 LEU A 48 28.443 1.121 -14.346 1.00 0.00 C ATOM 0 H LEU A 48 26.473 -0.671 -11.191 1.00 0.00 H new ATOM 0 HA LEU A 48 29.118 -0.422 -12.229 1.00 0.00 H new ATOM 0 HB2 LEU A 48 27.025 1.535 -11.217 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.581 2.059 -11.829 1.00 0.00 H new ATOM 0 HG LEU A 48 26.718 0.258 -13.403 1.00 0.00 H new ATOM 0 HD11 LEU A 48 26.051 2.311 -14.663 1.00 0.00 H new ATOM 0 HD12 LEU A 48 25.583 2.414 -12.949 1.00 0.00 H new ATOM 0 HD13 LEU A 48 27.011 3.298 -13.537 1.00 0.00 H new ATOM 0 HD21 LEU A 48 28.030 1.058 -15.353 1.00 0.00 H new ATOM 0 HD22 LEU A 48 29.051 2.022 -14.259 1.00 0.00 H new ATOM 0 HD23 LEU A 48 29.062 0.245 -14.152 1.00 0.00 H new ATOM 782 N ARG A 49 28.839 -0.198 -8.993 1.00 0.00 N ATOM 783 CA ARG A 49 29.694 -0.132 -7.811 1.00 0.00 C ATOM 784 C ARG A 49 30.846 -1.121 -7.959 1.00 0.00 C ATOM 785 O ARG A 49 30.618 -2.271 -8.330 1.00 0.00 O ATOM 786 CB ARG A 49 28.936 -0.500 -6.529 1.00 0.00 C ATOM 787 CG ARG A 49 27.646 0.290 -6.323 1.00 0.00 C ATOM 788 CD ARG A 49 26.986 -0.116 -5.004 1.00 0.00 C ATOM 789 NE ARG A 49 25.611 0.391 -4.940 1.00 0.00 N ATOM 790 CZ ARG A 49 24.682 -0.023 -4.071 1.00 0.00 C ATOM 791 NH1 ARG A 49 24.986 -0.845 -3.066 1.00 0.00 N1+ ATOM 792 NH2 ARG A 49 23.426 0.394 -4.208 1.00 0.00 N ATOM 0 H ARG A 49 27.883 -0.508 -8.820 1.00 0.00 H new ATOM 0 HA ARG A 49 30.051 0.895 -7.733 1.00 0.00 H new ATOM 0 HB2 ARG A 49 28.699 -1.564 -6.552 1.00 0.00 H new ATOM 0 HB3 ARG A 49 29.590 -0.337 -5.673 1.00 0.00 H new ATOM 0 HG2 ARG A 49 27.862 1.358 -6.317 1.00 0.00 H new ATOM 0 HG3 ARG A 49 26.962 0.108 -7.152 1.00 0.00 H new ATOM 0 HD2 ARG A 49 26.984 -1.202 -4.911 1.00 0.00 H new ATOM 0 HD3 ARG A 49 27.563 0.275 -4.166 1.00 0.00 H new ATOM 0 HE ARG A 49 25.343 1.113 -5.608 1.00 0.00 H new ATOM 0 HH11 ARG A 49 25.945 -1.172 -2.947 1.00 0.00 H new ATOM 0 HH12 ARG A 49 24.260 -1.147 -2.416 1.00 0.00 H new ATOM 0 HH21 ARG A 49 23.178 1.024 -4.971 1.00 0.00 H new ATOM 0 HH22 ARG A 49 22.711 0.084 -3.550 1.00 0.00 H new ATOM 806 N PRO A 50 32.087 -0.709 -7.678 1.00 0.00 N ATOM 807 CA PRO A 50 33.213 -1.616 -7.598 1.00 0.00 C ATOM 808 C PRO A 50 33.275 -2.273 -6.221 1.00 0.00 C ATOM 809 O PRO A 50 34.151 -3.097 -5.974 1.00 0.00 O ATOM 810 CB PRO A 50 34.429 -0.722 -7.826 1.00 0.00 C ATOM 811 CG PRO A 50 34.005 0.576 -7.138 1.00 0.00 C ATOM 812 CD PRO A 50 32.505 0.656 -7.426 1.00 0.00 C ATOM 0 HA PRO A 50 33.151 -2.428 -8.322 1.00 0.00 H new ATOM 0 HB2 PRO A 50 35.332 -1.142 -7.383 1.00 0.00 H new ATOM 0 HB3 PRO A 50 34.633 -0.574 -8.886 1.00 0.00 H new ATOM 0 HG2 PRO A 50 34.208 0.548 -6.067 1.00 0.00 H new ATOM 0 HG3 PRO A 50 34.538 1.437 -7.541 1.00 0.00 H new ATOM 0 HD2 PRO A 50 31.965 1.082 -6.581 1.00 0.00 H new ATOM 0 HD3 PRO A 50 32.304 1.294 -8.287 1.00 0.00 H new ATOM 820 N SER A 51 32.351 -1.915 -5.324 1.00 0.00 N ATOM 821 CA SER A 51 32.284 -2.516 -4.003 1.00 0.00 C ATOM 822 C SER A 51 31.831 -3.972 -4.102 1.00 0.00 C ATOM 823 O SER A 51 31.794 -4.676 -3.096 1.00 0.00 O ATOM 824 CB SER A 51 31.328 -1.709 -3.123 1.00 0.00 C ATOM 825 OG SER A 51 30.011 -1.807 -3.617 1.00 0.00 O ATOM 0 H SER A 51 31.638 -1.207 -5.498 1.00 0.00 H new ATOM 0 HA SER A 51 33.276 -2.503 -3.551 1.00 0.00 H new ATOM 0 HB2 SER A 51 31.368 -2.077 -2.098 1.00 0.00 H new ATOM 0 HB3 SER A 51 31.638 -0.664 -3.099 1.00 0.00 H new ATOM 0 HG SER A 51 29.408 -1.288 -3.045 1.00 0.00 H new ATOM 831 N VAL A 52 31.487 -4.422 -5.313 1.00 0.00 N ATOM 832 CA VAL A 52 31.106 -5.802 -5.569 1.00 0.00 C ATOM 833 C VAL A 52 31.997 -6.427 -6.643 1.00 0.00 C ATOM 834 O VAL A 52 32.511 -5.726 -7.509 1.00 0.00 O ATOM 835 CB VAL A 52 29.628 -5.892 -5.969 1.00 0.00 C ATOM 836 CG1 VAL A 52 28.824 -6.468 -4.802 1.00 0.00 C ATOM 837 CG2 VAL A 52 29.013 -4.547 -6.357 1.00 0.00 C ATOM 0 H VAL A 52 31.467 -3.830 -6.144 1.00 0.00 H new ATOM 0 HA VAL A 52 31.245 -6.366 -4.647 1.00 0.00 H new ATOM 0 HB VAL A 52 29.587 -6.534 -6.849 1.00 0.00 H new ATOM 0 HG11 VAL A 52 27.773 -6.534 -5.082 1.00 0.00 H new ATOM 0 HG12 VAL A 52 29.198 -7.463 -4.559 1.00 0.00 H new ATOM 0 HG13 VAL A 52 28.928 -5.819 -3.933 1.00 0.00 H new ATOM 0 HG21 VAL A 52 27.967 -4.690 -6.627 1.00 0.00 H new ATOM 0 HG22 VAL A 52 29.079 -3.860 -5.514 1.00 0.00 H new ATOM 0 HG23 VAL A 52 29.554 -4.131 -7.207 1.00 0.00 H new ATOM 847 N ASN A 53 32.170 -7.751 -6.580 1.00 0.00 N ATOM 848 CA ASN A 53 33.005 -8.486 -7.523 1.00 0.00 C ATOM 849 C ASN A 53 32.256 -8.837 -8.812 1.00 0.00 C ATOM 850 O ASN A 53 31.026 -8.784 -8.866 1.00 0.00 O ATOM 851 CB ASN A 53 33.551 -9.750 -6.852 1.00 0.00 C ATOM 852 CG ASN A 53 32.483 -10.709 -6.332 1.00 0.00 C ATOM 853 OD1 ASN A 53 31.211 -10.444 -6.614 1.00 0.00 O flip ATOM 854 ND2 ASN A 53 32.804 -11.694 -5.676 1.00 0.00 N flip ATOM 0 H ASN A 53 31.733 -8.340 -5.871 1.00 0.00 H new ATOM 0 HA ASN A 53 33.834 -7.839 -7.809 1.00 0.00 H new ATOM 0 HB2 ASN A 53 34.180 -10.281 -7.566 1.00 0.00 H new ATOM 0 HB3 ASN A 53 34.191 -9.456 -6.021 1.00 0.00 H new ATOM 0 HD21 ASN A 53 33.787 -11.874 -5.474 1.00 0.00 H new ATOM 0 HD22 ASN A 53 32.088 -12.334 -5.332 1.00 0.00 H new ATOM 861 N THR A 54 33.022 -9.196 -9.846 1.00 0.00 N ATOM 862 CA THR A 54 32.505 -9.506 -11.169 1.00 0.00 C ATOM 863 C THR A 54 31.441 -10.600 -11.120 1.00 0.00 C ATOM 864 O THR A 54 30.519 -10.579 -11.932 1.00 0.00 O ATOM 865 CB THR A 54 33.660 -9.959 -12.068 1.00 0.00 C ATOM 866 OG1 THR A 54 34.265 -11.102 -11.507 1.00 0.00 O ATOM 867 CG2 THR A 54 34.707 -8.858 -12.229 1.00 0.00 C ATOM 0 H THR A 54 34.036 -9.279 -9.779 1.00 0.00 H new ATOM 0 HA THR A 54 32.040 -8.605 -11.570 1.00 0.00 H new ATOM 0 HB THR A 54 33.256 -10.189 -13.054 1.00 0.00 H new ATOM 0 HG1 THR A 54 35.003 -11.396 -12.080 1.00 0.00 H new ATOM 0 HG21 THR A 54 35.512 -9.213 -12.872 1.00 0.00 H new ATOM 0 HG22 THR A 54 34.244 -7.979 -12.678 1.00 0.00 H new ATOM 0 HG23 THR A 54 35.112 -8.596 -11.252 1.00 0.00 H new ATOM 875 N ARG A 55 31.547 -11.554 -10.189 1.00 0.00 N ATOM 876 CA ARG A 55 30.537 -12.595 -10.066 1.00 0.00 C ATOM 877 C ARG A 55 29.173 -11.999 -9.754 1.00 0.00 C ATOM 878 O ARG A 55 28.188 -12.397 -10.364 1.00 0.00 O ATOM 879 CB ARG A 55 30.927 -13.611 -8.993 1.00 0.00 C ATOM 880 CG ARG A 55 31.778 -14.720 -9.614 1.00 0.00 C ATOM 881 CD ARG A 55 31.941 -15.876 -8.625 1.00 0.00 C ATOM 882 NE ARG A 55 30.649 -16.510 -8.323 1.00 0.00 N ATOM 883 CZ ARG A 55 30.377 -17.108 -7.154 1.00 0.00 C ATOM 884 NH1 ARG A 55 31.298 -17.177 -6.191 1.00 0.00 N1+ ATOM 885 NH2 ARG A 55 29.174 -17.642 -6.944 1.00 0.00 N ATOM 0 H ARG A 55 32.314 -11.622 -9.520 1.00 0.00 H new ATOM 0 HA ARG A 55 30.476 -13.110 -11.025 1.00 0.00 H new ATOM 0 HB2 ARG A 55 31.483 -13.117 -8.196 1.00 0.00 H new ATOM 0 HB3 ARG A 55 30.032 -14.037 -8.540 1.00 0.00 H new ATOM 0 HG2 ARG A 55 31.309 -15.079 -10.530 1.00 0.00 H new ATOM 0 HG3 ARG A 55 32.756 -14.327 -9.890 1.00 0.00 H new ATOM 0 HD2 ARG A 55 32.624 -16.618 -9.039 1.00 0.00 H new ATOM 0 HD3 ARG A 55 32.391 -15.508 -7.703 1.00 0.00 H new ATOM 0 HE ARG A 55 29.923 -16.494 -9.039 1.00 0.00 H new ATOM 0 HH11 ARG A 55 32.222 -16.772 -6.339 1.00 0.00 H new ATOM 0 HH12 ARG A 55 31.078 -17.635 -5.307 1.00 0.00 H new ATOM 0 HH21 ARG A 55 28.461 -17.596 -7.672 1.00 0.00 H new ATOM 0 HH22 ARG A 55 28.966 -18.097 -6.055 1.00 0.00 H new ATOM 899 N ARG A 56 29.085 -11.053 -8.817 1.00 0.00 N ATOM 900 CA ARG A 56 27.791 -10.470 -8.489 1.00 0.00 C ATOM 901 C ARG A 56 27.285 -9.624 -9.653 1.00 0.00 C ATOM 902 O ARG A 56 26.074 -9.555 -9.876 1.00 0.00 O ATOM 903 CB ARG A 56 27.866 -9.709 -7.163 1.00 0.00 C ATOM 904 CG ARG A 56 27.937 -10.745 -6.038 1.00 0.00 C ATOM 905 CD ARG A 56 27.810 -10.064 -4.676 1.00 0.00 C ATOM 906 NE ARG A 56 28.025 -11.015 -3.577 1.00 0.00 N ATOM 907 CZ ARG A 56 27.184 -12.002 -3.236 1.00 0.00 C ATOM 908 NH1 ARG A 56 26.046 -12.210 -3.898 1.00 0.00 N1+ ATOM 909 NH2 ARG A 56 27.482 -12.797 -2.209 1.00 0.00 N ATOM 0 H ARG A 56 29.874 -10.684 -8.286 1.00 0.00 H new ATOM 0 HA ARG A 56 27.056 -11.261 -8.341 1.00 0.00 H new ATOM 0 HB2 ARG A 56 28.742 -9.061 -7.143 1.00 0.00 H new ATOM 0 HB3 ARG A 56 26.993 -9.069 -7.039 1.00 0.00 H new ATOM 0 HG2 ARG A 56 27.140 -11.479 -6.160 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.881 -11.287 -6.094 1.00 0.00 H new ATOM 0 HD2 ARG A 56 28.535 -9.253 -4.604 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.821 -9.616 -4.583 1.00 0.00 H new ATOM 0 HE ARG A 56 28.881 -10.917 -3.031 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.797 -11.611 -4.685 1.00 0.00 H new ATOM 0 HH12 ARG A 56 25.424 -12.968 -3.618 1.00 0.00 H new ATOM 0 HH21 ARG A 56 28.346 -12.653 -1.687 1.00 0.00 H new ATOM 0 HH22 ARG A 56 26.846 -13.549 -1.945 1.00 0.00 H new ATOM 923 N LYS A 57 28.189 -8.978 -10.403 1.00 0.00 N ATOM 924 CA LYS A 57 27.766 -8.281 -11.611 1.00 0.00 C ATOM 925 C LYS A 57 27.175 -9.290 -12.592 1.00 0.00 C ATOM 926 O LYS A 57 26.228 -8.968 -13.302 1.00 0.00 O ATOM 927 CB LYS A 57 28.934 -7.524 -12.253 1.00 0.00 C ATOM 928 CG LYS A 57 29.225 -6.192 -11.553 1.00 0.00 C ATOM 929 CD LYS A 57 30.019 -6.376 -10.259 1.00 0.00 C ATOM 930 CE LYS A 57 30.255 -5.040 -9.557 1.00 0.00 C ATOM 931 NZ LYS A 57 30.953 -4.069 -10.416 1.00 0.00 N1+ ATOM 0 H LYS A 57 29.187 -8.927 -10.198 1.00 0.00 H new ATOM 0 HA LYS A 57 27.007 -7.545 -11.346 1.00 0.00 H new ATOM 0 HB2 LYS A 57 29.827 -8.148 -12.225 1.00 0.00 H new ATOM 0 HB3 LYS A 57 28.709 -7.337 -13.303 1.00 0.00 H new ATOM 0 HG2 LYS A 57 29.782 -5.543 -12.229 1.00 0.00 H new ATOM 0 HG3 LYS A 57 28.284 -5.688 -11.331 1.00 0.00 H new ATOM 0 HD2 LYS A 57 29.480 -7.049 -9.592 1.00 0.00 H new ATOM 0 HD3 LYS A 57 30.977 -6.846 -10.481 1.00 0.00 H new ATOM 0 HE2 LYS A 57 29.298 -4.623 -9.245 1.00 0.00 H new ATOM 0 HE3 LYS A 57 30.840 -5.207 -8.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 31.255 -3.254 -9.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 31.787 -4.520 -10.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 30.311 -3.746 -11.168 1.00 0.00 H new ATOM 945 N LEU A 58 27.728 -10.509 -12.636 1.00 0.00 N ATOM 946 CA LEU A 58 27.233 -11.567 -13.504 1.00 0.00 C ATOM 947 C LEU A 58 25.845 -12.044 -13.070 1.00 0.00 C ATOM 948 O LEU A 58 25.028 -12.401 -13.918 1.00 0.00 O ATOM 949 CB LEU A 58 28.247 -12.720 -13.499 1.00 0.00 C ATOM 950 CG LEU A 58 27.878 -13.852 -14.460 1.00 0.00 C ATOM 951 CD1 LEU A 58 27.994 -13.383 -15.909 1.00 0.00 C ATOM 952 CD2 LEU A 58 28.841 -15.014 -14.227 1.00 0.00 C ATOM 0 H LEU A 58 28.530 -10.782 -12.068 1.00 0.00 H new ATOM 0 HA LEU A 58 27.126 -11.182 -14.518 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.230 -12.332 -13.766 1.00 0.00 H new ATOM 0 HB3 LEU A 58 28.326 -13.121 -12.489 1.00 0.00 H new ATOM 0 HG LEU A 58 26.849 -14.162 -14.278 1.00 0.00 H new ATOM 0 HD11 LEU A 58 27.728 -14.201 -16.579 1.00 0.00 H new ATOM 0 HD12 LEU A 58 27.319 -12.544 -16.075 1.00 0.00 H new ATOM 0 HD13 LEU A 58 29.019 -13.069 -16.109 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.594 -15.832 -14.903 1.00 0.00 H new ATOM 0 HD22 LEU A 58 29.862 -14.683 -14.415 1.00 0.00 H new ATOM 0 HD23 LEU A 58 28.755 -15.357 -13.196 1.00 0.00 H new ATOM 964 N LEU A 59 25.564 -12.056 -11.759 1.00 0.00 N ATOM 965 CA LEU A 59 24.242 -12.435 -11.270 1.00 0.00 C ATOM 966 C LEU A 59 23.203 -11.483 -11.836 1.00 0.00 C ATOM 967 O LEU A 59 22.276 -11.901 -12.526 1.00 0.00 O ATOM 968 CB LEU A 59 24.171 -12.367 -9.740 1.00 0.00 C ATOM 969 CG LEU A 59 25.264 -13.178 -9.058 1.00 0.00 C ATOM 970 CD1 LEU A 59 25.122 -13.010 -7.550 1.00 0.00 C ATOM 971 CD2 LEU A 59 25.172 -14.647 -9.447 1.00 0.00 C ATOM 0 H LEU A 59 26.232 -11.809 -11.028 1.00 0.00 H new ATOM 0 HA LEU A 59 24.049 -13.459 -11.589 1.00 0.00 H new ATOM 0 HB2 LEU A 59 24.247 -11.327 -9.424 1.00 0.00 H new ATOM 0 HB3 LEU A 59 23.197 -12.730 -9.410 1.00 0.00 H new ATOM 0 HG LEU A 59 26.241 -12.817 -9.379 1.00 0.00 H new ATOM 0 HD11 LEU A 59 25.898 -13.585 -7.045 1.00 0.00 H new ATOM 0 HD12 LEU A 59 25.224 -11.956 -7.290 1.00 0.00 H new ATOM 0 HD13 LEU A 59 24.142 -13.368 -7.235 1.00 0.00 H new ATOM 0 HD21 LEU A 59 25.963 -15.206 -8.947 1.00 0.00 H new ATOM 0 HD22 LEU A 59 24.202 -15.043 -9.146 1.00 0.00 H new ATOM 0 HD23 LEU A 59 25.285 -14.745 -10.527 1.00 0.00 H new ATOM 983 N GLY A 60 23.371 -10.193 -11.536 1.00 0.00 N ATOM 984 CA GLY A 60 22.492 -9.167 -12.057 1.00 0.00 C ATOM 985 C GLY A 60 22.414 -9.176 -13.583 1.00 0.00 C ATOM 986 O GLY A 60 21.387 -8.794 -14.142 1.00 0.00 O ATOM 0 H GLY A 60 24.114 -9.842 -10.931 1.00 0.00 H new ATOM 0 HA2 GLY A 60 21.492 -9.307 -11.645 1.00 0.00 H new ATOM 0 HA3 GLY A 60 22.841 -8.191 -11.721 1.00 0.00 H new ATOM 990 N LEU A 61 23.484 -9.606 -14.258 1.00 0.00 N ATOM 991 CA LEU A 61 23.505 -9.712 -15.709 1.00 0.00 C ATOM 992 C LEU A 61 22.531 -10.806 -16.145 1.00 0.00 C ATOM 993 O LEU A 61 21.656 -10.562 -16.974 1.00 0.00 O ATOM 994 CB LEU A 61 24.946 -10.002 -16.152 1.00 0.00 C ATOM 995 CG LEU A 61 25.243 -9.703 -17.626 1.00 0.00 C ATOM 996 CD1 LEU A 61 26.682 -10.113 -17.915 1.00 0.00 C ATOM 997 CD2 LEU A 61 24.341 -10.461 -18.591 1.00 0.00 C ATOM 0 H LEU A 61 24.355 -9.888 -13.810 1.00 0.00 H new ATOM 0 HA LEU A 61 23.185 -8.783 -16.182 1.00 0.00 H new ATOM 0 HB2 LEU A 61 25.625 -9.415 -15.534 1.00 0.00 H new ATOM 0 HB3 LEU A 61 25.165 -11.052 -15.958 1.00 0.00 H new ATOM 0 HG LEU A 61 25.068 -8.638 -17.779 1.00 0.00 H new ATOM 0 HD11 LEU A 61 26.916 -9.909 -18.960 1.00 0.00 H new ATOM 0 HD12 LEU A 61 27.358 -9.546 -17.275 1.00 0.00 H new ATOM 0 HD13 LEU A 61 26.804 -11.178 -17.717 1.00 0.00 H new ATOM 0 HD21 LEU A 61 24.606 -10.202 -19.616 1.00 0.00 H new ATOM 0 HD22 LEU A 61 24.469 -11.533 -18.443 1.00 0.00 H new ATOM 0 HD23 LEU A 61 23.301 -10.191 -18.406 1.00 0.00 H new ATOM 1009 N TYR A 62 22.677 -12.012 -15.588 1.00 0.00 N ATOM 1010 CA TYR A 62 21.777 -13.115 -15.891 1.00 0.00 C ATOM 1011 C TYR A 62 20.340 -12.742 -15.536 1.00 0.00 C ATOM 1012 O TYR A 62 19.408 -13.069 -16.271 1.00 0.00 O ATOM 1013 CB TYR A 62 22.187 -14.348 -15.085 1.00 0.00 C ATOM 1014 CG TYR A 62 23.499 -15.009 -15.467 1.00 0.00 C ATOM 1015 CD1 TYR A 62 24.174 -15.788 -14.516 1.00 0.00 C ATOM 1016 CD2 TYR A 62 24.038 -14.860 -16.755 1.00 0.00 C ATOM 1017 CE1 TYR A 62 25.368 -16.444 -14.851 1.00 0.00 C ATOM 1018 CE2 TYR A 62 25.228 -15.517 -17.101 1.00 0.00 C ATOM 1019 CZ TYR A 62 25.892 -16.323 -16.155 1.00 0.00 C ATOM 1020 OH TYR A 62 27.034 -16.974 -16.513 1.00 0.00 O ATOM 0 H TYR A 62 23.415 -12.244 -14.923 1.00 0.00 H new ATOM 0 HA TYR A 62 21.837 -13.331 -16.958 1.00 0.00 H new ATOM 0 HB2 TYR A 62 22.243 -14.064 -14.034 1.00 0.00 H new ATOM 0 HB3 TYR A 62 21.394 -15.091 -15.173 1.00 0.00 H new ATOM 0 HD1 TYR A 62 23.772 -15.884 -13.518 1.00 0.00 H new ATOM 0 HD2 TYR A 62 23.535 -14.238 -17.481 1.00 0.00 H new ATOM 0 HE1 TYR A 62 25.884 -17.040 -14.113 1.00 0.00 H new ATOM 0 HE2 TYR A 62 25.636 -15.405 -18.095 1.00 0.00 H new ATOM 0 HH TYR A 62 27.244 -16.775 -17.449 1.00 0.00 H new ATOM 1030 N LEU A 63 20.158 -12.058 -14.405 1.00 0.00 N ATOM 1031 CA LEU A 63 18.843 -11.635 -13.955 1.00 0.00 C ATOM 1032 C LEU A 63 18.208 -10.692 -14.959 1.00 0.00 C ATOM 1033 O LEU A 63 17.037 -10.851 -15.298 1.00 0.00 O ATOM 1034 CB LEU A 63 18.990 -10.977 -12.585 1.00 0.00 C ATOM 1035 CG LEU A 63 17.686 -10.393 -12.037 1.00 0.00 C ATOM 1036 CD1 LEU A 63 16.544 -11.403 -12.068 1.00 0.00 C ATOM 1037 CD2 LEU A 63 17.937 -10.006 -10.585 1.00 0.00 C ATOM 0 H LEU A 63 20.918 -11.786 -13.782 1.00 0.00 H new ATOM 0 HA LEU A 63 18.183 -12.498 -13.871 1.00 0.00 H new ATOM 0 HB2 LEU A 63 19.373 -11.713 -11.878 1.00 0.00 H new ATOM 0 HB3 LEU A 63 19.733 -10.182 -12.652 1.00 0.00 H new ATOM 0 HG LEU A 63 17.398 -9.543 -12.655 1.00 0.00 H new ATOM 0 HD11 LEU A 63 15.640 -10.942 -11.669 1.00 0.00 H new ATOM 0 HD12 LEU A 63 16.367 -11.720 -13.096 1.00 0.00 H new ATOM 0 HD13 LEU A 63 16.808 -12.269 -11.461 1.00 0.00 H new ATOM 0 HD21 LEU A 63 17.027 -9.584 -10.158 1.00 0.00 H new ATOM 0 HD22 LEU A 63 18.228 -10.890 -10.018 1.00 0.00 H new ATOM 0 HD23 LEU A 63 18.736 -9.266 -10.539 1.00 0.00 H new ATOM 1049 N MET A 64 18.970 -9.706 -15.438 1.00 0.00 N ATOM 1050 CA MET A 64 18.430 -8.799 -16.426 1.00 0.00 C ATOM 1051 C MET A 64 18.041 -9.587 -17.665 1.00 0.00 C ATOM 1052 O MET A 64 16.948 -9.394 -18.189 1.00 0.00 O ATOM 1053 CB MET A 64 19.451 -7.719 -16.776 1.00 0.00 C ATOM 1054 CG MET A 64 19.103 -7.006 -18.090 1.00 0.00 C ATOM 1055 SD MET A 64 19.618 -7.822 -19.630 1.00 0.00 S ATOM 1056 CE MET A 64 21.411 -7.856 -19.412 1.00 0.00 C ATOM 0 H MET A 64 19.935 -9.526 -15.161 1.00 0.00 H new ATOM 0 HA MET A 64 17.547 -8.306 -16.020 1.00 0.00 H new ATOM 0 HB2 MET A 64 19.498 -6.989 -15.968 1.00 0.00 H new ATOM 0 HB3 MET A 64 20.441 -8.168 -16.858 1.00 0.00 H new ATOM 0 HG2 MET A 64 18.022 -6.867 -18.125 1.00 0.00 H new ATOM 0 HG3 MET A 64 19.551 -6.013 -18.066 1.00 0.00 H new ATOM 0 HE1 MET A 64 21.891 -8.041 -20.373 1.00 0.00 H new ATOM 0 HE2 MET A 64 21.748 -6.898 -19.016 1.00 0.00 H new ATOM 0 HE3 MET A 64 21.678 -8.650 -18.715 1.00 0.00 H new ATOM 1066 N ASN A 65 18.936 -10.466 -18.127 1.00 0.00 N ATOM 1067 CA ASN A 65 18.732 -11.171 -19.377 1.00 0.00 C ATOM 1068 C ASN A 65 17.423 -11.950 -19.366 1.00 0.00 C ATOM 1069 O ASN A 65 16.682 -11.930 -20.349 1.00 0.00 O ATOM 1070 CB ASN A 65 19.906 -12.121 -19.621 1.00 0.00 C ATOM 1071 CG ASN A 65 19.656 -12.992 -20.844 1.00 0.00 C ATOM 1072 OD1 ASN A 65 19.366 -12.372 -21.985 1.00 0.00 O flip ATOM 1073 ND2 ASN A 65 19.724 -14.215 -20.767 1.00 0.00 N flip ATOM 0 H ASN A 65 19.805 -10.700 -17.648 1.00 0.00 H new ATOM 0 HA ASN A 65 18.677 -10.438 -20.182 1.00 0.00 H new ATOM 0 HB2 ASN A 65 20.821 -11.546 -19.760 1.00 0.00 H new ATOM 0 HB3 ASN A 65 20.056 -12.752 -18.745 1.00 0.00 H new ATOM 0 HD21 ASN A 65 19.949 -14.658 -19.876 1.00 0.00 H new ATOM 0 HD22 ASN A 65 19.556 -14.788 -21.594 1.00 0.00 H new ATOM 1080 N HIS A 66 17.130 -12.638 -18.260 1.00 0.00 N ATOM 1081 CA HIS A 66 15.909 -13.422 -18.176 1.00 0.00 C ATOM 1082 C HIS A 66 14.697 -12.495 -18.163 1.00 0.00 C ATOM 1083 O HIS A 66 13.745 -12.720 -18.904 1.00 0.00 O ATOM 1084 CB HIS A 66 15.963 -14.320 -16.936 1.00 0.00 C ATOM 1085 CG HIS A 66 15.007 -15.487 -16.986 1.00 0.00 C ATOM 1086 ND1 HIS A 66 14.127 -15.752 -17.996 1.00 0.00 N flip ATOM 1087 CD2 HIS A 66 14.881 -16.478 -16.009 1.00 0.00 C flip ATOM 1088 CE1 HIS A 66 13.461 -16.903 -17.652 1.00 0.00 C flip ATOM 1089 NE2 HIS A 66 13.931 -17.313 -16.463 1.00 0.00 N flip ATOM 0 H HIS A 66 17.715 -12.665 -17.425 1.00 0.00 H new ATOM 0 HA HIS A 66 15.816 -14.067 -19.050 1.00 0.00 H new ATOM 0 HB2 HIS A 66 16.978 -14.699 -16.817 1.00 0.00 H new ATOM 0 HB3 HIS A 66 15.742 -13.719 -16.054 1.00 0.00 H new ATOM 0 HD2 HIS A 66 15.432 -16.556 -15.083 1.00 0.00 H new ATOM 0 HE1 HIS A 66 12.695 -17.392 -18.235 1.00 0.00 H new ATOM 0 HE2 HIS A 66 13.610 -18.146 -15.970 1.00 0.00 H new ATOM 1097 N VAL A 67 14.730 -11.454 -17.326 1.00 0.00 N ATOM 1098 CA VAL A 67 13.615 -10.528 -17.180 1.00 0.00 C ATOM 1099 C VAL A 67 13.318 -9.804 -18.493 1.00 0.00 C ATOM 1100 O VAL A 67 12.148 -9.655 -18.839 1.00 0.00 O ATOM 1101 CB VAL A 67 13.937 -9.539 -16.060 1.00 0.00 C ATOM 1102 CG1 VAL A 67 12.870 -8.449 -15.983 1.00 0.00 C ATOM 1103 CG2 VAL A 67 13.949 -10.276 -14.723 1.00 0.00 C ATOM 0 H VAL A 67 15.531 -11.234 -16.734 1.00 0.00 H new ATOM 0 HA VAL A 67 12.716 -11.086 -16.919 1.00 0.00 H new ATOM 0 HB VAL A 67 14.908 -9.091 -16.268 1.00 0.00 H new ATOM 0 HG11 VAL A 67 13.117 -7.755 -15.180 1.00 0.00 H new ATOM 0 HG12 VAL A 67 12.831 -7.910 -16.930 1.00 0.00 H new ATOM 0 HG13 VAL A 67 11.899 -8.903 -15.784 1.00 0.00 H new ATOM 0 HG21 VAL A 67 14.178 -9.573 -13.922 1.00 0.00 H new ATOM 0 HG22 VAL A 67 12.971 -10.722 -14.545 1.00 0.00 H new ATOM 0 HG23 VAL A 67 14.706 -11.059 -14.746 1.00 0.00 H new ATOM 1113 N VAL A 68 14.336 -9.349 -19.236 1.00 0.00 N ATOM 1114 CA VAL A 68 14.077 -8.645 -20.493 1.00 0.00 C ATOM 1115 C VAL A 68 13.506 -9.597 -21.534 1.00 0.00 C ATOM 1116 O VAL A 68 12.634 -9.196 -22.305 1.00 0.00 O ATOM 1117 CB VAL A 68 15.326 -7.935 -21.044 1.00 0.00 C ATOM 1118 CG1 VAL A 68 15.802 -6.882 -20.051 1.00 0.00 C ATOM 1119 CG2 VAL A 68 16.463 -8.906 -21.363 1.00 0.00 C ATOM 0 H VAL A 68 15.322 -9.453 -18.995 1.00 0.00 H new ATOM 0 HA VAL A 68 13.341 -7.871 -20.273 1.00 0.00 H new ATOM 0 HB VAL A 68 15.040 -7.460 -21.982 1.00 0.00 H new ATOM 0 HG11 VAL A 68 16.687 -6.383 -20.446 1.00 0.00 H new ATOM 0 HG12 VAL A 68 15.012 -6.148 -19.892 1.00 0.00 H new ATOM 0 HG13 VAL A 68 16.049 -7.361 -19.103 1.00 0.00 H new ATOM 0 HG21 VAL A 68 17.318 -8.351 -21.748 1.00 0.00 H new ATOM 0 HG22 VAL A 68 16.753 -9.437 -20.456 1.00 0.00 H new ATOM 0 HG23 VAL A 68 16.129 -9.624 -22.112 1.00 0.00 H new ATOM 1129 N GLN A 69 13.977 -10.851 -21.573 1.00 0.00 N ATOM 1130 CA GLN A 69 13.449 -11.816 -22.523 1.00 0.00 C ATOM 1131 C GLN A 69 12.003 -12.157 -22.174 1.00 0.00 C ATOM 1132 O GLN A 69 11.168 -12.275 -23.069 1.00 0.00 O ATOM 1133 CB GLN A 69 14.335 -13.066 -22.552 1.00 0.00 C ATOM 1134 CG GLN A 69 15.427 -12.869 -23.614 1.00 0.00 C ATOM 1135 CD GLN A 69 16.646 -13.777 -23.458 1.00 0.00 C ATOM 1136 OE1 GLN A 69 17.733 -13.433 -23.916 1.00 0.00 O ATOM 1137 NE2 GLN A 69 16.497 -14.935 -22.819 1.00 0.00 N ATOM 0 H GLN A 69 14.712 -11.209 -20.963 1.00 0.00 H new ATOM 0 HA GLN A 69 13.456 -11.382 -23.523 1.00 0.00 H new ATOM 0 HB2 GLN A 69 14.785 -13.233 -21.573 1.00 0.00 H new ATOM 0 HB3 GLN A 69 13.737 -13.948 -22.783 1.00 0.00 H new ATOM 0 HG2 GLN A 69 14.991 -13.037 -24.599 1.00 0.00 H new ATOM 0 HG3 GLN A 69 15.759 -11.831 -23.585 1.00 0.00 H new ATOM 0 HE21 GLN A 69 15.584 -15.199 -22.447 1.00 0.00 H new ATOM 0 HE22 GLN A 69 17.295 -15.559 -22.701 1.00 0.00 H new ATOM 1146 N GLN A 70 11.692 -12.315 -20.883 1.00 0.00 N ATOM 1147 CA GLN A 70 10.329 -12.613 -20.483 1.00 0.00 C ATOM 1148 C GLN A 70 9.430 -11.390 -20.660 1.00 0.00 C ATOM 1149 O GLN A 70 8.264 -11.531 -21.024 1.00 0.00 O ATOM 1150 CB GLN A 70 10.300 -13.049 -19.021 1.00 0.00 C ATOM 1151 CG GLN A 70 11.062 -14.354 -18.815 1.00 0.00 C ATOM 1152 CD GLN A 70 11.251 -14.637 -17.331 1.00 0.00 C ATOM 1153 OE1 GLN A 70 11.964 -13.914 -16.639 1.00 0.00 O ATOM 1154 NE2 GLN A 70 10.612 -15.692 -16.831 1.00 0.00 N ATOM 0 H GLN A 70 12.359 -12.241 -20.115 1.00 0.00 H new ATOM 0 HA GLN A 70 9.958 -13.418 -21.117 1.00 0.00 H new ATOM 0 HB2 GLN A 70 10.737 -12.268 -18.398 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.267 -13.174 -18.697 1.00 0.00 H new ATOM 0 HG2 GLN A 70 10.518 -15.176 -19.281 1.00 0.00 H new ATOM 0 HG3 GLN A 70 12.033 -14.295 -19.306 1.00 0.00 H new ATOM 0 HE21 GLN A 70 10.029 -16.269 -17.437 1.00 0.00 H new ATOM 0 HE22 GLN A 70 10.706 -15.923 -15.842 1.00 0.00 H new ATOM 1163 N ALA A 71 9.965 -10.193 -20.403 1.00 0.00 N ATOM 1164 CA ALA A 71 9.237 -8.950 -20.584 1.00 0.00 C ATOM 1165 C ALA A 71 8.858 -8.776 -22.049 1.00 0.00 C ATOM 1166 O ALA A 71 7.715 -8.454 -22.362 1.00 0.00 O ATOM 1167 CB ALA A 71 10.120 -7.798 -20.110 1.00 0.00 C ATOM 0 H ALA A 71 10.918 -10.067 -20.063 1.00 0.00 H new ATOM 0 HA ALA A 71 8.316 -8.964 -20.000 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.588 -6.855 -20.239 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.364 -7.936 -19.057 1.00 0.00 H new ATOM 0 HB3 ALA A 71 11.039 -7.779 -20.696 1.00 0.00 H new ATOM 1173 N LYS A 72 9.839 -8.996 -22.930 1.00 0.00 N ATOM 1174 CA LYS A 72 9.643 -9.061 -24.369 1.00 0.00 C ATOM 1175 C LYS A 72 8.611 -10.132 -24.720 1.00 0.00 C ATOM 1176 O LYS A 72 7.894 -9.996 -25.710 1.00 0.00 O ATOM 1177 CB LYS A 72 11.011 -9.385 -24.984 1.00 0.00 C ATOM 1178 CG LYS A 72 10.914 -10.094 -26.334 1.00 0.00 C ATOM 1179 CD LYS A 72 10.336 -9.205 -27.431 1.00 0.00 C ATOM 1180 CE LYS A 72 9.827 -10.086 -28.576 1.00 0.00 C ATOM 1181 NZ LYS A 72 8.866 -11.101 -28.097 1.00 0.00 N1+ ATOM 0 H LYS A 72 10.810 -9.136 -22.650 1.00 0.00 H new ATOM 0 HA LYS A 72 9.261 -8.118 -24.760 1.00 0.00 H new ATOM 0 HB2 LYS A 72 11.575 -8.460 -25.107 1.00 0.00 H new ATOM 0 HB3 LYS A 72 11.574 -10.012 -24.292 1.00 0.00 H new ATOM 0 HG2 LYS A 72 11.906 -10.433 -26.633 1.00 0.00 H new ATOM 0 HG3 LYS A 72 10.292 -10.983 -26.228 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.522 -8.598 -27.033 1.00 0.00 H new ATOM 0 HD3 LYS A 72 11.098 -8.516 -27.797 1.00 0.00 H new ATOM 0 HE2 LYS A 72 9.351 -9.462 -29.332 1.00 0.00 H new ATOM 0 HE3 LYS A 72 10.670 -10.581 -29.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 8.091 -11.197 -28.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 9.350 -12.015 -27.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 8.479 -10.806 -27.178 1.00 0.00 H new ATOM 1195 N GLY A 73 8.539 -11.192 -23.911 1.00 0.00 N ATOM 1196 CA GLY A 73 7.593 -12.277 -24.096 1.00 0.00 C ATOM 1197 C GLY A 73 6.157 -11.827 -23.878 1.00 0.00 C ATOM 1198 O GLY A 73 5.463 -11.479 -24.828 1.00 0.00 O ATOM 0 H GLY A 73 9.147 -11.315 -23.101 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.697 -12.680 -25.103 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.828 -13.085 -23.403 1.00 0.00 H new ATOM 1202 N GLN A 74 5.719 -11.841 -22.615 1.00 0.00 N ATOM 1203 CA GLN A 74 4.336 -11.593 -22.239 1.00 0.00 C ATOM 1204 C GLN A 74 3.851 -10.190 -22.618 1.00 0.00 C ATOM 1205 O GLN A 74 3.263 -10.020 -23.686 1.00 0.00 O ATOM 1206 CB GLN A 74 4.134 -11.919 -20.757 1.00 0.00 C ATOM 1207 CG GLN A 74 5.354 -11.555 -19.913 1.00 0.00 C ATOM 1208 CD GLN A 74 5.049 -11.545 -18.422 1.00 0.00 C ATOM 1209 OE1 GLN A 74 3.896 -11.443 -18.010 1.00 0.00 O ATOM 1210 NE2 GLN A 74 6.099 -11.651 -17.608 1.00 0.00 N ATOM 0 H GLN A 74 6.329 -12.028 -21.819 1.00 0.00 H new ATOM 0 HA GLN A 74 3.703 -12.263 -22.821 1.00 0.00 H new ATOM 0 HB2 GLN A 74 3.263 -11.380 -20.384 1.00 0.00 H new ATOM 0 HB3 GLN A 74 3.922 -12.983 -20.647 1.00 0.00 H new ATOM 0 HG2 GLN A 74 6.155 -12.267 -20.112 1.00 0.00 H new ATOM 0 HG3 GLN A 74 5.719 -10.573 -20.213 1.00 0.00 H new ATOM 0 HE21 GLN A 74 7.039 -11.734 -17.996 1.00 0.00 H new ATOM 0 HE22 GLN A 74 5.963 -11.650 -16.597 1.00 0.00 H new ATOM 1219 N LYS A 75 4.081 -9.180 -21.769 1.00 0.00 N ATOM 1220 CA LYS A 75 3.625 -7.825 -22.068 1.00 0.00 C ATOM 1221 C LYS A 75 4.358 -6.739 -21.276 1.00 0.00 C ATOM 1222 O LYS A 75 3.975 -5.571 -21.343 1.00 0.00 O ATOM 1223 CB LYS A 75 2.110 -7.728 -21.825 1.00 0.00 C ATOM 1224 CG LYS A 75 1.716 -7.577 -20.348 1.00 0.00 C ATOM 1225 CD LYS A 75 1.980 -8.799 -19.469 1.00 0.00 C ATOM 1226 CE LYS A 75 1.135 -9.994 -19.902 1.00 0.00 C ATOM 1227 NZ LYS A 75 1.242 -11.084 -18.916 1.00 0.00 N1+ ATOM 0 H LYS A 75 4.574 -9.277 -20.881 1.00 0.00 H new ATOM 0 HA LYS A 75 3.857 -7.640 -23.117 1.00 0.00 H new ATOM 0 HB2 LYS A 75 1.718 -6.877 -22.382 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.631 -8.621 -22.227 1.00 0.00 H new ATOM 0 HG2 LYS A 75 2.256 -6.727 -19.931 1.00 0.00 H new ATOM 0 HG3 LYS A 75 0.654 -7.336 -20.296 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.037 -9.062 -19.519 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.761 -8.555 -18.430 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.093 -9.691 -20.007 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.465 -10.346 -20.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 0.977 -11.984 -19.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.221 -11.144 -18.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.604 -10.893 -18.117 1.00 0.00 H new ATOM 1241 N ILE A 76 5.404 -7.100 -20.529 1.00 0.00 N ATOM 1242 CA ILE A 76 6.051 -6.183 -19.598 1.00 0.00 C ATOM 1243 C ILE A 76 7.032 -5.259 -20.320 1.00 0.00 C ATOM 1244 O ILE A 76 8.194 -5.172 -19.931 1.00 0.00 O ATOM 1245 CB ILE A 76 6.734 -6.956 -18.458 1.00 0.00 C ATOM 1246 CG1 ILE A 76 5.904 -8.151 -17.965 1.00 0.00 C ATOM 1247 CG2 ILE A 76 7.016 -6.002 -17.296 1.00 0.00 C ATOM 1248 CD1 ILE A 76 4.530 -7.748 -17.428 1.00 0.00 C ATOM 0 H ILE A 76 5.821 -8.030 -20.554 1.00 0.00 H new ATOM 0 HA ILE A 76 5.281 -5.551 -19.155 1.00 0.00 H new ATOM 0 HB ILE A 76 7.665 -7.362 -18.853 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.774 -8.858 -18.785 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.456 -8.670 -17.181 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.500 -6.548 -16.486 1.00 0.00 H new ATOM 0 HG22 ILE A 76 7.671 -5.199 -17.635 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.078 -5.578 -16.937 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.994 -8.637 -17.096 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.654 -7.064 -16.588 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.961 -7.255 -18.217 1.00 0.00 H new ATOM 1260 N ILE A 77 6.587 -4.560 -21.370 1.00 0.00 N ATOM 1261 CA ILE A 77 7.476 -3.722 -22.166 1.00 0.00 C ATOM 1262 C ILE A 77 8.229 -2.722 -21.294 1.00 0.00 C ATOM 1263 O ILE A 77 9.314 -2.280 -21.670 1.00 0.00 O ATOM 1264 CB ILE A 77 6.695 -2.995 -23.269 1.00 0.00 C ATOM 1265 CG1 ILE A 77 5.689 -1.978 -22.713 1.00 0.00 C ATOM 1266 CG2 ILE A 77 5.963 -4.013 -24.148 1.00 0.00 C ATOM 1267 CD1 ILE A 77 6.283 -0.570 -22.664 1.00 0.00 C ATOM 0 H ILE A 77 5.617 -4.561 -21.684 1.00 0.00 H new ATOM 0 HA ILE A 77 8.212 -4.375 -22.635 1.00 0.00 H new ATOM 0 HB ILE A 77 7.423 -2.440 -23.860 1.00 0.00 H new ATOM 0 HG12 ILE A 77 4.793 -1.974 -23.334 1.00 0.00 H new ATOM 0 HG13 ILE A 77 5.382 -2.279 -21.712 1.00 0.00 H new ATOM 0 HG21 ILE A 77 5.411 -3.489 -24.929 1.00 0.00 H new ATOM 0 HG22 ILE A 77 6.688 -4.686 -24.606 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.268 -4.589 -23.536 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.543 0.124 -22.265 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.164 -0.569 -22.022 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.566 -0.259 -23.670 1.00 0.00 H new ATOM 1279 N GLN A 78 7.673 -2.359 -20.135 1.00 0.00 N ATOM 1280 CA GLN A 78 8.323 -1.421 -19.240 1.00 0.00 C ATOM 1281 C GLN A 78 9.691 -1.945 -18.813 1.00 0.00 C ATOM 1282 O GLN A 78 10.595 -1.145 -18.586 1.00 0.00 O ATOM 1283 CB GLN A 78 7.436 -1.179 -18.013 1.00 0.00 C ATOM 1284 CG GLN A 78 6.064 -0.615 -18.404 1.00 0.00 C ATOM 1285 CD GLN A 78 6.161 0.770 -19.038 1.00 0.00 C ATOM 1286 OE1 GLN A 78 7.195 1.426 -18.975 1.00 0.00 O ATOM 1287 NE2 GLN A 78 5.074 1.225 -19.656 1.00 0.00 N ATOM 0 H GLN A 78 6.773 -2.705 -19.802 1.00 0.00 H new ATOM 0 HA GLN A 78 8.471 -0.477 -19.765 1.00 0.00 H new ATOM 0 HB2 GLN A 78 7.303 -2.115 -17.470 1.00 0.00 H new ATOM 0 HB3 GLN A 78 7.934 -0.486 -17.335 1.00 0.00 H new ATOM 0 HG2 GLN A 78 5.580 -1.298 -19.102 1.00 0.00 H new ATOM 0 HG3 GLN A 78 5.431 -0.562 -17.519 1.00 0.00 H new ATOM 0 HE21 GLN A 78 4.230 0.653 -19.690 1.00 0.00 H new ATOM 0 HE22 GLN A 78 5.085 2.145 -20.096 1.00 0.00 H new ATOM 1296 N PHE A 79 9.861 -3.268 -18.698 1.00 0.00 N ATOM 1297 CA PHE A 79 11.114 -3.840 -18.229 1.00 0.00 C ATOM 1298 C PHE A 79 12.162 -3.945 -19.332 1.00 0.00 C ATOM 1299 O PHE A 79 13.319 -3.593 -19.101 1.00 0.00 O ATOM 1300 CB PHE A 79 10.850 -5.208 -17.600 1.00 0.00 C ATOM 1301 CG PHE A 79 11.006 -5.184 -16.095 1.00 0.00 C ATOM 1302 CD1 PHE A 79 9.905 -4.912 -15.269 1.00 0.00 C ATOM 1303 CD2 PHE A 79 12.262 -5.434 -15.524 1.00 0.00 C ATOM 1304 CE1 PHE A 79 10.069 -4.903 -13.877 1.00 0.00 C ATOM 1305 CE2 PHE A 79 12.421 -5.442 -14.130 1.00 0.00 C ATOM 1306 CZ PHE A 79 11.319 -5.175 -13.309 1.00 0.00 C ATOM 0 H PHE A 79 9.143 -3.956 -18.925 1.00 0.00 H new ATOM 0 HA PHE A 79 11.524 -3.165 -17.478 1.00 0.00 H new ATOM 0 HB2 PHE A 79 9.842 -5.534 -17.854 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.538 -5.940 -18.023 1.00 0.00 H new ATOM 0 HD1 PHE A 79 8.937 -4.711 -15.703 1.00 0.00 H new ATOM 0 HD2 PHE A 79 13.113 -5.622 -16.162 1.00 0.00 H new ATOM 0 HE1 PHE A 79 9.226 -4.685 -13.239 1.00 0.00 H new ATOM 0 HE2 PHE A 79 13.386 -5.653 -13.694 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.434 -5.179 -12.235 1.00 0.00 H new ATOM 1316 N GLN A 80 11.788 -4.420 -20.526 1.00 0.00 N ATOM 1317 CA GLN A 80 12.762 -4.523 -21.603 1.00 0.00 C ATOM 1318 C GLN A 80 13.230 -3.121 -21.990 1.00 0.00 C ATOM 1319 O GLN A 80 14.387 -2.938 -22.365 1.00 0.00 O ATOM 1320 CB GLN A 80 12.173 -5.292 -22.792 1.00 0.00 C ATOM 1321 CG GLN A 80 11.017 -4.538 -23.451 1.00 0.00 C ATOM 1322 CD GLN A 80 10.288 -5.405 -24.470 1.00 0.00 C ATOM 1323 OE1 GLN A 80 9.111 -5.708 -24.303 1.00 0.00 O ATOM 1324 NE2 GLN A 80 10.966 -5.816 -25.536 1.00 0.00 N ATOM 0 H GLN A 80 10.845 -4.729 -20.761 1.00 0.00 H new ATOM 0 HA GLN A 80 13.631 -5.089 -21.267 1.00 0.00 H new ATOM 0 HB2 GLN A 80 12.955 -5.472 -23.530 1.00 0.00 H new ATOM 0 HB3 GLN A 80 11.823 -6.267 -22.454 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.315 -4.207 -22.686 1.00 0.00 H new ATOM 0 HG3 GLN A 80 11.399 -3.643 -23.942 1.00 0.00 H new ATOM 0 HE21 GLN A 80 11.944 -5.550 -25.652 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.509 -6.397 -26.238 1.00 0.00 H new ATOM 1333 N ASP A 81 12.335 -2.131 -21.899 1.00 0.00 N ATOM 1334 CA ASP A 81 12.678 -0.742 -22.138 1.00 0.00 C ATOM 1335 C ASP A 81 13.536 -0.181 -21.003 1.00 0.00 C ATOM 1336 O ASP A 81 14.536 0.487 -21.261 1.00 0.00 O ATOM 1337 CB ASP A 81 11.395 0.083 -22.281 1.00 0.00 C ATOM 1338 CG ASP A 81 10.590 -0.294 -23.523 1.00 0.00 C ATOM 1339 OD1 ASP A 81 11.098 -1.109 -24.326 1.00 0.00 O ATOM 1340 OD2 ASP A 81 9.472 0.246 -23.649 1.00 0.00 O1- ATOM 0 H ASP A 81 11.355 -2.280 -21.657 1.00 0.00 H new ATOM 0 HA ASP A 81 13.258 -0.683 -23.059 1.00 0.00 H new ATOM 0 HB2 ASP A 81 10.776 -0.058 -21.395 1.00 0.00 H new ATOM 0 HB3 ASP A 81 11.651 1.142 -22.326 1.00 0.00 H new ATOM 1345 N SER A 82 13.157 -0.446 -19.747 1.00 0.00 N ATOM 1346 CA SER A 82 13.872 0.109 -18.611 1.00 0.00 C ATOM 1347 C SER A 82 15.294 -0.430 -18.510 1.00 0.00 C ATOM 1348 O SER A 82 16.198 0.315 -18.136 1.00 0.00 O ATOM 1349 CB SER A 82 13.112 -0.159 -17.316 1.00 0.00 C ATOM 1350 OG SER A 82 11.887 0.534 -17.331 1.00 0.00 O ATOM 0 H SER A 82 12.364 -1.038 -19.501 1.00 0.00 H new ATOM 0 HA SER A 82 13.940 1.185 -18.768 1.00 0.00 H new ATOM 0 HB2 SER A 82 12.934 -1.228 -17.202 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.709 0.157 -16.461 1.00 0.00 H new ATOM 0 HG SER A 82 11.217 0.003 -17.809 1.00 0.00 H new ATOM 1356 N PHE A 83 15.511 -1.708 -18.835 1.00 0.00 N ATOM 1357 CA PHE A 83 16.862 -2.234 -18.849 1.00 0.00 C ATOM 1358 C PHE A 83 17.559 -1.903 -20.159 1.00 0.00 C ATOM 1359 O PHE A 83 18.748 -1.603 -20.148 1.00 0.00 O ATOM 1360 CB PHE A 83 16.855 -3.747 -18.627 1.00 0.00 C ATOM 1361 CG PHE A 83 16.634 -4.196 -17.195 1.00 0.00 C ATOM 1362 CD1 PHE A 83 15.806 -5.294 -16.919 1.00 0.00 C ATOM 1363 CD2 PHE A 83 17.266 -3.523 -16.136 1.00 0.00 C ATOM 1364 CE1 PHE A 83 15.632 -5.735 -15.601 1.00 0.00 C ATOM 1365 CE2 PHE A 83 17.078 -3.955 -14.819 1.00 0.00 C ATOM 1366 CZ PHE A 83 16.268 -5.065 -14.550 1.00 0.00 C ATOM 0 H PHE A 83 14.782 -2.377 -19.085 1.00 0.00 H new ATOM 0 HA PHE A 83 17.413 -1.763 -18.035 1.00 0.00 H new ATOM 0 HB2 PHE A 83 16.076 -4.185 -19.251 1.00 0.00 H new ATOM 0 HB3 PHE A 83 17.806 -4.152 -18.974 1.00 0.00 H new ATOM 0 HD1 PHE A 83 15.300 -5.802 -17.727 1.00 0.00 H new ATOM 0 HD2 PHE A 83 17.898 -2.671 -16.339 1.00 0.00 H new ATOM 0 HE1 PHE A 83 15.007 -6.592 -15.396 1.00 0.00 H new ATOM 0 HE2 PHE A 83 17.559 -3.431 -14.007 1.00 0.00 H new ATOM 0 HZ PHE A 83 16.134 -5.403 -13.533 1.00 0.00 H new ATOM 1376 N GLY A 84 16.847 -1.950 -21.285 1.00 0.00 N ATOM 1377 CA GLY A 84 17.450 -1.652 -22.572 1.00 0.00 C ATOM 1378 C GLY A 84 18.056 -0.255 -22.584 1.00 0.00 C ATOM 1379 O GLY A 84 19.106 -0.047 -23.188 1.00 0.00 O ATOM 0 H GLY A 84 15.857 -2.191 -21.326 1.00 0.00 H new ATOM 0 HA2 GLY A 84 18.222 -2.388 -22.794 1.00 0.00 H new ATOM 0 HA3 GLY A 84 16.698 -1.732 -23.357 1.00 0.00 H new ATOM 1383 N LYS A 85 17.405 0.708 -21.923 1.00 0.00 N ATOM 1384 CA LYS A 85 17.871 2.086 -21.930 1.00 0.00 C ATOM 1385 C LYS A 85 19.215 2.252 -21.221 1.00 0.00 C ATOM 1386 O LYS A 85 20.007 3.112 -21.602 1.00 0.00 O ATOM 1387 CB LYS A 85 16.775 2.986 -21.358 1.00 0.00 C ATOM 1388 CG LYS A 85 16.908 3.235 -19.859 1.00 0.00 C ATOM 1389 CD LYS A 85 15.873 4.260 -19.390 1.00 0.00 C ATOM 1390 CE LYS A 85 14.455 3.753 -19.645 1.00 0.00 C ATOM 1391 NZ LYS A 85 13.448 4.739 -19.213 1.00 0.00 N1+ ATOM 0 H LYS A 85 16.556 0.552 -21.379 1.00 0.00 H new ATOM 0 HA LYS A 85 18.064 2.391 -22.958 1.00 0.00 H new ATOM 0 HB2 LYS A 85 16.794 3.943 -21.880 1.00 0.00 H new ATOM 0 HB3 LYS A 85 15.804 2.533 -21.558 1.00 0.00 H new ATOM 0 HG2 LYS A 85 16.773 2.300 -19.316 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.912 3.594 -19.632 1.00 0.00 H new ATOM 0 HD2 LYS A 85 16.007 4.459 -18.327 1.00 0.00 H new ATOM 0 HD3 LYS A 85 16.026 5.204 -19.913 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.328 3.541 -20.707 1.00 0.00 H new ATOM 0 HE3 LYS A 85 14.301 2.815 -19.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 12.495 4.366 -19.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 13.556 4.922 -18.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 13.582 5.626 -19.740 1.00 0.00 H new ATOM 1405 N VAL A 86 19.476 1.432 -20.195 1.00 0.00 N ATOM 1406 CA VAL A 86 20.736 1.471 -19.459 1.00 0.00 C ATOM 1407 C VAL A 86 21.717 0.406 -19.947 1.00 0.00 C ATOM 1408 O VAL A 86 22.903 0.474 -19.635 1.00 0.00 O ATOM 1409 CB VAL A 86 20.470 1.295 -17.959 1.00 0.00 C ATOM 1410 CG1 VAL A 86 19.604 2.436 -17.427 1.00 0.00 C ATOM 1411 CG2 VAL A 86 19.784 -0.034 -17.655 1.00 0.00 C ATOM 0 H VAL A 86 18.820 0.728 -19.857 1.00 0.00 H new ATOM 0 HA VAL A 86 21.194 2.444 -19.638 1.00 0.00 H new ATOM 0 HB VAL A 86 21.441 1.306 -17.463 1.00 0.00 H new ATOM 0 HG11 VAL A 86 19.427 2.292 -16.361 1.00 0.00 H new ATOM 0 HG12 VAL A 86 20.116 3.385 -17.585 1.00 0.00 H new ATOM 0 HG13 VAL A 86 18.650 2.446 -17.955 1.00 0.00 H new ATOM 0 HG21 VAL A 86 19.614 -0.119 -16.582 1.00 0.00 H new ATOM 0 HG22 VAL A 86 18.829 -0.079 -18.178 1.00 0.00 H new ATOM 0 HG23 VAL A 86 20.419 -0.855 -17.988 1.00 0.00 H new ATOM 1421 N ALA A 87 21.234 -0.577 -20.712 1.00 0.00 N ATOM 1422 CA ALA A 87 22.019 -1.723 -21.137 1.00 0.00 C ATOM 1423 C ALA A 87 23.296 -1.344 -21.880 1.00 0.00 C ATOM 1424 O ALA A 87 24.311 -2.005 -21.681 1.00 0.00 O ATOM 1425 CB ALA A 87 21.143 -2.612 -22.010 1.00 0.00 C ATOM 0 H ALA A 87 20.273 -0.593 -21.054 1.00 0.00 H new ATOM 0 HA ALA A 87 22.344 -2.252 -20.241 1.00 0.00 H new ATOM 0 HB1 ALA A 87 21.717 -3.478 -22.338 1.00 0.00 H new ATOM 0 HB2 ALA A 87 20.278 -2.946 -21.437 1.00 0.00 H new ATOM 0 HB3 ALA A 87 20.806 -2.049 -22.880 1.00 0.00 H new ATOM 1431 N ALA A 88 23.286 -0.307 -22.727 1.00 0.00 N ATOM 1432 CA ALA A 88 24.502 0.104 -23.407 1.00 0.00 C ATOM 1433 C ALA A 88 25.584 0.499 -22.402 1.00 0.00 C ATOM 1434 O ALA A 88 26.699 -0.021 -22.451 1.00 0.00 O ATOM 1435 CB ALA A 88 24.169 1.249 -24.364 1.00 0.00 C ATOM 0 H ALA A 88 22.460 0.249 -22.950 1.00 0.00 H new ATOM 0 HA ALA A 88 24.902 -0.731 -23.983 1.00 0.00 H new ATOM 0 HB1 ALA A 88 25.075 1.566 -24.881 1.00 0.00 H new ATOM 0 HB2 ALA A 88 23.434 0.911 -25.094 1.00 0.00 H new ATOM 0 HB3 ALA A 88 23.760 2.087 -23.800 1.00 0.00 H new ATOM 1441 N GLU A 89 25.256 1.417 -21.489 1.00 0.00 N ATOM 1442 CA GLU A 89 26.175 1.855 -20.451 1.00 0.00 C ATOM 1443 C GLU A 89 26.594 0.665 -19.596 1.00 0.00 C ATOM 1444 O GLU A 89 27.783 0.451 -19.355 1.00 0.00 O ATOM 1445 CB GLU A 89 25.458 2.906 -19.595 1.00 0.00 C ATOM 1446 CG GLU A 89 26.121 3.138 -18.234 1.00 0.00 C ATOM 1447 CD GLU A 89 25.304 4.104 -17.378 1.00 0.00 C ATOM 1448 OE1 GLU A 89 24.138 4.363 -17.745 1.00 0.00 O ATOM 1449 OE2 GLU A 89 25.850 4.580 -16.360 1.00 0.00 O1- ATOM 0 H GLU A 89 24.345 1.874 -21.454 1.00 0.00 H new ATOM 0 HA GLU A 89 27.073 2.287 -20.892 1.00 0.00 H new ATOM 0 HB2 GLU A 89 25.427 3.849 -20.141 1.00 0.00 H new ATOM 0 HB3 GLU A 89 24.425 2.594 -19.439 1.00 0.00 H new ATOM 0 HG2 GLU A 89 26.228 2.187 -17.712 1.00 0.00 H new ATOM 0 HG3 GLU A 89 27.125 3.537 -18.379 1.00 0.00 H new ATOM 1456 N VAL A 90 25.601 -0.104 -19.140 1.00 0.00 N ATOM 1457 CA VAL A 90 25.811 -1.221 -18.245 1.00 0.00 C ATOM 1458 C VAL A 90 26.654 -2.319 -18.885 1.00 0.00 C ATOM 1459 O VAL A 90 27.773 -2.563 -18.442 1.00 0.00 O ATOM 1460 CB VAL A 90 24.460 -1.736 -17.749 1.00 0.00 C ATOM 1461 CG1 VAL A 90 24.630 -3.081 -17.048 1.00 0.00 C ATOM 1462 CG2 VAL A 90 23.880 -0.736 -16.747 1.00 0.00 C ATOM 0 H VAL A 90 24.623 0.042 -19.390 1.00 0.00 H new ATOM 0 HA VAL A 90 26.385 -0.878 -17.384 1.00 0.00 H new ATOM 0 HB VAL A 90 23.794 -1.854 -18.603 1.00 0.00 H new ATOM 0 HG11 VAL A 90 23.660 -3.435 -16.700 1.00 0.00 H new ATOM 0 HG12 VAL A 90 25.052 -3.804 -17.746 1.00 0.00 H new ATOM 0 HG13 VAL A 90 25.300 -2.965 -16.196 1.00 0.00 H new ATOM 0 HG21 VAL A 90 22.916 -1.097 -16.389 1.00 0.00 H new ATOM 0 HG22 VAL A 90 24.563 -0.628 -15.904 1.00 0.00 H new ATOM 0 HG23 VAL A 90 23.748 0.231 -17.233 1.00 0.00 H new ATOM 1472 N LEU A 91 26.138 -2.990 -19.920 1.00 0.00 N ATOM 1473 CA LEU A 91 26.828 -4.122 -20.521 1.00 0.00 C ATOM 1474 C LEU A 91 28.221 -3.718 -20.978 1.00 0.00 C ATOM 1475 O LEU A 91 29.137 -4.537 -20.935 1.00 0.00 O ATOM 1476 CB LEU A 91 26.017 -4.651 -21.703 1.00 0.00 C ATOM 1477 CG LEU A 91 24.655 -5.187 -21.266 1.00 0.00 C ATOM 1478 CD1 LEU A 91 23.753 -5.334 -22.489 1.00 0.00 C ATOM 1479 CD2 LEU A 91 24.813 -6.545 -20.584 1.00 0.00 C ATOM 0 H LEU A 91 25.244 -2.764 -20.355 1.00 0.00 H new ATOM 0 HA LEU A 91 26.928 -4.910 -19.774 1.00 0.00 H new ATOM 0 HB2 LEU A 91 25.876 -3.853 -22.432 1.00 0.00 H new ATOM 0 HB3 LEU A 91 26.576 -5.443 -22.201 1.00 0.00 H new ATOM 0 HG LEU A 91 24.209 -4.487 -20.559 1.00 0.00 H new ATOM 0 HD11 LEU A 91 22.780 -5.716 -22.180 1.00 0.00 H new ATOM 0 HD12 LEU A 91 23.626 -4.362 -22.966 1.00 0.00 H new ATOM 0 HD13 LEU A 91 24.208 -6.028 -23.195 1.00 0.00 H new ATOM 0 HD21 LEU A 91 23.834 -6.915 -20.278 1.00 0.00 H new ATOM 0 HD22 LEU A 91 25.266 -7.251 -21.280 1.00 0.00 H new ATOM 0 HD23 LEU A 91 25.451 -6.440 -19.707 1.00 0.00 H new ATOM 1491 N GLY A 92 28.383 -2.464 -21.410 1.00 0.00 N ATOM 1492 CA GLY A 92 29.693 -1.946 -21.751 1.00 0.00 C ATOM 1493 C GLY A 92 30.594 -2.032 -20.529 1.00 0.00 C ATOM 1494 O GLY A 92 31.623 -2.697 -20.574 1.00 0.00 O ATOM 0 H GLY A 92 27.620 -1.797 -21.529 1.00 0.00 H new ATOM 0 HA2 GLY A 92 30.121 -2.517 -22.575 1.00 0.00 H new ATOM 0 HA3 GLY A 92 29.613 -0.912 -22.088 1.00 0.00 H new ATOM 1498 N ARG A 93 30.204 -1.361 -19.442 1.00 0.00 N ATOM 1499 CA ARG A 93 30.961 -1.322 -18.200 1.00 0.00 C ATOM 1500 C ARG A 93 31.300 -2.715 -17.671 1.00 0.00 C ATOM 1501 O ARG A 93 32.406 -2.914 -17.177 1.00 0.00 O ATOM 1502 CB ARG A 93 30.113 -0.562 -17.183 1.00 0.00 C ATOM 1503 CG ARG A 93 30.355 0.940 -17.332 1.00 0.00 C ATOM 1504 CD ARG A 93 31.418 1.408 -16.338 1.00 0.00 C ATOM 1505 NE ARG A 93 32.695 0.698 -16.481 1.00 0.00 N ATOM 1506 CZ ARG A 93 33.134 -0.269 -15.665 1.00 0.00 C ATOM 1507 NH1 ARG A 93 32.414 -0.693 -14.626 1.00 0.00 N1+ ATOM 1508 NH2 ARG A 93 34.321 -0.826 -15.893 1.00 0.00 N ATOM 0 H ARG A 93 29.338 -0.823 -19.405 1.00 0.00 H new ATOM 0 HA ARG A 93 31.917 -0.829 -18.378 1.00 0.00 H new ATOM 0 HB2 ARG A 93 29.057 -0.787 -17.334 1.00 0.00 H new ATOM 0 HB3 ARG A 93 30.365 -0.883 -16.172 1.00 0.00 H new ATOM 0 HG2 ARG A 93 30.675 1.164 -18.349 1.00 0.00 H new ATOM 0 HG3 ARG A 93 29.425 1.483 -17.163 1.00 0.00 H new ATOM 0 HD2 ARG A 93 31.587 2.476 -16.472 1.00 0.00 H new ATOM 0 HD3 ARG A 93 31.044 1.269 -15.324 1.00 0.00 H new ATOM 0 HE ARG A 93 33.295 0.962 -17.263 1.00 0.00 H new ATOM 0 HH11 ARG A 93 31.502 -0.279 -14.435 1.00 0.00 H new ATOM 0 HH12 ARG A 93 32.775 -1.432 -14.022 1.00 0.00 H new ATOM 0 HH21 ARG A 93 34.887 -0.516 -16.683 1.00 0.00 H new ATOM 0 HH22 ARG A 93 34.665 -1.563 -15.278 1.00 0.00 H new ATOM 1522 N ILE A 94 30.375 -3.673 -17.767 1.00 0.00 N ATOM 1523 CA ILE A 94 30.637 -5.018 -17.269 1.00 0.00 C ATOM 1524 C ILE A 94 31.757 -5.670 -18.065 1.00 0.00 C ATOM 1525 O ILE A 94 32.637 -6.316 -17.501 1.00 0.00 O ATOM 1526 CB ILE A 94 29.384 -5.887 -17.380 1.00 0.00 C ATOM 1527 CG1 ILE A 94 28.221 -5.233 -16.648 1.00 0.00 C ATOM 1528 CG2 ILE A 94 29.658 -7.269 -16.781 1.00 0.00 C ATOM 1529 CD1 ILE A 94 26.926 -6.004 -16.910 1.00 0.00 C ATOM 0 H ILE A 94 29.451 -3.542 -18.180 1.00 0.00 H new ATOM 0 HA ILE A 94 30.930 -4.935 -16.223 1.00 0.00 H new ATOM 0 HB ILE A 94 29.123 -5.993 -18.433 1.00 0.00 H new ATOM 0 HG12 ILE A 94 28.426 -5.206 -15.578 1.00 0.00 H new ATOM 0 HG13 ILE A 94 28.110 -4.200 -16.978 1.00 0.00 H new ATOM 0 HG21 ILE A 94 28.762 -7.885 -16.862 1.00 0.00 H new ATOM 0 HG22 ILE A 94 30.476 -7.745 -17.322 1.00 0.00 H new ATOM 0 HG23 ILE A 94 29.931 -7.163 -15.731 1.00 0.00 H new ATOM 0 HD11 ILE A 94 26.103 -5.524 -16.380 1.00 0.00 H new ATOM 0 HD12 ILE A 94 26.715 -6.008 -17.979 1.00 0.00 H new ATOM 0 HD13 ILE A 94 27.036 -7.030 -16.558 1.00 0.00 H new ATOM 1541 N ASN A 95 31.717 -5.495 -19.386 1.00 0.00 N ATOM 1542 CA ASN A 95 32.649 -6.085 -20.305 1.00 0.00 C ATOM 1543 C ASN A 95 34.052 -5.495 -20.137 1.00 0.00 C ATOM 1544 O ASN A 95 35.009 -6.049 -20.670 1.00 0.00 O ATOM 1545 CB ASN A 95 32.045 -5.811 -21.675 1.00 0.00 C ATOM 1546 CG ASN A 95 32.731 -6.597 -22.759 1.00 0.00 C ATOM 1547 OD1 ASN A 95 32.843 -7.818 -22.692 1.00 0.00 O ATOM 1548 ND2 ASN A 95 33.195 -5.882 -23.769 1.00 0.00 N ATOM 0 H ASN A 95 31.010 -4.920 -19.844 1.00 0.00 H new ATOM 0 HA ASN A 95 32.791 -7.153 -20.141 1.00 0.00 H new ATOM 0 HB2 ASN A 95 30.984 -6.062 -21.661 1.00 0.00 H new ATOM 0 HB3 ASN A 95 32.118 -4.746 -21.897 1.00 0.00 H new ATOM 0 HD21 ASN A 95 33.673 -6.343 -24.543 1.00 0.00 H new ATOM 0 HD22 ASN A 95 33.075 -4.869 -23.775 1.00 0.00 H new ATOM 1555 N GLN A 96 34.188 -4.381 -19.410 1.00 0.00 N ATOM 1556 CA GLN A 96 35.486 -3.785 -19.136 1.00 0.00 C ATOM 1557 C GLN A 96 36.153 -4.425 -17.923 1.00 0.00 C ATOM 1558 O GLN A 96 37.377 -4.520 -17.873 1.00 0.00 O ATOM 1559 CB GLN A 96 35.299 -2.300 -18.831 1.00 0.00 C ATOM 1560 CG GLN A 96 34.592 -1.598 -19.981 1.00 0.00 C ATOM 1561 CD GLN A 96 34.176 -0.180 -19.611 1.00 0.00 C ATOM 1562 OE1 GLN A 96 34.609 0.370 -18.597 1.00 0.00 O ATOM 1563 NE2 GLN A 96 33.329 0.427 -20.436 1.00 0.00 N ATOM 0 H GLN A 96 33.403 -3.875 -19.000 1.00 0.00 H new ATOM 0 HA GLN A 96 36.114 -3.940 -20.013 1.00 0.00 H new ATOM 0 HB2 GLN A 96 34.719 -2.182 -17.915 1.00 0.00 H new ATOM 0 HB3 GLN A 96 36.269 -1.835 -18.656 1.00 0.00 H new ATOM 0 HG2 GLN A 96 35.251 -1.568 -20.849 1.00 0.00 H new ATOM 0 HG3 GLN A 96 33.711 -2.171 -20.270 1.00 0.00 H new ATOM 0 HE21 GLN A 96 32.990 -0.058 -21.267 1.00 0.00 H new ATOM 0 HE22 GLN A 96 33.018 1.378 -20.238 1.00 0.00 H new ATOM 1572 N GLU A 97 35.348 -4.859 -16.948 1.00 0.00 N ATOM 1573 CA GLU A 97 35.879 -5.387 -15.700 1.00 0.00 C ATOM 1574 C GLU A 97 35.769 -6.910 -15.622 1.00 0.00 C ATOM 1575 O GLU A 97 36.302 -7.518 -14.693 1.00 0.00 O ATOM 1576 CB GLU A 97 35.193 -4.691 -14.519 1.00 0.00 C ATOM 1577 CG GLU A 97 33.712 -5.053 -14.407 1.00 0.00 C ATOM 1578 CD GLU A 97 33.036 -4.228 -13.315 1.00 0.00 C ATOM 1579 OE1 GLU A 97 32.440 -4.852 -12.409 1.00 0.00 O ATOM 1580 OE2 GLU A 97 33.126 -2.982 -13.400 1.00 0.00 O1- ATOM 0 H GLU A 97 34.330 -4.853 -17.004 1.00 0.00 H new ATOM 0 HA GLU A 97 36.946 -5.171 -15.657 1.00 0.00 H new ATOM 0 HB2 GLU A 97 35.702 -4.965 -13.595 1.00 0.00 H new ATOM 0 HB3 GLU A 97 35.293 -3.611 -14.630 1.00 0.00 H new ATOM 0 HG2 GLU A 97 33.216 -4.877 -15.362 1.00 0.00 H new ATOM 0 HG3 GLU A 97 33.608 -6.115 -14.184 1.00 0.00 H new ATOM 1587 N PHE A 98 35.084 -7.537 -16.583 1.00 0.00 N ATOM 1588 CA PHE A 98 35.023 -8.987 -16.661 1.00 0.00 C ATOM 1589 C PHE A 98 36.333 -9.535 -17.224 1.00 0.00 C ATOM 1590 O PHE A 98 36.941 -8.915 -18.096 1.00 0.00 O ATOM 1591 CB PHE A 98 33.844 -9.423 -17.535 1.00 0.00 C ATOM 1592 CG PHE A 98 32.530 -9.613 -16.806 1.00 0.00 C ATOM 1593 CD1 PHE A 98 32.347 -9.145 -15.497 1.00 0.00 C ATOM 1594 CD2 PHE A 98 31.481 -10.277 -17.460 1.00 0.00 C ATOM 1595 CE1 PHE A 98 31.135 -9.374 -14.834 1.00 0.00 C ATOM 1596 CE2 PHE A 98 30.268 -10.501 -16.798 1.00 0.00 C ATOM 1597 CZ PHE A 98 30.098 -10.057 -15.482 1.00 0.00 C ATOM 0 H PHE A 98 34.565 -7.055 -17.317 1.00 0.00 H new ATOM 0 HA PHE A 98 34.876 -9.388 -15.658 1.00 0.00 H new ATOM 0 HB2 PHE A 98 33.701 -8.680 -18.319 1.00 0.00 H new ATOM 0 HB3 PHE A 98 34.106 -10.360 -18.027 1.00 0.00 H new ATOM 0 HD1 PHE A 98 33.141 -8.608 -15.000 1.00 0.00 H new ATOM 0 HD2 PHE A 98 31.610 -10.616 -18.477 1.00 0.00 H new ATOM 0 HE1 PHE A 98 31.000 -9.023 -13.821 1.00 0.00 H new ATOM 0 HE2 PHE A 98 29.464 -11.016 -17.303 1.00 0.00 H new ATOM 0 HZ PHE A 98 29.167 -10.241 -14.966 1.00 0.00 H new ATOM 1607 N PRO A 99 36.778 -10.701 -16.732 1.00 0.00 N ATOM 1608 CA PRO A 99 37.903 -11.422 -17.293 1.00 0.00 C ATOM 1609 C PRO A 99 37.478 -11.958 -18.655 1.00 0.00 C ATOM 1610 O PRO A 99 36.284 -12.047 -18.934 1.00 0.00 O ATOM 1611 CB PRO A 99 38.190 -12.559 -16.312 1.00 0.00 C ATOM 1612 CG PRO A 99 36.808 -12.830 -15.719 1.00 0.00 C ATOM 1613 CD PRO A 99 36.223 -11.428 -15.607 1.00 0.00 C ATOM 0 HA PRO A 99 38.793 -10.808 -17.432 1.00 0.00 H new ATOM 0 HB2 PRO A 99 38.597 -13.437 -16.814 1.00 0.00 H new ATOM 0 HB3 PRO A 99 38.910 -12.266 -15.548 1.00 0.00 H new ATOM 0 HG2 PRO A 99 36.207 -13.471 -16.364 1.00 0.00 H new ATOM 0 HG3 PRO A 99 36.871 -13.323 -14.749 1.00 0.00 H new ATOM 0 HD2 PRO A 99 35.134 -11.450 -15.649 1.00 0.00 H new ATOM 0 HD3 PRO A 99 36.496 -10.960 -14.661 1.00 0.00 H new ATOM 1621 N ARG A 100 38.443 -12.320 -19.505 1.00 0.00 N ATOM 1622 CA ARG A 100 38.130 -12.724 -20.872 1.00 0.00 C ATOM 1623 C ARG A 100 37.121 -13.873 -20.906 1.00 0.00 C ATOM 1624 O ARG A 100 36.387 -14.011 -21.881 1.00 0.00 O ATOM 1625 CB ARG A 100 39.422 -13.111 -21.597 1.00 0.00 C ATOM 1626 CG ARG A 100 40.478 -12.001 -21.525 1.00 0.00 C ATOM 1627 CD ARG A 100 39.900 -10.656 -21.956 1.00 0.00 C ATOM 1628 NE ARG A 100 40.922 -9.603 -21.972 1.00 0.00 N ATOM 1629 CZ ARG A 100 40.697 -8.333 -21.614 1.00 0.00 C ATOM 1630 NH1 ARG A 100 39.507 -7.952 -21.149 1.00 0.00 N1+ ATOM 1631 NH2 ARG A 100 41.665 -7.425 -21.719 1.00 0.00 N ATOM 0 H ARG A 100 39.436 -12.341 -19.271 1.00 0.00 H new ATOM 0 HA ARG A 100 37.667 -11.880 -21.384 1.00 0.00 H new ATOM 0 HB2 ARG A 100 39.825 -14.023 -21.157 1.00 0.00 H new ATOM 0 HB3 ARG A 100 39.199 -13.332 -22.641 1.00 0.00 H new ATOM 0 HG2 ARG A 100 40.860 -11.925 -20.507 1.00 0.00 H new ATOM 0 HG3 ARG A 100 41.323 -12.258 -22.164 1.00 0.00 H new ATOM 0 HD2 ARG A 100 39.460 -10.751 -22.949 1.00 0.00 H new ATOM 0 HD3 ARG A 100 39.096 -10.372 -21.277 1.00 0.00 H new ATOM 0 HE ARG A 100 41.863 -9.855 -22.275 1.00 0.00 H new ATOM 0 HH11 ARG A 100 38.752 -8.632 -21.062 1.00 0.00 H new ATOM 0 HH12 ARG A 100 39.352 -6.980 -20.880 1.00 0.00 H new ATOM 0 HH21 ARG A 100 42.582 -7.696 -22.073 1.00 0.00 H new ATOM 0 HH22 ARG A 100 41.489 -6.458 -21.445 1.00 0.00 H new ATOM 1645 N ASP A 101 37.071 -14.698 -19.856 1.00 0.00 N ATOM 1646 CA ASP A 101 36.119 -15.796 -19.776 1.00 0.00 C ATOM 1647 C ASP A 101 34.703 -15.312 -19.492 1.00 0.00 C ATOM 1648 O ASP A 101 33.763 -15.764 -20.145 1.00 0.00 O ATOM 1649 CB ASP A 101 36.599 -16.796 -18.730 1.00 0.00 C ATOM 1650 CG ASP A 101 37.899 -17.463 -19.178 1.00 0.00 C ATOM 1651 OD1 ASP A 101 38.523 -18.114 -18.314 1.00 0.00 O ATOM 1652 OD2 ASP A 101 38.242 -17.308 -20.372 1.00 0.00 O1- ATOM 0 H ASP A 101 37.687 -14.620 -19.046 1.00 0.00 H new ATOM 0 HA ASP A 101 36.072 -16.290 -20.746 1.00 0.00 H new ATOM 0 HB2 ASP A 101 36.754 -16.288 -17.778 1.00 0.00 H new ATOM 0 HB3 ASP A 101 35.833 -17.554 -18.566 1.00 0.00 H new ATOM 1657 N LEU A 102 34.527 -14.399 -18.530 1.00 0.00 N ATOM 1658 CA LEU A 102 33.202 -13.873 -18.267 1.00 0.00 C ATOM 1659 C LEU A 102 32.785 -12.939 -19.401 1.00 0.00 C ATOM 1660 O LEU A 102 31.593 -12.822 -19.672 1.00 0.00 O ATOM 1661 CB LEU A 102 33.157 -13.177 -16.905 1.00 0.00 C ATOM 1662 CG LEU A 102 33.443 -14.133 -15.738 1.00 0.00 C ATOM 1663 CD1 LEU A 102 33.188 -13.407 -14.420 1.00 0.00 C ATOM 1664 CD2 LEU A 102 32.541 -15.367 -15.796 1.00 0.00 C ATOM 0 H LEU A 102 35.269 -14.023 -17.940 1.00 0.00 H new ATOM 0 HA LEU A 102 32.487 -14.695 -18.227 1.00 0.00 H new ATOM 0 HB2 LEU A 102 33.886 -12.367 -16.892 1.00 0.00 H new ATOM 0 HB3 LEU A 102 32.175 -12.725 -16.766 1.00 0.00 H new ATOM 0 HG LEU A 102 34.482 -14.454 -15.810 1.00 0.00 H new ATOM 0 HD11 LEU A 102 33.390 -14.082 -13.588 1.00 0.00 H new ATOM 0 HD12 LEU A 102 33.843 -12.539 -14.350 1.00 0.00 H new ATOM 0 HD13 LEU A 102 32.149 -13.081 -14.379 1.00 0.00 H new ATOM 0 HD21 LEU A 102 32.768 -16.024 -14.956 1.00 0.00 H new ATOM 0 HD22 LEU A 102 31.497 -15.058 -15.742 1.00 0.00 H new ATOM 0 HD23 LEU A 102 32.714 -15.900 -16.731 1.00 0.00 H new ATOM 1676 N LYS A 103 33.736 -12.274 -20.069 1.00 0.00 N ATOM 1677 CA LYS A 103 33.410 -11.506 -21.265 1.00 0.00 C ATOM 1678 C LYS A 103 32.819 -12.410 -22.343 1.00 0.00 C ATOM 1679 O LYS A 103 31.886 -11.995 -23.031 1.00 0.00 O ATOM 1680 CB LYS A 103 34.643 -10.779 -21.810 1.00 0.00 C ATOM 1681 CG LYS A 103 35.076 -9.665 -20.853 1.00 0.00 C ATOM 1682 CD LYS A 103 36.274 -8.862 -21.376 1.00 0.00 C ATOM 1683 CE LYS A 103 35.865 -7.992 -22.567 1.00 0.00 C ATOM 1684 NZ LYS A 103 36.887 -6.969 -22.871 1.00 0.00 N1+ ATOM 0 H LYS A 103 34.721 -12.255 -19.803 1.00 0.00 H new ATOM 0 HA LYS A 103 32.667 -10.759 -20.984 1.00 0.00 H new ATOM 0 HB2 LYS A 103 35.460 -11.488 -21.946 1.00 0.00 H new ATOM 0 HB3 LYS A 103 34.420 -10.358 -22.790 1.00 0.00 H new ATOM 0 HG2 LYS A 103 34.237 -8.989 -20.686 1.00 0.00 H new ATOM 0 HG3 LYS A 103 35.331 -10.101 -19.887 1.00 0.00 H new ATOM 0 HD2 LYS A 103 36.672 -8.233 -20.580 1.00 0.00 H new ATOM 0 HD3 LYS A 103 37.072 -9.542 -21.674 1.00 0.00 H new ATOM 0 HE2 LYS A 103 35.709 -8.623 -23.442 1.00 0.00 H new ATOM 0 HE3 LYS A 103 34.914 -7.504 -22.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 36.576 -6.398 -23.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 37.017 -6.352 -22.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 37.788 -7.436 -23.100 1.00 0.00 H new ATOM 1698 N LYS A 104 33.337 -13.635 -22.504 1.00 0.00 N ATOM 1699 CA LYS A 104 32.753 -14.577 -23.449 1.00 0.00 C ATOM 1700 C LYS A 104 31.327 -14.943 -23.049 1.00 0.00 C ATOM 1701 O LYS A 104 30.449 -14.977 -23.909 1.00 0.00 O ATOM 1702 CB LYS A 104 33.627 -15.829 -23.563 1.00 0.00 C ATOM 1703 CG LYS A 104 34.881 -15.533 -24.388 1.00 0.00 C ATOM 1704 CD LYS A 104 35.707 -16.802 -24.625 1.00 0.00 C ATOM 1705 CE LYS A 104 36.298 -17.371 -23.333 1.00 0.00 C ATOM 1706 NZ LYS A 104 37.370 -16.512 -22.802 1.00 0.00 N1+ ATOM 0 H LYS A 104 34.149 -13.987 -21.996 1.00 0.00 H new ATOM 0 HA LYS A 104 32.710 -14.097 -24.427 1.00 0.00 H new ATOM 0 HB2 LYS A 104 33.911 -16.173 -22.569 1.00 0.00 H new ATOM 0 HB3 LYS A 104 33.060 -16.635 -24.029 1.00 0.00 H new ATOM 0 HG2 LYS A 104 34.594 -15.100 -25.346 1.00 0.00 H new ATOM 0 HG3 LYS A 104 35.491 -14.791 -23.872 1.00 0.00 H new ATOM 0 HD2 LYS A 104 35.078 -17.558 -25.096 1.00 0.00 H new ATOM 0 HD3 LYS A 104 36.515 -16.580 -25.322 1.00 0.00 H new ATOM 0 HE2 LYS A 104 35.510 -17.474 -22.587 1.00 0.00 H new ATOM 0 HE3 LYS A 104 36.691 -18.370 -23.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 37.701 -16.892 -21.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 38.162 -16.489 -23.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 37.005 -15.548 -22.663 1.00 0.00 H new ATOM 1720 N LYS A 105 31.082 -15.216 -21.762 1.00 0.00 N ATOM 1721 CA LYS A 105 29.729 -15.548 -21.318 1.00 0.00 C ATOM 1722 C LYS A 105 28.803 -14.354 -21.516 1.00 0.00 C ATOM 1723 O LYS A 105 27.693 -14.501 -22.022 1.00 0.00 O ATOM 1724 CB LYS A 105 29.719 -15.972 -19.849 1.00 0.00 C ATOM 1725 CG LYS A 105 30.517 -17.259 -19.649 1.00 0.00 C ATOM 1726 CD LYS A 105 30.225 -17.837 -18.263 1.00 0.00 C ATOM 1727 CE LYS A 105 31.032 -19.119 -18.054 1.00 0.00 C ATOM 1728 NZ LYS A 105 30.662 -19.785 -16.791 1.00 0.00 N1+ ATOM 0 H LYS A 105 31.788 -15.214 -21.026 1.00 0.00 H new ATOM 0 HA LYS A 105 29.374 -16.385 -21.920 1.00 0.00 H new ATOM 0 HB2 LYS A 105 30.142 -15.178 -19.234 1.00 0.00 H new ATOM 0 HB3 LYS A 105 28.692 -16.121 -19.516 1.00 0.00 H new ATOM 0 HG2 LYS A 105 30.254 -17.985 -20.419 1.00 0.00 H new ATOM 0 HG3 LYS A 105 31.583 -17.057 -19.752 1.00 0.00 H new ATOM 0 HD2 LYS A 105 30.479 -17.107 -17.494 1.00 0.00 H new ATOM 0 HD3 LYS A 105 29.160 -18.047 -18.164 1.00 0.00 H new ATOM 0 HE2 LYS A 105 30.862 -19.798 -18.889 1.00 0.00 H new ATOM 0 HE3 LYS A 105 32.096 -18.884 -18.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 31.226 -20.651 -16.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 30.847 -19.144 -15.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 29.651 -20.030 -16.811 1.00 0.00 H new ATOM 1742 N LEU A 106 29.273 -13.172 -21.112 1.00 0.00 N ATOM 1743 CA LEU A 106 28.545 -11.925 -21.272 1.00 0.00 C ATOM 1744 C LEU A 106 28.190 -11.724 -22.736 1.00 0.00 C ATOM 1745 O LEU A 106 27.051 -11.399 -23.061 1.00 0.00 O ATOM 1746 CB LEU A 106 29.426 -10.785 -20.749 1.00 0.00 C ATOM 1747 CG LEU A 106 28.870 -9.396 -21.081 1.00 0.00 C ATOM 1748 CD1 LEU A 106 29.277 -8.415 -19.982 1.00 0.00 C ATOM 1749 CD2 LEU A 106 29.436 -8.847 -22.393 1.00 0.00 C ATOM 0 H LEU A 106 30.181 -13.059 -20.660 1.00 0.00 H new ATOM 0 HA LEU A 106 27.614 -11.945 -20.706 1.00 0.00 H new ATOM 0 HB2 LEU A 106 29.529 -10.880 -19.668 1.00 0.00 H new ATOM 0 HB3 LEU A 106 30.425 -10.881 -21.174 1.00 0.00 H new ATOM 0 HG LEU A 106 27.788 -9.498 -21.166 1.00 0.00 H new ATOM 0 HD11 LEU A 106 28.884 -7.425 -20.214 1.00 0.00 H new ATOM 0 HD12 LEU A 106 28.874 -8.751 -19.027 1.00 0.00 H new ATOM 0 HD13 LEU A 106 30.364 -8.368 -19.921 1.00 0.00 H new ATOM 0 HD21 LEU A 106 29.014 -7.861 -22.587 1.00 0.00 H new ATOM 0 HD22 LEU A 106 30.521 -8.769 -22.317 1.00 0.00 H new ATOM 0 HD23 LEU A 106 29.177 -9.520 -23.211 1.00 0.00 H new ATOM 1761 N SER A 107 29.171 -11.922 -23.618 1.00 0.00 N ATOM 1762 CA SER A 107 28.974 -11.747 -25.044 1.00 0.00 C ATOM 1763 C SER A 107 27.823 -12.614 -25.547 1.00 0.00 C ATOM 1764 O SER A 107 27.020 -12.134 -26.344 1.00 0.00 O ATOM 1765 CB SER A 107 30.274 -12.067 -25.783 1.00 0.00 C ATOM 1766 OG SER A 107 31.295 -11.185 -25.369 1.00 0.00 O ATOM 0 H SER A 107 30.116 -12.206 -23.359 1.00 0.00 H new ATOM 0 HA SER A 107 28.706 -10.709 -25.241 1.00 0.00 H new ATOM 0 HB2 SER A 107 30.570 -13.097 -25.585 1.00 0.00 H new ATOM 0 HB3 SER A 107 30.121 -11.980 -26.859 1.00 0.00 H new ATOM 0 HG SER A 107 31.421 -11.262 -24.400 1.00 0.00 H new ATOM 1772 N ARG A 108 27.719 -13.876 -25.106 1.00 0.00 N ATOM 1773 CA ARG A 108 26.604 -14.711 -25.534 1.00 0.00 C ATOM 1774 C ARG A 108 25.288 -14.078 -25.104 1.00 0.00 C ATOM 1775 O ARG A 108 24.366 -13.990 -25.912 1.00 0.00 O ATOM 1776 CB ARG A 108 26.674 -16.111 -24.930 1.00 0.00 C ATOM 1777 CG ARG A 108 27.799 -16.973 -25.493 1.00 0.00 C ATOM 1778 CD ARG A 108 27.587 -18.411 -25.010 1.00 0.00 C ATOM 1779 NE ARG A 108 26.415 -19.028 -25.650 1.00 0.00 N ATOM 1780 CZ ARG A 108 25.688 -20.015 -25.106 1.00 0.00 C ATOM 1781 NH1 ARG A 108 25.988 -20.528 -23.912 1.00 0.00 N1+ ATOM 1782 NH2 ARG A 108 24.637 -20.514 -25.754 1.00 0.00 N ATOM 0 H ARG A 108 28.378 -14.326 -24.470 1.00 0.00 H new ATOM 0 HA ARG A 108 26.664 -14.791 -26.619 1.00 0.00 H new ATOM 0 HB2 ARG A 108 26.802 -16.024 -23.851 1.00 0.00 H new ATOM 0 HB3 ARG A 108 25.723 -16.617 -25.099 1.00 0.00 H new ATOM 0 HG2 ARG A 108 27.799 -16.934 -26.582 1.00 0.00 H new ATOM 0 HG3 ARG A 108 28.767 -16.599 -25.160 1.00 0.00 H new ATOM 0 HD2 ARG A 108 28.476 -19.004 -25.228 1.00 0.00 H new ATOM 0 HD3 ARG A 108 27.457 -18.417 -23.928 1.00 0.00 H new ATOM 0 HE ARG A 108 26.137 -18.682 -26.568 1.00 0.00 H new ATOM 0 HH11 ARG A 108 26.787 -20.170 -23.389 1.00 0.00 H new ATOM 0 HH12 ARG A 108 25.418 -21.278 -23.522 1.00 0.00 H new ATOM 0 HH21 ARG A 108 24.381 -20.146 -26.670 1.00 0.00 H new ATOM 0 HH22 ARG A 108 24.088 -21.265 -25.334 1.00 0.00 H new ATOM 1796 N VAL A 109 25.201 -13.641 -23.842 1.00 0.00 N ATOM 1797 CA VAL A 109 23.977 -13.040 -23.333 1.00 0.00 C ATOM 1798 C VAL A 109 23.591 -11.869 -24.227 1.00 0.00 C ATOM 1799 O VAL A 109 22.449 -11.768 -24.672 1.00 0.00 O ATOM 1800 CB VAL A 109 24.164 -12.557 -21.890 1.00 0.00 C ATOM 1801 CG1 VAL A 109 22.869 -11.897 -21.416 1.00 0.00 C ATOM 1802 CG2 VAL A 109 24.513 -13.702 -20.939 1.00 0.00 C ATOM 0 H VAL A 109 25.961 -13.695 -23.164 1.00 0.00 H new ATOM 0 HA VAL A 109 23.185 -13.789 -23.338 1.00 0.00 H new ATOM 0 HB VAL A 109 24.993 -11.849 -21.880 1.00 0.00 H new ATOM 0 HG11 VAL A 109 22.992 -11.550 -20.390 1.00 0.00 H new ATOM 0 HG12 VAL A 109 22.636 -11.049 -22.060 1.00 0.00 H new ATOM 0 HG13 VAL A 109 22.055 -12.621 -21.459 1.00 0.00 H new ATOM 0 HG21 VAL A 109 24.636 -13.311 -19.929 1.00 0.00 H new ATOM 0 HG22 VAL A 109 23.711 -14.440 -20.948 1.00 0.00 H new ATOM 0 HG23 VAL A 109 25.442 -14.173 -21.261 1.00 0.00 H new ATOM 1812 N VAL A 110 24.554 -10.981 -24.488 1.00 0.00 N ATOM 1813 CA VAL A 110 24.328 -9.811 -25.313 1.00 0.00 C ATOM 1814 C VAL A 110 23.870 -10.225 -26.707 1.00 0.00 C ATOM 1815 O VAL A 110 22.905 -9.662 -27.217 1.00 0.00 O ATOM 1816 CB VAL A 110 25.605 -8.960 -25.354 1.00 0.00 C ATOM 1817 CG1 VAL A 110 25.414 -7.748 -26.258 1.00 0.00 C ATOM 1818 CG2 VAL A 110 25.956 -8.455 -23.955 1.00 0.00 C ATOM 0 H VAL A 110 25.506 -11.060 -24.131 1.00 0.00 H new ATOM 0 HA VAL A 110 23.532 -9.204 -24.882 1.00 0.00 H new ATOM 0 HB VAL A 110 26.407 -9.590 -25.739 1.00 0.00 H new ATOM 0 HG11 VAL A 110 26.330 -7.158 -26.274 1.00 0.00 H new ATOM 0 HG12 VAL A 110 25.180 -8.081 -27.269 1.00 0.00 H new ATOM 0 HG13 VAL A 110 24.595 -7.137 -25.879 1.00 0.00 H new ATOM 0 HG21 VAL A 110 26.864 -7.854 -24.002 1.00 0.00 H new ATOM 0 HG22 VAL A 110 25.137 -7.846 -23.572 1.00 0.00 H new ATOM 0 HG23 VAL A 110 26.118 -9.305 -23.292 1.00 0.00 H new ATOM 1828 N ASN A 111 24.541 -11.196 -27.329 1.00 0.00 N ATOM 1829 CA ASN A 111 24.184 -11.643 -28.664 1.00 0.00 C ATOM 1830 C ASN A 111 22.743 -12.137 -28.720 1.00 0.00 C ATOM 1831 O ASN A 111 21.976 -11.720 -29.584 1.00 0.00 O ATOM 1832 CB ASN A 111 25.139 -12.735 -29.106 1.00 0.00 C ATOM 1833 CG ASN A 111 26.519 -12.164 -29.276 1.00 0.00 C ATOM 1834 OD1 ASN A 111 26.705 -11.007 -29.647 1.00 0.00 O ATOM 1835 ND2 ASN A 111 27.491 -13.001 -28.995 1.00 0.00 N ATOM 0 H ASN A 111 25.338 -11.686 -26.922 1.00 0.00 H new ATOM 0 HA ASN A 111 24.264 -10.795 -29.344 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.155 -13.537 -28.368 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.798 -13.172 -30.045 1.00 0.00 H new ATOM 0 HD21 ASN A 111 28.462 -12.702 -29.080 1.00 0.00 H new ATOM 0 HD22 ASN A 111 27.275 -13.950 -28.691 1.00 0.00 H new ATOM 1842 N ILE A 112 22.382 -13.026 -27.792 1.00 0.00 N ATOM 1843 CA ILE A 112 21.061 -13.638 -27.764 1.00 0.00 C ATOM 1844 C ILE A 112 19.980 -12.569 -27.628 1.00 0.00 C ATOM 1845 O ILE A 112 18.878 -12.739 -28.149 1.00 0.00 O ATOM 1846 CB ILE A 112 21.032 -14.668 -26.628 1.00 0.00 C ATOM 1847 CG1 ILE A 112 21.964 -15.829 -27.002 1.00 0.00 C ATOM 1848 CG2 ILE A 112 19.618 -15.190 -26.367 1.00 0.00 C ATOM 1849 CD1 ILE A 112 22.450 -16.564 -25.754 1.00 0.00 C ATOM 0 H ILE A 112 22.999 -13.338 -27.042 1.00 0.00 H new ATOM 0 HA ILE A 112 20.853 -14.157 -28.700 1.00 0.00 H new ATOM 0 HB ILE A 112 21.369 -14.187 -25.710 1.00 0.00 H new ATOM 0 HG12 ILE A 112 21.440 -16.525 -27.657 1.00 0.00 H new ATOM 0 HG13 ILE A 112 22.819 -15.448 -27.560 1.00 0.00 H new ATOM 0 HG21 ILE A 112 19.643 -15.917 -25.555 1.00 0.00 H new ATOM 0 HG22 ILE A 112 18.969 -14.359 -26.091 1.00 0.00 H new ATOM 0 HG23 ILE A 112 19.234 -15.666 -27.269 1.00 0.00 H new ATOM 0 HD11 ILE A 112 23.109 -17.382 -26.047 1.00 0.00 H new ATOM 0 HD12 ILE A 112 22.995 -15.871 -25.113 1.00 0.00 H new ATOM 0 HD13 ILE A 112 21.594 -16.964 -25.211 1.00 0.00 H new ATOM 1861 N LEU A 113 20.283 -11.467 -26.936 1.00 0.00 N ATOM 1862 CA LEU A 113 19.352 -10.356 -26.823 1.00 0.00 C ATOM 1863 C LEU A 113 19.117 -9.697 -28.184 1.00 0.00 C ATOM 1864 O LEU A 113 17.978 -9.408 -28.543 1.00 0.00 O ATOM 1865 CB LEU A 113 19.915 -9.343 -25.831 1.00 0.00 C ATOM 1866 CG LEU A 113 19.884 -9.879 -24.393 1.00 0.00 C ATOM 1867 CD1 LEU A 113 20.717 -8.995 -23.465 1.00 0.00 C ATOM 1868 CD2 LEU A 113 18.450 -9.929 -23.875 1.00 0.00 C ATOM 0 H LEU A 113 21.168 -11.327 -26.448 1.00 0.00 H new ATOM 0 HA LEU A 113 18.391 -10.727 -26.467 1.00 0.00 H new ATOM 0 HB2 LEU A 113 20.941 -9.096 -26.105 1.00 0.00 H new ATOM 0 HB3 LEU A 113 19.339 -8.419 -25.888 1.00 0.00 H new ATOM 0 HG LEU A 113 20.305 -10.884 -24.404 1.00 0.00 H new ATOM 0 HD11 LEU A 113 20.680 -9.395 -22.452 1.00 0.00 H new ATOM 0 HD12 LEU A 113 21.751 -8.977 -23.810 1.00 0.00 H new ATOM 0 HD13 LEU A 113 20.315 -7.982 -23.470 1.00 0.00 H new ATOM 0 HD21 LEU A 113 18.445 -10.311 -22.854 1.00 0.00 H new ATOM 0 HD22 LEU A 113 18.023 -8.926 -23.889 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.856 -10.585 -24.511 1.00 0.00 H new ATOM 1880 N LYS A 114 20.192 -9.462 -28.940 1.00 0.00 N ATOM 1881 CA LYS A 114 20.105 -8.918 -30.295 1.00 0.00 C ATOM 1882 C LYS A 114 19.270 -9.820 -31.192 1.00 0.00 C ATOM 1883 O LYS A 114 18.351 -9.352 -31.861 1.00 0.00 O ATOM 1884 CB LYS A 114 21.483 -8.816 -30.958 1.00 0.00 C ATOM 1885 CG LYS A 114 22.560 -8.157 -30.107 1.00 0.00 C ATOM 1886 CD LYS A 114 23.903 -8.343 -30.822 1.00 0.00 C ATOM 1887 CE LYS A 114 25.038 -8.037 -29.851 1.00 0.00 C ATOM 1888 NZ LYS A 114 26.349 -8.341 -30.451 1.00 0.00 N1+ ATOM 0 H LYS A 114 21.146 -9.644 -28.629 1.00 0.00 H new ATOM 0 HA LYS A 114 19.655 -7.931 -30.190 1.00 0.00 H new ATOM 0 HB2 LYS A 114 21.816 -9.819 -31.226 1.00 0.00 H new ATOM 0 HB3 LYS A 114 21.382 -8.255 -31.887 1.00 0.00 H new ATOM 0 HG2 LYS A 114 22.344 -7.097 -29.971 1.00 0.00 H new ATOM 0 HG3 LYS A 114 22.590 -8.606 -29.114 1.00 0.00 H new ATOM 0 HD2 LYS A 114 23.992 -9.364 -31.193 1.00 0.00 H new ATOM 0 HD3 LYS A 114 23.962 -7.683 -31.687 1.00 0.00 H new ATOM 0 HE2 LYS A 114 25.001 -6.986 -29.564 1.00 0.00 H new ATOM 0 HE3 LYS A 114 24.908 -8.621 -28.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 27.087 -7.789 -29.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 26.552 -9.356 -30.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 26.334 -8.093 -31.461 1.00 0.00 H new ATOM 1902 N GLU A 115 19.602 -11.117 -31.199 1.00 0.00 N ATOM 1903 CA GLU A 115 18.948 -12.094 -32.057 1.00 0.00 C ATOM 1904 C GLU A 115 17.473 -12.213 -31.718 1.00 0.00 C ATOM 1905 O GLU A 115 16.643 -12.358 -32.612 1.00 0.00 O ATOM 1906 CB GLU A 115 19.629 -13.461 -31.917 1.00 0.00 C ATOM 1907 CG GLU A 115 21.118 -13.441 -32.289 1.00 0.00 C ATOM 1908 CD GLU A 115 21.444 -12.470 -33.419 1.00 0.00 C ATOM 1909 OE1 GLU A 115 20.746 -12.544 -34.455 1.00 0.00 O ATOM 1910 OE2 GLU A 115 22.385 -11.668 -33.234 1.00 0.00 O1- ATOM 0 H GLU A 115 20.333 -11.512 -30.607 1.00 0.00 H new ATOM 0 HA GLU A 115 19.037 -11.753 -33.089 1.00 0.00 H new ATOM 0 HB2 GLU A 115 19.524 -13.808 -30.889 1.00 0.00 H new ATOM 0 HB3 GLU A 115 19.113 -14.182 -32.551 1.00 0.00 H new ATOM 0 HG2 GLU A 115 21.702 -13.172 -31.409 1.00 0.00 H new ATOM 0 HG3 GLU A 115 21.426 -14.445 -32.582 1.00 0.00 H new ATOM 1917 N ARG A 116 17.133 -12.153 -30.424 1.00 0.00 N ATOM 1918 CA ARG A 116 15.741 -12.153 -30.015 1.00 0.00 C ATOM 1919 C ARG A 116 15.096 -10.775 -30.187 1.00 0.00 C ATOM 1920 O ARG A 116 13.908 -10.629 -29.933 1.00 0.00 O ATOM 1921 CB ARG A 116 15.636 -12.632 -28.580 1.00 0.00 C ATOM 1922 CG ARG A 116 16.025 -14.098 -28.481 1.00 0.00 C ATOM 1923 CD ARG A 116 15.960 -14.513 -27.018 1.00 0.00 C ATOM 1924 NE ARG A 116 16.391 -15.900 -26.891 1.00 0.00 N ATOM 1925 CZ ARG A 116 15.927 -16.776 -25.990 1.00 0.00 C ATOM 1926 NH1 ARG A 116 14.982 -16.442 -25.111 1.00 0.00 N1+ ATOM 1927 NH2 ARG A 116 16.410 -18.017 -25.962 1.00 0.00 N ATOM 0 H ARG A 116 17.803 -12.105 -29.656 1.00 0.00 H new ATOM 0 HA ARG A 116 15.192 -12.837 -30.662 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.285 -12.033 -27.942 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.617 -12.494 -28.218 1.00 0.00 H new ATOM 0 HG2 ARG A 116 15.351 -14.711 -29.080 1.00 0.00 H new ATOM 0 HG3 ARG A 116 17.030 -14.251 -28.875 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.597 -13.866 -26.416 1.00 0.00 H new ATOM 0 HD3 ARG A 116 14.944 -14.400 -26.641 1.00 0.00 H new ATOM 0 HE ARG A 116 17.104 -16.230 -27.541 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.594 -15.499 -25.113 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.647 -17.130 -24.436 1.00 0.00 H new ATOM 0 HH21 ARG A 116 17.132 -18.299 -26.626 1.00 0.00 H new ATOM 0 HH22 ARG A 116 16.058 -18.686 -25.277 1.00 0.00 H new ATOM 1941 N ASN A 117 15.841 -9.753 -30.613 1.00 0.00 N ATOM 1942 CA ASN A 117 15.272 -8.430 -30.848 1.00 0.00 C ATOM 1943 C ASN A 117 14.615 -7.862 -29.591 1.00 0.00 C ATOM 1944 O ASN A 117 13.708 -7.038 -29.686 1.00 0.00 O ATOM 1945 CB ASN A 117 14.282 -8.473 -32.020 1.00 0.00 C ATOM 1946 CG ASN A 117 14.606 -9.579 -33.003 1.00 0.00 C ATOM 1947 OD1 ASN A 117 15.397 -9.404 -33.925 1.00 0.00 O ATOM 1948 ND2 ASN A 117 13.969 -10.724 -32.780 1.00 0.00 N ATOM 0 H ASN A 117 16.841 -9.819 -30.802 1.00 0.00 H new ATOM 0 HA ASN A 117 16.089 -7.758 -31.111 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.272 -8.616 -31.635 1.00 0.00 H new ATOM 0 HB3 ASN A 117 14.293 -7.514 -32.538 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.126 -11.523 -33.394 1.00 0.00 H new ATOM 0 HD22 ASN A 117 13.323 -10.804 -31.995 1.00 0.00 H new ATOM 1955 N ILE A 118 15.075 -8.306 -28.419 1.00 0.00 N ATOM 1956 CA ILE A 118 14.535 -7.908 -27.130 1.00 0.00 C ATOM 1957 C ILE A 118 14.434 -6.392 -27.023 1.00 0.00 C ATOM 1958 O ILE A 118 13.352 -5.859 -26.782 1.00 0.00 O ATOM 1959 CB ILE A 118 15.428 -8.474 -26.021 1.00 0.00 C ATOM 1960 CG1 ILE A 118 15.646 -9.985 -26.178 1.00 0.00 C ATOM 1961 CG2 ILE A 118 14.817 -8.150 -24.660 1.00 0.00 C ATOM 1962 CD1 ILE A 118 14.357 -10.769 -26.380 1.00 0.00 C ATOM 0 H ILE A 118 15.849 -8.966 -28.345 1.00 0.00 H new ATOM 0 HA ILE A 118 13.526 -8.308 -27.024 1.00 0.00 H new ATOM 0 HB ILE A 118 16.409 -8.004 -26.097 1.00 0.00 H new ATOM 0 HG12 ILE A 118 16.306 -10.162 -27.027 1.00 0.00 H new ATOM 0 HG13 ILE A 118 16.157 -10.364 -25.293 1.00 0.00 H new ATOM 0 HG21 ILE A 118 15.452 -8.553 -23.871 1.00 0.00 H new ATOM 0 HG22 ILE A 118 14.737 -7.069 -24.545 1.00 0.00 H new ATOM 0 HG23 ILE A 118 13.825 -8.597 -24.591 1.00 0.00 H new ATOM 0 HD11 ILE A 118 14.588 -11.829 -26.483 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.703 -10.622 -25.520 1.00 0.00 H new ATOM 0 HD13 ILE A 118 13.855 -10.418 -27.281 1.00 0.00 H new ATOM 1974 N PHE A 119 15.558 -5.696 -27.202 1.00 0.00 N ATOM 1975 CA PHE A 119 15.562 -4.242 -27.305 1.00 0.00 C ATOM 1976 C PHE A 119 15.384 -3.790 -28.752 1.00 0.00 C ATOM 1977 O PHE A 119 15.392 -4.604 -29.675 1.00 0.00 O ATOM 1978 CB PHE A 119 16.875 -3.684 -26.768 1.00 0.00 C ATOM 1979 CG PHE A 119 17.398 -4.440 -25.577 1.00 0.00 C ATOM 1980 CD1 PHE A 119 18.556 -5.214 -25.714 1.00 0.00 C ATOM 1981 CD2 PHE A 119 16.732 -4.383 -24.346 1.00 0.00 C ATOM 1982 CE1 PHE A 119 19.045 -5.937 -24.626 1.00 0.00 C ATOM 1983 CE2 PHE A 119 17.227 -5.105 -23.252 1.00 0.00 C ATOM 1984 CZ PHE A 119 18.384 -5.883 -23.390 1.00 0.00 C ATOM 0 H PHE A 119 16.481 -6.123 -27.279 1.00 0.00 H new ATOM 0 HA PHE A 119 14.727 -3.865 -26.714 1.00 0.00 H new ATOM 0 HB2 PHE A 119 17.623 -3.706 -27.561 1.00 0.00 H new ATOM 0 HB3 PHE A 119 16.733 -2.639 -26.493 1.00 0.00 H new ATOM 0 HD1 PHE A 119 19.071 -5.251 -26.662 1.00 0.00 H new ATOM 0 HD2 PHE A 119 15.839 -3.784 -24.240 1.00 0.00 H new ATOM 0 HE1 PHE A 119 19.934 -6.540 -24.735 1.00 0.00 H new ATOM 0 HE2 PHE A 119 16.716 -5.062 -22.301 1.00 0.00 H new ATOM 0 HZ PHE A 119 18.766 -6.440 -22.547 1.00 0.00 H new ATOM 1994 N SER A 120 15.225 -2.480 -28.953 1.00 0.00 N ATOM 1995 CA SER A 120 15.135 -1.925 -30.290 1.00 0.00 C ATOM 1996 C SER A 120 16.500 -2.044 -30.956 1.00 0.00 C ATOM 1997 O SER A 120 17.524 -2.040 -30.273 1.00 0.00 O ATOM 1998 CB SER A 120 14.687 -0.466 -30.218 1.00 0.00 C ATOM 1999 OG SER A 120 14.784 0.127 -31.498 1.00 0.00 O ATOM 0 H SER A 120 15.157 -1.791 -28.204 1.00 0.00 H new ATOM 0 HA SER A 120 14.399 -2.472 -30.879 1.00 0.00 H new ATOM 0 HB2 SER A 120 13.660 -0.408 -29.857 1.00 0.00 H new ATOM 0 HB3 SER A 120 15.306 0.080 -29.506 1.00 0.00 H new ATOM 0 HG SER A 120 14.494 1.062 -31.448 1.00 0.00 H new ATOM 2005 N LYS A 121 16.534 -2.149 -32.287 1.00 0.00 N ATOM 2006 CA LYS A 121 17.798 -2.273 -32.990 1.00 0.00 C ATOM 2007 C LYS A 121 18.676 -1.047 -32.729 1.00 0.00 C ATOM 2008 O LYS A 121 19.896 -1.146 -32.830 1.00 0.00 O ATOM 2009 CB LYS A 121 17.552 -2.504 -34.483 1.00 0.00 C ATOM 2010 CG LYS A 121 16.776 -3.805 -34.732 1.00 0.00 C ATOM 2011 CD LYS A 121 17.529 -5.047 -34.237 1.00 0.00 C ATOM 2012 CE LYS A 121 16.689 -6.299 -34.497 1.00 0.00 C ATOM 2013 NZ LYS A 121 17.383 -7.525 -34.064 1.00 0.00 N1+ ATOM 0 H LYS A 121 15.709 -2.150 -32.886 1.00 0.00 H new ATOM 0 HA LYS A 121 18.338 -3.141 -32.612 1.00 0.00 H new ATOM 0 HB2 LYS A 121 16.995 -1.663 -34.895 1.00 0.00 H new ATOM 0 HB3 LYS A 121 18.506 -2.542 -35.008 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.809 -3.748 -34.232 1.00 0.00 H new ATOM 0 HG3 LYS A 121 16.578 -3.907 -35.799 1.00 0.00 H new ATOM 0 HD2 LYS A 121 18.489 -5.129 -34.747 1.00 0.00 H new ATOM 0 HD3 LYS A 121 17.741 -4.955 -33.172 1.00 0.00 H new ATOM 0 HE2 LYS A 121 15.738 -6.214 -33.970 1.00 0.00 H new ATOM 0 HE3 LYS A 121 16.459 -6.368 -35.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 16.690 -8.289 -33.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 18.077 -7.805 -34.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 17.873 -7.347 -33.164 1.00 0.00 H new ATOM 2027 N GLN A 122 18.083 0.104 -32.393 1.00 0.00 N ATOM 2028 CA GLN A 122 18.871 1.265 -32.007 1.00 0.00 C ATOM 2029 C GLN A 122 19.594 0.984 -30.691 1.00 0.00 C ATOM 2030 O GLN A 122 20.797 1.214 -30.583 1.00 0.00 O ATOM 2031 CB GLN A 122 17.970 2.498 -31.879 1.00 0.00 C ATOM 2032 CG GLN A 122 18.773 3.699 -31.381 1.00 0.00 C ATOM 2033 CD GLN A 122 19.917 4.027 -32.331 1.00 0.00 C ATOM 2034 OE1 GLN A 122 19.701 4.255 -33.518 1.00 0.00 O ATOM 2035 NE2 GLN A 122 21.144 4.055 -31.818 1.00 0.00 N ATOM 0 H GLN A 122 17.074 0.250 -32.382 1.00 0.00 H new ATOM 0 HA GLN A 122 19.615 1.466 -32.778 1.00 0.00 H new ATOM 0 HB2 GLN A 122 17.521 2.729 -32.845 1.00 0.00 H new ATOM 0 HB3 GLN A 122 17.153 2.288 -31.189 1.00 0.00 H new ATOM 0 HG2 GLN A 122 18.117 4.564 -31.285 1.00 0.00 H new ATOM 0 HG3 GLN A 122 19.170 3.488 -30.388 1.00 0.00 H new ATOM 0 HE21 GLN A 122 21.287 3.860 -30.827 1.00 0.00 H new ATOM 0 HE22 GLN A 122 21.942 4.271 -32.416 1.00 0.00 H new ATOM 2044 N VAL A 123 18.856 0.484 -29.692 1.00 0.00 N ATOM 2045 CA VAL A 123 19.436 0.148 -28.400 1.00 0.00 C ATOM 2046 C VAL A 123 20.504 -0.921 -28.582 1.00 0.00 C ATOM 2047 O VAL A 123 21.536 -0.887 -27.914 1.00 0.00 O ATOM 2048 CB VAL A 123 18.333 -0.328 -27.445 1.00 0.00 C ATOM 2049 CG1 VAL A 123 18.925 -0.851 -26.135 1.00 0.00 C ATOM 2050 CG2 VAL A 123 17.376 0.823 -27.126 1.00 0.00 C ATOM 0 H VAL A 123 17.854 0.305 -29.761 1.00 0.00 H new ATOM 0 HA VAL A 123 19.905 1.031 -27.965 1.00 0.00 H new ATOM 0 HB VAL A 123 17.794 -1.135 -27.941 1.00 0.00 H new ATOM 0 HG11 VAL A 123 18.120 -1.181 -25.478 1.00 0.00 H new ATOM 0 HG12 VAL A 123 19.589 -1.689 -26.345 1.00 0.00 H new ATOM 0 HG13 VAL A 123 19.488 -0.055 -25.647 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.598 0.472 -26.448 1.00 0.00 H new ATOM 0 HG22 VAL A 123 17.929 1.636 -26.655 1.00 0.00 H new ATOM 0 HG23 VAL A 123 16.918 1.182 -28.048 1.00 0.00 H new ATOM 2060 N VAL A 124 20.264 -1.875 -29.487 1.00 0.00 N ATOM 2061 CA VAL A 124 21.266 -2.879 -29.811 1.00 0.00 C ATOM 2062 C VAL A 124 22.548 -2.220 -30.315 1.00 0.00 C ATOM 2063 O VAL A 124 23.631 -2.581 -29.866 1.00 0.00 O ATOM 2064 CB VAL A 124 20.708 -3.868 -30.842 1.00 0.00 C ATOM 2065 CG1 VAL A 124 21.828 -4.720 -31.438 1.00 0.00 C ATOM 2066 CG2 VAL A 124 19.679 -4.784 -30.178 1.00 0.00 C ATOM 0 H VAL A 124 19.388 -1.968 -30.002 1.00 0.00 H new ATOM 0 HA VAL A 124 21.513 -3.433 -28.905 1.00 0.00 H new ATOM 0 HB VAL A 124 20.235 -3.297 -31.641 1.00 0.00 H new ATOM 0 HG11 VAL A 124 21.409 -5.414 -32.167 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.555 -4.073 -31.929 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.320 -5.281 -30.644 1.00 0.00 H new ATOM 0 HG21 VAL A 124 19.286 -5.484 -30.915 1.00 0.00 H new ATOM 0 HG22 VAL A 124 20.154 -5.338 -29.368 1.00 0.00 H new ATOM 0 HG23 VAL A 124 18.863 -4.183 -29.777 1.00 0.00 H new ATOM 2076 N ASN A 125 22.452 -1.259 -31.239 1.00 0.00 N ATOM 2077 CA ASN A 125 23.637 -0.588 -31.753 1.00 0.00 C ATOM 2078 C ASN A 125 24.322 0.239 -30.665 1.00 0.00 C ATOM 2079 O ASN A 125 25.542 0.387 -30.704 1.00 0.00 O ATOM 2080 CB ASN A 125 23.270 0.274 -32.963 1.00 0.00 C ATOM 2081 CG ASN A 125 23.150 -0.570 -34.226 1.00 0.00 C ATOM 2082 OD1 ASN A 125 24.112 -0.704 -34.976 1.00 0.00 O ATOM 2083 ND2 ASN A 125 21.976 -1.144 -34.477 1.00 0.00 N ATOM 0 H ASN A 125 21.572 -0.935 -31.640 1.00 0.00 H new ATOM 0 HA ASN A 125 24.351 -1.346 -32.076 1.00 0.00 H new ATOM 0 HB2 ASN A 125 22.327 0.787 -32.775 1.00 0.00 H new ATOM 0 HB3 ASN A 125 24.028 1.044 -33.108 1.00 0.00 H new ATOM 0 HD21 ASN A 125 21.856 -1.715 -35.313 1.00 0.00 H new ATOM 0 HD22 ASN A 125 21.196 -1.013 -33.833 1.00 0.00 H new ATOM 2090 N ASP A 126 23.561 0.774 -29.704 1.00 0.00 N ATOM 2091 CA ASP A 126 24.150 1.471 -28.567 1.00 0.00 C ATOM 2092 C ASP A 126 24.955 0.497 -27.710 1.00 0.00 C ATOM 2093 O ASP A 126 26.043 0.834 -27.248 1.00 0.00 O ATOM 2094 CB ASP A 126 23.032 2.127 -27.744 1.00 0.00 C ATOM 2095 CG ASP A 126 22.214 3.134 -28.548 1.00 0.00 C ATOM 2096 OD1 ASP A 126 21.052 3.366 -28.150 1.00 0.00 O ATOM 2097 OD2 ASP A 126 22.754 3.661 -29.547 1.00 0.00 O1- ATOM 0 H ASP A 126 22.542 0.736 -29.695 1.00 0.00 H new ATOM 0 HA ASP A 126 24.830 2.245 -28.924 1.00 0.00 H new ATOM 0 HB2 ASP A 126 22.369 1.352 -27.360 1.00 0.00 H new ATOM 0 HB3 ASP A 126 23.470 2.629 -26.881 1.00 0.00 H new ATOM 2102 N ILE A 127 24.422 -0.713 -27.497 1.00 0.00 N ATOM 2103 CA ILE A 127 25.133 -1.757 -26.778 1.00 0.00 C ATOM 2104 C ILE A 127 26.379 -2.168 -27.559 1.00 0.00 C ATOM 2105 O ILE A 127 27.462 -2.223 -26.984 1.00 0.00 O ATOM 2106 CB ILE A 127 24.180 -2.935 -26.533 1.00 0.00 C ATOM 2107 CG1 ILE A 127 23.086 -2.501 -25.553 1.00 0.00 C ATOM 2108 CG2 ILE A 127 24.932 -4.141 -25.969 1.00 0.00 C ATOM 2109 CD1 ILE A 127 21.921 -3.490 -25.550 1.00 0.00 C ATOM 0 H ILE A 127 23.493 -0.986 -27.818 1.00 0.00 H new ATOM 0 HA ILE A 127 25.470 -1.392 -25.808 1.00 0.00 H new ATOM 0 HB ILE A 127 23.734 -3.228 -27.483 1.00 0.00 H new ATOM 0 HG12 ILE A 127 23.503 -2.424 -24.549 1.00 0.00 H new ATOM 0 HG13 ILE A 127 22.724 -1.509 -25.824 1.00 0.00 H new ATOM 0 HG21 ILE A 127 24.233 -4.961 -25.805 1.00 0.00 H new ATOM 0 HG22 ILE A 127 25.700 -4.454 -26.676 1.00 0.00 H new ATOM 0 HG23 ILE A 127 25.400 -3.868 -25.023 1.00 0.00 H new ATOM 0 HD11 ILE A 127 21.161 -3.155 -24.845 1.00 0.00 H new ATOM 0 HD12 ILE A 127 21.489 -3.547 -26.549 1.00 0.00 H new ATOM 0 HD13 ILE A 127 22.281 -4.475 -25.254 1.00 0.00 H new ATOM 2121 N GLU A 128 26.242 -2.455 -28.859 1.00 0.00 N ATOM 2122 CA GLU A 128 27.381 -2.837 -29.685 1.00 0.00 C ATOM 2123 C GLU A 128 28.468 -1.766 -29.630 1.00 0.00 C ATOM 2124 O GLU A 128 29.651 -2.090 -29.527 1.00 0.00 O ATOM 2125 CB GLU A 128 26.937 -3.028 -31.138 1.00 0.00 C ATOM 2126 CG GLU A 128 25.988 -4.206 -31.348 1.00 0.00 C ATOM 2127 CD GLU A 128 26.704 -5.552 -31.328 1.00 0.00 C ATOM 2128 OE1 GLU A 128 27.556 -5.753 -30.435 1.00 0.00 O ATOM 2129 OE2 GLU A 128 26.389 -6.376 -32.216 1.00 0.00 O1- ATOM 0 H GLU A 128 25.352 -2.428 -29.356 1.00 0.00 H new ATOM 0 HA GLU A 128 27.782 -3.774 -29.298 1.00 0.00 H new ATOM 0 HB2 GLU A 128 26.449 -2.116 -31.481 1.00 0.00 H new ATOM 0 HB3 GLU A 128 27.820 -3.170 -31.761 1.00 0.00 H new ATOM 0 HG2 GLU A 128 25.224 -4.194 -30.571 1.00 0.00 H new ATOM 0 HG3 GLU A 128 25.474 -4.087 -32.302 1.00 0.00 H new ATOM 2136 N ARG A 129 28.069 -0.492 -29.699 1.00 0.00 N ATOM 2137 CA ARG A 129 28.979 0.635 -29.617 1.00 0.00 C ATOM 2138 C ARG A 129 29.719 0.639 -28.288 1.00 0.00 C ATOM 2139 O ARG A 129 30.944 0.722 -28.254 1.00 0.00 O ATOM 2140 CB ARG A 129 28.145 1.903 -29.786 1.00 0.00 C ATOM 2141 CG ARG A 129 28.850 3.101 -29.158 1.00 0.00 C ATOM 2142 CD ARG A 129 28.110 4.378 -29.552 1.00 0.00 C ATOM 2143 NE ARG A 129 27.024 4.682 -28.617 1.00 0.00 N ATOM 2144 CZ ARG A 129 25.719 4.609 -28.909 1.00 0.00 C ATOM 2145 NH1 ARG A 129 25.292 4.237 -30.116 1.00 0.00 N1+ ATOM 2146 NH2 ARG A 129 24.815 4.912 -27.981 1.00 0.00 N ATOM 0 H ARG A 129 27.093 -0.220 -29.815 1.00 0.00 H new ATOM 0 HA ARG A 129 29.738 0.573 -30.397 1.00 0.00 H new ATOM 0 HB2 ARG A 129 27.972 2.091 -30.845 1.00 0.00 H new ATOM 0 HB3 ARG A 129 27.168 1.766 -29.323 1.00 0.00 H new ATOM 0 HG2 ARG A 129 28.872 2.998 -28.073 1.00 0.00 H new ATOM 0 HG3 ARG A 129 29.886 3.147 -29.495 1.00 0.00 H new ATOM 0 HD2 ARG A 129 28.811 5.212 -29.579 1.00 0.00 H new ATOM 0 HD3 ARG A 129 27.705 4.269 -30.558 1.00 0.00 H new ATOM 0 HE ARG A 129 27.281 4.971 -27.673 1.00 0.00 H new ATOM 0 HH11 ARG A 129 25.965 3.999 -30.844 1.00 0.00 H new ATOM 0 HH12 ARG A 129 24.292 4.190 -30.311 1.00 0.00 H new ATOM 0 HH21 ARG A 129 25.117 5.199 -27.050 1.00 0.00 H new ATOM 0 HH22 ARG A 129 23.820 4.857 -28.201 1.00 0.00 H new ATOM 2160 N SER A 130 28.968 0.553 -27.193 1.00 0.00 N ATOM 2161 CA SER A 130 29.539 0.538 -25.860 1.00 0.00 C ATOM 2162 C SER A 130 30.542 -0.602 -25.680 1.00 0.00 C ATOM 2163 O SER A 130 31.652 -0.377 -25.204 1.00 0.00 O ATOM 2164 CB SER A 130 28.403 0.429 -24.856 1.00 0.00 C ATOM 2165 OG SER A 130 28.885 0.613 -23.548 1.00 0.00 O ATOM 0 H SER A 130 27.950 0.492 -27.210 1.00 0.00 H new ATOM 0 HA SER A 130 30.094 1.462 -25.699 1.00 0.00 H new ATOM 0 HB2 SER A 130 27.640 1.176 -25.078 1.00 0.00 H new ATOM 0 HB3 SER A 130 27.927 -0.548 -24.941 1.00 0.00 H new ATOM 0 HG SER A 130 28.130 0.732 -22.935 1.00 0.00 H new ATOM 2171 N LEU A 131 30.163 -1.829 -26.057 1.00 0.00 N ATOM 2172 CA LEU A 131 31.072 -2.959 -26.005 1.00 0.00 C ATOM 2173 C LEU A 131 32.236 -2.803 -26.980 1.00 0.00 C ATOM 2174 O LEU A 131 33.306 -3.352 -26.718 1.00 0.00 O ATOM 2175 CB LEU A 131 30.316 -4.258 -26.284 1.00 0.00 C ATOM 2176 CG LEU A 131 29.593 -4.748 -25.023 1.00 0.00 C ATOM 2177 CD1 LEU A 131 28.280 -4.014 -24.770 1.00 0.00 C ATOM 2178 CD2 LEU A 131 29.292 -6.236 -25.167 1.00 0.00 C ATOM 0 H LEU A 131 29.230 -2.055 -26.401 1.00 0.00 H new ATOM 0 HA LEU A 131 31.492 -2.995 -25.000 1.00 0.00 H new ATOM 0 HB2 LEU A 131 29.593 -4.099 -27.084 1.00 0.00 H new ATOM 0 HB3 LEU A 131 31.012 -5.022 -26.630 1.00 0.00 H new ATOM 0 HG LEU A 131 30.253 -4.551 -24.178 1.00 0.00 H new ATOM 0 HD11 LEU A 131 27.814 -4.403 -23.865 1.00 0.00 H new ATOM 0 HD12 LEU A 131 28.476 -2.949 -24.648 1.00 0.00 H new ATOM 0 HD13 LEU A 131 27.610 -4.164 -25.617 1.00 0.00 H new ATOM 0 HD21 LEU A 131 28.778 -6.591 -24.274 1.00 0.00 H new ATOM 0 HD22 LEU A 131 28.658 -6.396 -26.039 1.00 0.00 H new ATOM 0 HD23 LEU A 131 30.225 -6.786 -25.291 1.00 0.00 H new