USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 840 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 98 ASN : amide:sc= -0.0695 X(o=0.0089,f=-0.21) USER MOD Set 1.2: A 103 GLN :FLIP amide:sc= 0.0785 X(o=-0.21,f=0.0089) USER MOD Set 2.1: A 22 GLN :FLIP amide:sc= -0.226 F(o=-1.4,f=-0.89) USER MOD Set 2.2: A 26 ASN : amide:sc= -0.663 K(o=-0.89,f=-5.2!) USER MOD Single : A 23 MET CE :methyl -167:sc= -0.0259 (180deg=-0.228) USER MOD Single : A 27 GLN :FLIP amide:sc= -0.0709 F(o=-1,f=-0.071) USER MOD Single : A 32 THR OG1 : rot -63:sc= 1.43 USER MOD Single : A 35 GLN : amide:sc= 0.251 K(o=0.25,f=-3.8!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= -2.19 X(o=-2.2,f=-2.3!) USER MOD Single : A 45 LYS NZ :NH3+ -165:sc= -0.0431 (180deg=-0.304) USER MOD Single : A 47 SER OG : rot -82:sc= 0.747 USER MOD Single : A 48 ASN :FLIP amide:sc= -0.0462 F(o=-0.61,f=-0.046) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.507 X(o=-0.51,f=-0.061) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot -73:sc= 1.14 USER MOD Single : A 64 LYS NZ :NH3+ 170:sc= -2.52! (180deg=-2.99!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -0.0229 X(o=-0.023,f=-0.19) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.199 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 52:sc= 0.329 USER MOD Single : A 84 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 85 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0704) USER MOD Single : A 90 LYS NZ :NH3+ 158:sc= 1.06 (180deg=0.585) USER MOD Single : A 95 THR OG1 : rot 32:sc= 0.0348 USER MOD Single : A 96 HIS : no HD1:sc=-0.00197 X(o=-0.002,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 82:sc= 1.08 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 124 ASN : amide:sc= -0.587 K(o=-0.59,f=-3.5!) USER MOD Single : A 126 MET CE :methyl -159:sc= -0.187 (180deg=-0.724) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= -0.0843 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 22 2.037 0.454 -0.337 1.00 0.00 N ATOM 2 CA GLN A 22 2.800 0.017 -1.530 1.00 0.00 C ATOM 3 C GLN A 22 1.980 -0.991 -2.354 1.00 0.00 C ATOM 4 O GLN A 22 2.147 -1.050 -3.566 1.00 0.00 O ATOM 5 CB GLN A 22 4.169 -0.591 -1.092 1.00 0.00 C ATOM 6 CG GLN A 22 5.210 -0.798 -2.214 1.00 0.00 C ATOM 7 CD GLN A 22 5.575 0.491 -2.961 1.00 0.00 C ATOM 8 OE1 GLN A 22 4.910 0.754 -4.072 1.00 0.00 O flip ATOM 9 NE2 GLN A 22 6.463 1.233 -2.551 1.00 0.00 N flip ATOM 0 HA GLN A 22 2.997 0.881 -2.164 1.00 0.00 H new ATOM 0 HB2 GLN A 22 4.606 0.059 -0.334 1.00 0.00 H new ATOM 0 HB3 GLN A 22 3.981 -1.554 -0.617 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.115 -1.227 -1.783 1.00 0.00 H new ATOM 0 HG3 GLN A 22 4.822 -1.524 -2.928 1.00 0.00 H new ATOM 0 HE21 GLN A 22 6.960 1.006 -1.690 1.00 0.00 H new ATOM 0 HE22 GLN A 22 6.703 2.077 -3.071 1.00 0.00 H new ATOM 18 N MET A 23 1.079 -1.748 -1.681 1.00 0.00 N ATOM 19 CA MET A 23 0.248 -2.802 -2.310 1.00 0.00 C ATOM 20 C MET A 23 -0.531 -2.266 -3.532 1.00 0.00 C ATOM 21 O MET A 23 -0.350 -2.762 -4.643 1.00 0.00 O ATOM 22 CB MET A 23 -0.730 -3.402 -1.269 1.00 0.00 C ATOM 23 CG MET A 23 -1.667 -4.503 -1.805 1.00 0.00 C ATOM 24 SD MET A 23 -2.860 -5.069 -0.572 1.00 0.00 S ATOM 25 CE MET A 23 -1.795 -5.788 0.686 1.00 0.00 C ATOM 0 H MET A 23 0.908 -1.643 -0.681 1.00 0.00 H new ATOM 0 HA MET A 23 0.918 -3.584 -2.666 1.00 0.00 H new ATOM 0 HB2 MET A 23 -0.149 -3.812 -0.443 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.340 -2.596 -0.860 1.00 0.00 H new ATOM 0 HG2 MET A 23 -2.203 -4.125 -2.676 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.069 -5.350 -2.141 1.00 0.00 H new ATOM 0 HE1 MET A 23 -2.397 -6.373 1.382 1.00 0.00 H new ATOM 0 HE2 MET A 23 -1.057 -6.435 0.212 1.00 0.00 H new ATOM 0 HE3 MET A 23 -1.284 -4.992 1.228 1.00 0.00 H new ATOM 35 N LEU A 24 -1.351 -1.223 -3.304 1.00 0.00 N ATOM 36 CA LEU A 24 -2.155 -0.560 -4.361 1.00 0.00 C ATOM 37 C LEU A 24 -1.272 -0.033 -5.520 1.00 0.00 C ATOM 38 O LEU A 24 -1.687 -0.086 -6.692 1.00 0.00 O ATOM 39 CB LEU A 24 -3.028 0.600 -3.776 1.00 0.00 C ATOM 40 CG LEU A 24 -2.278 1.835 -3.166 1.00 0.00 C ATOM 41 CD1 LEU A 24 -3.182 3.080 -3.095 1.00 0.00 C ATOM 42 CD2 LEU A 24 -1.700 1.517 -1.772 1.00 0.00 C ATOM 0 H LEU A 24 -1.479 -0.811 -2.380 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.820 -1.322 -4.767 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.682 0.962 -4.570 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.670 0.180 -3.001 1.00 0.00 H new ATOM 0 HG LEU A 24 -1.450 2.057 -3.839 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -2.623 3.912 -2.666 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -3.515 3.345 -4.098 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.049 2.865 -2.470 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.188 2.396 -1.381 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.510 1.239 -1.097 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.994 0.691 -1.851 1.00 0.00 H new ATOM 54 N LEU A 25 -0.048 0.440 -5.186 1.00 0.00 N ATOM 55 CA LEU A 25 0.922 0.937 -6.188 1.00 0.00 C ATOM 56 C LEU A 25 1.360 -0.206 -7.107 1.00 0.00 C ATOM 57 O LEU A 25 1.255 -0.089 -8.314 1.00 0.00 O ATOM 58 CB LEU A 25 2.188 1.574 -5.538 1.00 0.00 C ATOM 59 CG LEU A 25 2.048 2.970 -4.844 1.00 0.00 C ATOM 60 CD1 LEU A 25 1.477 4.035 -5.804 1.00 0.00 C ATOM 61 CD2 LEU A 25 1.237 2.901 -3.541 1.00 0.00 C ATOM 0 H LEU A 25 0.291 0.487 -4.225 1.00 0.00 H new ATOM 0 HA LEU A 25 0.411 1.714 -6.757 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.569 0.872 -4.797 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.949 1.664 -6.313 1.00 0.00 H new ATOM 0 HG LEU A 25 3.058 3.278 -4.573 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.396 4.989 -5.283 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.141 4.145 -6.661 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.490 3.724 -6.147 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.170 3.896 -3.101 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.234 2.531 -3.756 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.730 2.227 -2.841 1.00 0.00 H new ATOM 73 N ASN A 26 1.797 -1.306 -6.484 1.00 0.00 N ATOM 74 CA ASN A 26 2.374 -2.487 -7.172 1.00 0.00 C ATOM 75 C ASN A 26 1.338 -3.127 -8.097 1.00 0.00 C ATOM 76 O ASN A 26 1.603 -3.368 -9.283 1.00 0.00 O ATOM 77 CB ASN A 26 2.866 -3.527 -6.125 1.00 0.00 C ATOM 78 CG ASN A 26 4.048 -3.041 -5.278 1.00 0.00 C ATOM 79 OD1 ASN A 26 4.285 -1.845 -5.153 1.00 0.00 O ATOM 80 ND2 ASN A 26 4.758 -3.957 -4.642 1.00 0.00 N ATOM 0 H ASN A 26 1.763 -1.411 -5.470 1.00 0.00 H new ATOM 0 HA ASN A 26 3.222 -2.158 -7.773 1.00 0.00 H new ATOM 0 HB2 ASN A 26 2.038 -3.782 -5.464 1.00 0.00 H new ATOM 0 HB3 ASN A 26 3.154 -4.442 -6.643 1.00 0.00 H new ATOM 0 HD21 ASN A 26 5.524 -3.675 -4.030 1.00 0.00 H new ATOM 0 HD22 ASN A 26 4.540 -4.946 -4.763 1.00 0.00 H new ATOM 87 N GLN A 27 0.158 -3.356 -7.515 1.00 0.00 N ATOM 88 CA GLN A 27 -1.007 -3.933 -8.185 1.00 0.00 C ATOM 89 C GLN A 27 -1.397 -3.133 -9.448 1.00 0.00 C ATOM 90 O GLN A 27 -1.442 -3.701 -10.550 1.00 0.00 O ATOM 91 CB GLN A 27 -2.182 -3.984 -7.175 1.00 0.00 C ATOM 92 CG GLN A 27 -2.076 -5.079 -6.092 1.00 0.00 C ATOM 93 CD GLN A 27 -2.481 -6.471 -6.587 1.00 0.00 C ATOM 94 OE1 GLN A 27 -3.516 -6.545 -7.421 1.00 0.00 O flip ATOM 95 NE2 GLN A 27 -1.917 -7.481 -6.162 1.00 0.00 N flip ATOM 0 H GLN A 27 -0.017 -3.138 -6.534 1.00 0.00 H new ATOM 0 HA GLN A 27 -0.762 -4.941 -8.520 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -2.257 -3.015 -6.682 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -3.109 -4.133 -7.729 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -1.050 -5.117 -5.725 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -2.707 -4.805 -5.247 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.126 -7.393 -5.524 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -2.241 -8.405 -6.448 1.00 0.00 H new ATOM 104 N LEU A 28 -1.622 -1.808 -9.284 1.00 0.00 N ATOM 105 CA LEU A 28 -2.097 -0.968 -10.394 1.00 0.00 C ATOM 106 C LEU A 28 -0.996 -0.770 -11.445 1.00 0.00 C ATOM 107 O LEU A 28 -1.272 -0.836 -12.633 1.00 0.00 O ATOM 108 CB LEU A 28 -2.633 0.402 -9.911 1.00 0.00 C ATOM 109 CG LEU A 28 -3.540 1.132 -10.953 1.00 0.00 C ATOM 110 CD1 LEU A 28 -4.877 0.393 -11.129 1.00 0.00 C ATOM 111 CD2 LEU A 28 -3.771 2.601 -10.599 1.00 0.00 C ATOM 0 H LEU A 28 -1.483 -1.309 -8.405 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.931 -1.500 -10.853 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.199 0.255 -8.991 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.788 1.045 -9.666 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.007 1.116 -11.903 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.491 0.920 -11.859 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.688 -0.622 -11.479 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.401 0.356 -10.174 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.407 3.062 -11.355 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.257 2.669 -9.626 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.814 3.122 -10.564 1.00 0.00 H new ATOM 123 N ARG A 29 0.248 -0.563 -10.982 1.00 0.00 N ATOM 124 CA ARG A 29 1.454 -0.417 -11.852 1.00 0.00 C ATOM 125 C ARG A 29 1.608 -1.615 -12.794 1.00 0.00 C ATOM 126 O ARG A 29 1.995 -1.461 -13.953 1.00 0.00 O ATOM 127 CB ARG A 29 2.726 -0.279 -10.965 1.00 0.00 C ATOM 128 CG ARG A 29 4.079 -0.281 -11.711 1.00 0.00 C ATOM 129 CD ARG A 29 5.287 -0.203 -10.758 1.00 0.00 C ATOM 130 NE ARG A 29 6.569 -0.377 -11.471 1.00 0.00 N ATOM 131 CZ ARG A 29 7.746 -0.703 -10.895 1.00 0.00 C ATOM 132 NH1 ARG A 29 7.840 -0.882 -9.587 1.00 0.00 N ATOM 133 NH2 ARG A 29 8.833 -0.861 -11.642 1.00 0.00 N ATOM 0 H ARG A 29 0.459 -0.490 -9.987 1.00 0.00 H new ATOM 0 HA ARG A 29 1.329 0.479 -12.460 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.649 0.648 -10.397 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.731 -1.096 -10.243 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.155 -1.186 -12.313 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.110 0.563 -12.400 1.00 0.00 H new ATOM 0 HD2 ARG A 29 5.284 0.760 -10.248 1.00 0.00 H new ATOM 0 HD3 ARG A 29 5.193 -0.971 -9.990 1.00 0.00 H new ATOM 0 HE ARG A 29 6.565 -0.240 -12.482 1.00 0.00 H new ATOM 0 HH11 ARG A 29 7.015 -0.774 -8.997 1.00 0.00 H new ATOM 0 HH12 ARG A 29 8.737 -1.128 -9.169 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.780 -0.736 -12.653 1.00 0.00 H new ATOM 0 HH22 ARG A 29 9.721 -1.107 -11.205 1.00 0.00 H new ATOM 147 N GLU A 30 1.291 -2.804 -12.269 1.00 0.00 N ATOM 148 CA GLU A 30 1.427 -4.051 -13.009 1.00 0.00 C ATOM 149 C GLU A 30 0.289 -4.203 -14.048 1.00 0.00 C ATOM 150 O GLU A 30 0.542 -4.615 -15.186 1.00 0.00 O ATOM 151 CB GLU A 30 1.460 -5.244 -12.022 1.00 0.00 C ATOM 152 CG GLU A 30 2.045 -6.541 -12.612 1.00 0.00 C ATOM 153 CD GLU A 30 3.491 -6.371 -13.124 1.00 0.00 C ATOM 154 OE1 GLU A 30 4.411 -6.277 -12.282 1.00 0.00 O ATOM 155 OE2 GLU A 30 3.714 -6.321 -14.354 1.00 0.00 O ATOM 0 H GLU A 30 0.934 -2.922 -11.321 1.00 0.00 H new ATOM 0 HA GLU A 30 2.367 -4.037 -13.561 1.00 0.00 H new ATOM 0 HB2 GLU A 30 2.046 -4.960 -11.148 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.446 -5.442 -11.676 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.024 -7.322 -11.852 1.00 0.00 H new ATOM 0 HG3 GLU A 30 1.412 -6.878 -13.433 1.00 0.00 H new ATOM 162 N ILE A 31 -0.956 -3.856 -13.657 1.00 0.00 N ATOM 163 CA ILE A 31 -2.145 -4.045 -14.535 1.00 0.00 C ATOM 164 C ILE A 31 -2.380 -2.854 -15.501 1.00 0.00 C ATOM 165 O ILE A 31 -3.205 -2.964 -16.407 1.00 0.00 O ATOM 166 CB ILE A 31 -3.449 -4.352 -13.699 1.00 0.00 C ATOM 167 CG1 ILE A 31 -3.871 -3.135 -12.822 1.00 0.00 C ATOM 168 CG2 ILE A 31 -3.257 -5.626 -12.833 1.00 0.00 C ATOM 169 CD1 ILE A 31 -5.133 -3.345 -12.001 1.00 0.00 C ATOM 0 H ILE A 31 -1.170 -3.446 -12.748 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.922 -4.916 -15.152 1.00 0.00 H new ATOM 0 HB ILE A 31 -4.259 -4.537 -14.405 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.051 -2.891 -12.146 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.017 -2.271 -13.471 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.167 -5.820 -12.265 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -3.045 -6.477 -13.480 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.425 -5.476 -12.145 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.346 -2.445 -11.424 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.970 -3.556 -12.667 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.990 -4.185 -11.322 1.00 0.00 H new ATOM 181 N THR A 32 -1.657 -1.727 -15.314 1.00 0.00 N ATOM 182 CA THR A 32 -1.692 -0.577 -16.258 1.00 0.00 C ATOM 183 C THR A 32 -0.417 -0.566 -17.115 1.00 0.00 C ATOM 184 O THR A 32 -0.470 -0.503 -18.350 1.00 0.00 O ATOM 185 CB THR A 32 -1.823 0.804 -15.512 1.00 0.00 C ATOM 186 OG1 THR A 32 -0.725 0.990 -14.600 1.00 0.00 O ATOM 187 CG2 THR A 32 -3.149 0.930 -14.745 1.00 0.00 C ATOM 0 H THR A 32 -1.038 -1.585 -14.516 1.00 0.00 H new ATOM 0 HA THR A 32 -2.573 -0.704 -16.887 1.00 0.00 H new ATOM 0 HB THR A 32 -1.804 1.578 -16.279 1.00 0.00 H new ATOM 0 HG1 THR A 32 -0.750 0.293 -13.911 1.00 0.00 H new ATOM 0 HG21 THR A 32 -3.191 1.899 -14.248 1.00 0.00 H new ATOM 0 HG22 THR A 32 -3.982 0.843 -15.442 1.00 0.00 H new ATOM 0 HG23 THR A 32 -3.215 0.137 -14.000 1.00 0.00 H new ATOM 195 N GLY A 33 0.725 -0.650 -16.420 1.00 0.00 N ATOM 196 CA GLY A 33 2.053 -0.530 -17.029 1.00 0.00 C ATOM 197 C GLY A 33 2.725 0.788 -16.653 1.00 0.00 C ATOM 198 O GLY A 33 3.890 1.011 -16.999 1.00 0.00 O ATOM 0 H GLY A 33 0.752 -0.804 -15.412 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.678 -1.363 -16.707 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.964 -0.598 -18.113 1.00 0.00 H new ATOM 202 N ILE A 34 1.981 1.649 -15.928 1.00 0.00 N ATOM 203 CA ILE A 34 2.430 2.991 -15.517 1.00 0.00 C ATOM 204 C ILE A 34 3.327 2.898 -14.271 1.00 0.00 C ATOM 205 O ILE A 34 2.896 2.429 -13.214 1.00 0.00 O ATOM 206 CB ILE A 34 1.195 3.935 -15.239 1.00 0.00 C ATOM 207 CG1 ILE A 34 0.323 4.062 -16.527 1.00 0.00 C ATOM 208 CG2 ILE A 34 1.636 5.329 -14.722 1.00 0.00 C ATOM 209 CD1 ILE A 34 -0.946 4.880 -16.366 1.00 0.00 C ATOM 0 H ILE A 34 1.038 1.426 -15.608 1.00 0.00 H new ATOM 0 HA ILE A 34 3.011 3.422 -16.333 1.00 0.00 H new ATOM 0 HB ILE A 34 0.595 3.483 -14.449 1.00 0.00 H new ATOM 0 HG12 ILE A 34 0.929 4.510 -17.315 1.00 0.00 H new ATOM 0 HG13 ILE A 34 0.052 3.061 -16.864 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.755 5.946 -14.544 1.00 0.00 H new ATOM 0 HG22 ILE A 34 2.192 5.213 -13.792 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.271 5.809 -15.467 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.483 4.910 -17.314 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.579 4.424 -15.605 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.689 5.895 -16.063 1.00 0.00 H new ATOM 221 N GLN A 35 4.587 3.347 -14.419 1.00 0.00 N ATOM 222 CA GLN A 35 5.593 3.306 -13.335 1.00 0.00 C ATOM 223 C GLN A 35 5.458 4.526 -12.410 1.00 0.00 C ATOM 224 O GLN A 35 5.973 4.519 -11.290 1.00 0.00 O ATOM 225 CB GLN A 35 7.030 3.234 -13.934 1.00 0.00 C ATOM 226 CG GLN A 35 7.214 2.189 -15.056 1.00 0.00 C ATOM 227 CD GLN A 35 6.907 0.747 -14.645 1.00 0.00 C ATOM 228 OE1 GLN A 35 7.787 0.007 -14.200 1.00 0.00 O ATOM 229 NE2 GLN A 35 5.652 0.346 -14.756 1.00 0.00 N ATOM 0 H GLN A 35 4.938 3.747 -15.289 1.00 0.00 H new ATOM 0 HA GLN A 35 5.415 2.410 -12.740 1.00 0.00 H new ATOM 0 HB2 GLN A 35 7.295 4.216 -14.325 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.732 3.011 -13.131 1.00 0.00 H new ATOM 0 HG2 GLN A 35 6.570 2.458 -15.893 1.00 0.00 H new ATOM 0 HG3 GLN A 35 8.242 2.239 -15.415 1.00 0.00 H new ATOM 0 HE21 GLN A 35 4.945 0.980 -15.128 1.00 0.00 H new ATOM 0 HE22 GLN A 35 5.391 -0.598 -14.470 1.00 0.00 H new ATOM 238 N ASP A 36 4.781 5.578 -12.907 1.00 0.00 N ATOM 239 CA ASP A 36 4.595 6.843 -12.178 1.00 0.00 C ATOM 240 C ASP A 36 3.652 6.632 -10.971 1.00 0.00 C ATOM 241 O ASP A 36 2.485 6.276 -11.172 1.00 0.00 O ATOM 242 CB ASP A 36 4.017 7.921 -13.131 1.00 0.00 C ATOM 243 CG ASP A 36 3.925 9.325 -12.497 1.00 0.00 C ATOM 244 OD1 ASP A 36 2.963 9.592 -11.760 1.00 0.00 O ATOM 245 OD2 ASP A 36 4.813 10.163 -12.726 1.00 0.00 O ATOM 0 H ASP A 36 4.346 5.573 -13.830 1.00 0.00 H new ATOM 0 HA ASP A 36 5.562 7.183 -11.806 1.00 0.00 H new ATOM 0 HB2 ASP A 36 4.640 7.975 -14.024 1.00 0.00 H new ATOM 0 HB3 ASP A 36 3.023 7.612 -13.454 1.00 0.00 H new ATOM 250 N PRO A 37 4.129 6.891 -9.703 1.00 0.00 N ATOM 251 CA PRO A 37 3.340 6.619 -8.478 1.00 0.00 C ATOM 252 C PRO A 37 2.128 7.557 -8.313 1.00 0.00 C ATOM 253 O PRO A 37 1.111 7.151 -7.738 1.00 0.00 O ATOM 254 CB PRO A 37 4.372 6.817 -7.339 1.00 0.00 C ATOM 255 CG PRO A 37 5.346 7.807 -7.894 1.00 0.00 C ATOM 256 CD PRO A 37 5.460 7.479 -9.369 1.00 0.00 C ATOM 0 HA PRO A 37 2.895 5.624 -8.495 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.897 7.191 -6.432 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.862 5.879 -7.078 1.00 0.00 H new ATOM 0 HG2 PRO A 37 4.996 8.828 -7.745 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.313 7.726 -7.398 1.00 0.00 H new ATOM 0 HD2 PRO A 37 5.665 8.370 -9.963 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.269 6.774 -9.561 1.00 0.00 H new ATOM 264 N SER A 38 2.239 8.796 -8.839 1.00 0.00 N ATOM 265 CA SER A 38 1.192 9.828 -8.699 1.00 0.00 C ATOM 266 C SER A 38 -0.097 9.374 -9.395 1.00 0.00 C ATOM 267 O SER A 38 -1.162 9.385 -8.788 1.00 0.00 O ATOM 268 CB SER A 38 1.672 11.179 -9.283 1.00 0.00 C ATOM 269 OG SER A 38 2.970 11.511 -8.813 1.00 0.00 O ATOM 0 H SER A 38 3.053 9.107 -9.370 1.00 0.00 H new ATOM 0 HA SER A 38 0.987 9.968 -7.638 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.680 11.125 -10.372 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.971 11.967 -9.008 1.00 0.00 H new ATOM 0 HG SER A 38 3.248 12.368 -9.199 1.00 0.00 H new ATOM 275 N PHE A 39 0.056 8.908 -10.651 1.00 0.00 N ATOM 276 CA PHE A 39 -1.050 8.372 -11.479 1.00 0.00 C ATOM 277 C PHE A 39 -1.784 7.232 -10.764 1.00 0.00 C ATOM 278 O PHE A 39 -3.011 7.136 -10.838 1.00 0.00 O ATOM 279 CB PHE A 39 -0.511 7.866 -12.850 1.00 0.00 C ATOM 280 CG PHE A 39 -0.192 8.960 -13.878 1.00 0.00 C ATOM 281 CD1 PHE A 39 0.374 10.185 -13.504 1.00 0.00 C ATOM 282 CD2 PHE A 39 -0.440 8.750 -15.241 1.00 0.00 C ATOM 283 CE1 PHE A 39 0.651 11.160 -14.440 1.00 0.00 C ATOM 284 CE2 PHE A 39 -0.161 9.730 -16.176 1.00 0.00 C ATOM 285 CZ PHE A 39 0.402 10.929 -15.779 1.00 0.00 C ATOM 0 H PHE A 39 0.958 8.892 -11.126 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.756 9.185 -11.646 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.393 7.283 -12.673 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.247 7.189 -13.283 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.598 10.370 -12.464 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -0.856 7.808 -15.567 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.064 12.107 -14.125 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -0.383 9.558 -17.219 1.00 0.00 H new ATOM 0 HZ PHE A 39 0.646 11.682 -16.513 1.00 0.00 H new ATOM 295 N LEU A 40 -1.009 6.391 -10.062 1.00 0.00 N ATOM 296 CA LEU A 40 -1.531 5.211 -9.367 1.00 0.00 C ATOM 297 C LEU A 40 -2.390 5.622 -8.156 1.00 0.00 C ATOM 298 O LEU A 40 -3.504 5.124 -7.985 1.00 0.00 O ATOM 299 CB LEU A 40 -0.365 4.272 -8.960 1.00 0.00 C ATOM 300 CG LEU A 40 0.638 3.901 -10.103 1.00 0.00 C ATOM 301 CD1 LEU A 40 1.806 3.051 -9.574 1.00 0.00 C ATOM 302 CD2 LEU A 40 -0.061 3.205 -11.295 1.00 0.00 C ATOM 0 H LEU A 40 -0.001 6.513 -9.962 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.181 4.659 -10.046 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.193 4.745 -8.152 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.788 3.351 -8.559 1.00 0.00 H new ATOM 0 HG LEU A 40 1.047 4.840 -10.476 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.483 2.812 -10.394 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.346 3.610 -8.810 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.418 2.128 -9.143 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.677 2.968 -12.061 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.536 2.286 -10.952 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.817 3.870 -11.713 1.00 0.00 H new ATOM 314 N HIS A 41 -1.868 6.561 -7.346 1.00 0.00 N ATOM 315 CA HIS A 41 -2.594 7.126 -6.189 1.00 0.00 C ATOM 316 C HIS A 41 -3.857 7.875 -6.636 1.00 0.00 C ATOM 317 O HIS A 41 -4.898 7.720 -6.016 1.00 0.00 O ATOM 318 CB HIS A 41 -1.699 8.100 -5.369 1.00 0.00 C ATOM 319 CG HIS A 41 -0.587 7.454 -4.573 1.00 0.00 C ATOM 320 ND1 HIS A 41 -0.818 6.746 -3.414 1.00 0.00 N ATOM 321 CD2 HIS A 41 0.765 7.457 -4.736 1.00 0.00 C ATOM 322 CE1 HIS A 41 0.332 6.340 -2.911 1.00 0.00 C ATOM 323 NE2 HIS A 41 1.300 6.758 -3.692 1.00 0.00 N ATOM 0 H HIS A 41 -0.934 6.950 -7.473 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.875 6.282 -5.558 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -1.258 8.823 -6.055 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -2.335 8.659 -4.683 1.00 0.00 H new ATOM 0 HD2 HIS A 41 1.312 7.925 -5.541 1.00 0.00 H new ATOM 0 HE1 HIS A 41 0.456 5.761 -2.008 1.00 0.00 H new ATOM 0 HE2 HIS A 41 2.295 6.588 -3.543 1.00 0.00 H new ATOM 332 N GLU A 42 -3.742 8.676 -7.710 1.00 0.00 N ATOM 333 CA GLU A 42 -4.831 9.540 -8.205 1.00 0.00 C ATOM 334 C GLU A 42 -5.959 8.726 -8.839 1.00 0.00 C ATOM 335 O GLU A 42 -7.116 9.148 -8.801 1.00 0.00 O ATOM 336 CB GLU A 42 -4.286 10.589 -9.215 1.00 0.00 C ATOM 337 CG GLU A 42 -3.352 11.651 -8.583 1.00 0.00 C ATOM 338 CD GLU A 42 -2.746 12.655 -9.590 1.00 0.00 C ATOM 339 OE1 GLU A 42 -1.734 12.318 -10.255 1.00 0.00 O ATOM 340 OE2 GLU A 42 -3.239 13.800 -9.688 1.00 0.00 O ATOM 0 H GLU A 42 -2.887 8.743 -8.262 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.245 10.064 -7.344 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.745 10.069 -10.005 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -5.128 11.096 -9.686 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.911 12.205 -7.829 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.540 11.140 -8.066 1.00 0.00 H new ATOM 347 N ALA A 43 -5.614 7.571 -9.426 1.00 0.00 N ATOM 348 CA ALA A 43 -6.600 6.639 -9.984 1.00 0.00 C ATOM 349 C ALA A 43 -7.341 5.906 -8.855 1.00 0.00 C ATOM 350 O ALA A 43 -8.564 5.769 -8.893 1.00 0.00 O ATOM 351 CB ALA A 43 -5.914 5.650 -10.926 1.00 0.00 C ATOM 0 H ALA A 43 -4.648 7.259 -9.526 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.336 7.202 -10.558 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.655 4.963 -11.335 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.436 6.195 -11.740 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.161 5.086 -10.376 1.00 0.00 H new ATOM 357 N LEU A 44 -6.566 5.475 -7.836 1.00 0.00 N ATOM 358 CA LEU A 44 -7.096 4.814 -6.617 1.00 0.00 C ATOM 359 C LEU A 44 -7.948 5.808 -5.799 1.00 0.00 C ATOM 360 O LEU A 44 -8.878 5.411 -5.104 1.00 0.00 O ATOM 361 CB LEU A 44 -5.923 4.240 -5.746 1.00 0.00 C ATOM 362 CG LEU A 44 -5.575 2.721 -5.925 1.00 0.00 C ATOM 363 CD1 LEU A 44 -6.731 1.807 -5.484 1.00 0.00 C ATOM 364 CD2 LEU A 44 -5.127 2.391 -7.352 1.00 0.00 C ATOM 0 H LEU A 44 -5.551 5.575 -7.833 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.731 3.982 -6.920 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.026 4.820 -5.963 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.167 4.410 -4.697 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.730 2.524 -5.266 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.445 0.765 -5.626 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.952 1.983 -4.431 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.616 2.025 -6.082 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.898 1.328 -7.425 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -5.926 2.638 -8.051 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.238 2.972 -7.598 1.00 0.00 H new ATOM 376 N LYS A 45 -7.595 7.100 -5.898 1.00 0.00 N ATOM 377 CA LYS A 45 -8.315 8.200 -5.238 1.00 0.00 C ATOM 378 C LYS A 45 -9.627 8.497 -5.970 1.00 0.00 C ATOM 379 O LYS A 45 -10.663 8.692 -5.334 1.00 0.00 O ATOM 380 CB LYS A 45 -7.383 9.460 -5.144 1.00 0.00 C ATOM 381 CG LYS A 45 -8.069 10.833 -4.869 1.00 0.00 C ATOM 382 CD LYS A 45 -8.401 11.618 -6.167 1.00 0.00 C ATOM 383 CE LYS A 45 -7.152 12.174 -6.870 1.00 0.00 C ATOM 384 NZ LYS A 45 -6.355 13.058 -5.985 1.00 0.00 N ATOM 0 H LYS A 45 -6.793 7.413 -6.445 1.00 0.00 H new ATOM 0 HA LYS A 45 -8.580 7.908 -4.222 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.653 9.282 -4.354 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -6.828 9.541 -6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -8.988 10.667 -4.307 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.416 11.440 -4.241 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -8.936 10.963 -6.854 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.072 12.442 -5.925 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.529 11.346 -7.209 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -7.454 12.729 -7.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -5.680 13.604 -6.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -6.990 13.710 -5.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.835 12.480 -5.294 1.00 0.00 H new ATOM 398 N ALA A 46 -9.567 8.521 -7.314 1.00 0.00 N ATOM 399 CA ALA A 46 -10.728 8.818 -8.171 1.00 0.00 C ATOM 400 C ALA A 46 -11.785 7.707 -8.060 1.00 0.00 C ATOM 401 O ALA A 46 -12.993 7.972 -8.093 1.00 0.00 O ATOM 402 CB ALA A 46 -10.266 9.008 -9.623 1.00 0.00 C ATOM 0 H ALA A 46 -8.711 8.335 -7.836 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.193 9.744 -7.833 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.128 9.227 -10.253 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.559 9.836 -9.674 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.783 8.096 -9.973 1.00 0.00 H new ATOM 408 N SER A 47 -11.311 6.471 -7.883 1.00 0.00 N ATOM 409 CA SER A 47 -12.168 5.295 -7.697 1.00 0.00 C ATOM 410 C SER A 47 -12.509 5.075 -6.203 1.00 0.00 C ATOM 411 O SER A 47 -13.291 4.175 -5.874 1.00 0.00 O ATOM 412 CB SER A 47 -11.445 4.076 -8.272 1.00 0.00 C ATOM 413 OG SER A 47 -10.227 3.833 -7.582 1.00 0.00 O ATOM 0 H SER A 47 -10.314 6.256 -7.864 1.00 0.00 H new ATOM 0 HA SER A 47 -13.112 5.450 -8.219 1.00 0.00 H new ATOM 0 HB2 SER A 47 -12.089 3.200 -8.200 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.241 4.236 -9.331 1.00 0.00 H new ATOM 0 HG SER A 47 -9.528 4.422 -7.935 1.00 0.00 H new ATOM 419 N ASN A 48 -11.871 5.881 -5.319 1.00 0.00 N ATOM 420 CA ASN A 48 -12.072 5.862 -3.846 1.00 0.00 C ATOM 421 C ASN A 48 -11.569 4.532 -3.210 1.00 0.00 C ATOM 422 O ASN A 48 -11.834 4.242 -2.031 1.00 0.00 O ATOM 423 CB ASN A 48 -13.567 6.163 -3.489 1.00 0.00 C ATOM 424 CG ASN A 48 -13.839 6.514 -2.018 1.00 0.00 C ATOM 425 OD1 ASN A 48 -12.932 7.254 -1.385 1.00 0.00 O flip ATOM 426 ND2 ASN A 48 -14.858 6.128 -1.450 1.00 0.00 N flip ATOM 0 H ASN A 48 -11.187 6.578 -5.615 1.00 0.00 H new ATOM 0 HA ASN A 48 -11.464 6.656 -3.412 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -13.911 6.989 -4.111 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -14.168 5.293 -3.754 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -15.540 5.562 -1.955 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -15.022 6.374 -0.474 1.00 0.00 H new ATOM 433 N GLY A 49 -10.801 3.742 -3.992 1.00 0.00 N ATOM 434 CA GLY A 49 -10.215 2.483 -3.525 1.00 0.00 C ATOM 435 C GLY A 49 -10.449 1.315 -4.475 1.00 0.00 C ATOM 436 O GLY A 49 -9.793 0.273 -4.341 1.00 0.00 O ATOM 0 H GLY A 49 -10.575 3.965 -4.961 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.142 2.620 -3.387 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -10.633 2.237 -2.549 1.00 0.00 H new ATOM 440 N ASP A 50 -11.388 1.476 -5.431 1.00 0.00 N ATOM 441 CA ASP A 50 -11.743 0.402 -6.385 1.00 0.00 C ATOM 442 C ASP A 50 -10.673 0.311 -7.499 1.00 0.00 C ATOM 443 O ASP A 50 -10.664 1.114 -8.435 1.00 0.00 O ATOM 444 CB ASP A 50 -13.154 0.640 -6.990 1.00 0.00 C ATOM 445 CG ASP A 50 -13.695 -0.593 -7.747 1.00 0.00 C ATOM 446 OD1 ASP A 50 -13.261 -0.845 -8.884 1.00 0.00 O ATOM 447 OD2 ASP A 50 -14.552 -1.315 -7.208 1.00 0.00 O ATOM 0 H ASP A 50 -11.915 2.339 -5.563 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.770 -0.546 -5.848 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.847 0.904 -6.191 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -13.114 1.490 -7.671 1.00 0.00 H new ATOM 452 N ILE A 51 -9.790 -0.688 -7.395 1.00 0.00 N ATOM 453 CA ILE A 51 -8.647 -0.845 -8.311 1.00 0.00 C ATOM 454 C ILE A 51 -9.086 -1.142 -9.775 1.00 0.00 C ATOM 455 O ILE A 51 -8.378 -0.781 -10.724 1.00 0.00 O ATOM 456 CB ILE A 51 -7.652 -1.938 -7.779 1.00 0.00 C ATOM 457 CG1 ILE A 51 -6.374 -2.006 -8.671 1.00 0.00 C ATOM 458 CG2 ILE A 51 -8.339 -3.322 -7.669 1.00 0.00 C ATOM 459 CD1 ILE A 51 -5.276 -2.889 -8.145 1.00 0.00 C ATOM 0 H ILE A 51 -9.844 -1.410 -6.677 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.126 0.112 -8.336 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.344 -1.649 -6.774 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -6.660 -2.359 -9.662 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.981 -0.997 -8.793 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.623 -4.055 -7.298 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -9.181 -3.256 -6.980 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -8.697 -3.630 -8.651 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.432 -2.870 -8.834 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.955 -2.527 -7.168 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.644 -3.911 -8.051 1.00 0.00 H new ATOM 471 N THR A 52 -10.273 -1.755 -9.945 1.00 0.00 N ATOM 472 CA THR A 52 -10.819 -2.095 -11.273 1.00 0.00 C ATOM 473 C THR A 52 -11.195 -0.805 -12.048 1.00 0.00 C ATOM 474 O THR A 52 -10.911 -0.665 -13.249 1.00 0.00 O ATOM 475 CB THR A 52 -12.071 -3.020 -11.126 1.00 0.00 C ATOM 476 OG1 THR A 52 -11.798 -4.061 -10.171 1.00 0.00 O ATOM 477 CG2 THR A 52 -12.499 -3.647 -12.465 1.00 0.00 C ATOM 0 H THR A 52 -10.878 -2.027 -9.170 1.00 0.00 H new ATOM 0 HA THR A 52 -10.054 -2.630 -11.835 1.00 0.00 H new ATOM 0 HB THR A 52 -12.895 -2.396 -10.779 1.00 0.00 H new ATOM 0 HG1 THR A 52 -12.586 -4.637 -10.081 1.00 0.00 H new ATOM 0 HG21 THR A 52 -13.372 -4.280 -12.308 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.746 -2.857 -13.174 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.682 -4.249 -12.863 1.00 0.00 H new ATOM 485 N GLN A 53 -11.805 0.146 -11.329 1.00 0.00 N ATOM 486 CA GLN A 53 -12.157 1.461 -11.877 1.00 0.00 C ATOM 487 C GLN A 53 -10.896 2.313 -12.075 1.00 0.00 C ATOM 488 O GLN A 53 -10.819 3.085 -13.021 1.00 0.00 O ATOM 489 CB GLN A 53 -13.170 2.171 -10.946 1.00 0.00 C ATOM 490 CG GLN A 53 -14.570 1.520 -10.905 1.00 0.00 C ATOM 491 CD GLN A 53 -15.313 1.547 -12.245 1.00 0.00 C ATOM 492 OE1 GLN A 53 -16.060 0.624 -12.571 1.00 0.00 O ATOM 493 NE2 GLN A 53 -15.162 2.624 -13.012 1.00 0.00 N ATOM 0 H GLN A 53 -12.068 0.025 -10.351 1.00 0.00 H new ATOM 0 HA GLN A 53 -12.626 1.325 -12.851 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -12.763 2.190 -9.935 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -13.275 3.207 -11.267 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -14.468 0.485 -10.579 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -15.175 2.032 -10.156 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -14.537 3.375 -12.719 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -15.671 2.698 -13.893 1.00 0.00 H new ATOM 502 N ALA A 54 -9.906 2.125 -11.185 1.00 0.00 N ATOM 503 CA ALA A 54 -8.620 2.846 -11.232 1.00 0.00 C ATOM 504 C ALA A 54 -7.860 2.558 -12.547 1.00 0.00 C ATOM 505 O ALA A 54 -7.443 3.497 -13.256 1.00 0.00 O ATOM 506 CB ALA A 54 -7.770 2.481 -10.007 1.00 0.00 C ATOM 0 H ALA A 54 -9.975 1.466 -10.409 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.824 3.917 -11.208 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -6.822 3.017 -10.049 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.304 2.758 -9.098 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -7.580 1.408 -10.003 1.00 0.00 H new ATOM 512 N VAL A 55 -7.705 1.256 -12.877 1.00 0.00 N ATOM 513 CA VAL A 55 -7.077 0.827 -14.145 1.00 0.00 C ATOM 514 C VAL A 55 -7.925 1.285 -15.337 1.00 0.00 C ATOM 515 O VAL A 55 -7.372 1.764 -16.318 1.00 0.00 O ATOM 516 CB VAL A 55 -6.795 -0.735 -14.208 1.00 0.00 C ATOM 517 CG1 VAL A 55 -8.057 -1.584 -13.989 1.00 0.00 C ATOM 518 CG2 VAL A 55 -6.094 -1.148 -15.529 1.00 0.00 C ATOM 0 H VAL A 55 -8.007 0.485 -12.282 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.100 1.308 -14.194 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.117 -0.939 -13.379 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -7.798 -2.641 -14.044 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -8.478 -1.364 -13.008 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -8.791 -1.350 -14.760 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -5.921 -2.224 -15.528 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -6.728 -0.883 -16.375 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.140 -0.627 -15.613 1.00 0.00 H new ATOM 528 N SER A 56 -9.270 1.195 -15.206 1.00 0.00 N ATOM 529 CA SER A 56 -10.211 1.625 -16.266 1.00 0.00 C ATOM 530 C SER A 56 -10.056 3.131 -16.601 1.00 0.00 C ATOM 531 O SER A 56 -10.233 3.533 -17.758 1.00 0.00 O ATOM 532 CB SER A 56 -11.666 1.304 -15.851 1.00 0.00 C ATOM 533 OG SER A 56 -12.604 1.588 -16.888 1.00 0.00 O ATOM 0 H SER A 56 -9.728 0.827 -14.373 1.00 0.00 H new ATOM 0 HA SER A 56 -9.969 1.067 -17.171 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.739 0.251 -15.578 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.924 1.882 -14.964 1.00 0.00 H new ATOM 0 HG SER A 56 -13.508 1.368 -16.580 1.00 0.00 H new ATOM 539 N LEU A 57 -9.715 3.947 -15.585 1.00 0.00 N ATOM 540 CA LEU A 57 -9.512 5.403 -15.754 1.00 0.00 C ATOM 541 C LEU A 57 -8.142 5.713 -16.388 1.00 0.00 C ATOM 542 O LEU A 57 -8.017 6.658 -17.180 1.00 0.00 O ATOM 543 CB LEU A 57 -9.673 6.130 -14.389 1.00 0.00 C ATOM 544 CG LEU A 57 -11.117 6.116 -13.788 1.00 0.00 C ATOM 545 CD1 LEU A 57 -11.149 6.689 -12.357 1.00 0.00 C ATOM 546 CD2 LEU A 57 -12.114 6.865 -14.696 1.00 0.00 C ATOM 0 H LEU A 57 -9.573 3.620 -14.629 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.275 5.774 -16.438 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -8.994 5.672 -13.670 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -9.358 7.166 -14.509 1.00 0.00 H new ATOM 0 HG LEU A 57 -11.426 5.072 -13.734 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.170 6.661 -11.977 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -10.505 6.092 -11.711 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -10.795 7.720 -12.370 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -13.107 6.835 -14.248 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -11.797 7.902 -14.807 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -12.144 6.388 -15.675 1.00 0.00 H new ATOM 558 N LEU A 58 -7.111 4.924 -16.031 1.00 0.00 N ATOM 559 CA LEU A 58 -5.759 5.082 -16.614 1.00 0.00 C ATOM 560 C LEU A 58 -5.655 4.466 -18.025 1.00 0.00 C ATOM 561 O LEU A 58 -4.728 4.794 -18.775 1.00 0.00 O ATOM 562 CB LEU A 58 -4.675 4.492 -15.678 1.00 0.00 C ATOM 563 CG LEU A 58 -4.464 5.237 -14.319 1.00 0.00 C ATOM 564 CD1 LEU A 58 -3.344 4.584 -13.482 1.00 0.00 C ATOM 565 CD2 LEU A 58 -4.180 6.747 -14.526 1.00 0.00 C ATOM 0 H LEU A 58 -7.185 4.173 -15.345 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.583 6.153 -16.715 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -4.933 3.455 -15.465 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.726 4.481 -16.215 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.398 5.147 -13.764 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.226 5.128 -12.545 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -3.606 3.548 -13.269 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.408 4.614 -14.040 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.040 7.227 -13.557 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.278 6.869 -15.125 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.023 7.208 -15.041 1.00 0.00 H new ATOM 577 N THR A 59 -6.599 3.572 -18.379 1.00 0.00 N ATOM 578 CA THR A 59 -6.665 2.952 -19.720 1.00 0.00 C ATOM 579 C THR A 59 -7.798 3.572 -20.560 1.00 0.00 C ATOM 580 O THR A 59 -8.128 3.074 -21.637 1.00 0.00 O ATOM 581 CB THR A 59 -6.841 1.401 -19.618 1.00 0.00 C ATOM 582 OG1 THR A 59 -8.049 1.076 -18.913 1.00 0.00 O ATOM 583 CG2 THR A 59 -5.640 0.741 -18.918 1.00 0.00 C ATOM 0 H THR A 59 -7.336 3.259 -17.747 1.00 0.00 H new ATOM 0 HA THR A 59 -5.719 3.152 -20.223 1.00 0.00 H new ATOM 0 HB THR A 59 -6.901 1.013 -20.635 1.00 0.00 H new ATOM 0 HG1 THR A 59 -7.931 1.262 -17.958 1.00 0.00 H new ATOM 0 HG21 THR A 59 -5.797 -0.336 -18.865 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.731 0.948 -19.483 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.540 1.143 -17.910 1.00 0.00 H new ATOM 591 N ASP A 60 -8.363 4.681 -20.063 1.00 0.00 N ATOM 592 CA ASP A 60 -9.422 5.446 -20.756 1.00 0.00 C ATOM 593 C ASP A 60 -8.912 6.049 -22.085 1.00 0.00 C ATOM 594 O ASP A 60 -9.679 6.247 -23.039 1.00 0.00 O ATOM 595 CB ASP A 60 -9.944 6.556 -19.806 1.00 0.00 C ATOM 596 CG ASP A 60 -11.052 7.429 -20.415 1.00 0.00 C ATOM 597 OD1 ASP A 60 -12.220 6.987 -20.451 1.00 0.00 O ATOM 598 OD2 ASP A 60 -10.771 8.567 -20.844 1.00 0.00 O ATOM 0 H ASP A 60 -8.099 5.080 -19.162 1.00 0.00 H new ATOM 0 HA ASP A 60 -10.238 4.770 -21.010 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.321 6.092 -18.894 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -9.109 7.195 -19.517 1.00 0.00 H new ATOM 603 N GLU A 61 -7.596 6.308 -22.127 1.00 0.00 N ATOM 604 CA GLU A 61 -6.923 6.924 -23.284 1.00 0.00 C ATOM 605 C GLU A 61 -6.763 5.947 -24.473 1.00 0.00 C ATOM 606 O GLU A 61 -6.756 6.371 -25.631 1.00 0.00 O ATOM 607 CB GLU A 61 -5.559 7.565 -22.851 1.00 0.00 C ATOM 608 CG GLU A 61 -4.686 6.765 -21.846 1.00 0.00 C ATOM 609 CD GLU A 61 -4.130 5.431 -22.372 1.00 0.00 C ATOM 610 OE1 GLU A 61 -3.188 5.447 -23.195 1.00 0.00 O ATOM 611 OE2 GLU A 61 -4.641 4.364 -21.977 1.00 0.00 O ATOM 0 H GLU A 61 -6.964 6.095 -21.355 1.00 0.00 H new ATOM 0 HA GLU A 61 -7.567 7.723 -23.649 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.967 7.738 -23.750 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -5.768 8.541 -22.414 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -3.849 7.392 -21.538 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.280 6.565 -20.954 1.00 0.00 H new ATOM 618 N ARG A 62 -6.636 4.637 -24.190 1.00 0.00 N ATOM 619 CA ARG A 62 -6.439 3.604 -25.240 1.00 0.00 C ATOM 620 C ARG A 62 -7.778 3.045 -25.765 1.00 0.00 C ATOM 621 O ARG A 62 -7.795 2.291 -26.746 1.00 0.00 O ATOM 622 CB ARG A 62 -5.527 2.470 -24.700 1.00 0.00 C ATOM 623 CG ARG A 62 -6.146 1.593 -23.594 1.00 0.00 C ATOM 624 CD ARG A 62 -5.110 0.725 -22.860 1.00 0.00 C ATOM 625 NE ARG A 62 -4.418 -0.237 -23.740 1.00 0.00 N ATOM 626 CZ ARG A 62 -3.193 -0.750 -23.499 1.00 0.00 C ATOM 627 NH1 ARG A 62 -2.459 -0.330 -22.461 1.00 0.00 N ATOM 628 NH2 ARG A 62 -2.691 -1.673 -24.298 1.00 0.00 N ATOM 0 H ARG A 62 -6.666 4.262 -23.242 1.00 0.00 H new ATOM 0 HA ARG A 62 -5.948 4.077 -26.090 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -5.243 1.827 -25.533 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -4.610 2.917 -24.315 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.652 2.234 -22.871 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -6.906 0.947 -24.034 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -4.370 1.374 -22.392 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -5.608 0.179 -22.058 1.00 0.00 H new ATOM 0 HE ARG A 62 -4.899 -0.535 -24.589 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -2.824 0.389 -21.836 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.535 -0.729 -22.295 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -3.229 -2.001 -25.100 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -1.765 -2.059 -24.113 1.00 0.00 H new ATOM 642 N VAL A 63 -8.887 3.413 -25.100 1.00 0.00 N ATOM 643 CA VAL A 63 -10.252 3.061 -25.537 1.00 0.00 C ATOM 644 C VAL A 63 -11.093 4.355 -25.691 1.00 0.00 C ATOM 645 O VAL A 63 -11.847 4.770 -24.798 1.00 0.00 O ATOM 646 CB VAL A 63 -10.921 1.976 -24.590 1.00 0.00 C ATOM 647 CG1 VAL A 63 -10.939 2.405 -23.107 1.00 0.00 C ATOM 648 CG2 VAL A 63 -12.333 1.590 -25.083 1.00 0.00 C ATOM 0 H VAL A 63 -8.863 3.964 -24.242 1.00 0.00 H new ATOM 0 HA VAL A 63 -10.204 2.581 -26.514 1.00 0.00 H new ATOM 0 HB VAL A 63 -10.291 1.088 -24.646 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -11.408 1.624 -22.508 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -9.917 2.563 -22.762 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -11.505 3.331 -23.003 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -12.762 0.846 -24.412 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -12.968 2.476 -25.096 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -12.267 1.176 -26.089 1.00 0.00 H new ATOM 658 N LYS A 64 -10.873 5.026 -26.835 1.00 0.00 N ATOM 659 CA LYS A 64 -11.578 6.257 -27.216 1.00 0.00 C ATOM 660 C LYS A 64 -11.324 6.540 -28.719 1.00 0.00 C ATOM 661 O LYS A 64 -10.231 6.957 -29.106 1.00 0.00 O ATOM 662 CB LYS A 64 -11.108 7.439 -26.313 1.00 0.00 C ATOM 663 CG LYS A 64 -11.941 8.734 -26.437 1.00 0.00 C ATOM 664 CD LYS A 64 -11.681 9.742 -25.282 1.00 0.00 C ATOM 665 CE LYS A 64 -12.374 9.369 -23.947 1.00 0.00 C ATOM 666 NZ LYS A 64 -11.950 8.043 -23.397 1.00 0.00 N ATOM 0 H LYS A 64 -10.190 4.722 -27.529 1.00 0.00 H new ATOM 0 HA LYS A 64 -12.652 6.141 -27.067 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -11.128 7.111 -25.274 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.070 7.669 -26.554 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -11.714 9.215 -27.388 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.000 8.477 -26.455 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -10.607 9.815 -25.113 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -12.023 10.729 -25.592 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -12.161 10.143 -23.209 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.453 9.361 -24.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -12.318 7.934 -22.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.325 7.282 -23.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -10.911 7.990 -23.380 1.00 0.00 H new ATOM 680 N GLU A 65 -12.333 6.231 -29.553 1.00 0.00 N ATOM 681 CA GLU A 65 -12.305 6.476 -31.019 1.00 0.00 C ATOM 682 C GLU A 65 -12.356 8.007 -31.343 1.00 0.00 C ATOM 683 O GLU A 65 -12.749 8.800 -30.479 1.00 0.00 O ATOM 684 CB GLU A 65 -13.481 5.705 -31.717 1.00 0.00 C ATOM 685 CG GLU A 65 -14.918 6.224 -31.447 1.00 0.00 C ATOM 686 CD GLU A 65 -15.424 6.043 -30.002 1.00 0.00 C ATOM 687 OE1 GLU A 65 -15.148 4.987 -29.386 1.00 0.00 O ATOM 688 OE2 GLU A 65 -16.100 6.950 -29.468 1.00 0.00 O ATOM 0 H GLU A 65 -13.201 5.801 -29.233 1.00 0.00 H new ATOM 0 HA GLU A 65 -11.362 6.097 -31.413 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -13.309 5.726 -32.793 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -13.433 4.661 -31.407 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -14.957 7.284 -31.698 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -15.604 5.712 -32.121 1.00 0.00 H new ATOM 695 N PRO A 66 -11.938 8.470 -32.578 1.00 0.00 N ATOM 696 CA PRO A 66 -11.324 7.644 -33.644 1.00 0.00 C ATOM 697 C PRO A 66 -9.780 7.547 -33.532 1.00 0.00 C ATOM 698 O PRO A 66 -9.047 8.486 -33.872 1.00 0.00 O ATOM 699 CB PRO A 66 -11.782 8.382 -34.929 1.00 0.00 C ATOM 700 CG PRO A 66 -11.819 9.835 -34.539 1.00 0.00 C ATOM 701 CD PRO A 66 -12.094 9.876 -33.036 1.00 0.00 C ATOM 0 HA PRO A 66 -11.632 6.599 -33.604 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -11.090 8.210 -35.753 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -12.761 8.035 -35.258 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -10.873 10.323 -34.773 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -12.596 10.365 -35.090 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -11.395 10.538 -32.525 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -13.097 10.250 -32.828 1.00 0.00 H new ATOM 709 N SER A 67 -9.302 6.398 -33.022 1.00 0.00 N ATOM 710 CA SER A 67 -7.871 6.057 -33.034 1.00 0.00 C ATOM 711 C SER A 67 -7.420 5.822 -34.486 1.00 0.00 C ATOM 712 O SER A 67 -6.403 6.356 -34.939 1.00 0.00 O ATOM 713 CB SER A 67 -7.611 4.801 -32.173 1.00 0.00 C ATOM 714 OG SER A 67 -8.063 4.993 -30.844 1.00 0.00 O ATOM 0 H SER A 67 -9.893 5.686 -32.593 1.00 0.00 H new ATOM 0 HA SER A 67 -7.297 6.881 -32.609 1.00 0.00 H new ATOM 0 HB2 SER A 67 -8.119 3.943 -32.613 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.545 4.573 -32.169 1.00 0.00 H new ATOM 0 HG SER A 67 -7.889 4.184 -30.319 1.00 0.00 H new ATOM 720 N GLN A 68 -8.219 5.025 -35.205 1.00 0.00 N ATOM 721 CA GLN A 68 -8.005 4.747 -36.628 1.00 0.00 C ATOM 722 C GLN A 68 -8.820 5.728 -37.481 1.00 0.00 C ATOM 723 O GLN A 68 -10.058 5.760 -37.396 1.00 0.00 O ATOM 724 CB GLN A 68 -8.401 3.281 -36.959 1.00 0.00 C ATOM 725 CG GLN A 68 -8.165 2.862 -38.431 1.00 0.00 C ATOM 726 CD GLN A 68 -6.699 2.946 -38.877 1.00 0.00 C ATOM 727 OE1 GLN A 68 -5.774 2.748 -38.087 1.00 0.00 O ATOM 728 NE2 GLN A 68 -6.476 3.276 -40.141 1.00 0.00 N ATOM 0 H GLN A 68 -9.035 4.554 -34.814 1.00 0.00 H new ATOM 0 HA GLN A 68 -6.947 4.877 -36.857 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -7.836 2.611 -36.310 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.455 3.141 -36.721 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -8.518 1.840 -38.568 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -8.768 3.497 -39.080 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -7.261 3.434 -40.773 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -5.519 3.372 -40.482 1.00 0.00 H new ATOM 737 N ASP A 69 -8.119 6.538 -38.292 1.00 0.00 N ATOM 738 CA ASP A 69 -8.759 7.416 -39.283 1.00 0.00 C ATOM 739 C ASP A 69 -9.245 6.574 -40.481 1.00 0.00 C ATOM 740 O ASP A 69 -8.478 5.772 -41.037 1.00 0.00 O ATOM 741 CB ASP A 69 -7.780 8.521 -39.748 1.00 0.00 C ATOM 742 CG ASP A 69 -7.437 9.515 -38.624 1.00 0.00 C ATOM 743 OD1 ASP A 69 -8.179 10.506 -38.447 1.00 0.00 O ATOM 744 OD2 ASP A 69 -6.434 9.304 -37.911 1.00 0.00 O ATOM 0 H ASP A 69 -7.101 6.602 -38.279 1.00 0.00 H new ATOM 0 HA ASP A 69 -9.618 7.905 -38.823 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -6.863 8.059 -40.113 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -8.219 9.062 -40.586 1.00 0.00 H new ATOM 749 N THR A 70 -10.517 6.767 -40.861 1.00 0.00 N ATOM 750 CA THR A 70 -11.188 5.979 -41.906 1.00 0.00 C ATOM 751 C THR A 70 -12.483 6.696 -42.335 1.00 0.00 C ATOM 752 O THR A 70 -12.909 7.656 -41.685 1.00 0.00 O ATOM 753 CB THR A 70 -11.523 4.522 -41.401 1.00 0.00 C ATOM 754 OG1 THR A 70 -12.228 3.784 -42.420 1.00 0.00 O ATOM 755 CG2 THR A 70 -12.370 4.525 -40.110 1.00 0.00 C ATOM 0 H THR A 70 -11.115 7.482 -40.447 1.00 0.00 H new ATOM 0 HA THR A 70 -10.513 5.891 -42.757 1.00 0.00 H new ATOM 0 HB THR A 70 -10.569 4.044 -41.181 1.00 0.00 H new ATOM 0 HG1 THR A 70 -12.427 2.882 -42.092 1.00 0.00 H new ATOM 0 HG21 THR A 70 -12.573 3.498 -39.805 1.00 0.00 H new ATOM 0 HG22 THR A 70 -11.824 5.038 -39.318 1.00 0.00 H new ATOM 0 HG23 THR A 70 -13.312 5.041 -40.294 1.00 0.00 H new ATOM 763 N VAL A 71 -13.093 6.233 -43.444 1.00 0.00 N ATOM 764 CA VAL A 71 -14.453 6.637 -43.828 1.00 0.00 C ATOM 765 C VAL A 71 -15.476 5.934 -42.906 1.00 0.00 C ATOM 766 O VAL A 71 -15.268 4.787 -42.493 1.00 0.00 O ATOM 767 CB VAL A 71 -14.756 6.311 -45.341 1.00 0.00 C ATOM 768 CG1 VAL A 71 -13.801 7.075 -46.285 1.00 0.00 C ATOM 769 CG2 VAL A 71 -14.716 4.789 -45.650 1.00 0.00 C ATOM 0 H VAL A 71 -12.659 5.575 -44.091 1.00 0.00 H new ATOM 0 HA VAL A 71 -14.536 7.717 -43.711 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.776 6.651 -45.523 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.037 6.827 -47.320 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -13.920 8.148 -46.132 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -12.771 6.790 -46.070 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.932 4.626 -46.706 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -13.726 4.396 -45.417 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -15.462 4.275 -45.044 1.00 0.00 H new ATOM 779 N ALA A 72 -16.572 6.633 -42.585 1.00 0.00 N ATOM 780 CA ALA A 72 -17.627 6.127 -41.682 1.00 0.00 C ATOM 781 C ALA A 72 -18.806 5.534 -42.484 1.00 0.00 C ATOM 782 O ALA A 72 -19.920 5.410 -41.959 1.00 0.00 O ATOM 783 CB ALA A 72 -18.088 7.272 -40.762 1.00 0.00 C ATOM 0 H ALA A 72 -16.758 7.570 -42.943 1.00 0.00 H new ATOM 0 HA ALA A 72 -17.226 5.320 -41.069 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -18.867 6.909 -40.091 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -17.242 7.630 -40.175 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -18.482 8.089 -41.367 1.00 0.00 H new ATOM 789 N THR A 73 -18.530 5.156 -43.754 1.00 0.00 N ATOM 790 CA THR A 73 -19.514 4.591 -44.705 1.00 0.00 C ATOM 791 C THR A 73 -20.596 5.645 -45.075 1.00 0.00 C ATOM 792 O THR A 73 -21.735 5.324 -45.444 1.00 0.00 O ATOM 793 CB THR A 73 -20.135 3.234 -44.169 1.00 0.00 C ATOM 794 OG1 THR A 73 -19.094 2.422 -43.597 1.00 0.00 O ATOM 795 CG2 THR A 73 -20.836 2.411 -45.276 1.00 0.00 C ATOM 0 H THR A 73 -17.595 5.238 -44.154 1.00 0.00 H new ATOM 0 HA THR A 73 -18.989 4.338 -45.626 1.00 0.00 H new ATOM 0 HB THR A 73 -20.885 3.506 -43.426 1.00 0.00 H new ATOM 0 HG1 THR A 73 -19.478 1.584 -43.264 1.00 0.00 H new ATOM 0 HG21 THR A 73 -21.240 1.494 -44.847 1.00 0.00 H new ATOM 0 HG22 THR A 73 -21.647 2.998 -45.708 1.00 0.00 H new ATOM 0 HG23 THR A 73 -20.115 2.160 -46.054 1.00 0.00 H new ATOM 803 N GLU A 74 -20.186 6.919 -45.018 1.00 0.00 N ATOM 804 CA GLU A 74 -21.019 8.071 -45.407 1.00 0.00 C ATOM 805 C GLU A 74 -20.921 8.291 -46.942 1.00 0.00 C ATOM 806 O GLU A 74 -19.917 7.894 -47.553 1.00 0.00 O ATOM 807 CB GLU A 74 -20.587 9.362 -44.623 1.00 0.00 C ATOM 808 CG GLU A 74 -19.222 9.989 -45.006 1.00 0.00 C ATOM 809 CD GLU A 74 -18.002 9.174 -44.542 1.00 0.00 C ATOM 810 OE1 GLU A 74 -17.543 8.273 -45.271 1.00 0.00 O ATOM 811 OE2 GLU A 74 -17.502 9.430 -43.436 1.00 0.00 O ATOM 0 H GLU A 74 -19.255 7.185 -44.697 1.00 0.00 H new ATOM 0 HA GLU A 74 -22.057 7.862 -45.148 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -21.359 10.118 -44.763 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -20.564 9.122 -43.560 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -19.178 10.103 -46.089 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -19.161 10.989 -44.577 1.00 0.00 H new ATOM 818 N PRO A 75 -21.955 8.909 -47.597 1.00 0.00 N ATOM 819 CA PRO A 75 -21.905 9.221 -49.051 1.00 0.00 C ATOM 820 C PRO A 75 -20.969 10.417 -49.379 1.00 0.00 C ATOM 821 O PRO A 75 -20.180 10.854 -48.528 1.00 0.00 O ATOM 822 CB PRO A 75 -23.386 9.506 -49.390 1.00 0.00 C ATOM 823 CG PRO A 75 -23.966 10.043 -48.120 1.00 0.00 C ATOM 824 CD PRO A 75 -23.257 9.323 -46.992 1.00 0.00 C ATOM 0 HA PRO A 75 -21.482 8.411 -49.646 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -23.475 10.227 -50.203 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -23.901 8.600 -49.709 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -23.816 11.120 -48.049 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -25.041 9.867 -48.079 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -23.109 9.975 -46.131 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -23.829 8.462 -46.645 1.00 0.00 H new ATOM 832 N SER A 76 -21.047 10.915 -50.634 1.00 0.00 N ATOM 833 CA SER A 76 -20.181 12.007 -51.123 1.00 0.00 C ATOM 834 C SER A 76 -20.547 13.346 -50.442 1.00 0.00 C ATOM 835 O SER A 76 -21.462 14.063 -50.880 1.00 0.00 O ATOM 836 CB SER A 76 -20.272 12.124 -52.667 1.00 0.00 C ATOM 837 OG SER A 76 -19.404 13.132 -53.168 1.00 0.00 O ATOM 0 H SER A 76 -21.708 10.572 -51.331 1.00 0.00 H new ATOM 0 HA SER A 76 -19.150 11.771 -50.861 1.00 0.00 H new ATOM 0 HB2 SER A 76 -20.018 11.166 -53.121 1.00 0.00 H new ATOM 0 HB3 SER A 76 -21.298 12.351 -52.955 1.00 0.00 H new ATOM 0 HG SER A 76 -19.485 13.178 -54.144 1.00 0.00 H new ATOM 843 N GLU A 77 -19.841 13.643 -49.336 1.00 0.00 N ATOM 844 CA GLU A 77 -20.001 14.891 -48.572 1.00 0.00 C ATOM 845 C GLU A 77 -19.105 16.010 -49.150 1.00 0.00 C ATOM 846 O GLU A 77 -19.326 17.193 -48.866 1.00 0.00 O ATOM 847 CB GLU A 77 -19.700 14.637 -47.072 1.00 0.00 C ATOM 848 CG GLU A 77 -20.554 13.511 -46.435 1.00 0.00 C ATOM 849 CD GLU A 77 -22.072 13.723 -46.597 1.00 0.00 C ATOM 850 OE1 GLU A 77 -22.660 14.516 -45.831 1.00 0.00 O ATOM 851 OE2 GLU A 77 -22.684 13.115 -47.499 1.00 0.00 O ATOM 0 H GLU A 77 -19.137 13.017 -48.945 1.00 0.00 H new ATOM 0 HA GLU A 77 -21.034 15.228 -48.659 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -18.645 14.384 -46.962 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -19.866 15.561 -46.518 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -20.278 12.558 -46.886 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -20.316 13.442 -45.373 1.00 0.00 H new ATOM 858 N VAL A 78 -18.093 15.615 -49.954 1.00 0.00 N ATOM 859 CA VAL A 78 -17.257 16.563 -50.714 1.00 0.00 C ATOM 860 C VAL A 78 -18.069 17.101 -51.903 1.00 0.00 C ATOM 861 O VAL A 78 -18.574 16.328 -52.718 1.00 0.00 O ATOM 862 CB VAL A 78 -15.918 15.906 -51.227 1.00 0.00 C ATOM 863 CG1 VAL A 78 -15.073 16.891 -52.072 1.00 0.00 C ATOM 864 CG2 VAL A 78 -15.094 15.365 -50.045 1.00 0.00 C ATOM 0 H VAL A 78 -17.836 14.638 -50.092 1.00 0.00 H new ATOM 0 HA VAL A 78 -16.975 17.376 -50.045 1.00 0.00 H new ATOM 0 HB VAL A 78 -16.193 15.075 -51.876 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -14.161 16.396 -52.404 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -15.648 17.211 -52.941 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -14.815 17.760 -51.467 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -14.174 14.915 -50.418 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -14.849 16.183 -49.367 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -15.675 14.613 -49.511 1.00 0.00 H new ATOM 874 N GLU A 79 -18.192 18.432 -51.974 1.00 0.00 N ATOM 875 CA GLU A 79 -19.017 19.128 -52.972 1.00 0.00 C ATOM 876 C GLU A 79 -18.164 20.010 -53.886 1.00 0.00 C ATOM 877 O GLU A 79 -17.020 20.348 -53.565 1.00 0.00 O ATOM 878 CB GLU A 79 -20.145 19.947 -52.260 1.00 0.00 C ATOM 879 CG GLU A 79 -19.747 20.609 -50.914 1.00 0.00 C ATOM 880 CD GLU A 79 -18.653 21.686 -51.019 1.00 0.00 C ATOM 881 OE1 GLU A 79 -18.972 22.828 -51.409 1.00 0.00 O ATOM 882 OE2 GLU A 79 -17.472 21.399 -50.714 1.00 0.00 O ATOM 0 H GLU A 79 -17.715 19.065 -51.332 1.00 0.00 H new ATOM 0 HA GLU A 79 -19.491 18.382 -53.611 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -20.487 20.727 -52.940 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -20.992 19.285 -52.082 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -20.636 21.057 -50.470 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -19.406 19.831 -50.230 1.00 0.00 H new ATOM 889 N GLY A 80 -18.735 20.333 -55.052 1.00 0.00 N ATOM 890 CA GLY A 80 -18.135 21.267 -55.997 1.00 0.00 C ATOM 891 C GLY A 80 -19.008 22.494 -56.161 1.00 0.00 C ATOM 892 O GLY A 80 -19.882 22.522 -57.033 1.00 0.00 O ATOM 0 H GLY A 80 -19.628 19.950 -55.363 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -17.146 21.562 -55.647 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -17.999 20.779 -56.962 1.00 0.00 H new ATOM 896 N SER A 81 -18.790 23.486 -55.278 1.00 0.00 N ATOM 897 CA SER A 81 -19.486 24.793 -55.318 1.00 0.00 C ATOM 898 C SER A 81 -19.365 25.469 -56.698 1.00 0.00 C ATOM 899 O SER A 81 -18.307 25.404 -57.347 1.00 0.00 O ATOM 900 CB SER A 81 -18.923 25.733 -54.228 1.00 0.00 C ATOM 901 OG SER A 81 -19.182 25.219 -52.936 1.00 0.00 O ATOM 0 H SER A 81 -18.123 23.406 -54.511 1.00 0.00 H new ATOM 0 HA SER A 81 -20.543 24.603 -55.129 1.00 0.00 H new ATOM 0 HB2 SER A 81 -17.849 25.855 -54.367 1.00 0.00 H new ATOM 0 HB3 SER A 81 -19.372 26.721 -54.327 1.00 0.00 H new ATOM 0 HG SER A 81 -18.878 24.289 -52.887 1.00 0.00 H new ATOM 907 N ALA A 82 -20.456 26.115 -57.129 1.00 0.00 N ATOM 908 CA ALA A 82 -20.506 26.884 -58.376 1.00 0.00 C ATOM 909 C ALA A 82 -19.939 28.283 -58.119 1.00 0.00 C ATOM 910 O ALA A 82 -20.675 29.273 -58.018 1.00 0.00 O ATOM 911 CB ALA A 82 -21.943 26.928 -58.917 1.00 0.00 C ATOM 0 H ALA A 82 -21.337 26.118 -56.615 1.00 0.00 H new ATOM 0 HA ALA A 82 -19.896 26.404 -59.141 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -21.966 27.502 -59.843 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -22.290 25.913 -59.111 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -22.594 27.400 -58.181 1.00 0.00 H new ATOM 917 N ALA A 83 -18.616 28.326 -57.935 1.00 0.00 N ATOM 918 CA ALA A 83 -17.856 29.575 -57.737 1.00 0.00 C ATOM 919 C ALA A 83 -17.968 30.496 -58.967 1.00 0.00 C ATOM 920 O ALA A 83 -17.932 31.722 -58.835 1.00 0.00 O ATOM 921 CB ALA A 83 -16.391 29.249 -57.421 1.00 0.00 C ATOM 0 H ALA A 83 -18.032 27.490 -57.918 1.00 0.00 H new ATOM 0 HA ALA A 83 -18.284 30.112 -56.891 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -15.835 30.175 -57.276 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -16.340 28.649 -56.513 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -15.956 28.691 -58.250 1.00 0.00 H new ATOM 927 N ASN A 84 -18.106 29.854 -60.148 1.00 0.00 N ATOM 928 CA ASN A 84 -18.422 30.506 -61.432 1.00 0.00 C ATOM 929 C ASN A 84 -17.361 31.541 -61.828 1.00 0.00 C ATOM 930 O ASN A 84 -17.649 32.736 -61.999 1.00 0.00 O ATOM 931 CB ASN A 84 -19.858 31.108 -61.423 1.00 0.00 C ATOM 932 CG ASN A 84 -20.956 30.051 -61.261 1.00 0.00 C ATOM 933 OD1 ASN A 84 -20.823 28.917 -61.726 1.00 0.00 O ATOM 934 ND2 ASN A 84 -22.045 30.405 -60.593 1.00 0.00 N ATOM 0 H ASN A 84 -17.997 28.843 -60.234 1.00 0.00 H new ATOM 0 HA ASN A 84 -18.402 29.735 -62.202 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -19.937 31.831 -60.611 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -20.022 31.653 -62.353 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -22.799 29.732 -60.453 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -22.129 31.350 -60.219 1.00 0.00 H new ATOM 941 N LYS A 85 -16.115 31.063 -61.945 1.00 0.00 N ATOM 942 CA LYS A 85 -14.993 31.850 -62.490 1.00 0.00 C ATOM 943 C LYS A 85 -14.714 31.393 -63.932 1.00 0.00 C ATOM 944 O LYS A 85 -14.601 30.187 -64.208 1.00 0.00 O ATOM 945 CB LYS A 85 -13.726 31.737 -61.596 1.00 0.00 C ATOM 946 CG LYS A 85 -13.197 30.304 -61.354 1.00 0.00 C ATOM 947 CD LYS A 85 -11.967 30.279 -60.412 1.00 0.00 C ATOM 948 CE LYS A 85 -11.374 28.873 -60.233 1.00 0.00 C ATOM 949 NZ LYS A 85 -10.836 28.317 -61.510 1.00 0.00 N ATOM 0 H LYS A 85 -15.853 30.118 -61.665 1.00 0.00 H new ATOM 0 HA LYS A 85 -15.268 32.905 -62.498 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -12.930 32.326 -62.052 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -13.945 32.191 -60.630 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -13.992 29.694 -60.925 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -12.929 29.853 -62.309 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -11.199 30.943 -60.809 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -12.255 30.672 -59.437 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -10.576 28.909 -59.491 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.142 28.204 -59.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -10.328 27.431 -61.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.622 28.129 -62.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.183 29.003 -61.940 1.00 0.00 H new ATOM 963 N GLU A 86 -14.623 32.367 -64.850 1.00 0.00 N ATOM 964 CA GLU A 86 -14.495 32.125 -66.297 1.00 0.00 C ATOM 965 C GLU A 86 -13.102 31.572 -66.658 1.00 0.00 C ATOM 966 O GLU A 86 -12.103 31.928 -66.021 1.00 0.00 O ATOM 967 CB GLU A 86 -14.770 33.446 -67.070 1.00 0.00 C ATOM 968 CG GLU A 86 -14.819 33.296 -68.605 1.00 0.00 C ATOM 969 CD GLU A 86 -15.032 34.636 -69.339 1.00 0.00 C ATOM 970 OE1 GLU A 86 -16.183 35.116 -69.394 1.00 0.00 O ATOM 971 OE2 GLU A 86 -14.057 35.208 -69.862 1.00 0.00 O ATOM 0 H GLU A 86 -14.636 33.357 -64.606 1.00 0.00 H new ATOM 0 HA GLU A 86 -15.229 31.373 -66.585 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.719 33.860 -66.728 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -13.996 34.169 -66.814 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -13.889 32.844 -68.949 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.624 32.611 -68.871 1.00 0.00 H new ATOM 978 N VAL A 87 -13.047 30.683 -67.668 1.00 0.00 N ATOM 979 CA VAL A 87 -11.777 30.174 -68.220 1.00 0.00 C ATOM 980 C VAL A 87 -11.187 31.180 -69.234 1.00 0.00 C ATOM 981 O VAL A 87 -11.922 31.921 -69.896 1.00 0.00 O ATOM 982 CB VAL A 87 -11.958 28.763 -68.888 1.00 0.00 C ATOM 983 CG1 VAL A 87 -12.393 27.707 -67.849 1.00 0.00 C ATOM 984 CG2 VAL A 87 -12.956 28.809 -70.066 1.00 0.00 C ATOM 0 H VAL A 87 -13.876 30.299 -68.122 1.00 0.00 H new ATOM 0 HA VAL A 87 -11.080 30.059 -67.390 1.00 0.00 H new ATOM 0 HB VAL A 87 -10.987 28.472 -69.289 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -12.511 26.741 -68.340 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -11.634 27.629 -67.070 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -13.342 28.005 -67.403 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -13.053 27.814 -70.500 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -13.929 29.144 -69.706 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -12.592 29.502 -70.825 1.00 0.00 H new ATOM 994 N LEU A 88 -9.851 31.195 -69.343 1.00 0.00 N ATOM 995 CA LEU A 88 -9.112 32.125 -70.223 1.00 0.00 C ATOM 996 C LEU A 88 -8.508 31.377 -71.432 1.00 0.00 C ATOM 997 O LEU A 88 -7.484 31.790 -71.991 1.00 0.00 O ATOM 998 CB LEU A 88 -8.044 32.907 -69.378 1.00 0.00 C ATOM 999 CG LEU A 88 -7.227 32.096 -68.306 1.00 0.00 C ATOM 1000 CD1 LEU A 88 -6.245 31.088 -68.933 1.00 0.00 C ATOM 1001 CD2 LEU A 88 -6.492 33.044 -67.332 1.00 0.00 C ATOM 0 H LEU A 88 -9.245 30.561 -68.822 1.00 0.00 H new ATOM 0 HA LEU A 88 -9.796 32.862 -70.643 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -7.334 33.359 -70.070 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -8.553 33.723 -68.865 1.00 0.00 H new ATOM 0 HG LEU A 88 -7.956 31.513 -67.743 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.711 30.560 -68.143 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.798 30.371 -69.540 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -5.530 31.619 -69.561 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.936 32.456 -66.602 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.802 33.676 -67.891 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -7.219 33.670 -66.815 1.00 0.00 H new ATOM 1013 N ALA A 89 -9.189 30.295 -71.852 1.00 0.00 N ATOM 1014 CA ALA A 89 -8.747 29.429 -72.963 1.00 0.00 C ATOM 1015 C ALA A 89 -9.233 29.998 -74.305 1.00 0.00 C ATOM 1016 O ALA A 89 -10.260 30.690 -74.362 1.00 0.00 O ATOM 1017 CB ALA A 89 -9.264 27.995 -72.749 1.00 0.00 C ATOM 0 H ALA A 89 -10.067 29.994 -71.428 1.00 0.00 H new ATOM 0 HA ALA A 89 -7.658 29.400 -72.984 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.934 27.362 -73.573 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -8.872 27.603 -71.811 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -10.353 28.003 -72.712 1.00 0.00 H new ATOM 1023 N LYS A 90 -8.487 29.688 -75.382 1.00 0.00 N ATOM 1024 CA LYS A 90 -8.774 30.183 -76.734 1.00 0.00 C ATOM 1025 C LYS A 90 -9.973 29.422 -77.321 1.00 0.00 C ATOM 1026 O LYS A 90 -10.156 28.232 -77.019 1.00 0.00 O ATOM 1027 CB LYS A 90 -7.514 30.024 -77.649 1.00 0.00 C ATOM 1028 CG LYS A 90 -7.482 30.956 -78.904 1.00 0.00 C ATOM 1029 CD LYS A 90 -6.673 32.263 -78.671 1.00 0.00 C ATOM 1030 CE LYS A 90 -7.201 33.141 -77.518 1.00 0.00 C ATOM 1031 NZ LYS A 90 -8.471 33.819 -77.847 1.00 0.00 N ATOM 0 H LYS A 90 -7.666 29.085 -75.335 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.024 31.243 -76.682 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -6.623 30.216 -77.051 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -7.456 28.988 -77.984 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.048 30.412 -79.743 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.503 31.213 -79.185 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -5.635 32.002 -78.467 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.679 32.849 -79.590 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.344 32.522 -76.633 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -6.450 33.890 -77.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.964 34.077 -76.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -8.273 34.678 -78.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -9.071 33.180 -78.406 1.00 0.00 H new ATOM 1045 N VAL A 91 -10.769 30.085 -78.183 1.00 0.00 N ATOM 1046 CA VAL A 91 -11.990 29.484 -78.760 1.00 0.00 C ATOM 1047 C VAL A 91 -11.929 29.494 -80.316 1.00 0.00 C ATOM 1048 O VAL A 91 -12.956 29.375 -81.002 1.00 0.00 O ATOM 1049 CB VAL A 91 -13.279 30.219 -78.186 1.00 0.00 C ATOM 1050 CG1 VAL A 91 -13.409 31.665 -78.695 1.00 0.00 C ATOM 1051 CG2 VAL A 91 -14.577 29.425 -78.436 1.00 0.00 C ATOM 0 H VAL A 91 -10.588 31.039 -78.496 1.00 0.00 H new ATOM 0 HA VAL A 91 -12.056 28.437 -78.463 1.00 0.00 H new ATOM 0 HB VAL A 91 -13.132 30.266 -77.107 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -14.305 32.120 -78.273 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -12.533 32.238 -78.391 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -13.481 31.663 -79.783 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -15.424 29.973 -78.024 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -14.720 29.289 -79.508 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -14.506 28.450 -77.953 1.00 0.00 H new ATOM 1061 N ILE A 92 -10.683 29.525 -80.850 1.00 0.00 N ATOM 1062 CA ILE A 92 -10.392 29.698 -82.303 1.00 0.00 C ATOM 1063 C ILE A 92 -11.179 30.916 -82.842 1.00 0.00 C ATOM 1064 O ILE A 92 -12.201 30.804 -83.524 1.00 0.00 O ATOM 1065 CB ILE A 92 -10.661 28.386 -83.165 1.00 0.00 C ATOM 1066 CG1 ILE A 92 -9.799 27.182 -82.656 1.00 0.00 C ATOM 1067 CG2 ILE A 92 -10.410 28.616 -84.685 1.00 0.00 C ATOM 1068 CD1 ILE A 92 -8.289 27.364 -82.778 1.00 0.00 C ATOM 0 H ILE A 92 -9.841 29.430 -80.282 1.00 0.00 H new ATOM 0 HA ILE A 92 -9.323 29.885 -82.406 1.00 0.00 H new ATOM 0 HB ILE A 92 -11.716 28.144 -83.034 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -10.043 26.998 -81.610 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.087 26.290 -83.212 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -10.607 27.693 -85.230 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -11.074 29.401 -85.049 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -9.374 28.916 -84.841 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -7.784 26.476 -82.399 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.024 27.513 -83.825 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.979 28.233 -82.198 1.00 0.00 H new ATOM 1080 N ASP A 93 -10.722 32.078 -82.400 1.00 0.00 N ATOM 1081 CA ASP A 93 -11.370 33.379 -82.626 1.00 0.00 C ATOM 1082 C ASP A 93 -10.428 34.311 -83.377 1.00 0.00 C ATOM 1083 O ASP A 93 -10.515 35.533 -83.270 1.00 0.00 O ATOM 1084 CB ASP A 93 -11.797 33.966 -81.255 1.00 0.00 C ATOM 1085 CG ASP A 93 -10.659 33.970 -80.212 1.00 0.00 C ATOM 1086 OD1 ASP A 93 -10.368 32.891 -79.641 1.00 0.00 O ATOM 1087 OD2 ASP A 93 -10.034 35.029 -79.982 1.00 0.00 O ATOM 0 H ASP A 93 -9.863 32.153 -81.856 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.260 33.259 -83.244 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -12.152 34.986 -81.399 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.636 33.389 -80.866 1.00 0.00 H new ATOM 1092 N LEU A 94 -9.569 33.700 -84.197 1.00 0.00 N ATOM 1093 CA LEU A 94 -8.506 34.382 -84.957 1.00 0.00 C ATOM 1094 C LEU A 94 -9.026 34.893 -86.321 1.00 0.00 C ATOM 1095 O LEU A 94 -8.355 34.755 -87.354 1.00 0.00 O ATOM 1096 CB LEU A 94 -7.275 33.415 -85.066 1.00 0.00 C ATOM 1097 CG LEU A 94 -7.542 31.879 -85.346 1.00 0.00 C ATOM 1098 CD1 LEU A 94 -8.086 31.602 -86.768 1.00 0.00 C ATOM 1099 CD2 LEU A 94 -6.272 31.039 -85.071 1.00 0.00 C ATOM 0 H LEU A 94 -9.590 32.693 -84.358 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.178 35.280 -84.434 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.629 33.789 -85.860 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.712 33.489 -84.136 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.326 31.574 -84.652 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -8.247 30.531 -86.894 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.030 32.130 -86.906 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -7.365 31.950 -87.508 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -6.481 29.988 -85.270 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -5.464 31.378 -85.719 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.975 31.159 -84.029 1.00 0.00 H new ATOM 1111 N THR A 95 -10.204 35.540 -86.288 1.00 0.00 N ATOM 1112 CA THR A 95 -10.864 36.085 -87.472 1.00 0.00 C ATOM 1113 C THR A 95 -10.065 37.274 -88.040 1.00 0.00 C ATOM 1114 O THR A 95 -9.708 38.204 -87.307 1.00 0.00 O ATOM 1115 CB THR A 95 -12.336 36.512 -87.150 1.00 0.00 C ATOM 1116 OG1 THR A 95 -12.351 37.491 -86.093 1.00 0.00 O ATOM 1117 CG2 THR A 95 -13.211 35.307 -86.747 1.00 0.00 C ATOM 0 H THR A 95 -10.725 35.697 -85.425 1.00 0.00 H new ATOM 0 HA THR A 95 -10.899 35.301 -88.228 1.00 0.00 H new ATOM 0 HB THR A 95 -12.754 36.943 -88.060 1.00 0.00 H new ATOM 0 HG1 THR A 95 -11.538 38.037 -86.141 1.00 0.00 H new ATOM 0 HG21 THR A 95 -14.224 35.648 -86.532 1.00 0.00 H new ATOM 0 HG22 THR A 95 -13.237 34.586 -87.564 1.00 0.00 H new ATOM 0 HG23 THR A 95 -12.792 34.834 -85.859 1.00 0.00 H new ATOM 1125 N HIS A 96 -9.769 37.205 -89.345 1.00 0.00 N ATOM 1126 CA HIS A 96 -8.938 38.194 -90.039 1.00 0.00 C ATOM 1127 C HIS A 96 -9.804 39.309 -90.629 1.00 0.00 C ATOM 1128 O HIS A 96 -10.936 39.068 -91.057 1.00 0.00 O ATOM 1129 CB HIS A 96 -8.102 37.510 -91.153 1.00 0.00 C ATOM 1130 CG HIS A 96 -7.126 36.474 -90.635 1.00 0.00 C ATOM 1131 ND1 HIS A 96 -5.776 36.713 -90.475 1.00 0.00 N ATOM 1132 CD2 HIS A 96 -7.321 35.198 -90.221 1.00 0.00 C ATOM 1133 CE1 HIS A 96 -5.194 35.638 -89.981 1.00 0.00 C ATOM 1134 NE2 HIS A 96 -6.108 34.705 -89.820 1.00 0.00 N ATOM 0 H HIS A 96 -10.102 36.456 -89.951 1.00 0.00 H new ATOM 0 HA HIS A 96 -8.255 38.638 -89.315 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -8.779 37.035 -91.863 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -7.550 38.274 -91.701 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.261 34.667 -90.210 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -4.144 35.540 -89.748 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -5.940 33.767 -89.456 1.00 0.00 H new ATOM 1143 N ASP A 97 -9.244 40.522 -90.639 1.00 0.00 N ATOM 1144 CA ASP A 97 -9.869 41.712 -91.254 1.00 0.00 C ATOM 1145 C ASP A 97 -10.012 41.551 -92.776 1.00 0.00 C ATOM 1146 O ASP A 97 -9.289 40.766 -93.403 1.00 0.00 O ATOM 1147 CB ASP A 97 -9.051 42.992 -90.938 1.00 0.00 C ATOM 1148 CG ASP A 97 -9.024 43.319 -89.438 1.00 0.00 C ATOM 1149 OD1 ASP A 97 -9.942 44.014 -88.953 1.00 0.00 O ATOM 1150 OD2 ASP A 97 -8.096 42.874 -88.735 1.00 0.00 O ATOM 0 H ASP A 97 -8.335 40.715 -90.218 1.00 0.00 H new ATOM 0 HA ASP A 97 -10.865 41.811 -90.823 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -8.030 42.864 -91.297 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -9.477 43.835 -91.482 1.00 0.00 H new ATOM 1155 N ASN A 98 -10.963 42.306 -93.349 1.00 0.00 N ATOM 1156 CA ASN A 98 -11.230 42.325 -94.797 1.00 0.00 C ATOM 1157 C ASN A 98 -10.044 42.977 -95.553 1.00 0.00 C ATOM 1158 O ASN A 98 -9.717 44.149 -95.328 1.00 0.00 O ATOM 1159 CB ASN A 98 -12.584 43.041 -95.072 1.00 0.00 C ATOM 1160 CG ASN A 98 -12.686 44.446 -94.464 1.00 0.00 C ATOM 1161 OD1 ASN A 98 -13.041 44.605 -93.293 1.00 0.00 O ATOM 1162 ND2 ASN A 98 -12.391 45.470 -95.245 1.00 0.00 N ATOM 0 H ASN A 98 -11.573 42.926 -92.816 1.00 0.00 H new ATOM 0 HA ASN A 98 -11.320 41.305 -95.172 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -12.733 43.112 -96.149 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -13.394 42.427 -94.678 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -12.454 46.422 -94.884 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -12.100 45.309 -96.209 1.00 0.00 H new ATOM 1169 N LYS A 99 -9.394 42.183 -96.427 1.00 0.00 N ATOM 1170 CA LYS A 99 -8.167 42.576 -97.142 1.00 0.00 C ATOM 1171 C LYS A 99 -8.413 43.792 -98.059 1.00 0.00 C ATOM 1172 O LYS A 99 -9.473 43.916 -98.679 1.00 0.00 O ATOM 1173 CB LYS A 99 -7.636 41.366 -97.967 1.00 0.00 C ATOM 1174 CG LYS A 99 -6.332 41.617 -98.761 1.00 0.00 C ATOM 1175 CD LYS A 99 -5.113 41.952 -97.871 1.00 0.00 C ATOM 1176 CE LYS A 99 -4.703 40.796 -96.947 1.00 0.00 C ATOM 1177 NZ LYS A 99 -3.561 41.169 -96.069 1.00 0.00 N ATOM 0 H LYS A 99 -9.711 41.241 -96.658 1.00 0.00 H new ATOM 0 HA LYS A 99 -7.418 42.870 -96.407 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -7.471 40.530 -97.287 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -8.413 41.058 -98.667 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.104 40.732 -99.355 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -6.496 42.437 -99.460 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -4.269 42.217 -98.507 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.343 42.829 -97.265 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.554 40.503 -96.332 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.431 39.929 -97.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -3.313 40.363 -95.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -2.741 41.424 -96.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.829 41.981 -95.477 1.00 0.00 H new ATOM 1191 N ASP A 100 -7.398 44.661 -98.157 1.00 0.00 N ATOM 1192 CA ASP A 100 -7.446 45.925 -98.937 1.00 0.00 C ATOM 1193 C ASP A 100 -7.359 45.686-100.460 1.00 0.00 C ATOM 1194 O ASP A 100 -7.372 46.645-101.223 1.00 0.00 O ATOM 1195 CB ASP A 100 -6.295 46.867 -98.484 1.00 0.00 C ATOM 1196 CG ASP A 100 -6.311 47.194 -96.980 1.00 0.00 C ATOM 1197 OD1 ASP A 100 -5.989 46.291 -96.170 1.00 0.00 O ATOM 1198 OD2 ASP A 100 -6.638 48.333 -96.604 1.00 0.00 O ATOM 0 H ASP A 100 -6.502 44.512 -97.693 1.00 0.00 H new ATOM 0 HA ASP A 100 -8.412 46.390 -98.739 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -5.340 46.405 -98.735 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -6.357 47.797 -99.049 1.00 0.00 H new ATOM 1203 N ASP A 101 -7.271 44.411-100.867 1.00 0.00 N ATOM 1204 CA ASP A 101 -7.169 43.981-102.277 1.00 0.00 C ATOM 1205 C ASP A 101 -8.316 44.551-103.137 1.00 0.00 C ATOM 1206 O ASP A 101 -8.102 45.454-103.961 1.00 0.00 O ATOM 1207 CB ASP A 101 -7.151 42.421-102.340 1.00 0.00 C ATOM 1208 CG ASP A 101 -7.163 41.847-103.773 1.00 0.00 C ATOM 1209 OD1 ASP A 101 -6.094 41.785-104.410 1.00 0.00 O ATOM 1210 OD2 ASP A 101 -8.245 41.456-104.262 1.00 0.00 O ATOM 0 H ASP A 101 -7.268 43.629-100.212 1.00 0.00 H new ATOM 0 HA ASP A 101 -6.240 44.374-102.690 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.263 42.058-101.822 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -8.016 42.036-101.799 1.00 0.00 H new ATOM 1215 N LEU A 102 -9.532 44.037-102.906 1.00 0.00 N ATOM 1216 CA LEU A 102 -10.729 44.409-103.686 1.00 0.00 C ATOM 1217 C LEU A 102 -11.157 45.861-103.428 1.00 0.00 C ATOM 1218 O LEU A 102 -11.720 46.514-104.318 1.00 0.00 O ATOM 1219 CB LEU A 102 -11.899 43.384-103.452 1.00 0.00 C ATOM 1220 CG LEU A 102 -12.632 43.286-102.043 1.00 0.00 C ATOM 1221 CD1 LEU A 102 -11.652 43.169-100.858 1.00 0.00 C ATOM 1222 CD2 LEU A 102 -13.672 44.419-101.813 1.00 0.00 C ATOM 0 H LEU A 102 -9.717 43.351-102.174 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.464 44.357-104.742 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -12.666 43.599-104.197 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -11.505 42.393-103.677 1.00 0.00 H new ATOM 0 HG LEU A 102 -13.191 42.351-102.083 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.214 43.106 -99.926 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.043 42.272-100.976 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.005 44.046-100.833 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -14.136 44.294-100.834 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -13.172 45.386-101.857 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -14.439 44.372-102.586 1.00 0.00 H new ATOM 1234 N GLN A 103 -10.891 46.354-102.207 1.00 0.00 N ATOM 1235 CA GLN A 103 -11.221 47.726-101.810 1.00 0.00 C ATOM 1236 C GLN A 103 -10.394 48.724-102.624 1.00 0.00 C ATOM 1237 O GLN A 103 -10.946 49.649-103.203 1.00 0.00 O ATOM 1238 CB GLN A 103 -10.983 47.921-100.291 1.00 0.00 C ATOM 1239 CG GLN A 103 -11.893 47.048 -99.406 1.00 0.00 C ATOM 1240 CD GLN A 103 -11.583 47.128 -97.908 1.00 0.00 C ATOM 1241 OE1 GLN A 103 -10.682 46.280 -97.440 1.00 0.00 O flip ATOM 1242 NE2 GLN A 103 -12.142 47.949 -97.181 1.00 0.00 N flip ATOM 0 H GLN A 103 -10.441 45.810-101.470 1.00 0.00 H new ATOM 0 HA GLN A 103 -12.276 47.907-102.014 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -9.942 47.693-100.063 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -11.142 48.969-100.039 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -12.929 47.345 -99.567 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -11.805 46.010 -99.728 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -12.833 48.590 -97.572 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -11.915 47.989 -96.187 1.00 0.00 H new ATOM 1251 N ALA A 104 -9.078 48.478-102.703 1.00 0.00 N ATOM 1252 CA ALA A 104 -8.143 49.333-103.457 1.00 0.00 C ATOM 1253 C ALA A 104 -8.373 49.205-104.968 1.00 0.00 C ATOM 1254 O ALA A 104 -8.171 50.169-105.699 1.00 0.00 O ATOM 1255 CB ALA A 104 -6.695 48.980-103.108 1.00 0.00 C ATOM 0 H ALA A 104 -8.630 47.683-102.248 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.330 50.368-103.172 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -6.018 49.620-103.673 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -6.531 49.131-102.041 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -6.504 47.937-103.361 1.00 0.00 H new ATOM 1261 N ALA A 105 -8.796 48.008-105.417 1.00 0.00 N ATOM 1262 CA ALA A 105 -9.086 47.738-106.836 1.00 0.00 C ATOM 1263 C ALA A 105 -10.246 48.618-107.340 1.00 0.00 C ATOM 1264 O ALA A 105 -10.078 49.398-108.283 1.00 0.00 O ATOM 1265 CB ALA A 105 -9.393 46.244-107.039 1.00 0.00 C ATOM 0 H ALA A 105 -8.946 47.204-104.807 1.00 0.00 H new ATOM 0 HA ALA A 105 -8.204 47.991-107.424 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -9.606 46.056-108.091 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -8.532 45.651-106.731 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -10.259 45.966-106.438 1.00 0.00 H new ATOM 1271 N ILE A 106 -11.397 48.522-106.652 1.00 0.00 N ATOM 1272 CA ILE A 106 -12.637 49.221-107.044 1.00 0.00 C ATOM 1273 C ILE A 106 -12.524 50.736-106.756 1.00 0.00 C ATOM 1274 O ILE A 106 -12.932 51.552-107.588 1.00 0.00 O ATOM 1275 CB ILE A 106 -13.884 48.606-106.302 1.00 0.00 C ATOM 1276 CG1 ILE A 106 -14.002 47.066-106.579 1.00 0.00 C ATOM 1277 CG2 ILE A 106 -15.200 49.340-106.678 1.00 0.00 C ATOM 1278 CD1 ILE A 106 -14.162 46.672-108.047 1.00 0.00 C ATOM 0 H ILE A 106 -11.496 47.958-105.808 1.00 0.00 H new ATOM 0 HA ILE A 106 -12.778 49.086-108.116 1.00 0.00 H new ATOM 0 HB ILE A 106 -13.726 48.749-105.233 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -13.113 46.574-106.184 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -14.855 46.679-106.022 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -16.035 48.885-106.145 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -15.122 50.391-106.401 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -15.368 49.259-107.752 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -14.234 45.587-108.127 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -15.067 47.127-108.449 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -13.298 47.021-108.613 1.00 0.00 H new ATOM 1290 N ALA A 107 -11.948 51.091-105.584 1.00 0.00 N ATOM 1291 CA ALA A 107 -11.771 52.502-105.168 1.00 0.00 C ATOM 1292 C ALA A 107 -10.825 53.255-106.115 1.00 0.00 C ATOM 1293 O ALA A 107 -11.130 54.379-106.515 1.00 0.00 O ATOM 1294 CB ALA A 107 -11.289 52.593-103.711 1.00 0.00 C ATOM 0 H ALA A 107 -11.596 50.415-104.906 1.00 0.00 H new ATOM 0 HA ALA A 107 -12.745 52.987-105.229 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.168 53.640-103.433 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.023 52.126-103.055 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -10.334 52.078-103.611 1.00 0.00 H new ATOM 1300 N LEU A 108 -9.700 52.620-106.508 1.00 0.00 N ATOM 1301 CA LEU A 108 -8.767 53.228-107.480 1.00 0.00 C ATOM 1302 C LEU A 108 -9.475 53.401-108.824 1.00 0.00 C ATOM 1303 O LEU A 108 -9.440 54.487-109.383 1.00 0.00 O ATOM 1304 CB LEU A 108 -7.463 52.408-107.656 1.00 0.00 C ATOM 1305 CG LEU A 108 -6.388 53.013-108.625 1.00 0.00 C ATOM 1306 CD1 LEU A 108 -5.906 54.406-108.155 1.00 0.00 C ATOM 1307 CD2 LEU A 108 -5.192 52.058-108.791 1.00 0.00 C ATOM 0 H LEU A 108 -9.418 51.699-106.172 1.00 0.00 H new ATOM 0 HA LEU A 108 -8.469 54.200-107.086 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -7.005 52.278-106.675 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -7.729 51.415-108.018 1.00 0.00 H new ATOM 0 HG LEU A 108 -6.869 53.139-109.595 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -5.162 54.789-108.854 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -6.754 55.090-108.116 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -5.462 54.322-107.163 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -4.462 52.503-109.468 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.728 51.884-107.820 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -5.538 51.110-109.203 1.00 0.00 H new ATOM 1319 N SER A 109 -10.182 52.341-109.287 1.00 0.00 N ATOM 1320 CA SER A 109 -10.977 52.380-110.539 1.00 0.00 C ATOM 1321 C SER A 109 -12.079 53.468-110.505 1.00 0.00 C ATOM 1322 O SER A 109 -12.509 53.951-111.553 1.00 0.00 O ATOM 1323 CB SER A 109 -11.604 50.995-110.815 1.00 0.00 C ATOM 1324 OG SER A 109 -10.613 49.980-110.953 1.00 0.00 O ATOM 0 H SER A 109 -10.217 51.442-108.807 1.00 0.00 H new ATOM 0 HA SER A 109 -10.293 52.639-111.347 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.280 50.734-110.001 1.00 0.00 H new ATOM 0 HB3 SER A 109 -12.204 51.043-111.724 1.00 0.00 H new ATOM 0 HG SER A 109 -10.328 49.679-110.065 1.00 0.00 H new ATOM 1330 N LEU A 110 -12.517 53.843-109.297 1.00 0.00 N ATOM 1331 CA LEU A 110 -13.499 54.920-109.098 1.00 0.00 C ATOM 1332 C LEU A 110 -12.811 56.283-109.319 1.00 0.00 C ATOM 1333 O LEU A 110 -13.356 57.163-110.009 1.00 0.00 O ATOM 1334 CB LEU A 110 -14.134 54.776-107.678 1.00 0.00 C ATOM 1335 CG LEU A 110 -15.490 55.514-107.404 1.00 0.00 C ATOM 1336 CD1 LEU A 110 -15.326 57.043-107.222 1.00 0.00 C ATOM 1337 CD2 LEU A 110 -16.526 55.191-108.510 1.00 0.00 C ATOM 0 H LEU A 110 -12.202 53.410-108.429 1.00 0.00 H new ATOM 0 HA LEU A 110 -14.311 54.852-109.822 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -14.286 53.714-107.486 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -13.406 55.131-106.948 1.00 0.00 H new ATOM 0 HG LEU A 110 -15.863 55.134-106.453 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -16.301 57.494-107.036 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -14.667 57.240-106.376 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -14.894 57.473-108.126 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -17.459 55.714-108.299 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -16.139 55.515-109.476 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -16.710 54.117-108.534 1.00 0.00 H new ATOM 1349 N LEU A 111 -11.602 56.440-108.753 1.00 0.00 N ATOM 1350 CA LEU A 111 -10.798 57.672-108.922 1.00 0.00 C ATOM 1351 C LEU A 111 -10.060 57.697-110.281 1.00 0.00 C ATOM 1352 O LEU A 111 -9.466 58.728-110.634 1.00 0.00 O ATOM 1353 CB LEU A 111 -9.790 57.868-107.743 1.00 0.00 C ATOM 1354 CG LEU A 111 -10.379 58.387-106.380 1.00 0.00 C ATOM 1355 CD1 LEU A 111 -11.243 59.657-106.579 1.00 0.00 C ATOM 1356 CD2 LEU A 111 -11.172 57.305-105.628 1.00 0.00 C ATOM 0 H LEU A 111 -11.156 55.730-108.173 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.498 58.507-108.909 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.296 56.914-107.557 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.020 58.568-108.068 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.522 58.649-105.760 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.633 59.986-105.616 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -10.632 60.448-107.013 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -12.073 59.431-107.248 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.556 57.718-104.695 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -12.005 56.969-106.246 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.518 56.461-105.410 1.00 0.00 H new ATOM 1368 N GLU A 112 -10.081 56.574-111.030 1.00 0.00 N ATOM 1369 CA GLU A 112 -9.535 56.524-112.398 1.00 0.00 C ATOM 1370 C GLU A 112 -10.399 57.370-113.343 1.00 0.00 C ATOM 1371 O GLU A 112 -11.612 57.507-113.147 1.00 0.00 O ATOM 1372 CB GLU A 112 -9.418 55.065-112.923 1.00 0.00 C ATOM 1373 CG GLU A 112 -8.296 54.222-112.280 1.00 0.00 C ATOM 1374 CD GLU A 112 -6.874 54.707-112.613 1.00 0.00 C ATOM 1375 OE1 GLU A 112 -6.354 55.597-111.912 1.00 0.00 O ATOM 1376 OE2 GLU A 112 -6.271 54.184-113.572 1.00 0.00 O ATOM 0 H GLU A 112 -10.472 55.689-110.707 1.00 0.00 H new ATOM 0 HA GLU A 112 -8.527 56.939-112.368 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -10.370 54.560-112.759 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -9.255 55.096-114.000 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -8.426 54.229-111.198 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -8.401 53.188-112.607 1.00 0.00 H new ATOM 1383 N SER A 113 -9.747 57.931-114.357 1.00 0.00 N ATOM 1384 CA SER A 113 -10.341 58.918-115.277 1.00 0.00 C ATOM 1385 C SER A 113 -10.401 58.349-116.712 1.00 0.00 C ATOM 1386 O SER A 113 -9.631 57.440-117.038 1.00 0.00 O ATOM 1387 CB SER A 113 -9.488 60.205-115.221 1.00 0.00 C ATOM 1388 OG SER A 113 -9.361 60.663-113.879 1.00 0.00 O ATOM 0 H SER A 113 -8.774 57.714-114.573 1.00 0.00 H new ATOM 0 HA SER A 113 -11.364 59.147-114.977 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.501 60.012-115.640 1.00 0.00 H new ATOM 0 HB3 SER A 113 -9.948 60.980-115.834 1.00 0.00 H new ATOM 0 HG SER A 113 -8.817 61.478-113.862 1.00 0.00 H new ATOM 1394 N PRO A 114 -11.339 58.843-117.597 1.00 0.00 N ATOM 1395 CA PRO A 114 -11.352 58.454-119.030 1.00 0.00 C ATOM 1396 C PRO A 114 -10.038 58.861-119.723 1.00 0.00 C ATOM 1397 O PRO A 114 -9.585 59.994-119.558 1.00 0.00 O ATOM 1398 CB PRO A 114 -12.577 59.219-119.610 1.00 0.00 C ATOM 1399 CG PRO A 114 -13.429 59.524-118.407 1.00 0.00 C ATOM 1400 CD PRO A 114 -12.459 59.772-117.276 1.00 0.00 C ATOM 0 HA PRO A 114 -11.431 57.377-119.181 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -12.270 60.131-120.122 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -13.117 58.612-120.337 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -14.058 60.397-118.583 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -14.095 58.692-118.177 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -12.128 60.810-117.246 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -12.903 59.551-116.305 1.00 0.00 H new ATOM 1408 N LYS A 115 -9.419 57.924-120.463 1.00 0.00 N ATOM 1409 CA LYS A 115 -8.130 58.177-121.154 1.00 0.00 C ATOM 1410 C LYS A 115 -8.363 59.199-122.270 1.00 0.00 C ATOM 1411 O LYS A 115 -7.610 60.166-122.431 1.00 0.00 O ATOM 1412 CB LYS A 115 -7.503 56.867-121.726 1.00 0.00 C ATOM 1413 CG LYS A 115 -7.052 55.814-120.672 1.00 0.00 C ATOM 1414 CD LYS A 115 -8.224 55.158-119.909 1.00 0.00 C ATOM 1415 CE LYS A 115 -7.787 54.052-118.943 1.00 0.00 C ATOM 1416 NZ LYS A 115 -8.954 53.393-118.293 1.00 0.00 N ATOM 0 H LYS A 115 -9.786 56.983-120.601 1.00 0.00 H new ATOM 0 HA LYS A 115 -7.418 58.571-120.429 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -8.229 56.399-122.391 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -6.640 57.136-122.335 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.475 55.036-121.172 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.386 56.293-119.955 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -8.758 55.927-119.350 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -8.928 54.742-120.630 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -7.203 53.307-119.484 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.135 54.474-118.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -8.618 52.651-117.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -9.497 54.099-117.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -9.563 52.968-119.021 1.00 0.00 H new ATOM 1430 N ILE A 116 -9.448 58.966-123.014 1.00 0.00 N ATOM 1431 CA ILE A 116 -9.995 59.932-123.964 1.00 0.00 C ATOM 1432 C ILE A 116 -10.939 60.848-123.168 1.00 0.00 C ATOM 1433 O ILE A 116 -11.949 60.382-122.645 1.00 0.00 O ATOM 1434 CB ILE A 116 -10.752 59.238-125.164 1.00 0.00 C ATOM 1435 CG1 ILE A 116 -9.791 58.389-126.062 1.00 0.00 C ATOM 1436 CG2 ILE A 116 -11.497 60.278-126.035 1.00 0.00 C ATOM 1437 CD1 ILE A 116 -9.212 57.139-125.416 1.00 0.00 C ATOM 0 H ILE A 116 -9.974 58.093-122.972 1.00 0.00 H new ATOM 0 HA ILE A 116 -9.186 60.500-124.423 1.00 0.00 H new ATOM 0 HB ILE A 116 -11.480 58.561-124.716 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -10.332 58.093-126.961 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -8.966 59.026-126.381 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -12.008 59.769-126.852 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -12.228 60.808-125.424 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -10.781 60.991-126.443 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -8.562 56.630-126.127 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -8.636 57.419-124.534 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -10.023 56.472-125.123 1.00 0.00 H new ATOM 1449 N GLN A 117 -10.576 62.136-123.072 1.00 0.00 N ATOM 1450 CA GLN A 117 -11.258 63.127-122.201 1.00 0.00 C ATOM 1451 C GLN A 117 -12.774 63.249-122.481 1.00 0.00 C ATOM 1452 O GLN A 117 -13.561 63.473-121.557 1.00 0.00 O ATOM 1453 CB GLN A 117 -10.554 64.516-122.299 1.00 0.00 C ATOM 1454 CG GLN A 117 -10.483 65.104-123.719 1.00 0.00 C ATOM 1455 CD GLN A 117 -9.791 66.470-123.797 1.00 0.00 C ATOM 1456 OE1 GLN A 117 -9.842 67.270-122.865 1.00 0.00 O ATOM 1457 NE2 GLN A 117 -9.144 66.748-124.922 1.00 0.00 N ATOM 0 H GLN A 117 -9.796 62.530-123.598 1.00 0.00 H new ATOM 0 HA GLN A 117 -11.172 62.756-121.180 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -11.080 65.221-121.655 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -9.541 64.423-121.908 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -9.954 64.403-124.365 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -11.495 65.198-124.113 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -9.119 66.064-125.678 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -8.672 67.646-125.030 1.00 0.00 H new ATOM 1466 N ALA A 118 -13.171 63.087-123.749 1.00 0.00 N ATOM 1467 CA ALA A 118 -14.585 63.081-124.147 1.00 0.00 C ATOM 1468 C ALA A 118 -15.205 61.691-123.903 1.00 0.00 C ATOM 1469 O ALA A 118 -15.168 60.828-124.770 1.00 0.00 O ATOM 1470 CB ALA A 118 -14.723 63.522-125.612 1.00 0.00 C ATOM 0 H ALA A 118 -12.524 62.957-124.526 1.00 0.00 H new ATOM 0 HA ALA A 118 -15.135 63.795-123.534 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -15.775 63.514-125.897 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -14.323 64.529-125.728 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -14.169 62.836-126.252 1.00 0.00 H new ATOM 1476 N ASP A 119 -15.655 61.465-122.650 1.00 0.00 N ATOM 1477 CA ASP A 119 -16.470 60.282-122.235 1.00 0.00 C ATOM 1478 C ASP A 119 -15.737 58.921-122.395 1.00 0.00 C ATOM 1479 O ASP A 119 -16.341 57.875-122.137 1.00 0.00 O ATOM 1480 CB ASP A 119 -17.825 60.236-123.006 1.00 0.00 C ATOM 1481 CG ASP A 119 -18.661 61.513-122.853 1.00 0.00 C ATOM 1482 OD1 ASP A 119 -19.338 61.668-121.822 1.00 0.00 O ATOM 1483 OD2 ASP A 119 -18.629 62.368-123.761 1.00 0.00 O ATOM 0 H ASP A 119 -15.464 62.105-121.879 1.00 0.00 H new ATOM 0 HA ASP A 119 -16.650 60.421-121.169 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -17.626 60.066-124.064 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -18.407 59.386-122.651 1.00 0.00 H new ATOM 1488 N GLY A 120 -14.457 58.939-122.817 1.00 0.00 N ATOM 1489 CA GLY A 120 -13.718 57.719-123.141 1.00 0.00 C ATOM 1490 C GLY A 120 -14.148 57.099-124.462 1.00 0.00 C ATOM 1491 O GLY A 120 -14.653 55.970-124.486 1.00 0.00 O ATOM 0 H GLY A 120 -13.917 59.796-122.940 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.653 57.946-123.182 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -13.859 56.992-122.341 1.00 0.00 H new ATOM 1495 N ARG A 121 -13.918 57.828-125.578 1.00 0.00 N ATOM 1496 CA ARG A 121 -14.219 57.336-126.955 1.00 0.00 C ATOM 1497 C ARG A 121 -13.071 56.451-127.519 1.00 0.00 C ATOM 1498 O ARG A 121 -12.775 56.501-128.722 1.00 0.00 O ATOM 1499 CB ARG A 121 -14.500 58.536-127.920 1.00 0.00 C ATOM 1500 CG ARG A 121 -15.647 59.477-127.491 1.00 0.00 C ATOM 1501 CD ARG A 121 -16.951 58.741-127.165 1.00 0.00 C ATOM 1502 NE ARG A 121 -18.018 59.649-126.712 1.00 0.00 N ATOM 1503 CZ ARG A 121 -19.213 59.259-126.219 1.00 0.00 C ATOM 1504 NH1 ARG A 121 -19.497 57.967-126.043 1.00 0.00 N ATOM 1505 NH2 ARG A 121 -20.104 60.177-125.845 1.00 0.00 N ATOM 0 H ARG A 121 -13.522 58.768-125.557 1.00 0.00 H new ATOM 0 HA ARG A 121 -15.113 56.716-126.888 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -13.587 59.124-128.016 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -14.729 58.139-128.909 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -15.332 60.046-126.616 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -15.834 60.196-128.289 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -17.290 58.202-128.049 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -16.760 57.997-126.392 1.00 0.00 H new ATOM 0 HE ARG A 121 -17.840 60.651-126.776 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -18.806 57.256-126.282 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -20.405 57.691-125.669 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -19.882 61.169-125.932 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -21.008 59.888-125.472 1.00 0.00 H new ATOM 1519 N ASP A 122 -12.457 55.626-126.638 1.00 0.00 N ATOM 1520 CA ASP A 122 -11.391 54.665-127.010 1.00 0.00 C ATOM 1521 C ASP A 122 -11.829 53.711-128.136 1.00 0.00 C ATOM 1522 O ASP A 122 -11.031 53.363-129.007 1.00 0.00 O ATOM 1523 CB ASP A 122 -10.957 53.861-125.760 1.00 0.00 C ATOM 1524 CG ASP A 122 -9.787 52.889-126.036 1.00 0.00 C ATOM 1525 OD1 ASP A 122 -8.633 53.352-126.135 1.00 0.00 O ATOM 1526 OD2 ASP A 122 -10.012 51.661-126.142 1.00 0.00 O ATOM 0 H ASP A 122 -12.688 55.608-125.645 1.00 0.00 H new ATOM 0 HA ASP A 122 -10.546 55.238-127.392 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -10.665 54.556-124.973 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -11.810 53.295-125.386 1.00 0.00 H new ATOM 1531 N LEU A 123 -13.100 53.305-128.098 1.00 0.00 N ATOM 1532 CA LEU A 123 -13.730 52.500-129.156 1.00 0.00 C ATOM 1533 C LEU A 123 -15.152 53.057-129.369 1.00 0.00 C ATOM 1534 O LEU A 123 -16.152 52.470-128.931 1.00 0.00 O ATOM 1535 CB LEU A 123 -13.718 50.980-128.775 1.00 0.00 C ATOM 1536 CG LEU A 123 -13.719 49.938-129.952 1.00 0.00 C ATOM 1537 CD1 LEU A 123 -13.618 48.495-129.414 1.00 0.00 C ATOM 1538 CD2 LEU A 123 -14.947 50.077-130.875 1.00 0.00 C ATOM 0 H LEU A 123 -13.730 53.526-127.327 1.00 0.00 H new ATOM 0 HA LEU A 123 -13.177 52.570-130.093 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -12.837 50.794-128.161 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -14.589 50.783-128.150 1.00 0.00 H new ATOM 0 HG LEU A 123 -12.838 50.158-130.554 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -13.621 47.794-130.249 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -12.693 48.382-128.848 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -14.469 48.289-128.764 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -14.892 49.331-131.668 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -15.857 49.924-130.295 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -14.961 51.074-131.315 1.00 0.00 H new ATOM 1550 N ASN A 124 -15.198 54.240-129.993 1.00 0.00 N ATOM 1551 CA ASN A 124 -16.443 54.953-130.343 1.00 0.00 C ATOM 1552 C ASN A 124 -16.109 56.055-131.374 1.00 0.00 C ATOM 1553 O ASN A 124 -14.933 56.401-131.542 1.00 0.00 O ATOM 1554 CB ASN A 124 -17.107 55.554-129.070 1.00 0.00 C ATOM 1555 CG ASN A 124 -18.541 56.066-129.297 1.00 0.00 C ATOM 1556 OD1 ASN A 124 -18.754 57.234-129.641 1.00 0.00 O ATOM 1557 ND2 ASN A 124 -19.526 55.200-129.123 1.00 0.00 N ATOM 0 H ASN A 124 -14.357 54.743-130.277 1.00 0.00 H new ATOM 0 HA ASN A 124 -17.158 54.257-130.781 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -17.122 54.795-128.287 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -16.492 56.376-128.705 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -20.492 55.490-129.273 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -19.319 54.243-128.839 1.00 0.00 H new ATOM 1564 N ARG A 125 -17.154 56.588-132.062 1.00 0.00 N ATOM 1565 CA ARG A 125 -17.022 57.577-133.159 1.00 0.00 C ATOM 1566 C ARG A 125 -16.250 56.994-134.363 1.00 0.00 C ATOM 1567 O ARG A 125 -15.644 57.726-135.148 1.00 0.00 O ATOM 1568 CB ARG A 125 -16.391 58.918-132.644 1.00 0.00 C ATOM 1569 CG ARG A 125 -17.300 59.729-131.692 1.00 0.00 C ATOM 1570 CD ARG A 125 -18.589 60.213-132.384 1.00 0.00 C ATOM 1571 NE ARG A 125 -18.281 61.063-133.556 1.00 0.00 N ATOM 1572 CZ ARG A 125 -19.124 61.360-134.560 1.00 0.00 C ATOM 1573 NH1 ARG A 125 -20.377 60.898-134.578 1.00 0.00 N ATOM 1574 NH2 ARG A 125 -18.691 62.106-135.570 1.00 0.00 N ATOM 0 H ARG A 125 -18.123 56.338-131.865 1.00 0.00 H new ATOM 0 HA ARG A 125 -18.025 57.811-133.515 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -15.457 58.692-132.129 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -16.139 59.540-133.503 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -17.562 59.113-130.831 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -16.749 60.590-131.313 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -19.180 59.353-132.700 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -19.197 60.774-131.674 1.00 0.00 H new ATOM 0 HE ARG A 125 -17.343 61.460-133.606 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -20.713 60.306-133.819 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -20.998 61.137-135.351 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -17.729 62.446-135.577 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -19.320 62.339-136.338 1.00 0.00 H new ATOM 1588 N MET A 126 -16.345 55.659-134.530 1.00 0.00 N ATOM 1589 CA MET A 126 -15.650 54.924-135.612 1.00 0.00 C ATOM 1590 C MET A 126 -16.525 54.809-136.884 1.00 0.00 C ATOM 1591 O MET A 126 -16.139 54.137-137.847 1.00 0.00 O ATOM 1592 CB MET A 126 -15.223 53.513-135.115 1.00 0.00 C ATOM 1593 CG MET A 126 -16.378 52.573-134.728 1.00 0.00 C ATOM 1594 SD MET A 126 -15.808 50.921-134.264 1.00 0.00 S ATOM 1595 CE MET A 126 -15.005 50.370-135.773 1.00 0.00 C ATOM 0 H MET A 126 -16.903 55.060-133.922 1.00 0.00 H new ATOM 0 HA MET A 126 -14.759 55.492-135.880 1.00 0.00 H new ATOM 0 HB2 MET A 126 -14.633 53.034-135.897 1.00 0.00 H new ATOM 0 HB3 MET A 126 -14.569 53.633-134.251 1.00 0.00 H new ATOM 0 HG2 MET A 126 -16.932 53.008-133.897 1.00 0.00 H new ATOM 0 HG3 MET A 126 -17.071 52.492-135.565 1.00 0.00 H new ATOM 0 HE1 MET A 126 -14.942 49.282-135.775 1.00 0.00 H new ATOM 0 HE2 MET A 126 -15.584 50.702-136.635 1.00 0.00 H new ATOM 0 HE3 MET A 126 -14.001 50.792-135.826 1.00 0.00 H new ATOM 1605 N HIS A 127 -17.708 55.462-136.872 1.00 0.00 N ATOM 1606 CA HIS A 127 -18.623 55.515-138.033 1.00 0.00 C ATOM 1607 C HIS A 127 -19.448 56.812-137.997 1.00 0.00 C ATOM 1608 O HIS A 127 -19.685 57.375-136.918 1.00 0.00 O ATOM 1609 CB HIS A 127 -19.554 54.265-138.080 1.00 0.00 C ATOM 1610 CG HIS A 127 -20.538 54.140-136.936 1.00 0.00 C ATOM 1611 ND1 HIS A 127 -20.282 53.416-135.793 1.00 0.00 N ATOM 1612 CD2 HIS A 127 -21.797 54.635-136.776 1.00 0.00 C ATOM 1613 CE1 HIS A 127 -21.327 53.474-134.991 1.00 0.00 C ATOM 1614 NE2 HIS A 127 -22.256 54.209-135.565 1.00 0.00 N ATOM 0 H HIS A 127 -18.055 55.967-136.057 1.00 0.00 H new ATOM 0 HA HIS A 127 -18.021 55.508-138.942 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -20.113 54.285-139.016 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -18.931 53.371-138.100 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -22.334 55.253-137.481 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -21.407 52.998-134.025 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -23.171 54.425-135.168 1.00 0.00 H new ATOM 1623 N GLU A 128 -19.898 57.255-139.181 1.00 0.00 N ATOM 1624 CA GLU A 128 -20.737 58.453-139.350 1.00 0.00 C ATOM 1625 C GLU A 128 -21.396 58.393-140.740 1.00 0.00 C ATOM 1626 O GLU A 128 -20.724 58.581-141.764 1.00 0.00 O ATOM 1627 CB GLU A 128 -19.897 59.755-139.182 1.00 0.00 C ATOM 1628 CG GLU A 128 -20.723 61.057-139.238 1.00 0.00 C ATOM 1629 CD GLU A 128 -19.865 62.328-139.160 1.00 0.00 C ATOM 1630 OE1 GLU A 128 -19.222 62.683-140.166 1.00 0.00 O ATOM 1631 OE2 GLU A 128 -19.817 62.965-138.090 1.00 0.00 O ATOM 0 H GLU A 128 -19.687 56.785-140.061 1.00 0.00 H new ATOM 0 HA GLU A 128 -21.508 58.473-138.580 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -19.371 59.713-138.228 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -19.138 59.787-139.963 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -21.300 61.073-140.163 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -21.439 61.060-138.416 1.00 0.00 H new ATOM 1638 N ALA A 129 -22.705 58.082-140.775 1.00 0.00 N ATOM 1639 CA ALA A 129 -23.463 57.940-142.032 1.00 0.00 C ATOM 1640 C ALA A 129 -23.913 59.322-142.564 1.00 0.00 C ATOM 1641 O ALA A 129 -24.959 59.844-142.153 1.00 0.00 O ATOM 1642 CB ALA A 129 -24.659 56.997-141.817 1.00 0.00 C ATOM 0 H ALA A 129 -23.265 57.923-139.937 1.00 0.00 H new ATOM 0 HA ALA A 129 -22.815 57.500-142.790 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -25.215 56.896-142.749 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -24.298 56.018-141.502 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -25.312 57.408-141.047 1.00 0.00 H new ATOM 1648 N THR A 130 -23.076 59.916-143.439 1.00 0.00 N ATOM 1649 CA THR A 130 -23.350 61.214-144.093 1.00 0.00 C ATOM 1650 C THR A 130 -22.307 61.481-145.209 1.00 0.00 C ATOM 1651 O THR A 130 -21.356 60.706-145.378 1.00 0.00 O ATOM 1652 CB THR A 130 -23.373 62.395-143.051 1.00 0.00 C ATOM 1653 OG1 THR A 130 -23.771 63.628-143.680 1.00 0.00 O ATOM 1654 CG2 THR A 130 -22.017 62.589-142.362 1.00 0.00 C ATOM 0 H THR A 130 -22.184 59.506-143.714 1.00 0.00 H new ATOM 0 HA THR A 130 -24.341 61.162-144.544 1.00 0.00 H new ATOM 0 HB THR A 130 -24.104 62.122-142.290 1.00 0.00 H new ATOM 0 HG1 THR A 130 -23.780 64.347-143.014 1.00 0.00 H new ATOM 0 HG21 THR A 130 -22.084 63.414-141.653 1.00 0.00 H new ATOM 0 HG22 THR A 130 -21.744 61.676-141.832 1.00 0.00 H new ATOM 0 HG23 THR A 130 -21.257 62.814-143.111 1.00 0.00 H new ATOM 1662 N SER A 131 -22.507 62.577-145.967 1.00 0.00 N ATOM 1663 CA SER A 131 -21.644 62.957-147.102 1.00 0.00 C ATOM 1664 C SER A 131 -20.715 64.124-146.705 1.00 0.00 C ATOM 1665 O SER A 131 -21.130 65.033-145.978 1.00 0.00 O ATOM 1666 CB SER A 131 -22.528 63.353-148.307 1.00 0.00 C ATOM 1667 OG SER A 131 -23.420 62.302-148.649 1.00 0.00 O ATOM 0 H SER A 131 -23.277 63.227-145.808 1.00 0.00 H new ATOM 0 HA SER A 131 -21.020 62.108-147.380 1.00 0.00 H new ATOM 0 HB2 SER A 131 -23.095 64.253-148.067 1.00 0.00 H new ATOM 0 HB3 SER A 131 -21.897 63.593-149.163 1.00 0.00 H new ATOM 0 HG SER A 131 -23.970 62.575-149.412 1.00 0.00 H new ATOM 1673 N ALA A 132 -19.468 64.088-147.204 1.00 0.00 N ATOM 1674 CA ALA A 132 -18.444 65.119-146.947 1.00 0.00 C ATOM 1675 C ALA A 132 -17.741 65.483-148.279 1.00 0.00 C ATOM 1676 O ALA A 132 -17.898 66.623-148.760 1.00 0.00 O ATOM 1677 CB ALA A 132 -17.431 64.616-145.895 1.00 0.00 C ATOM 1678 OXT ALA A 132 -17.093 64.599-148.873 1.00 0.00 O ATOM 0 H ALA A 132 -19.137 63.333-147.805 1.00 0.00 H new ATOM 0 HA ALA A 132 -18.916 66.016-146.546 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -16.681 65.386-145.715 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -17.953 64.393-144.965 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -16.943 63.713-146.262 1.00 0.00 H new TER 1684 ALA A 132