USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 985 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 85 THR OG1 : rot 176:sc= 1.12 USER MOD Set 1.2: A 106 HIS : no HE2:sc= -0.341 K(o=0.78,f=-0.5) USER MOD Set 2.1: A 91 ASN : amide:sc= -0.0523 K(o=0.11,f=-0.9) USER MOD Set 2.2: B 239 ASN : amide:sc= 0.165! C(o=0.11!,f=-6.6!) USER MOD Set 3.1: A 32 TYR OH : rot 180:sc= 0.421 USER MOD Set 3.2: A 78 LYS NZ :NH3+ 163:sc= 0.809 (180deg=0.0928) USER MOD Single : A 25 ASN : amide:sc= -1.31 K(o=-1.3,f=-2.9) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00135) USER MOD Single : A 30 ASN : amide:sc= -1.33 K(o=-1.3,f=-4.6!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0.91 K(o=0.91,f=-0.51) USER MOD Single : A 39 ASN : amide:sc= -2.64! C(o=-2.6!,f=-7.3!) USER MOD Single : A 43 THR OG1 : rot -45:sc= 0.934 USER MOD Single : A 49 THR OG1 : rot 87:sc= 1.23 USER MOD Single : A 52 SER OG : rot 69:sc= -1.58! USER MOD Single : A 54 TYR OH : rot 44:sc= 1.01 USER MOD Single : A 63 SER OG : rot -177:sc= 1.06 USER MOD Single : A 67 ASN : amide:sc= 0.84 K(o=0.84,f=0) USER MOD Single : A 68 THR OG1 : rot -77:sc= 0.323 USER MOD Single : A 71 SER OG : rot 40:sc= 0.196 USER MOD Single : A 72 GLN : amide:sc= -0.0188 K(o=-0.019,f=-1.6!) USER MOD Single : A 76 TYR OH : rot 180:sc=-0.00549 USER MOD Single : A 79 TYR OH : rot -21:sc= 0.725 USER MOD Single : A 82 GLN : amide:sc= -1.82 K(o=-1.8,f=-3.9) USER MOD Single : A 84 SER OG : rot 1:sc= -2.21! USER MOD Single : A 93 ASN : amide:sc= -0.693 K(o=-0.69,f=-3.8!) USER MOD Single : A 96 LYS NZ :NH3+ -160:sc= -0.0687 (180deg=-0.477) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 143:sc= 1.03 (180deg=-0.00245) USER MOD Single : B 222 ASN : amide:sc= -0.161 K(o=-0.16,f=-3.1!) USER MOD Single : B 227 MET CE :methyl -131:sc= -0.364 (180deg=-0.771) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 236 HIS : no HD1:sc= -0.0553 X(o=-0.055,f=0.0039) USER MOD Single : B 238 SER OG : rot 180:sc= 0 USER MOD Single : B 244 LYS NZ :NH3+ -157:sc= 1.24 (180deg=0.86) USER MOD Single : B 248 LYS NZ :NH3+ -163:sc= 2.21 (180deg=1.91) USER MOD Single : B 249 GLN :FLIP amide:sc= -2.1! C(o=-3!,f=-2.1!) USER MOD Single : B 250 ASN : amide:sc= 1.04 K(o=1,f=-0.24) USER MOD Single : B 253 ASN : amide:sc= 0 X(o=0,f=-0.086) USER MOD Single : B 255 LYS NZ :NH3+ -155:sc= 2.2 (180deg=0.417) USER MOD Single : B 256 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.289) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 25 2.301 16.373 4.824 1.00 0.00 N ATOM 2 CA ASN A 25 3.575 17.064 5.016 1.00 0.00 C ATOM 3 C ASN A 25 4.692 16.048 5.131 1.00 0.00 C ATOM 4 O ASN A 25 4.568 15.057 5.841 1.00 0.00 O ATOM 5 CB ASN A 25 3.528 17.981 6.250 1.00 0.00 C ATOM 6 CG ASN A 25 4.802 18.780 6.452 1.00 0.00 C ATOM 7 OD1 ASN A 25 5.530 19.060 5.509 1.00 0.00 O ATOM 8 ND2 ASN A 25 5.068 19.167 7.664 1.00 0.00 N ATOM 0 HA ASN A 25 3.765 17.698 4.150 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.688 18.668 6.152 1.00 0.00 H new ATOM 0 HB3 ASN A 25 3.342 17.376 7.137 1.00 0.00 H new ATOM 0 HD21 ASN A 25 5.904 19.721 7.851 1.00 0.00 H new ATOM 0 HD22 ASN A 25 4.441 18.917 8.428 1.00 0.00 H new ATOM 17 N GLU A 26 5.807 16.336 4.485 1.00 0.00 N ATOM 18 CA GLU A 26 6.944 15.403 4.360 1.00 0.00 C ATOM 19 C GLU A 26 7.649 15.178 5.682 1.00 0.00 C ATOM 20 O GLU A 26 8.447 14.256 5.846 1.00 0.00 O ATOM 21 CB GLU A 26 7.903 15.953 3.341 1.00 0.00 C ATOM 22 CG GLU A 26 7.263 16.103 1.990 1.00 0.00 C ATOM 23 CD GLU A 26 8.176 16.699 0.972 1.00 0.00 C ATOM 24 OE1 GLU A 26 8.955 15.962 0.343 1.00 0.00 O ATOM 25 OE2 GLU A 26 8.112 17.922 0.757 1.00 0.00 O ATOM 0 H GLU A 26 5.964 17.231 4.022 1.00 0.00 H new ATOM 0 HA GLU A 26 6.564 14.433 4.041 1.00 0.00 H new ATOM 0 HB2 GLU A 26 8.273 16.922 3.677 1.00 0.00 H new ATOM 0 HB3 GLU A 26 8.766 15.292 3.262 1.00 0.00 H new ATOM 0 HG2 GLU A 26 6.930 15.125 1.642 1.00 0.00 H new ATOM 0 HG3 GLU A 26 6.375 16.728 2.083 1.00 0.00 H new ATOM 32 N TYR A 27 7.311 16.006 6.616 1.00 0.00 N ATOM 33 CA TYR A 27 7.857 15.971 7.947 1.00 0.00 C ATOM 34 C TYR A 27 7.056 15.011 8.838 1.00 0.00 C ATOM 35 O TYR A 27 7.209 14.984 10.054 1.00 0.00 O ATOM 36 CB TYR A 27 7.908 17.397 8.505 1.00 0.00 C ATOM 37 CG TYR A 27 8.863 18.304 7.730 1.00 0.00 C ATOM 38 CD1 TYR A 27 8.519 18.813 6.478 1.00 0.00 C ATOM 39 CD2 TYR A 27 10.110 18.629 8.237 1.00 0.00 C ATOM 40 CE1 TYR A 27 9.382 19.612 5.764 1.00 0.00 C ATOM 41 CE2 TYR A 27 10.984 19.431 7.525 1.00 0.00 C ATOM 42 CZ TYR A 27 10.614 19.919 6.291 1.00 0.00 C ATOM 43 OH TYR A 27 11.486 20.714 5.580 1.00 0.00 O ATOM 0 H TYR A 27 6.627 16.750 6.477 1.00 0.00 H new ATOM 0 HA TYR A 27 8.876 15.584 7.924 1.00 0.00 H new ATOM 0 HB2 TYR A 27 6.907 17.827 8.481 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.216 17.362 9.550 1.00 0.00 H new ATOM 0 HD1 TYR A 27 7.553 18.574 6.059 1.00 0.00 H new ATOM 0 HD2 TYR A 27 10.405 18.250 9.204 1.00 0.00 H new ATOM 0 HE1 TYR A 27 9.094 19.995 4.796 1.00 0.00 H new ATOM 0 HE2 TYR A 27 11.953 19.674 7.935 1.00 0.00 H new ATOM 0 HH TYR A 27 12.311 20.835 6.094 1.00 0.00 H new ATOM 53 N LYS A 28 6.203 14.235 8.202 1.00 0.00 N ATOM 54 CA LYS A 28 5.452 13.182 8.835 1.00 0.00 C ATOM 55 C LYS A 28 5.675 11.898 8.054 1.00 0.00 C ATOM 56 O LYS A 28 6.207 11.939 6.951 1.00 0.00 O ATOM 57 CB LYS A 28 3.964 13.487 8.854 1.00 0.00 C ATOM 58 CG LYS A 28 3.563 14.682 9.679 1.00 0.00 C ATOM 59 CD LYS A 28 2.079 14.631 9.929 1.00 0.00 C ATOM 60 CE LYS A 28 1.583 15.789 10.765 1.00 0.00 C ATOM 61 NZ LYS A 28 1.631 17.076 10.042 1.00 0.00 N ATOM 0 H LYS A 28 6.011 14.325 7.204 1.00 0.00 H new ATOM 0 HA LYS A 28 5.793 13.087 9.866 1.00 0.00 H new ATOM 0 HB2 LYS A 28 3.629 13.645 7.829 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.435 12.612 9.231 1.00 0.00 H new ATOM 0 HG2 LYS A 28 4.104 14.685 10.625 1.00 0.00 H new ATOM 0 HG3 LYS A 28 3.826 15.603 9.159 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.555 14.628 8.973 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.832 13.695 10.431 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.558 15.592 11.080 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.186 15.863 11.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.264 17.832 10.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.614 17.290 9.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.048 17.014 9.183 1.00 0.00 H new ATOM 75 N ASP A 29 5.200 10.789 8.576 1.00 0.00 N ATOM 76 CA ASP A 29 5.368 9.469 7.942 1.00 0.00 C ATOM 77 C ASP A 29 4.032 8.910 7.586 1.00 0.00 C ATOM 78 O ASP A 29 3.848 7.700 7.443 1.00 0.00 O ATOM 79 CB ASP A 29 6.097 8.490 8.861 1.00 0.00 C ATOM 80 CG ASP A 29 7.577 8.707 8.888 1.00 0.00 C ATOM 81 OD1 ASP A 29 8.279 8.151 8.022 1.00 0.00 O ATOM 82 OD2 ASP A 29 8.078 9.442 9.771 1.00 0.00 O ATOM 0 H ASP A 29 4.682 10.761 9.454 1.00 0.00 H new ATOM 0 HA ASP A 29 5.971 9.605 7.044 1.00 0.00 H new ATOM 0 HB2 ASP A 29 5.702 8.587 9.872 1.00 0.00 H new ATOM 0 HB3 ASP A 29 5.890 7.471 8.534 1.00 0.00 H new ATOM 87 N ASN A 30 3.112 9.802 7.373 1.00 0.00 N ATOM 88 CA ASN A 30 1.728 9.465 7.106 1.00 0.00 C ATOM 89 C ASN A 30 1.534 9.009 5.672 1.00 0.00 C ATOM 90 O ASN A 30 0.421 8.683 5.281 1.00 0.00 O ATOM 91 CB ASN A 30 0.791 10.665 7.389 1.00 0.00 C ATOM 92 CG ASN A 30 0.823 11.177 8.829 1.00 0.00 C ATOM 93 OD1 ASN A 30 1.847 11.114 9.519 1.00 0.00 O ATOM 94 ND2 ASN A 30 -0.278 11.711 9.284 1.00 0.00 N ATOM 0 H ASN A 30 3.296 10.805 7.378 1.00 0.00 H new ATOM 0 HA ASN A 30 1.470 8.645 7.777 1.00 0.00 H new ATOM 0 HB2 ASN A 30 1.060 11.483 6.721 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -0.231 10.376 7.144 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -0.308 12.090 10.231 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -1.108 11.750 8.693 1.00 0.00 H new ATOM 101 N ALA A 31 2.622 8.987 4.881 1.00 0.00 N ATOM 102 CA ALA A 31 2.552 8.548 3.484 1.00 0.00 C ATOM 103 C ALA A 31 2.604 7.048 3.405 1.00 0.00 C ATOM 104 O ALA A 31 2.284 6.459 2.374 1.00 0.00 O ATOM 105 CB ALA A 31 3.683 9.121 2.651 1.00 0.00 C ATOM 0 H ALA A 31 3.554 9.267 5.187 1.00 0.00 H new ATOM 0 HA ALA A 31 1.607 8.914 3.083 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.592 8.770 1.623 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.632 10.210 2.668 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.639 8.796 3.062 1.00 0.00 H new ATOM 111 N TYR A 32 3.014 6.443 4.491 1.00 0.00 N ATOM 112 CA TYR A 32 3.141 5.022 4.574 1.00 0.00 C ATOM 113 C TYR A 32 1.944 4.506 5.338 1.00 0.00 C ATOM 114 O TYR A 32 1.462 5.172 6.276 1.00 0.00 O ATOM 115 CB TYR A 32 4.438 4.668 5.331 1.00 0.00 C ATOM 116 CG TYR A 32 5.700 5.317 4.772 1.00 0.00 C ATOM 117 CD1 TYR A 32 6.437 4.700 3.788 1.00 0.00 C ATOM 118 CD2 TYR A 32 6.143 6.560 5.229 1.00 0.00 C ATOM 119 CE1 TYR A 32 7.563 5.275 3.273 1.00 0.00 C ATOM 120 CE2 TYR A 32 7.280 7.149 4.700 1.00 0.00 C ATOM 121 CZ TYR A 32 7.983 6.490 3.719 1.00 0.00 C ATOM 122 OH TYR A 32 9.101 7.061 3.150 1.00 0.00 O ATOM 0 H TYR A 32 3.270 6.934 5.348 1.00 0.00 H new ATOM 0 HA TYR A 32 3.184 4.574 3.581 1.00 0.00 H new ATOM 0 HB2 TYR A 32 4.326 4.963 6.374 1.00 0.00 H new ATOM 0 HB3 TYR A 32 4.566 3.586 5.318 1.00 0.00 H new ATOM 0 HD1 TYR A 32 6.117 3.738 3.414 1.00 0.00 H new ATOM 0 HD2 TYR A 32 5.592 7.069 6.006 1.00 0.00 H new ATOM 0 HE1 TYR A 32 8.124 4.762 2.506 1.00 0.00 H new ATOM 0 HE2 TYR A 32 7.610 8.114 5.054 1.00 0.00 H new ATOM 0 HH TYR A 32 9.276 7.928 3.572 1.00 0.00 H new ATOM 132 N ILE A 33 1.461 3.355 4.962 1.00 0.00 N ATOM 133 CA ILE A 33 0.319 2.759 5.607 1.00 0.00 C ATOM 134 C ILE A 33 0.470 1.269 5.691 1.00 0.00 C ATOM 135 O ILE A 33 1.287 0.660 4.983 1.00 0.00 O ATOM 136 CB ILE A 33 -1.035 3.065 4.892 1.00 0.00 C ATOM 137 CG1 ILE A 33 -0.963 2.698 3.408 1.00 0.00 C ATOM 138 CG2 ILE A 33 -1.460 4.514 5.087 1.00 0.00 C ATOM 139 CD1 ILE A 33 -2.268 2.831 2.672 1.00 0.00 C ATOM 0 H ILE A 33 1.847 2.800 4.198 1.00 0.00 H new ATOM 0 HA ILE A 33 0.288 3.207 6.600 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.801 2.443 5.355 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.221 3.333 2.925 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.611 1.670 3.317 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.406 4.688 4.575 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.581 4.718 6.151 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.698 5.175 4.675 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -2.127 2.552 1.628 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -3.010 2.175 3.126 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -2.614 3.863 2.728 1.00 0.00 H new ATOM 151 N TYR A 34 -0.311 0.710 6.545 1.00 0.00 N ATOM 152 CA TYR A 34 -0.411 -0.684 6.745 1.00 0.00 C ATOM 153 C TYR A 34 -1.790 -1.118 6.332 1.00 0.00 C ATOM 154 O TYR A 34 -2.796 -0.541 6.774 1.00 0.00 O ATOM 155 CB TYR A 34 -0.133 -1.018 8.223 1.00 0.00 C ATOM 156 CG TYR A 34 -0.748 -2.300 8.723 1.00 0.00 C ATOM 157 CD1 TYR A 34 -0.258 -3.541 8.351 1.00 0.00 C ATOM 158 CD2 TYR A 34 -1.831 -2.247 9.576 1.00 0.00 C ATOM 159 CE1 TYR A 34 -0.845 -4.700 8.818 1.00 0.00 C ATOM 160 CE2 TYR A 34 -2.427 -3.398 10.049 1.00 0.00 C ATOM 161 CZ TYR A 34 -1.930 -4.624 9.664 1.00 0.00 C ATOM 162 OH TYR A 34 -2.518 -5.785 10.129 1.00 0.00 O ATOM 0 H TYR A 34 -0.929 1.246 7.154 1.00 0.00 H new ATOM 0 HA TYR A 34 0.326 -1.217 6.144 1.00 0.00 H new ATOM 0 HB2 TYR A 34 0.946 -1.071 8.369 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -0.498 -0.196 8.839 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.593 -3.603 7.688 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.220 -1.286 9.879 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -0.455 -5.663 8.521 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.275 -3.338 10.715 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.270 -5.559 10.716 1.00 0.00 H new ATOM 172 N ILE A 35 -1.841 -2.071 5.464 1.00 0.00 N ATOM 173 CA ILE A 35 -3.075 -2.632 5.027 1.00 0.00 C ATOM 174 C ILE A 35 -3.154 -4.013 5.632 1.00 0.00 C ATOM 175 O ILE A 35 -2.225 -4.803 5.493 1.00 0.00 O ATOM 176 CB ILE A 35 -3.090 -2.780 3.493 1.00 0.00 C ATOM 177 CG1 ILE A 35 -2.668 -1.480 2.833 1.00 0.00 C ATOM 178 CG2 ILE A 35 -4.501 -3.142 3.029 1.00 0.00 C ATOM 179 CD1 ILE A 35 -2.017 -1.677 1.490 1.00 0.00 C ATOM 0 H ILE A 35 -1.016 -2.488 5.032 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.907 -1.994 5.325 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.391 -3.567 3.210 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.543 -0.840 2.715 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.976 -0.955 3.491 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.512 -3.247 1.944 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.804 -4.083 3.487 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.194 -2.355 3.324 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.740 -0.708 1.074 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.124 -2.291 1.605 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.715 -2.175 0.817 1.00 0.00 H new ATOM 191 N GLY A 36 -4.218 -4.290 6.286 1.00 0.00 N ATOM 192 CA GLY A 36 -4.402 -5.554 6.905 1.00 0.00 C ATOM 193 C GLY A 36 -5.679 -6.183 6.460 1.00 0.00 C ATOM 194 O GLY A 36 -6.550 -5.493 5.914 1.00 0.00 O ATOM 0 H GLY A 36 -4.996 -3.642 6.410 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.565 -6.208 6.661 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.408 -5.435 7.989 1.00 0.00 H new ATOM 198 N ASN A 37 -5.792 -7.473 6.711 1.00 0.00 N ATOM 199 CA ASN A 37 -6.929 -8.316 6.326 1.00 0.00 C ATOM 200 C ASN A 37 -6.931 -8.539 4.835 1.00 0.00 C ATOM 201 O ASN A 37 -7.957 -8.447 4.172 1.00 0.00 O ATOM 202 CB ASN A 37 -8.301 -7.779 6.795 1.00 0.00 C ATOM 203 CG ASN A 37 -8.406 -7.580 8.291 1.00 0.00 C ATOM 204 OD1 ASN A 37 -7.704 -8.216 9.080 1.00 0.00 O ATOM 205 ND2 ASN A 37 -9.308 -6.742 8.699 1.00 0.00 N ATOM 0 H ASN A 37 -5.069 -7.992 7.209 1.00 0.00 H new ATOM 0 HA ASN A 37 -6.790 -9.265 6.845 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -8.497 -6.829 6.298 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.079 -8.472 6.476 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.452 -6.594 9.698 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.873 -6.231 8.021 1.00 0.00 H new ATOM 212 N LEU A 38 -5.771 -8.839 4.304 1.00 0.00 N ATOM 213 CA LEU A 38 -5.651 -9.138 2.894 1.00 0.00 C ATOM 214 C LEU A 38 -6.156 -10.522 2.584 1.00 0.00 C ATOM 215 O LEU A 38 -6.022 -11.448 3.391 1.00 0.00 O ATOM 216 CB LEU A 38 -4.215 -8.982 2.367 1.00 0.00 C ATOM 217 CG LEU A 38 -3.823 -7.618 1.801 1.00 0.00 C ATOM 218 CD1 LEU A 38 -4.653 -7.295 0.579 1.00 0.00 C ATOM 219 CD2 LEU A 38 -3.974 -6.533 2.825 1.00 0.00 C ATOM 0 H LEU A 38 -4.895 -8.883 4.825 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.271 -8.403 2.381 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.529 -9.220 3.180 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.058 -9.729 1.588 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.772 -7.670 1.517 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.361 -6.320 0.188 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.489 -8.056 -0.184 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.708 -7.276 0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.686 -5.577 2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.012 -6.484 3.153 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.333 -6.748 3.680 1.00 0.00 H new ATOM 231 N ASN A 39 -6.752 -10.646 1.441 1.00 0.00 N ATOM 232 CA ASN A 39 -7.240 -11.912 0.949 1.00 0.00 C ATOM 233 C ASN A 39 -6.062 -12.605 0.292 1.00 0.00 C ATOM 234 O ASN A 39 -5.207 -11.933 -0.299 1.00 0.00 O ATOM 235 CB ASN A 39 -8.325 -11.666 -0.110 1.00 0.00 C ATOM 236 CG ASN A 39 -9.177 -12.887 -0.441 1.00 0.00 C ATOM 237 OD1 ASN A 39 -8.783 -14.030 -0.233 1.00 0.00 O ATOM 238 ND2 ASN A 39 -10.295 -12.650 -1.051 1.00 0.00 N ATOM 0 H ASN A 39 -6.920 -9.864 0.808 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.662 -12.511 1.756 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -8.979 -10.866 0.238 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -7.848 -11.313 -1.025 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -10.875 -13.425 -1.373 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -10.596 -11.688 -1.209 1.00 0.00 H new ATOM 245 N ARG A 40 -6.027 -13.914 0.364 1.00 0.00 N ATOM 246 CA ARG A 40 -4.958 -14.733 -0.212 1.00 0.00 C ATOM 247 C ARG A 40 -4.830 -14.525 -1.727 1.00 0.00 C ATOM 248 O ARG A 40 -3.788 -14.796 -2.316 1.00 0.00 O ATOM 249 CB ARG A 40 -5.197 -16.232 0.148 1.00 0.00 C ATOM 250 CG ARG A 40 -6.494 -16.848 -0.390 1.00 0.00 C ATOM 251 CD ARG A 40 -6.354 -17.211 -1.849 1.00 0.00 C ATOM 252 NE ARG A 40 -7.595 -17.652 -2.468 1.00 0.00 N ATOM 253 CZ ARG A 40 -7.751 -17.854 -3.789 1.00 0.00 C ATOM 254 NH1 ARG A 40 -6.692 -17.838 -4.602 1.00 0.00 N ATOM 255 NH2 ARG A 40 -8.952 -18.098 -4.285 1.00 0.00 N ATOM 0 H ARG A 40 -6.749 -14.462 0.831 1.00 0.00 H new ATOM 0 HA ARG A 40 -4.008 -14.417 0.219 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -4.356 -16.815 -0.228 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -5.193 -16.331 1.234 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.746 -17.738 0.188 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.316 -16.143 -0.264 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -5.975 -16.346 -2.394 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -5.610 -18.001 -1.947 1.00 0.00 H new ATOM 0 HE ARG A 40 -8.398 -17.819 -1.862 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -5.760 -17.672 -4.222 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -6.815 -17.992 -5.603 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -9.762 -18.133 -3.666 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -9.069 -18.251 -5.287 1.00 0.00 H new ATOM 269 N GLU A 41 -5.906 -14.051 -2.341 1.00 0.00 N ATOM 270 CA GLU A 41 -5.956 -13.881 -3.783 1.00 0.00 C ATOM 271 C GLU A 41 -5.540 -12.478 -4.202 1.00 0.00 C ATOM 272 O GLU A 41 -5.313 -12.226 -5.389 1.00 0.00 O ATOM 273 CB GLU A 41 -7.359 -14.194 -4.312 1.00 0.00 C ATOM 274 CG GLU A 41 -8.440 -13.263 -3.814 1.00 0.00 C ATOM 275 CD GLU A 41 -9.790 -13.621 -4.363 1.00 0.00 C ATOM 276 OE1 GLU A 41 -10.483 -14.458 -3.764 1.00 0.00 O ATOM 277 OE2 GLU A 41 -10.182 -13.081 -5.414 1.00 0.00 O ATOM 0 H GLU A 41 -6.761 -13.776 -1.857 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.245 -14.583 -4.218 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -7.339 -14.157 -5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.619 -15.215 -4.032 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.472 -13.295 -2.725 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -8.194 -12.239 -4.096 1.00 0.00 H new ATOM 284 N LEU A 42 -5.421 -11.580 -3.244 1.00 0.00 N ATOM 285 CA LEU A 42 -5.094 -10.205 -3.550 1.00 0.00 C ATOM 286 C LEU A 42 -3.616 -10.030 -3.798 1.00 0.00 C ATOM 287 O LEU A 42 -2.772 -10.554 -3.053 1.00 0.00 O ATOM 288 CB LEU A 42 -5.624 -9.238 -2.476 1.00 0.00 C ATOM 289 CG LEU A 42 -7.148 -9.021 -2.475 1.00 0.00 C ATOM 290 CD1 LEU A 42 -7.576 -8.154 -1.308 1.00 0.00 C ATOM 291 CD2 LEU A 42 -7.595 -8.382 -3.780 1.00 0.00 C ATOM 0 H LEU A 42 -5.546 -11.778 -2.251 1.00 0.00 H new ATOM 0 HA LEU A 42 -5.604 -9.947 -4.478 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.327 -9.612 -1.496 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.137 -8.272 -2.609 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.622 -9.997 -2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.657 -8.018 -1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -7.293 -8.637 -0.373 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -7.086 -7.183 -1.378 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.675 -8.236 -3.762 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.100 -7.418 -3.901 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.331 -9.033 -4.613 1.00 0.00 H new ATOM 303 N THR A 43 -3.318 -9.348 -4.863 1.00 0.00 N ATOM 304 CA THR A 43 -1.971 -9.108 -5.281 1.00 0.00 C ATOM 305 C THR A 43 -1.685 -7.608 -5.324 1.00 0.00 C ATOM 306 O THR A 43 -2.607 -6.787 -5.127 1.00 0.00 O ATOM 307 CB THR A 43 -1.707 -9.756 -6.666 1.00 0.00 C ATOM 308 OG1 THR A 43 -2.711 -9.342 -7.627 1.00 0.00 O ATOM 309 CG2 THR A 43 -1.695 -11.279 -6.564 1.00 0.00 C ATOM 0 H THR A 43 -4.019 -8.935 -5.478 1.00 0.00 H new ATOM 0 HA THR A 43 -1.297 -9.565 -4.556 1.00 0.00 H new ATOM 0 HB THR A 43 -0.728 -9.418 -7.006 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.599 -9.397 -7.216 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.508 -11.708 -7.548 1.00 0.00 H new ATOM 0 HG22 THR A 43 -0.909 -11.591 -5.877 1.00 0.00 H new ATOM 0 HG23 THR A 43 -2.660 -11.626 -6.194 1.00 0.00 H new ATOM 317 N GLU A 44 -0.425 -7.247 -5.574 1.00 0.00 N ATOM 318 CA GLU A 44 0.007 -5.849 -5.662 1.00 0.00 C ATOM 319 C GLU A 44 -0.812 -5.089 -6.689 1.00 0.00 C ATOM 320 O GLU A 44 -1.195 -3.953 -6.457 1.00 0.00 O ATOM 321 CB GLU A 44 1.487 -5.759 -6.040 1.00 0.00 C ATOM 322 CG GLU A 44 2.443 -6.266 -4.981 1.00 0.00 C ATOM 323 CD GLU A 44 3.880 -6.196 -5.428 1.00 0.00 C ATOM 324 OE1 GLU A 44 4.329 -5.135 -5.862 1.00 0.00 O ATOM 325 OE2 GLU A 44 4.607 -7.218 -5.341 1.00 0.00 O ATOM 0 H GLU A 44 0.328 -7.918 -5.722 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.144 -5.401 -4.680 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.649 -6.325 -6.957 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.729 -4.719 -6.261 1.00 0.00 H new ATOM 0 HG2 GLU A 44 2.319 -5.679 -4.071 1.00 0.00 H new ATOM 0 HG3 GLU A 44 2.192 -7.297 -4.732 1.00 0.00 H new ATOM 332 N GLY A 45 -1.110 -5.748 -7.796 1.00 0.00 N ATOM 333 CA GLY A 45 -1.879 -5.145 -8.864 1.00 0.00 C ATOM 334 C GLY A 45 -3.263 -4.729 -8.420 1.00 0.00 C ATOM 335 O GLY A 45 -3.749 -3.652 -8.797 1.00 0.00 O ATOM 0 H GLY A 45 -0.826 -6.711 -7.976 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.346 -4.273 -9.243 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.963 -5.851 -9.690 1.00 0.00 H new ATOM 339 N ASP A 46 -3.884 -5.549 -7.578 1.00 0.00 N ATOM 340 CA ASP A 46 -5.225 -5.255 -7.078 1.00 0.00 C ATOM 341 C ASP A 46 -5.166 -4.051 -6.199 1.00 0.00 C ATOM 342 O ASP A 46 -5.923 -3.089 -6.386 1.00 0.00 O ATOM 343 CB ASP A 46 -5.810 -6.408 -6.251 1.00 0.00 C ATOM 344 CG ASP A 46 -5.949 -7.704 -6.990 1.00 0.00 C ATOM 345 OD1 ASP A 46 -6.910 -7.861 -7.763 1.00 0.00 O ATOM 346 OD2 ASP A 46 -5.105 -8.607 -6.795 1.00 0.00 O ATOM 0 H ASP A 46 -3.483 -6.419 -7.228 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.862 -5.094 -7.947 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.176 -6.569 -5.379 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.791 -6.110 -5.881 1.00 0.00 H new ATOM 351 N ILE A 47 -4.224 -4.087 -5.272 1.00 0.00 N ATOM 352 CA ILE A 47 -4.031 -3.019 -4.325 1.00 0.00 C ATOM 353 C ILE A 47 -3.703 -1.716 -5.040 1.00 0.00 C ATOM 354 O ILE A 47 -4.348 -0.710 -4.807 1.00 0.00 O ATOM 355 CB ILE A 47 -2.934 -3.365 -3.268 1.00 0.00 C ATOM 356 CG1 ILE A 47 -3.406 -4.509 -2.357 1.00 0.00 C ATOM 357 CG2 ILE A 47 -2.540 -2.147 -2.447 1.00 0.00 C ATOM 358 CD1 ILE A 47 -2.445 -4.832 -1.230 1.00 0.00 C ATOM 0 H ILE A 47 -3.573 -4.864 -5.160 1.00 0.00 H new ATOM 0 HA ILE A 47 -4.969 -2.891 -3.785 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.046 -3.694 -3.808 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -4.374 -4.246 -1.932 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.556 -5.404 -2.961 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.775 -2.428 -1.723 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.148 -1.374 -3.108 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.415 -1.765 -1.921 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.848 -5.649 -0.631 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.482 -5.128 -1.646 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.313 -3.952 -0.601 1.00 0.00 H new ATOM 370 N LEU A 48 -2.782 -1.776 -5.984 1.00 0.00 N ATOM 371 CA LEU A 48 -2.330 -0.587 -6.698 1.00 0.00 C ATOM 372 C LEU A 48 -3.454 0.088 -7.415 1.00 0.00 C ATOM 373 O LEU A 48 -3.568 1.295 -7.365 1.00 0.00 O ATOM 374 CB LEU A 48 -1.237 -0.929 -7.696 1.00 0.00 C ATOM 375 CG LEU A 48 0.158 -1.125 -7.136 1.00 0.00 C ATOM 376 CD1 LEU A 48 1.067 -1.682 -8.213 1.00 0.00 C ATOM 377 CD2 LEU A 48 0.710 0.203 -6.625 1.00 0.00 C ATOM 0 H LEU A 48 -2.327 -2.640 -6.279 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.933 0.096 -5.947 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.526 -1.841 -8.218 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.196 -0.135 -8.442 1.00 0.00 H new ATOM 0 HG LEU A 48 0.112 -1.829 -6.305 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.069 -1.822 -7.807 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.678 -2.640 -8.557 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.109 -0.985 -9.050 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.712 0.051 -6.225 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.752 0.919 -7.445 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.061 0.589 -5.839 1.00 0.00 H new ATOM 389 N THR A 49 -4.292 -0.689 -8.041 1.00 0.00 N ATOM 390 CA THR A 49 -5.386 -0.150 -8.793 1.00 0.00 C ATOM 391 C THR A 49 -6.398 0.562 -7.888 1.00 0.00 C ATOM 392 O THR A 49 -6.803 1.692 -8.168 1.00 0.00 O ATOM 393 CB THR A 49 -6.081 -1.269 -9.548 1.00 0.00 C ATOM 394 OG1 THR A 49 -5.122 -1.943 -10.385 1.00 0.00 O ATOM 395 CG2 THR A 49 -7.209 -0.712 -10.383 1.00 0.00 C ATOM 0 H THR A 49 -4.236 -1.707 -8.044 1.00 0.00 H new ATOM 0 HA THR A 49 -4.985 0.584 -9.492 1.00 0.00 H new ATOM 0 HB THR A 49 -6.501 -1.981 -8.837 1.00 0.00 H new ATOM 0 HG1 THR A 49 -4.679 -2.650 -9.871 1.00 0.00 H new ATOM 0 HG21 THR A 49 -7.700 -1.524 -10.920 1.00 0.00 H new ATOM 0 HG22 THR A 49 -7.932 -0.217 -9.734 1.00 0.00 H new ATOM 0 HG23 THR A 49 -6.811 0.008 -11.099 1.00 0.00 H new ATOM 403 N VAL A 50 -6.747 -0.080 -6.793 1.00 0.00 N ATOM 404 CA VAL A 50 -7.726 0.455 -5.863 1.00 0.00 C ATOM 405 C VAL A 50 -7.178 1.699 -5.172 1.00 0.00 C ATOM 406 O VAL A 50 -7.834 2.735 -5.104 1.00 0.00 O ATOM 407 CB VAL A 50 -8.132 -0.609 -4.816 1.00 0.00 C ATOM 408 CG1 VAL A 50 -9.157 -0.059 -3.853 1.00 0.00 C ATOM 409 CG2 VAL A 50 -8.674 -1.849 -5.509 1.00 0.00 C ATOM 0 H VAL A 50 -6.363 -0.985 -6.521 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.616 0.732 -6.428 1.00 0.00 H new ATOM 0 HB VAL A 50 -7.243 -0.881 -4.247 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.424 -0.828 -3.128 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.741 0.803 -3.331 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -10.047 0.246 -4.404 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -8.956 -2.590 -4.761 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.548 -1.581 -6.102 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -7.907 -2.266 -6.161 1.00 0.00 H new ATOM 419 N PHE A 51 -5.947 1.592 -4.727 1.00 0.00 N ATOM 420 CA PHE A 51 -5.256 2.641 -4.041 1.00 0.00 C ATOM 421 C PHE A 51 -5.027 3.854 -4.938 1.00 0.00 C ATOM 422 O PHE A 51 -4.979 4.989 -4.479 1.00 0.00 O ATOM 423 CB PHE A 51 -3.976 2.090 -3.416 1.00 0.00 C ATOM 424 CG PHE A 51 -4.244 1.275 -2.141 1.00 0.00 C ATOM 425 CD1 PHE A 51 -5.166 0.234 -2.120 1.00 0.00 C ATOM 426 CD2 PHE A 51 -3.582 1.568 -0.968 1.00 0.00 C ATOM 427 CE1 PHE A 51 -5.408 -0.483 -0.971 1.00 0.00 C ATOM 428 CE2 PHE A 51 -3.819 0.858 0.177 1.00 0.00 C ATOM 429 CZ PHE A 51 -4.728 -0.168 0.186 1.00 0.00 C ATOM 0 H PHE A 51 -5.389 0.745 -4.839 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.881 3.010 -3.228 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -3.462 1.461 -4.143 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.306 2.917 -3.180 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -5.702 -0.016 -3.023 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.863 2.373 -0.953 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.127 -1.289 -0.975 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.285 1.108 1.082 1.00 0.00 H new ATOM 0 HZ PHE A 51 -4.910 -0.725 1.093 1.00 0.00 H new ATOM 439 N SER A 52 -4.990 3.617 -6.230 1.00 0.00 N ATOM 440 CA SER A 52 -4.846 4.681 -7.192 1.00 0.00 C ATOM 441 C SER A 52 -6.094 5.561 -7.293 1.00 0.00 C ATOM 442 O SER A 52 -6.013 6.685 -7.772 1.00 0.00 O ATOM 443 CB SER A 52 -4.465 4.141 -8.541 1.00 0.00 C ATOM 444 OG SER A 52 -3.175 3.593 -8.519 1.00 0.00 O ATOM 0 H SER A 52 -5.059 2.685 -6.640 1.00 0.00 H new ATOM 0 HA SER A 52 -4.039 5.318 -6.830 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.182 3.379 -8.847 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.512 4.939 -9.282 1.00 0.00 H new ATOM 0 HG SER A 52 -3.174 2.780 -7.972 1.00 0.00 H new ATOM 450 N GLU A 53 -7.238 5.070 -6.845 1.00 0.00 N ATOM 451 CA GLU A 53 -8.436 5.901 -6.844 1.00 0.00 C ATOM 452 C GLU A 53 -8.325 6.973 -5.736 1.00 0.00 C ATOM 453 O GLU A 53 -8.960 8.039 -5.794 1.00 0.00 O ATOM 454 CB GLU A 53 -9.719 5.043 -6.690 1.00 0.00 C ATOM 455 CG GLU A 53 -11.013 5.860 -6.694 1.00 0.00 C ATOM 456 CD GLU A 53 -12.278 5.029 -6.700 1.00 0.00 C ATOM 457 OE1 GLU A 53 -12.537 4.293 -5.712 1.00 0.00 O ATOM 458 OE2 GLU A 53 -13.085 5.181 -7.645 1.00 0.00 O ATOM 0 H GLU A 53 -7.365 4.124 -6.485 1.00 0.00 H new ATOM 0 HA GLU A 53 -8.514 6.408 -7.806 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -9.757 4.315 -7.500 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.659 4.480 -5.759 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -11.022 6.507 -5.817 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -11.015 6.509 -7.569 1.00 0.00 H new ATOM 465 N TYR A 54 -7.470 6.712 -4.763 1.00 0.00 N ATOM 466 CA TYR A 54 -7.283 7.613 -3.644 1.00 0.00 C ATOM 467 C TYR A 54 -6.121 8.564 -3.872 1.00 0.00 C ATOM 468 O TYR A 54 -6.020 9.619 -3.232 1.00 0.00 O ATOM 469 CB TYR A 54 -7.074 6.819 -2.388 1.00 0.00 C ATOM 470 CG TYR A 54 -8.195 5.854 -2.158 1.00 0.00 C ATOM 471 CD1 TYR A 54 -9.463 6.292 -1.829 1.00 0.00 C ATOM 472 CD2 TYR A 54 -7.982 4.511 -2.280 1.00 0.00 C ATOM 473 CE1 TYR A 54 -10.480 5.394 -1.623 1.00 0.00 C ATOM 474 CE2 TYR A 54 -8.984 3.607 -2.082 1.00 0.00 C ATOM 475 CZ TYR A 54 -10.232 4.050 -1.752 1.00 0.00 C ATOM 476 OH TYR A 54 -11.229 3.148 -1.529 1.00 0.00 O ATOM 0 H TYR A 54 -6.890 5.874 -4.728 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.182 8.222 -3.545 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -6.131 6.275 -2.452 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -6.994 7.496 -1.537 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.656 7.350 -1.733 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -6.996 4.156 -2.540 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -11.468 5.742 -1.361 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -8.791 2.549 -2.186 1.00 0.00 H new ATOM 0 HH TYR A 54 -12.053 3.457 -1.961 1.00 0.00 H new ATOM 486 N GLY A 55 -5.246 8.199 -4.772 1.00 0.00 N ATOM 487 CA GLY A 55 -4.129 9.027 -5.079 1.00 0.00 C ATOM 488 C GLY A 55 -3.119 8.297 -5.885 1.00 0.00 C ATOM 489 O GLY A 55 -3.455 7.355 -6.590 1.00 0.00 O ATOM 0 H GLY A 55 -5.293 7.329 -5.302 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.466 9.907 -5.626 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.672 9.382 -4.155 1.00 0.00 H new ATOM 493 N VAL A 56 -1.893 8.700 -5.773 1.00 0.00 N ATOM 494 CA VAL A 56 -0.830 8.111 -6.530 1.00 0.00 C ATOM 495 C VAL A 56 0.021 7.218 -5.639 1.00 0.00 C ATOM 496 O VAL A 56 0.707 7.707 -4.724 1.00 0.00 O ATOM 497 CB VAL A 56 0.066 9.195 -7.180 1.00 0.00 C ATOM 498 CG1 VAL A 56 1.212 8.562 -7.962 1.00 0.00 C ATOM 499 CG2 VAL A 56 -0.758 10.086 -8.089 1.00 0.00 C ATOM 0 H VAL A 56 -1.598 9.452 -5.150 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.281 7.513 -7.322 1.00 0.00 H new ATOM 0 HB VAL A 56 0.493 9.802 -6.382 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.825 9.346 -8.408 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.824 7.962 -7.289 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.808 7.926 -8.749 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -0.114 10.842 -8.538 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.212 9.483 -8.875 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.541 10.574 -7.508 1.00 0.00 H new ATOM 509 N PRO A 57 -0.043 5.903 -5.846 1.00 0.00 N ATOM 510 CA PRO A 57 0.804 4.980 -5.136 1.00 0.00 C ATOM 511 C PRO A 57 2.201 4.995 -5.762 1.00 0.00 C ATOM 512 O PRO A 57 2.347 4.972 -6.993 1.00 0.00 O ATOM 513 CB PRO A 57 0.119 3.630 -5.377 1.00 0.00 C ATOM 514 CG PRO A 57 -0.561 3.777 -6.686 1.00 0.00 C ATOM 515 CD PRO A 57 -0.955 5.222 -6.790 1.00 0.00 C ATOM 0 HA PRO A 57 0.926 5.210 -4.078 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.844 2.817 -5.398 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.594 3.401 -4.585 1.00 0.00 H new ATOM 0 HG2 PRO A 57 0.102 3.494 -7.504 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.436 3.129 -6.746 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -0.833 5.598 -7.806 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -1.999 5.373 -6.517 1.00 0.00 H new ATOM 523 N VAL A 58 3.217 5.021 -4.949 1.00 0.00 N ATOM 524 CA VAL A 58 4.564 5.095 -5.483 1.00 0.00 C ATOM 525 C VAL A 58 5.342 3.830 -5.205 1.00 0.00 C ATOM 526 O VAL A 58 6.346 3.540 -5.873 1.00 0.00 O ATOM 527 CB VAL A 58 5.348 6.336 -4.969 1.00 0.00 C ATOM 528 CG1 VAL A 58 4.684 7.623 -5.404 1.00 0.00 C ATOM 529 CG2 VAL A 58 5.494 6.322 -3.469 1.00 0.00 C ATOM 0 H VAL A 58 3.152 4.993 -3.931 1.00 0.00 H new ATOM 0 HA VAL A 58 4.453 5.205 -6.562 1.00 0.00 H new ATOM 0 HB VAL A 58 6.343 6.284 -5.412 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.256 8.472 -5.029 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.646 7.663 -6.493 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.671 7.663 -5.004 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.047 7.205 -3.149 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.507 6.325 -3.007 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.034 5.425 -3.164 1.00 0.00 H new ATOM 539 N ASP A 59 4.887 3.073 -4.230 1.00 0.00 N ATOM 540 CA ASP A 59 5.536 1.834 -3.865 1.00 0.00 C ATOM 541 C ASP A 59 4.564 0.966 -3.117 1.00 0.00 C ATOM 542 O ASP A 59 3.767 1.483 -2.322 1.00 0.00 O ATOM 543 CB ASP A 59 6.759 2.098 -2.994 1.00 0.00 C ATOM 544 CG ASP A 59 7.561 0.855 -2.742 1.00 0.00 C ATOM 545 OD1 ASP A 59 7.945 0.173 -3.723 1.00 0.00 O ATOM 546 OD2 ASP A 59 7.863 0.569 -1.573 1.00 0.00 O ATOM 0 H ASP A 59 4.063 3.297 -3.672 1.00 0.00 H new ATOM 0 HA ASP A 59 5.863 1.330 -4.774 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.391 2.843 -3.476 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.439 2.520 -2.041 1.00 0.00 H new ATOM 551 N VAL A 60 4.601 -0.320 -3.382 1.00 0.00 N ATOM 552 CA VAL A 60 3.721 -1.268 -2.742 1.00 0.00 C ATOM 553 C VAL A 60 4.469 -2.590 -2.492 1.00 0.00 C ATOM 554 O VAL A 60 5.305 -3.013 -3.312 1.00 0.00 O ATOM 555 CB VAL A 60 2.444 -1.526 -3.610 1.00 0.00 C ATOM 556 CG1 VAL A 60 2.788 -2.204 -4.928 1.00 0.00 C ATOM 557 CG2 VAL A 60 1.383 -2.312 -2.846 1.00 0.00 C ATOM 0 H VAL A 60 5.246 -0.739 -4.052 1.00 0.00 H new ATOM 0 HA VAL A 60 3.401 -0.849 -1.788 1.00 0.00 H new ATOM 0 HB VAL A 60 2.019 -0.549 -3.842 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.876 -2.366 -5.503 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.467 -1.569 -5.497 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.267 -3.163 -4.730 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.515 -2.468 -3.486 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.791 -3.277 -2.546 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.084 -1.753 -1.959 1.00 0.00 H new ATOM 567 N ILE A 61 4.283 -3.141 -1.318 1.00 0.00 N ATOM 568 CA ILE A 61 4.790 -4.444 -0.971 1.00 0.00 C ATOM 569 C ILE A 61 3.649 -5.332 -0.552 1.00 0.00 C ATOM 570 O ILE A 61 2.868 -4.960 0.329 1.00 0.00 O ATOM 571 CB ILE A 61 5.823 -4.367 0.169 1.00 0.00 C ATOM 572 CG1 ILE A 61 7.023 -3.568 -0.286 1.00 0.00 C ATOM 573 CG2 ILE A 61 6.251 -5.763 0.644 1.00 0.00 C ATOM 574 CD1 ILE A 61 7.983 -3.292 0.808 1.00 0.00 C ATOM 0 H ILE A 61 3.766 -2.688 -0.564 1.00 0.00 H new ATOM 0 HA ILE A 61 5.286 -4.856 -1.850 1.00 0.00 H new ATOM 0 HB ILE A 61 5.357 -3.867 1.018 1.00 0.00 H new ATOM 0 HG12 ILE A 61 7.533 -4.111 -1.082 1.00 0.00 H new ATOM 0 HG13 ILE A 61 6.684 -2.623 -0.711 1.00 0.00 H new ATOM 0 HG21 ILE A 61 6.980 -5.666 1.448 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.379 -6.307 1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.698 -6.309 -0.187 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.822 -2.716 0.419 1.00 0.00 H new ATOM 0 HD12 ILE A 61 7.486 -2.723 1.594 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.349 -4.234 1.218 1.00 0.00 H new ATOM 586 N LEU A 62 3.524 -6.465 -1.166 1.00 0.00 N ATOM 587 CA LEU A 62 2.565 -7.418 -0.735 1.00 0.00 C ATOM 588 C LEU A 62 3.340 -8.398 0.100 1.00 0.00 C ATOM 589 O LEU A 62 4.282 -9.023 -0.397 1.00 0.00 O ATOM 590 CB LEU A 62 1.956 -8.161 -1.928 1.00 0.00 C ATOM 591 CG LEU A 62 0.506 -8.664 -1.776 1.00 0.00 C ATOM 592 CD1 LEU A 62 0.278 -9.460 -0.501 1.00 0.00 C ATOM 593 CD2 LEU A 62 -0.447 -7.516 -1.866 1.00 0.00 C ATOM 0 H LEU A 62 4.080 -6.750 -1.972 1.00 0.00 H new ATOM 0 HA LEU A 62 1.749 -6.939 -0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 62 1.996 -7.501 -2.794 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.590 -9.019 -2.152 1.00 0.00 H new ATOM 0 HG LEU A 62 0.321 -9.355 -2.599 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.762 -9.784 -0.456 1.00 0.00 H new ATOM 0 HD12 LEU A 62 0.931 -10.333 -0.495 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.501 -8.834 0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.468 -7.881 -1.758 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.231 -6.801 -1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.337 -7.027 -2.834 1.00 0.00 H new ATOM 605 N SER A 63 3.006 -8.517 1.334 1.00 0.00 N ATOM 606 CA SER A 63 3.684 -9.428 2.166 1.00 0.00 C ATOM 607 C SER A 63 3.105 -10.795 1.916 1.00 0.00 C ATOM 608 O SER A 63 1.913 -11.029 2.147 1.00 0.00 O ATOM 609 CB SER A 63 3.477 -8.990 3.586 1.00 0.00 C ATOM 610 OG SER A 63 3.851 -7.625 3.714 1.00 0.00 O ATOM 0 H SER A 63 2.261 -7.988 1.788 1.00 0.00 H new ATOM 0 HA SER A 63 4.755 -9.461 1.964 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.433 -9.122 3.871 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.072 -9.607 4.260 1.00 0.00 H new ATOM 0 HG SER A 63 3.764 -7.348 4.650 1.00 0.00 H new ATOM 616 N ARG A 64 3.915 -11.681 1.420 1.00 0.00 N ATOM 617 CA ARG A 64 3.477 -13.003 1.101 1.00 0.00 C ATOM 618 C ARG A 64 4.394 -13.990 1.735 1.00 0.00 C ATOM 619 O ARG A 64 5.596 -13.772 1.786 1.00 0.00 O ATOM 620 CB ARG A 64 3.442 -13.243 -0.412 1.00 0.00 C ATOM 621 CG ARG A 64 2.505 -12.334 -1.187 1.00 0.00 C ATOM 622 CD ARG A 64 2.457 -12.722 -2.645 1.00 0.00 C ATOM 623 NE ARG A 64 3.779 -12.670 -3.270 1.00 0.00 N ATOM 624 CZ ARG A 64 4.161 -13.419 -4.302 1.00 0.00 C ATOM 625 NH1 ARG A 64 3.314 -14.299 -4.834 1.00 0.00 N ATOM 626 NH2 ARG A 64 5.385 -13.279 -4.799 1.00 0.00 N ATOM 0 H ARG A 64 4.901 -11.505 1.225 1.00 0.00 H new ATOM 0 HA ARG A 64 2.463 -13.122 1.482 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.451 -13.121 -0.807 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.152 -14.278 -0.593 1.00 0.00 H new ATOM 0 HG2 ARG A 64 1.504 -12.388 -0.759 1.00 0.00 H new ATOM 0 HG3 ARG A 64 2.836 -11.300 -1.093 1.00 0.00 H new ATOM 0 HD2 ARG A 64 2.051 -13.729 -2.739 1.00 0.00 H new ATOM 0 HD3 ARG A 64 1.779 -12.054 -3.176 1.00 0.00 H new ATOM 0 HE ARG A 64 4.457 -12.012 -2.887 1.00 0.00 H new ATOM 0 HH11 ARG A 64 2.374 -14.398 -4.451 1.00 0.00 H new ATOM 0 HH12 ARG A 64 3.605 -14.874 -5.625 1.00 0.00 H new ATOM 0 HH21 ARG A 64 6.027 -12.600 -4.390 1.00 0.00 H new ATOM 0 HH22 ARG A 64 5.683 -13.850 -5.590 1.00 0.00 H new ATOM 640 N ASP A 65 3.830 -15.049 2.224 1.00 0.00 N ATOM 641 CA ASP A 65 4.577 -16.111 2.843 1.00 0.00 C ATOM 642 C ASP A 65 5.372 -16.841 1.786 1.00 0.00 C ATOM 643 O ASP A 65 4.799 -17.350 0.831 1.00 0.00 O ATOM 644 CB ASP A 65 3.626 -17.064 3.567 1.00 0.00 C ATOM 645 CG ASP A 65 4.304 -18.317 3.987 1.00 0.00 C ATOM 646 OD1 ASP A 65 5.011 -18.330 5.000 1.00 0.00 O ATOM 647 OD2 ASP A 65 4.161 -19.304 3.280 1.00 0.00 O ATOM 0 H ASP A 65 2.823 -15.208 2.207 1.00 0.00 H new ATOM 0 HA ASP A 65 5.267 -15.698 3.579 1.00 0.00 H new ATOM 0 HB2 ASP A 65 3.211 -16.565 4.443 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.789 -17.307 2.912 1.00 0.00 H new ATOM 652 N GLU A 66 6.684 -16.860 1.942 1.00 0.00 N ATOM 653 CA GLU A 66 7.589 -17.483 0.955 1.00 0.00 C ATOM 654 C GLU A 66 7.351 -18.979 0.766 1.00 0.00 C ATOM 655 O GLU A 66 7.772 -19.553 -0.233 1.00 0.00 O ATOM 656 CB GLU A 66 9.075 -17.221 1.268 1.00 0.00 C ATOM 657 CG GLU A 66 9.557 -17.716 2.625 1.00 0.00 C ATOM 658 CD GLU A 66 11.060 -17.604 2.764 1.00 0.00 C ATOM 659 OE1 GLU A 66 11.568 -16.541 3.196 1.00 0.00 O ATOM 660 OE2 GLU A 66 11.767 -18.582 2.433 1.00 0.00 O ATOM 0 H GLU A 66 7.162 -16.451 2.745 1.00 0.00 H new ATOM 0 HA GLU A 66 7.342 -16.994 0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.680 -17.692 0.493 1.00 0.00 H new ATOM 0 HB3 GLU A 66 9.257 -16.148 1.206 1.00 0.00 H new ATOM 0 HG2 GLU A 66 9.075 -17.139 3.414 1.00 0.00 H new ATOM 0 HG3 GLU A 66 9.256 -18.755 2.761 1.00 0.00 H new ATOM 667 N ASN A 67 6.692 -19.596 1.708 1.00 0.00 N ATOM 668 CA ASN A 67 6.471 -21.033 1.660 1.00 0.00 C ATOM 669 C ASN A 67 5.286 -21.362 0.772 1.00 0.00 C ATOM 670 O ASN A 67 5.363 -22.235 -0.091 1.00 0.00 O ATOM 671 CB ASN A 67 6.253 -21.611 3.070 1.00 0.00 C ATOM 672 CG ASN A 67 7.352 -21.225 4.042 1.00 0.00 C ATOM 673 OD1 ASN A 67 8.375 -21.898 4.150 1.00 0.00 O ATOM 674 ND2 ASN A 67 7.139 -20.154 4.775 1.00 0.00 N ATOM 0 H ASN A 67 6.294 -19.133 2.525 1.00 0.00 H new ATOM 0 HA ASN A 67 7.365 -21.492 1.238 1.00 0.00 H new ATOM 0 HB2 ASN A 67 5.295 -21.263 3.456 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.196 -22.698 3.007 1.00 0.00 H new ATOM 0 HD21 ASN A 67 7.835 -19.858 5.460 1.00 0.00 H new ATOM 0 HD22 ASN A 67 6.278 -19.619 4.659 1.00 0.00 H new ATOM 681 N THR A 68 4.204 -20.653 0.982 1.00 0.00 N ATOM 682 CA THR A 68 2.962 -20.876 0.260 1.00 0.00 C ATOM 683 C THR A 68 2.856 -20.010 -1.002 1.00 0.00 C ATOM 684 O THR A 68 2.123 -20.340 -1.949 1.00 0.00 O ATOM 685 CB THR A 68 1.779 -20.531 1.187 1.00 0.00 C ATOM 686 OG1 THR A 68 1.921 -19.172 1.648 1.00 0.00 O ATOM 687 CG2 THR A 68 1.778 -21.420 2.399 1.00 0.00 C ATOM 0 H THR A 68 4.154 -19.896 1.664 1.00 0.00 H new ATOM 0 HA THR A 68 2.942 -21.922 -0.046 1.00 0.00 H new ATOM 0 HB THR A 68 0.854 -20.667 0.626 1.00 0.00 H new ATOM 0 HG1 THR A 68 2.603 -19.135 2.351 1.00 0.00 H new ATOM 0 HG21 THR A 68 0.936 -21.160 3.040 1.00 0.00 H new ATOM 0 HG22 THR A 68 1.689 -22.461 2.087 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.709 -21.285 2.950 1.00 0.00 H new ATOM 695 N GLY A 69 3.581 -18.911 -1.011 1.00 0.00 N ATOM 696 CA GLY A 69 3.536 -17.984 -2.117 1.00 0.00 C ATOM 697 C GLY A 69 2.270 -17.134 -2.089 1.00 0.00 C ATOM 698 O GLY A 69 1.943 -16.459 -3.068 1.00 0.00 O ATOM 0 H GLY A 69 4.212 -18.639 -0.258 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.411 -17.335 -2.084 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.584 -18.535 -3.056 1.00 0.00 H new ATOM 702 N GLU A 70 1.561 -17.163 -0.972 1.00 0.00 N ATOM 703 CA GLU A 70 0.304 -16.451 -0.837 1.00 0.00 C ATOM 704 C GLU A 70 0.435 -15.335 0.182 1.00 0.00 C ATOM 705 O GLU A 70 1.350 -15.358 1.012 1.00 0.00 O ATOM 706 CB GLU A 70 -0.809 -17.416 -0.426 1.00 0.00 C ATOM 707 CG GLU A 70 -1.028 -18.546 -1.413 1.00 0.00 C ATOM 708 CD GLU A 70 -2.112 -19.492 -0.993 1.00 0.00 C ATOM 709 OE1 GLU A 70 -3.302 -19.126 -1.067 1.00 0.00 O ATOM 710 OE2 GLU A 70 -1.801 -20.636 -0.614 1.00 0.00 O ATOM 0 H GLU A 70 1.841 -17.679 -0.138 1.00 0.00 H new ATOM 0 HA GLU A 70 0.048 -16.012 -1.801 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -0.570 -17.838 0.550 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -1.739 -16.858 -0.313 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -1.278 -18.126 -2.387 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -0.097 -19.100 -1.534 1.00 0.00 H new ATOM 717 N SER A 71 -0.454 -14.360 0.084 1.00 0.00 N ATOM 718 CA SER A 71 -0.500 -13.203 0.972 1.00 0.00 C ATOM 719 C SER A 71 -0.503 -13.609 2.445 1.00 0.00 C ATOM 720 O SER A 71 -1.143 -14.576 2.840 1.00 0.00 O ATOM 721 CB SER A 71 -1.750 -12.360 0.661 1.00 0.00 C ATOM 722 OG SER A 71 -1.821 -11.192 1.477 1.00 0.00 O ATOM 0 H SER A 71 -1.182 -14.348 -0.631 1.00 0.00 H new ATOM 0 HA SER A 71 0.401 -12.615 0.795 1.00 0.00 H new ATOM 0 HB2 SER A 71 -1.739 -12.069 -0.389 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.643 -12.965 0.815 1.00 0.00 H new ATOM 0 HG SER A 71 -0.925 -10.806 1.574 1.00 0.00 H new ATOM 728 N GLN A 72 0.221 -12.858 3.243 1.00 0.00 N ATOM 729 CA GLN A 72 0.289 -13.076 4.667 1.00 0.00 C ATOM 730 C GLN A 72 -0.884 -12.423 5.357 1.00 0.00 C ATOM 731 O GLN A 72 -1.040 -12.509 6.583 1.00 0.00 O ATOM 732 CB GLN A 72 1.574 -12.518 5.217 1.00 0.00 C ATOM 733 CG GLN A 72 2.782 -13.195 4.658 1.00 0.00 C ATOM 734 CD GLN A 72 4.009 -12.869 5.415 1.00 0.00 C ATOM 735 OE1 GLN A 72 4.692 -11.895 5.128 1.00 0.00 O ATOM 736 NE2 GLN A 72 4.321 -13.692 6.358 1.00 0.00 N ATOM 0 H GLN A 72 0.784 -12.072 2.917 1.00 0.00 H new ATOM 0 HA GLN A 72 0.256 -14.150 4.852 1.00 0.00 H new ATOM 0 HB2 GLN A 72 1.626 -11.452 4.997 1.00 0.00 H new ATOM 0 HB3 GLN A 72 1.575 -12.620 6.302 1.00 0.00 H new ATOM 0 HG2 GLN A 72 2.628 -14.274 4.667 1.00 0.00 H new ATOM 0 HG3 GLN A 72 2.911 -12.901 3.617 1.00 0.00 H new ATOM 0 HE21 GLN A 72 3.718 -14.490 6.559 1.00 0.00 H new ATOM 0 HE22 GLN A 72 5.171 -13.545 6.903 1.00 0.00 H new ATOM 745 N GLY A 73 -1.697 -11.747 4.574 1.00 0.00 N ATOM 746 CA GLY A 73 -2.848 -11.104 5.104 1.00 0.00 C ATOM 747 C GLY A 73 -2.609 -9.665 5.414 1.00 0.00 C ATOM 748 O GLY A 73 -3.439 -9.026 6.051 1.00 0.00 O ATOM 0 H GLY A 73 -1.569 -11.637 3.568 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.667 -11.187 4.390 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.163 -11.620 6.011 1.00 0.00 H new ATOM 752 N PHE A 74 -1.505 -9.135 4.957 1.00 0.00 N ATOM 753 CA PHE A 74 -1.201 -7.748 5.162 1.00 0.00 C ATOM 754 C PHE A 74 -0.320 -7.280 4.040 1.00 0.00 C ATOM 755 O PHE A 74 0.318 -8.106 3.368 1.00 0.00 O ATOM 756 CB PHE A 74 -0.546 -7.477 6.540 1.00 0.00 C ATOM 757 CG PHE A 74 0.860 -7.989 6.724 1.00 0.00 C ATOM 758 CD1 PHE A 74 1.103 -9.313 7.026 1.00 0.00 C ATOM 759 CD2 PHE A 74 1.935 -7.124 6.607 1.00 0.00 C ATOM 760 CE1 PHE A 74 2.395 -9.771 7.203 1.00 0.00 C ATOM 761 CE2 PHE A 74 3.227 -7.574 6.785 1.00 0.00 C ATOM 762 CZ PHE A 74 3.456 -8.903 7.082 1.00 0.00 C ATOM 0 H PHE A 74 -0.797 -9.651 4.435 1.00 0.00 H new ATOM 0 HA PHE A 74 -2.135 -7.186 5.163 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.543 -6.401 6.712 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -1.175 -7.921 7.311 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.275 -9.999 7.125 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.760 -6.084 6.374 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.572 -10.811 7.436 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.057 -6.889 6.692 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.466 -9.261 7.219 1.00 0.00 H new ATOM 772 N ALA A 75 -0.311 -6.001 3.803 1.00 0.00 N ATOM 773 CA ALA A 75 0.493 -5.423 2.775 1.00 0.00 C ATOM 774 C ALA A 75 0.828 -3.982 3.119 1.00 0.00 C ATOM 775 O ALA A 75 0.293 -3.418 4.088 1.00 0.00 O ATOM 776 CB ALA A 75 -0.231 -5.497 1.454 1.00 0.00 C ATOM 0 H ALA A 75 -0.869 -5.326 4.325 1.00 0.00 H new ATOM 0 HA ALA A 75 1.425 -5.983 2.695 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.389 -5.054 0.674 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.434 -6.539 1.208 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.172 -4.951 1.524 1.00 0.00 H new ATOM 782 N TYR A 76 1.680 -3.398 2.328 1.00 0.00 N ATOM 783 CA TYR A 76 2.145 -2.049 2.510 1.00 0.00 C ATOM 784 C TYR A 76 2.063 -1.289 1.199 1.00 0.00 C ATOM 785 O TYR A 76 2.308 -1.860 0.150 1.00 0.00 O ATOM 786 CB TYR A 76 3.604 -2.090 3.009 1.00 0.00 C ATOM 787 CG TYR A 76 4.437 -0.876 2.653 1.00 0.00 C ATOM 788 CD1 TYR A 76 4.269 0.339 3.291 1.00 0.00 C ATOM 789 CD2 TYR A 76 5.391 -0.961 1.654 1.00 0.00 C ATOM 790 CE1 TYR A 76 5.036 1.427 2.942 1.00 0.00 C ATOM 791 CE2 TYR A 76 6.159 0.111 1.301 1.00 0.00 C ATOM 792 CZ TYR A 76 5.987 1.301 1.940 1.00 0.00 C ATOM 793 OH TYR A 76 6.768 2.370 1.581 1.00 0.00 O ATOM 0 H TYR A 76 2.084 -3.859 1.513 1.00 0.00 H new ATOM 0 HA TYR A 76 1.520 -1.539 3.243 1.00 0.00 H new ATOM 0 HB2 TYR A 76 3.598 -2.203 4.093 1.00 0.00 H new ATOM 0 HB3 TYR A 76 4.088 -2.977 2.599 1.00 0.00 H new ATOM 0 HD1 TYR A 76 3.528 0.435 4.071 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.532 -1.900 1.140 1.00 0.00 H new ATOM 0 HE1 TYR A 76 4.898 2.373 3.445 1.00 0.00 H new ATOM 0 HE2 TYR A 76 6.898 0.016 0.520 1.00 0.00 H new ATOM 0 HH TYR A 76 7.380 2.102 0.864 1.00 0.00 H new ATOM 803 N LEU A 77 1.747 -0.014 1.271 1.00 0.00 N ATOM 804 CA LEU A 77 1.724 0.843 0.119 1.00 0.00 C ATOM 805 C LEU A 77 1.974 2.255 0.600 1.00 0.00 C ATOM 806 O LEU A 77 1.549 2.615 1.686 1.00 0.00 O ATOM 807 CB LEU A 77 0.388 0.711 -0.683 1.00 0.00 C ATOM 808 CG LEU A 77 0.314 1.454 -2.049 1.00 0.00 C ATOM 809 CD1 LEU A 77 -0.694 0.792 -2.963 1.00 0.00 C ATOM 810 CD2 LEU A 77 -0.105 2.889 -1.860 1.00 0.00 C ATOM 0 H LEU A 77 1.497 0.455 2.142 1.00 0.00 H new ATOM 0 HA LEU A 77 2.504 0.551 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.202 -0.348 -0.862 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.424 1.075 -0.053 1.00 0.00 H new ATOM 0 HG LEU A 77 1.309 1.412 -2.492 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.730 1.326 -3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.400 -0.243 -3.140 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.679 0.815 -2.496 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.149 3.386 -2.829 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.088 2.922 -1.390 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.619 3.399 -1.224 1.00 0.00 H new ATOM 822 N LYS A 78 2.731 3.011 -0.139 1.00 0.00 N ATOM 823 CA LYS A 78 2.975 4.378 0.220 1.00 0.00 C ATOM 824 C LYS A 78 2.568 5.267 -0.936 1.00 0.00 C ATOM 825 O LYS A 78 2.721 4.886 -2.124 1.00 0.00 O ATOM 826 CB LYS A 78 4.436 4.654 0.623 1.00 0.00 C ATOM 827 CG LYS A 78 5.423 4.580 -0.512 1.00 0.00 C ATOM 828 CD LYS A 78 6.754 5.237 -0.171 1.00 0.00 C ATOM 829 CE LYS A 78 6.608 6.743 0.079 1.00 0.00 C ATOM 830 NZ LYS A 78 7.901 7.390 0.420 1.00 0.00 N ATOM 0 H LYS A 78 3.191 2.704 -0.996 1.00 0.00 H new ATOM 0 HA LYS A 78 2.376 4.597 1.104 1.00 0.00 H new ATOM 0 HB2 LYS A 78 4.494 5.645 1.074 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.729 3.937 1.390 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.593 3.536 -0.774 1.00 0.00 H new ATOM 0 HG3 LYS A 78 4.998 5.063 -1.391 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.175 4.762 0.715 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.458 5.072 -0.986 1.00 0.00 H new ATOM 0 HE2 LYS A 78 6.191 7.217 -0.810 1.00 0.00 H new ATOM 0 HE3 LYS A 78 5.898 6.906 0.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 7.817 8.419 0.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.146 7.177 1.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.647 7.027 -0.207 1.00 0.00 H new ATOM 844 N TYR A 79 2.043 6.401 -0.617 1.00 0.00 N ATOM 845 CA TYR A 79 1.575 7.337 -1.609 1.00 0.00 C ATOM 846 C TYR A 79 2.538 8.459 -1.803 1.00 0.00 C ATOM 847 O TYR A 79 3.453 8.659 -0.999 1.00 0.00 O ATOM 848 CB TYR A 79 0.235 7.922 -1.231 1.00 0.00 C ATOM 849 CG TYR A 79 -0.915 6.982 -1.337 1.00 0.00 C ATOM 850 CD1 TYR A 79 -1.097 5.973 -0.423 1.00 0.00 C ATOM 851 CD2 TYR A 79 -1.837 7.126 -2.348 1.00 0.00 C ATOM 852 CE1 TYR A 79 -2.159 5.133 -0.509 1.00 0.00 C ATOM 853 CE2 TYR A 79 -2.911 6.297 -2.440 1.00 0.00 C ATOM 854 CZ TYR A 79 -3.070 5.304 -1.520 1.00 0.00 C ATOM 855 OH TYR A 79 -4.136 4.490 -1.603 1.00 0.00 O ATOM 0 H TYR A 79 1.921 6.717 0.345 1.00 0.00 H new ATOM 0 HA TYR A 79 1.480 6.774 -2.537 1.00 0.00 H new ATOM 0 HB2 TYR A 79 0.292 8.289 -0.206 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.039 8.785 -1.868 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.383 5.846 0.377 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.706 7.909 -3.080 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -2.286 4.338 0.211 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -3.631 6.424 -3.235 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.954 3.661 -1.113 1.00 0.00 H new ATOM 865 N GLU A 80 2.340 9.167 -2.880 1.00 0.00 N ATOM 866 CA GLU A 80 3.098 10.344 -3.194 1.00 0.00 C ATOM 867 C GLU A 80 2.653 11.490 -2.273 1.00 0.00 C ATOM 868 O GLU A 80 3.469 12.310 -1.827 1.00 0.00 O ATOM 869 CB GLU A 80 2.852 10.709 -4.657 1.00 0.00 C ATOM 870 CG GLU A 80 3.637 11.894 -5.163 1.00 0.00 C ATOM 871 CD GLU A 80 3.291 12.223 -6.584 1.00 0.00 C ATOM 872 OE1 GLU A 80 2.320 12.955 -6.807 1.00 0.00 O ATOM 873 OE2 GLU A 80 3.992 11.761 -7.515 1.00 0.00 O ATOM 0 H GLU A 80 1.633 8.936 -3.578 1.00 0.00 H new ATOM 0 HA GLU A 80 4.163 10.165 -3.043 1.00 0.00 H new ATOM 0 HB2 GLU A 80 3.091 9.844 -5.276 1.00 0.00 H new ATOM 0 HB3 GLU A 80 1.790 10.913 -4.790 1.00 0.00 H new ATOM 0 HG2 GLU A 80 3.438 12.759 -4.530 1.00 0.00 H new ATOM 0 HG3 GLU A 80 4.704 11.683 -5.088 1.00 0.00 H new ATOM 880 N ASP A 81 1.365 11.518 -1.956 1.00 0.00 N ATOM 881 CA ASP A 81 0.801 12.575 -1.124 1.00 0.00 C ATOM 882 C ASP A 81 0.082 11.959 0.082 1.00 0.00 C ATOM 883 O ASP A 81 -0.630 10.959 -0.055 1.00 0.00 O ATOM 884 CB ASP A 81 -0.200 13.386 -1.949 1.00 0.00 C ATOM 885 CG ASP A 81 -0.527 14.732 -1.356 1.00 0.00 C ATOM 886 OD1 ASP A 81 -1.069 14.813 -0.242 1.00 0.00 O ATOM 887 OD2 ASP A 81 -0.232 15.758 -2.012 1.00 0.00 O ATOM 0 H ASP A 81 0.689 10.819 -2.263 1.00 0.00 H new ATOM 0 HA ASP A 81 1.603 13.224 -0.772 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.202 13.529 -2.952 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.121 12.812 -2.053 1.00 0.00 H new ATOM 892 N GLN A 82 0.269 12.549 1.249 1.00 0.00 N ATOM 893 CA GLN A 82 -0.340 12.073 2.492 1.00 0.00 C ATOM 894 C GLN A 82 -1.855 12.294 2.541 1.00 0.00 C ATOM 895 O GLN A 82 -2.552 11.687 3.339 1.00 0.00 O ATOM 896 CB GLN A 82 0.358 12.633 3.717 1.00 0.00 C ATOM 897 CG GLN A 82 1.823 12.300 3.751 1.00 0.00 C ATOM 898 CD GLN A 82 2.498 12.790 4.990 1.00 0.00 C ATOM 899 OE1 GLN A 82 2.089 13.773 5.593 1.00 0.00 O ATOM 900 NE2 GLN A 82 3.535 12.124 5.382 1.00 0.00 N ATOM 0 H GLN A 82 0.851 13.378 1.369 1.00 0.00 H new ATOM 0 HA GLN A 82 -0.195 10.993 2.505 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.235 13.716 3.737 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -0.121 12.241 4.614 1.00 0.00 H new ATOM 0 HG2 GLN A 82 1.947 11.220 3.678 1.00 0.00 H new ATOM 0 HG3 GLN A 82 2.311 12.737 2.880 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.847 11.309 4.854 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.041 12.414 6.219 1.00 0.00 H new ATOM 909 N ARG A 83 -2.357 13.198 1.727 1.00 0.00 N ATOM 910 CA ARG A 83 -3.798 13.401 1.624 1.00 0.00 C ATOM 911 C ARG A 83 -4.448 12.148 1.048 1.00 0.00 C ATOM 912 O ARG A 83 -5.567 11.784 1.378 1.00 0.00 O ATOM 913 CB ARG A 83 -4.121 14.613 0.786 1.00 0.00 C ATOM 914 CG ARG A 83 -3.670 15.924 1.397 1.00 0.00 C ATOM 915 CD ARG A 83 -3.856 17.052 0.413 1.00 0.00 C ATOM 916 NE ARG A 83 -3.030 16.848 -0.781 1.00 0.00 N ATOM 917 CZ ARG A 83 -3.249 17.381 -1.987 1.00 0.00 C ATOM 918 NH1 ARG A 83 -4.346 18.093 -2.223 1.00 0.00 N ATOM 919 NH2 ARG A 83 -2.372 17.177 -2.955 1.00 0.00 N ATOM 0 H ARG A 83 -1.797 13.804 1.127 1.00 0.00 H new ATOM 0 HA ARG A 83 -4.199 13.583 2.621 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.654 14.500 -0.192 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -5.198 14.652 0.622 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.240 16.126 2.304 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.622 15.856 1.688 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.905 17.120 0.126 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.592 17.998 0.885 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.214 16.244 -0.682 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.030 18.237 -1.480 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.504 18.496 -3.147 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.538 16.617 -2.778 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.530 17.579 -3.879 1.00 0.00 H new ATOM 933 N SER A 84 -3.735 11.521 0.172 1.00 0.00 N ATOM 934 CA SER A 84 -4.156 10.309 -0.456 1.00 0.00 C ATOM 935 C SER A 84 -4.224 9.137 0.533 1.00 0.00 C ATOM 936 O SER A 84 -5.122 8.302 0.435 1.00 0.00 O ATOM 937 CB SER A 84 -3.237 10.004 -1.606 1.00 0.00 C ATOM 938 OG SER A 84 -3.286 11.041 -2.557 1.00 0.00 O ATOM 0 H SER A 84 -2.818 11.845 -0.136 1.00 0.00 H new ATOM 0 HA SER A 84 -5.170 10.448 -0.831 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.217 9.882 -1.243 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.525 9.061 -2.071 1.00 0.00 H new ATOM 0 HG SER A 84 -3.900 11.739 -2.248 1.00 0.00 H new ATOM 944 N THR A 85 -3.284 9.069 1.481 1.00 0.00 N ATOM 945 CA THR A 85 -3.267 7.958 2.416 1.00 0.00 C ATOM 946 C THR A 85 -4.505 7.984 3.306 1.00 0.00 C ATOM 947 O THR A 85 -5.166 6.975 3.467 1.00 0.00 O ATOM 948 CB THR A 85 -1.998 7.954 3.291 1.00 0.00 C ATOM 949 OG1 THR A 85 -1.907 9.159 4.027 1.00 0.00 O ATOM 950 CG2 THR A 85 -0.765 7.825 2.450 1.00 0.00 C ATOM 0 H THR A 85 -2.543 9.758 1.614 1.00 0.00 H new ATOM 0 HA THR A 85 -3.267 7.044 1.821 1.00 0.00 H new ATOM 0 HB THR A 85 -2.069 7.102 3.967 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.129 9.121 4.622 1.00 0.00 H new ATOM 0 HG21 THR A 85 0.115 7.825 3.093 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.804 6.892 1.888 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.708 8.664 1.757 1.00 0.00 H new ATOM 958 N ILE A 86 -4.844 9.162 3.820 1.00 0.00 N ATOM 959 CA ILE A 86 -6.039 9.330 4.642 1.00 0.00 C ATOM 960 C ILE A 86 -7.295 9.031 3.846 1.00 0.00 C ATOM 961 O ILE A 86 -8.213 8.398 4.358 1.00 0.00 O ATOM 962 CB ILE A 86 -6.107 10.719 5.331 1.00 0.00 C ATOM 963 CG1 ILE A 86 -5.845 11.833 4.326 1.00 0.00 C ATOM 964 CG2 ILE A 86 -5.141 10.794 6.497 1.00 0.00 C ATOM 965 CD1 ILE A 86 -5.633 13.183 4.929 1.00 0.00 C ATOM 0 H ILE A 86 -4.306 10.018 3.682 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.972 8.600 5.449 1.00 0.00 H new ATOM 0 HB ILE A 86 -7.114 10.854 5.726 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -4.966 11.572 3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -6.687 11.887 3.636 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.208 11.777 6.963 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.395 10.028 7.229 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -4.125 10.631 6.139 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.454 13.911 4.138 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -6.519 13.472 5.494 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -4.771 13.152 5.596 1.00 0.00 H new ATOM 977 N LEU A 87 -7.310 9.455 2.580 1.00 0.00 N ATOM 978 CA LEU A 87 -8.420 9.134 1.672 1.00 0.00 C ATOM 979 C LEU A 87 -8.571 7.638 1.512 1.00 0.00 C ATOM 980 O LEU A 87 -9.678 7.105 1.567 1.00 0.00 O ATOM 981 CB LEU A 87 -8.200 9.755 0.288 1.00 0.00 C ATOM 982 CG LEU A 87 -8.528 11.227 0.143 1.00 0.00 C ATOM 983 CD1 LEU A 87 -8.157 11.721 -1.255 1.00 0.00 C ATOM 984 CD2 LEU A 87 -10.009 11.419 0.377 1.00 0.00 C ATOM 0 H LEU A 87 -6.571 10.019 2.160 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.326 9.549 2.115 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.155 9.610 0.012 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.800 9.200 -0.433 1.00 0.00 H new ATOM 0 HG LEU A 87 -7.956 11.800 0.873 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.399 12.780 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.089 11.578 -1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.718 11.158 -2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.259 12.475 0.276 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.571 10.841 -0.356 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.266 11.080 1.381 1.00 0.00 H new ATOM 996 N ALA A 88 -7.457 6.968 1.358 1.00 0.00 N ATOM 997 CA ALA A 88 -7.457 5.543 1.197 1.00 0.00 C ATOM 998 C ALA A 88 -7.869 4.857 2.474 1.00 0.00 C ATOM 999 O ALA A 88 -8.721 4.008 2.458 1.00 0.00 O ATOM 1000 CB ALA A 88 -6.110 5.054 0.701 1.00 0.00 C ATOM 0 H ALA A 88 -6.531 7.396 1.341 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.195 5.284 0.438 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.136 3.970 0.587 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.887 5.515 -0.261 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.337 5.325 1.420 1.00 0.00 H new ATOM 1006 N VAL A 89 -7.303 5.276 3.584 1.00 0.00 N ATOM 1007 CA VAL A 89 -7.625 4.689 4.875 1.00 0.00 C ATOM 1008 C VAL A 89 -9.122 4.826 5.182 1.00 0.00 C ATOM 1009 O VAL A 89 -9.787 3.855 5.458 1.00 0.00 O ATOM 1010 CB VAL A 89 -6.781 5.321 6.033 1.00 0.00 C ATOM 1011 CG1 VAL A 89 -7.216 4.785 7.383 1.00 0.00 C ATOM 1012 CG2 VAL A 89 -5.302 5.047 5.832 1.00 0.00 C ATOM 0 H VAL A 89 -6.612 6.026 3.623 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.371 3.631 4.814 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.952 6.397 6.012 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.612 5.242 8.167 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -8.267 5.024 7.548 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.082 3.703 7.405 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.735 5.495 6.648 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.130 3.971 5.819 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.978 5.478 4.885 1.00 0.00 H new ATOM 1022 N ASP A 90 -9.634 6.009 5.016 1.00 0.00 N ATOM 1023 CA ASP A 90 -11.022 6.338 5.371 1.00 0.00 C ATOM 1024 C ASP A 90 -12.033 5.627 4.487 1.00 0.00 C ATOM 1025 O ASP A 90 -13.128 5.317 4.927 1.00 0.00 O ATOM 1026 CB ASP A 90 -11.259 7.857 5.333 1.00 0.00 C ATOM 1027 CG ASP A 90 -12.667 8.262 5.754 1.00 0.00 C ATOM 1028 OD1 ASP A 90 -12.993 8.184 6.963 1.00 0.00 O ATOM 1029 OD2 ASP A 90 -13.463 8.706 4.895 1.00 0.00 O ATOM 0 H ASP A 90 -9.112 6.795 4.628 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.172 5.982 6.390 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.538 8.346 5.988 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.071 8.221 4.323 1.00 0.00 H new ATOM 1034 N ASN A 91 -11.667 5.352 3.267 1.00 0.00 N ATOM 1035 CA ASN A 91 -12.595 4.689 2.345 1.00 0.00 C ATOM 1036 C ASN A 91 -12.382 3.187 2.239 1.00 0.00 C ATOM 1037 O ASN A 91 -13.295 2.462 1.840 1.00 0.00 O ATOM 1038 CB ASN A 91 -12.598 5.322 0.950 1.00 0.00 C ATOM 1039 CG ASN A 91 -13.259 6.699 0.867 1.00 0.00 C ATOM 1040 OD1 ASN A 91 -12.872 7.542 0.045 1.00 0.00 O ATOM 1041 ND2 ASN A 91 -14.275 6.935 1.663 1.00 0.00 N ATOM 0 H ASN A 91 -10.750 5.566 2.876 1.00 0.00 H new ATOM 0 HA ASN A 91 -13.576 4.845 2.793 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.568 5.409 0.604 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -13.109 4.648 0.263 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -14.765 7.828 1.613 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -14.575 6.225 2.331 1.00 0.00 H new ATOM 1048 N LEU A 92 -11.206 2.720 2.598 1.00 0.00 N ATOM 1049 CA LEU A 92 -10.883 1.296 2.469 1.00 0.00 C ATOM 1050 C LEU A 92 -11.039 0.570 3.766 1.00 0.00 C ATOM 1051 O LEU A 92 -11.354 -0.620 3.787 1.00 0.00 O ATOM 1052 CB LEU A 92 -9.458 1.123 1.990 1.00 0.00 C ATOM 1053 CG LEU A 92 -9.200 1.294 0.518 1.00 0.00 C ATOM 1054 CD1 LEU A 92 -7.752 1.675 0.306 1.00 0.00 C ATOM 1055 CD2 LEU A 92 -9.485 -0.016 -0.185 1.00 0.00 C ATOM 0 H LEU A 92 -10.454 3.293 2.981 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.581 0.876 1.745 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.833 1.836 2.527 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.124 0.126 2.278 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.843 2.076 0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.561 1.800 -0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.542 2.611 0.824 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -7.108 0.889 0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.301 0.097 -1.253 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.834 -0.793 0.215 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.526 -0.297 -0.024 1.00 0.00 H new ATOM 1067 N ASN A 93 -10.796 1.259 4.850 1.00 0.00 N ATOM 1068 CA ASN A 93 -10.918 0.648 6.147 1.00 0.00 C ATOM 1069 C ASN A 93 -12.377 0.308 6.391 1.00 0.00 C ATOM 1070 O ASN A 93 -13.248 1.183 6.300 1.00 0.00 O ATOM 1071 CB ASN A 93 -10.421 1.614 7.205 1.00 0.00 C ATOM 1072 CG ASN A 93 -10.433 1.055 8.589 1.00 0.00 C ATOM 1073 OD1 ASN A 93 -10.238 -0.137 8.799 1.00 0.00 O ATOM 1074 ND2 ASN A 93 -10.630 1.905 9.532 1.00 0.00 N ATOM 0 H ASN A 93 -10.514 2.239 4.861 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.321 -0.263 6.194 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -9.405 1.919 6.956 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -11.038 2.512 7.181 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -10.628 1.597 10.504 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -10.788 2.888 9.308 1.00 0.00 H new ATOM 1081 N GLY A 94 -12.640 -0.935 6.692 1.00 0.00 N ATOM 1082 CA GLY A 94 -13.992 -1.382 6.928 1.00 0.00 C ATOM 1083 C GLY A 94 -14.725 -1.757 5.646 1.00 0.00 C ATOM 1084 O GLY A 94 -15.880 -2.198 5.696 1.00 0.00 O ATOM 0 H GLY A 94 -11.932 -1.664 6.781 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.973 -2.244 7.595 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.545 -0.595 7.440 1.00 0.00 H new ATOM 1088 N PHE A 95 -14.063 -1.595 4.504 1.00 0.00 N ATOM 1089 CA PHE A 95 -14.655 -1.929 3.223 1.00 0.00 C ATOM 1090 C PHE A 95 -14.332 -3.380 2.906 1.00 0.00 C ATOM 1091 O PHE A 95 -13.209 -3.831 3.134 1.00 0.00 O ATOM 1092 CB PHE A 95 -14.122 -0.998 2.109 1.00 0.00 C ATOM 1093 CG PHE A 95 -14.782 -1.198 0.766 1.00 0.00 C ATOM 1094 CD1 PHE A 95 -15.940 -0.525 0.444 1.00 0.00 C ATOM 1095 CD2 PHE A 95 -14.249 -2.068 -0.165 1.00 0.00 C ATOM 1096 CE1 PHE A 95 -16.550 -0.714 -0.779 1.00 0.00 C ATOM 1097 CE2 PHE A 95 -14.859 -2.264 -1.388 1.00 0.00 C ATOM 1098 CZ PHE A 95 -16.010 -1.584 -1.694 1.00 0.00 C ATOM 0 H PHE A 95 -13.112 -1.232 4.445 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.735 -1.792 3.274 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -14.262 0.038 2.419 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -13.049 -1.157 2.001 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -16.376 0.159 1.157 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -13.340 -2.604 0.067 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -17.455 -0.176 -1.018 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -14.431 -2.951 -2.102 1.00 0.00 H new ATOM 0 HZ PHE A 95 -16.490 -1.732 -2.650 1.00 0.00 H new ATOM 1108 N LYS A 96 -15.294 -4.108 2.399 1.00 0.00 N ATOM 1109 CA LYS A 96 -15.098 -5.506 2.123 1.00 0.00 C ATOM 1110 C LYS A 96 -14.660 -5.737 0.701 1.00 0.00 C ATOM 1111 O LYS A 96 -15.364 -5.379 -0.244 1.00 0.00 O ATOM 1112 CB LYS A 96 -16.355 -6.356 2.423 1.00 0.00 C ATOM 1113 CG LYS A 96 -16.778 -6.453 3.896 1.00 0.00 C ATOM 1114 CD LYS A 96 -17.317 -5.140 4.451 1.00 0.00 C ATOM 1115 CE LYS A 96 -17.854 -5.305 5.862 1.00 0.00 C ATOM 1116 NZ LYS A 96 -18.960 -6.283 5.916 1.00 0.00 N ATOM 0 H LYS A 96 -16.222 -3.754 2.169 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.305 -5.830 2.796 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -17.189 -5.945 1.854 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -16.182 -7.365 2.050 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.541 -7.224 3.999 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.923 -6.769 4.493 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.525 -4.391 4.448 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.109 -4.768 3.801 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.049 -5.629 6.522 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -18.202 -4.341 6.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -19.516 -6.131 6.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -19.573 -6.160 5.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.571 -7.247 5.920 1.00 0.00 H new ATOM 1130 N ILE A 97 -13.503 -6.312 0.549 1.00 0.00 N ATOM 1131 CA ILE A 97 -13.011 -6.715 -0.736 1.00 0.00 C ATOM 1132 C ILE A 97 -12.838 -8.217 -0.674 1.00 0.00 C ATOM 1133 O ILE A 97 -12.429 -8.751 0.375 1.00 0.00 O ATOM 1134 CB ILE A 97 -11.664 -6.007 -1.102 1.00 0.00 C ATOM 1135 CG1 ILE A 97 -11.889 -4.487 -1.208 1.00 0.00 C ATOM 1136 CG2 ILE A 97 -11.077 -6.564 -2.395 1.00 0.00 C ATOM 1137 CD1 ILE A 97 -10.698 -3.678 -1.687 1.00 0.00 C ATOM 0 H ILE A 97 -12.868 -6.516 1.321 1.00 0.00 H new ATOM 0 HA ILE A 97 -13.713 -6.427 -1.518 1.00 0.00 H new ATOM 0 HB ILE A 97 -10.942 -6.204 -0.309 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -12.723 -4.308 -1.886 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -12.189 -4.113 -0.229 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -10.142 -6.051 -2.621 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -10.886 -7.631 -2.278 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -11.782 -6.409 -3.211 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -10.967 -2.622 -1.724 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -9.864 -3.816 -0.999 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -10.407 -4.014 -2.682 1.00 0.00 H new ATOM 1149 N GLY A 98 -13.140 -8.899 -1.760 1.00 0.00 N ATOM 1150 CA GLY A 98 -13.125 -10.337 -1.758 1.00 0.00 C ATOM 1151 C GLY A 98 -14.290 -10.855 -0.959 1.00 0.00 C ATOM 1152 O GLY A 98 -15.357 -11.151 -1.508 1.00 0.00 O ATOM 0 H GLY A 98 -13.398 -8.476 -2.652 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -13.177 -10.712 -2.780 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -12.190 -10.700 -1.332 1.00 0.00 H new ATOM 1156 N GLY A 99 -14.089 -10.934 0.321 1.00 0.00 N ATOM 1157 CA GLY A 99 -15.112 -11.309 1.242 1.00 0.00 C ATOM 1158 C GLY A 99 -14.730 -10.895 2.642 1.00 0.00 C ATOM 1159 O GLY A 99 -15.307 -11.377 3.623 1.00 0.00 O ATOM 0 H GLY A 99 -13.190 -10.735 0.761 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -16.055 -10.840 0.961 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.269 -12.387 1.204 1.00 0.00 H new ATOM 1163 N ARG A 100 -13.772 -9.982 2.748 1.00 0.00 N ATOM 1164 CA ARG A 100 -13.263 -9.571 4.036 1.00 0.00 C ATOM 1165 C ARG A 100 -13.086 -8.069 4.082 1.00 0.00 C ATOM 1166 O ARG A 100 -12.843 -7.441 3.053 1.00 0.00 O ATOM 1167 CB ARG A 100 -11.953 -10.306 4.351 1.00 0.00 C ATOM 1168 CG ARG A 100 -10.868 -10.184 3.280 1.00 0.00 C ATOM 1169 CD ARG A 100 -9.654 -11.013 3.646 1.00 0.00 C ATOM 1170 NE ARG A 100 -9.990 -12.434 3.777 1.00 0.00 N ATOM 1171 CZ ARG A 100 -9.298 -13.349 4.472 1.00 0.00 C ATOM 1172 NH1 ARG A 100 -8.153 -13.031 5.081 1.00 0.00 N ATOM 1173 NH2 ARG A 100 -9.755 -14.586 4.536 1.00 0.00 N ATOM 0 H ARG A 100 -13.336 -9.516 1.952 1.00 0.00 H new ATOM 0 HA ARG A 100 -13.988 -9.840 4.805 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -11.557 -9.924 5.292 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -12.175 -11.362 4.503 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -11.262 -10.513 2.318 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -10.579 -9.139 3.166 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -8.885 -10.889 2.884 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -9.234 -10.650 4.584 1.00 0.00 H new ATOM 0 HE ARG A 100 -10.829 -12.757 3.294 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.791 -12.079 5.022 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -7.640 -13.740 5.605 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -10.623 -14.834 4.061 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -9.240 -15.293 5.061 1.00 0.00 H new ATOM 1187 N ALA A 101 -13.233 -7.500 5.252 1.00 0.00 N ATOM 1188 CA ALA A 101 -13.135 -6.071 5.419 1.00 0.00 C ATOM 1189 C ALA A 101 -11.707 -5.657 5.650 1.00 0.00 C ATOM 1190 O ALA A 101 -11.055 -6.138 6.577 1.00 0.00 O ATOM 1191 CB ALA A 101 -14.021 -5.602 6.561 1.00 0.00 C ATOM 0 H ALA A 101 -13.423 -8.012 6.113 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.482 -5.597 4.501 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -13.932 -4.521 6.670 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -15.058 -5.861 6.347 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -13.709 -6.087 7.486 1.00 0.00 H new ATOM 1197 N LEU A 102 -11.228 -4.785 4.806 1.00 0.00 N ATOM 1198 CA LEU A 102 -9.889 -4.272 4.901 1.00 0.00 C ATOM 1199 C LEU A 102 -9.673 -3.423 6.121 1.00 0.00 C ATOM 1200 O LEU A 102 -10.591 -2.760 6.625 1.00 0.00 O ATOM 1201 CB LEU A 102 -9.507 -3.483 3.658 1.00 0.00 C ATOM 1202 CG LEU A 102 -8.936 -4.289 2.509 1.00 0.00 C ATOM 1203 CD1 LEU A 102 -8.685 -3.390 1.318 1.00 0.00 C ATOM 1204 CD2 LEU A 102 -7.638 -4.919 2.958 1.00 0.00 C ATOM 0 H LEU A 102 -11.762 -4.406 4.024 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.244 -5.146 4.986 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.391 -2.955 3.301 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.777 -2.726 3.943 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.644 -5.064 2.216 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -8.275 -3.979 0.498 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.623 -2.933 1.003 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -7.976 -2.609 1.594 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.215 -5.503 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.935 -4.138 3.247 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.826 -5.572 3.811 1.00 0.00 H new ATOM 1216 N LYS A 103 -8.475 -3.468 6.612 1.00 0.00 N ATOM 1217 CA LYS A 103 -8.078 -2.649 7.700 1.00 0.00 C ATOM 1218 C LYS A 103 -6.906 -1.814 7.275 1.00 0.00 C ATOM 1219 O LYS A 103 -5.869 -2.337 6.944 1.00 0.00 O ATOM 1220 CB LYS A 103 -7.739 -3.481 8.946 1.00 0.00 C ATOM 1221 CG LYS A 103 -7.122 -2.688 10.110 1.00 0.00 C ATOM 1222 CD LYS A 103 -8.037 -1.582 10.624 1.00 0.00 C ATOM 1223 CE LYS A 103 -7.374 -0.808 11.755 1.00 0.00 C ATOM 1224 NZ LYS A 103 -8.231 0.274 12.274 1.00 0.00 N ATOM 0 H LYS A 103 -7.741 -4.083 6.261 1.00 0.00 H new ATOM 0 HA LYS A 103 -8.910 -2.001 7.976 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.649 -3.966 9.299 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.047 -4.272 8.658 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.892 -3.372 10.927 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.178 -2.250 9.785 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -8.285 -0.902 9.809 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -8.974 -2.014 10.975 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -7.129 -1.494 12.566 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -6.434 -0.385 11.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.736 0.771 13.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -8.445 0.945 11.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -9.117 -0.130 12.638 1.00 0.00 H new ATOM 1238 N ILE A 104 -7.073 -0.532 7.252 1.00 0.00 N ATOM 1239 CA ILE A 104 -5.981 0.320 6.855 1.00 0.00 C ATOM 1240 C ILE A 104 -5.609 1.179 8.033 1.00 0.00 C ATOM 1241 O ILE A 104 -6.496 1.681 8.738 1.00 0.00 O ATOM 1242 CB ILE A 104 -6.337 1.267 5.685 1.00 0.00 C ATOM 1243 CG1 ILE A 104 -7.322 0.630 4.694 1.00 0.00 C ATOM 1244 CG2 ILE A 104 -5.055 1.658 4.953 1.00 0.00 C ATOM 1245 CD1 ILE A 104 -6.810 -0.602 3.969 1.00 0.00 C ATOM 0 H ILE A 104 -7.938 -0.050 7.498 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.170 -0.328 6.524 1.00 0.00 H new ATOM 0 HB ILE A 104 -6.825 2.146 6.105 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.231 0.362 5.233 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -7.600 1.378 3.952 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -5.297 2.326 4.126 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -4.382 2.165 5.644 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -4.570 0.762 4.565 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.581 -0.974 3.294 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.920 -0.343 3.396 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -6.561 -1.375 4.696 1.00 0.00 H new ATOM 1257 N ASP A 105 -4.344 1.317 8.277 1.00 0.00 N ATOM 1258 CA ASP A 105 -3.856 2.150 9.358 1.00 0.00 C ATOM 1259 C ASP A 105 -2.582 2.823 8.925 1.00 0.00 C ATOM 1260 O ASP A 105 -1.856 2.284 8.098 1.00 0.00 O ATOM 1261 CB ASP A 105 -3.598 1.306 10.599 1.00 0.00 C ATOM 1262 CG ASP A 105 -3.169 2.114 11.803 1.00 0.00 C ATOM 1263 OD1 ASP A 105 -3.667 3.242 11.991 1.00 0.00 O ATOM 1264 OD2 ASP A 105 -2.352 1.604 12.604 1.00 0.00 O ATOM 0 H ASP A 105 -3.610 0.859 7.737 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.606 2.903 9.600 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.504 0.753 10.847 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.827 0.569 10.373 1.00 0.00 H new ATOM 1269 N HIS A 106 -2.318 3.980 9.447 1.00 0.00 N ATOM 1270 CA HIS A 106 -1.092 4.693 9.126 1.00 0.00 C ATOM 1271 C HIS A 106 0.017 4.164 10.007 1.00 0.00 C ATOM 1272 O HIS A 106 -0.190 3.935 11.201 1.00 0.00 O ATOM 1273 CB HIS A 106 -1.225 6.206 9.332 1.00 0.00 C ATOM 1274 CG HIS A 106 -2.260 6.887 8.488 1.00 0.00 C ATOM 1275 ND1 HIS A 106 -1.980 7.555 7.312 1.00 0.00 N ATOM 1276 CD2 HIS A 106 -3.590 7.045 8.702 1.00 0.00 C ATOM 1277 CE1 HIS A 106 -3.116 8.089 6.865 1.00 0.00 C ATOM 1278 NE2 HIS A 106 -4.130 7.806 7.673 1.00 0.00 N ATOM 0 H HIS A 106 -2.931 4.465 10.103 1.00 0.00 H new ATOM 0 HA HIS A 106 -0.871 4.528 8.071 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -1.457 6.393 10.381 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -0.258 6.668 9.132 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -1.066 7.627 6.865 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -4.141 6.643 9.539 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -3.201 8.676 5.962 1.00 0.00 H new ATOM 1286 N THR A 107 1.164 3.968 9.448 1.00 0.00 N ATOM 1287 CA THR A 107 2.263 3.416 10.173 1.00 0.00 C ATOM 1288 C THR A 107 3.526 3.824 9.412 1.00 0.00 C ATOM 1289 O THR A 107 3.431 4.137 8.227 1.00 0.00 O ATOM 1290 CB THR A 107 2.127 1.835 10.218 1.00 0.00 C ATOM 1291 OG1 THR A 107 3.026 1.266 11.175 1.00 0.00 O ATOM 1292 CG2 THR A 107 2.438 1.224 8.851 1.00 0.00 C ATOM 0 H THR A 107 1.368 4.186 8.473 1.00 0.00 H new ATOM 0 HA THR A 107 2.295 3.777 11.201 1.00 0.00 H new ATOM 0 HB THR A 107 1.099 1.612 10.502 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.921 0.292 11.184 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.338 0.140 8.906 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.741 1.615 8.110 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.457 1.481 8.561 1.00 0.00 H new ATOM 1300 N PHE A 108 4.675 3.895 10.054 1.00 0.00 N ATOM 1301 CA PHE A 108 5.858 4.125 9.275 1.00 0.00 C ATOM 1302 C PHE A 108 6.473 2.778 8.945 1.00 0.00 C ATOM 1303 O PHE A 108 6.915 2.033 9.828 1.00 0.00 O ATOM 1304 CB PHE A 108 6.873 5.112 9.949 1.00 0.00 C ATOM 1305 CG PHE A 108 7.437 4.706 11.294 1.00 0.00 C ATOM 1306 CD1 PHE A 108 6.795 5.054 12.464 1.00 0.00 C ATOM 1307 CD2 PHE A 108 8.619 3.986 11.380 1.00 0.00 C ATOM 1308 CE1 PHE A 108 7.307 4.692 13.694 1.00 0.00 C ATOM 1309 CE2 PHE A 108 9.134 3.620 12.602 1.00 0.00 C ATOM 1310 CZ PHE A 108 8.479 3.972 13.761 1.00 0.00 C ATOM 0 H PHE A 108 4.807 3.801 11.061 1.00 0.00 H new ATOM 0 HA PHE A 108 5.579 4.636 8.353 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.707 5.261 9.263 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.380 6.077 10.066 1.00 0.00 H new ATOM 0 HD1 PHE A 108 5.876 5.619 12.417 1.00 0.00 H new ATOM 0 HD2 PHE A 108 9.142 3.709 10.476 1.00 0.00 H new ATOM 0 HE1 PHE A 108 6.790 4.972 14.600 1.00 0.00 H new ATOM 0 HE2 PHE A 108 10.053 3.056 12.652 1.00 0.00 H new ATOM 0 HZ PHE A 108 8.883 3.684 14.720 1.00 0.00 H new ATOM 1320 N TYR A 109 6.428 2.437 7.698 1.00 0.00 N ATOM 1321 CA TYR A 109 6.963 1.188 7.236 1.00 0.00 C ATOM 1322 C TYR A 109 8.250 1.432 6.490 1.00 0.00 C ATOM 1323 O TYR A 109 8.361 2.419 5.746 1.00 0.00 O ATOM 1324 CB TYR A 109 5.935 0.471 6.348 1.00 0.00 C ATOM 1325 CG TYR A 109 6.316 -0.934 5.878 1.00 0.00 C ATOM 1326 CD1 TYR A 109 7.197 -1.128 4.821 1.00 0.00 C ATOM 1327 CD2 TYR A 109 5.775 -2.060 6.484 1.00 0.00 C ATOM 1328 CE1 TYR A 109 7.532 -2.385 4.387 1.00 0.00 C ATOM 1329 CE2 TYR A 109 6.101 -3.332 6.050 1.00 0.00 C ATOM 1330 CZ TYR A 109 6.980 -3.488 5.002 1.00 0.00 C ATOM 1331 OH TYR A 109 7.305 -4.756 4.557 1.00 0.00 O ATOM 0 H TYR A 109 6.019 3.016 6.965 1.00 0.00 H new ATOM 0 HA TYR A 109 7.177 0.545 8.090 1.00 0.00 H new ATOM 0 HB2 TYR A 109 4.995 0.407 6.895 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.751 1.089 5.469 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.628 -0.268 4.330 1.00 0.00 H new ATOM 0 HD2 TYR A 109 5.088 -1.940 7.309 1.00 0.00 H new ATOM 0 HE1 TYR A 109 8.225 -2.510 3.568 1.00 0.00 H new ATOM 0 HE2 TYR A 109 5.669 -4.197 6.530 1.00 0.00 H new ATOM 0 HH TYR A 109 6.832 -5.423 5.097 1.00 0.00 H new ATOM 1341 N ARG A 110 9.233 0.627 6.756 1.00 0.00 N ATOM 1342 CA ARG A 110 10.462 0.630 6.001 1.00 0.00 C ATOM 1343 C ARG A 110 10.697 -0.753 5.424 1.00 0.00 C ATOM 1344 O ARG A 110 10.669 -1.737 6.159 1.00 0.00 O ATOM 1345 CB ARG A 110 11.657 1.102 6.822 1.00 0.00 C ATOM 1346 CG ARG A 110 11.562 2.550 7.267 1.00 0.00 C ATOM 1347 CD ARG A 110 11.422 3.505 6.095 1.00 0.00 C ATOM 1348 NE ARG A 110 11.403 4.893 6.551 1.00 0.00 N ATOM 1349 CZ ARG A 110 10.301 5.588 6.866 1.00 0.00 C ATOM 1350 NH1 ARG A 110 9.086 5.042 6.734 1.00 0.00 N ATOM 1351 NH2 ARG A 110 10.408 6.827 7.295 1.00 0.00 N ATOM 0 H ARG A 110 9.210 -0.060 7.510 1.00 0.00 H new ATOM 0 HA ARG A 110 10.359 1.350 5.189 1.00 0.00 H new ATOM 0 HB2 ARG A 110 11.754 0.467 7.702 1.00 0.00 H new ATOM 0 HB3 ARG A 110 12.565 0.972 6.233 1.00 0.00 H new ATOM 0 HG2 ARG A 110 10.707 2.668 7.933 1.00 0.00 H new ATOM 0 HG3 ARG A 110 12.451 2.811 7.841 1.00 0.00 H new ATOM 0 HD2 ARG A 110 12.249 3.358 5.400 1.00 0.00 H new ATOM 0 HD3 ARG A 110 10.504 3.285 5.549 1.00 0.00 H new ATOM 0 HE ARG A 110 12.300 5.371 6.636 1.00 0.00 H new ATOM 0 HH11 ARG A 110 8.991 4.086 6.390 1.00 0.00 H new ATOM 0 HH12 ARG A 110 8.255 5.582 6.977 1.00 0.00 H new ATOM 0 HH21 ARG A 110 11.328 7.257 7.387 1.00 0.00 H new ATOM 0 HH22 ARG A 110 9.571 7.358 7.535 1.00 0.00 H new ATOM 1365 N PRO A 111 10.869 -0.856 4.116 1.00 0.00 N ATOM 1366 CA PRO A 111 11.072 -2.133 3.450 1.00 0.00 C ATOM 1367 C PRO A 111 12.463 -2.718 3.655 1.00 0.00 C ATOM 1368 O PRO A 111 13.454 -1.992 3.750 1.00 0.00 O ATOM 1369 CB PRO A 111 10.869 -1.789 1.982 1.00 0.00 C ATOM 1370 CG PRO A 111 11.273 -0.368 1.873 1.00 0.00 C ATOM 1371 CD PRO A 111 10.858 0.264 3.162 1.00 0.00 C ATOM 0 HA PRO A 111 10.396 -2.893 3.843 1.00 0.00 H new ATOM 0 HB2 PRO A 111 11.477 -2.425 1.338 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.831 -1.930 1.681 1.00 0.00 H new ATOM 0 HG2 PRO A 111 12.348 -0.276 1.719 1.00 0.00 H new ATOM 0 HG3 PRO A 111 10.787 0.114 1.025 1.00 0.00 H new ATOM 0 HD2 PRO A 111 11.548 1.053 3.462 1.00 0.00 H new ATOM 0 HD3 PRO A 111 9.869 0.717 3.087 1.00 0.00 H new ATOM 1379 N LYS A 112 12.523 -4.017 3.739 1.00 0.00 N ATOM 1380 CA LYS A 112 13.766 -4.726 3.815 1.00 0.00 C ATOM 1381 C LYS A 112 14.073 -5.223 2.411 1.00 0.00 C ATOM 1382 O LYS A 112 13.208 -5.811 1.756 1.00 0.00 O ATOM 1383 CB LYS A 112 13.661 -5.904 4.839 1.00 0.00 C ATOM 1384 CG LYS A 112 14.971 -6.679 5.134 1.00 0.00 C ATOM 1385 CD LYS A 112 15.425 -7.558 3.972 1.00 0.00 C ATOM 1386 CE LYS A 112 16.780 -8.187 4.212 1.00 0.00 C ATOM 1387 NZ LYS A 112 17.228 -8.975 3.037 1.00 0.00 N ATOM 0 H LYS A 112 11.700 -4.619 3.757 1.00 0.00 H new ATOM 0 HA LYS A 112 14.572 -4.083 4.169 1.00 0.00 H new ATOM 0 HB2 LYS A 112 13.280 -5.506 5.780 1.00 0.00 H new ATOM 0 HB3 LYS A 112 12.920 -6.613 4.469 1.00 0.00 H new ATOM 0 HG2 LYS A 112 15.761 -5.967 5.372 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.826 -7.302 6.017 1.00 0.00 H new ATOM 0 HD2 LYS A 112 14.688 -8.344 3.806 1.00 0.00 H new ATOM 0 HD3 LYS A 112 15.463 -6.959 3.062 1.00 0.00 H new ATOM 0 HE2 LYS A 112 17.511 -7.408 4.429 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.733 -8.833 5.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 18.255 -8.866 2.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 17.001 -9.979 3.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 16.742 -8.633 2.184 1.00 0.00 H new ATOM 1401 N ARG A 113 15.267 -4.969 1.949 1.00 0.00 N ATOM 1402 CA ARG A 113 15.675 -5.390 0.639 1.00 0.00 C ATOM 1403 C ARG A 113 16.646 -6.548 0.764 1.00 0.00 C ATOM 1404 O ARG A 113 16.220 -7.707 0.694 1.00 0.00 O ATOM 1405 CB ARG A 113 16.291 -4.215 -0.104 1.00 0.00 C ATOM 1406 CG ARG A 113 15.321 -3.058 -0.221 1.00 0.00 C ATOM 1407 CD ARG A 113 15.917 -1.876 -0.921 1.00 0.00 C ATOM 1408 NE ARG A 113 14.973 -0.742 -0.947 1.00 0.00 N ATOM 1409 CZ ARG A 113 15.260 0.503 -1.361 1.00 0.00 C ATOM 1410 NH1 ARG A 113 16.446 0.782 -1.879 1.00 0.00 N ATOM 1411 NH2 ARG A 113 14.356 1.463 -1.262 1.00 0.00 N ATOM 1412 OXT ARG A 113 17.830 -6.321 1.021 1.00 0.00 O ATOM 0 H ARG A 113 15.983 -4.464 2.471 1.00 0.00 H new ATOM 0 HA ARG A 113 14.813 -5.732 0.066 1.00 0.00 H new ATOM 0 HB2 ARG A 113 17.190 -3.885 0.417 1.00 0.00 H new ATOM 0 HB3 ARG A 113 16.599 -4.535 -1.100 1.00 0.00 H new ATOM 0 HG2 ARG A 113 14.433 -3.386 -0.762 1.00 0.00 H new ATOM 0 HG3 ARG A 113 14.995 -2.759 0.775 1.00 0.00 H new ATOM 0 HD2 ARG A 113 16.836 -1.577 -0.417 1.00 0.00 H new ATOM 0 HD3 ARG A 113 16.187 -2.151 -1.940 1.00 0.00 H new ATOM 0 HE ARG A 113 14.022 -0.919 -0.623 1.00 0.00 H new ATOM 0 HH11 ARG A 113 17.150 0.049 -1.966 1.00 0.00 H new ATOM 0 HH12 ARG A 113 16.656 1.730 -2.191 1.00 0.00 H new ATOM 0 HH21 ARG A 113 13.437 1.259 -0.870 1.00 0.00 H new ATOM 0 HH22 ARG A 113 14.578 2.407 -1.578 1.00 0.00 H new TER 1426 ARG A 113 ATOM 1427 N ASN B 222 -13.044 12.512 1.416 1.00 0.00 N ATOM 1428 CA ASN B 222 -14.175 13.438 1.421 1.00 0.00 C ATOM 1429 C ASN B 222 -13.630 14.855 1.406 1.00 0.00 C ATOM 1430 O ASN B 222 -12.885 15.206 2.284 1.00 0.00 O ATOM 1431 CB ASN B 222 -15.051 13.203 2.672 1.00 0.00 C ATOM 1432 CG ASN B 222 -16.380 13.961 2.660 1.00 0.00 C ATOM 1433 OD1 ASN B 222 -16.514 15.030 2.076 1.00 0.00 O ATOM 1434 ND2 ASN B 222 -17.374 13.408 3.318 1.00 0.00 N ATOM 0 HA ASN B 222 -14.799 13.275 0.542 1.00 0.00 H new ATOM 0 HB2 ASN B 222 -15.255 12.136 2.763 1.00 0.00 H new ATOM 0 HB3 ASN B 222 -14.487 13.496 3.557 1.00 0.00 H new ATOM 0 HD21 ASN B 222 -18.283 13.869 3.351 1.00 0.00 H new ATOM 0 HD22 ASN B 222 -17.236 12.517 3.796 1.00 0.00 H new ATOM 1443 N ARG B 223 -13.982 15.619 0.355 1.00 0.00 N ATOM 1444 CA ARG B 223 -13.597 17.038 0.084 1.00 0.00 C ATOM 1445 C ARG B 223 -12.115 17.242 -0.242 1.00 0.00 C ATOM 1446 O ARG B 223 -11.622 18.368 -0.212 1.00 0.00 O ATOM 1447 CB ARG B 223 -14.067 18.088 1.135 1.00 0.00 C ATOM 1448 CG ARG B 223 -13.394 18.036 2.498 1.00 0.00 C ATOM 1449 CD ARG B 223 -13.480 19.367 3.196 1.00 0.00 C ATOM 1450 NE ARG B 223 -12.718 20.391 2.468 1.00 0.00 N ATOM 1451 CZ ARG B 223 -12.703 21.697 2.767 1.00 0.00 C ATOM 1452 NH1 ARG B 223 -13.453 22.157 3.755 1.00 0.00 N ATOM 1453 NH2 ARG B 223 -11.948 22.538 2.060 1.00 0.00 N ATOM 0 H ARG B 223 -14.582 15.248 -0.382 1.00 0.00 H new ATOM 0 HA ARG B 223 -14.172 17.238 -0.820 1.00 0.00 H new ATOM 0 HB2 ARG B 223 -13.912 19.082 0.716 1.00 0.00 H new ATOM 0 HB3 ARG B 223 -15.141 17.967 1.280 1.00 0.00 H new ATOM 0 HG2 ARG B 223 -13.867 17.269 3.111 1.00 0.00 H new ATOM 0 HG3 ARG B 223 -12.349 17.750 2.380 1.00 0.00 H new ATOM 0 HD2 ARG B 223 -14.523 19.673 3.277 1.00 0.00 H new ATOM 0 HD3 ARG B 223 -13.095 19.275 4.212 1.00 0.00 H new ATOM 0 HE ARG B 223 -12.157 20.084 1.673 1.00 0.00 H new ATOM 0 HH11 ARG B 223 -14.042 21.518 4.288 1.00 0.00 H new ATOM 0 HH12 ARG B 223 -13.442 23.151 3.983 1.00 0.00 H new ATOM 0 HH21 ARG B 223 -11.380 22.188 1.289 1.00 0.00 H new ATOM 0 HH22 ARG B 223 -11.939 23.532 2.290 1.00 0.00 H new ATOM 1467 N PHE B 224 -11.427 16.195 -0.604 1.00 0.00 N ATOM 1468 CA PHE B 224 -10.031 16.308 -1.001 1.00 0.00 C ATOM 1469 C PHE B 224 -9.970 16.376 -2.501 1.00 0.00 C ATOM 1470 O PHE B 224 -10.908 15.947 -3.176 1.00 0.00 O ATOM 1471 CB PHE B 224 -9.217 15.107 -0.536 1.00 0.00 C ATOM 1472 CG PHE B 224 -9.066 14.967 0.944 1.00 0.00 C ATOM 1473 CD1 PHE B 224 -10.085 14.454 1.696 1.00 0.00 C ATOM 1474 CD2 PHE B 224 -7.896 15.328 1.574 1.00 0.00 C ATOM 1475 CE1 PHE B 224 -9.971 14.299 3.046 1.00 0.00 C ATOM 1476 CE2 PHE B 224 -7.759 15.173 2.934 1.00 0.00 C ATOM 1477 CZ PHE B 224 -8.803 14.656 3.674 1.00 0.00 C ATOM 0 H PHE B 224 -11.802 15.247 -0.636 1.00 0.00 H new ATOM 0 HA PHE B 224 -9.612 17.204 -0.542 1.00 0.00 H new ATOM 0 HB2 PHE B 224 -9.684 14.201 -0.923 1.00 0.00 H new ATOM 0 HB3 PHE B 224 -8.224 15.169 -0.981 1.00 0.00 H new ATOM 0 HD1 PHE B 224 -11.004 14.164 1.209 1.00 0.00 H new ATOM 0 HD2 PHE B 224 -7.080 15.736 0.996 1.00 0.00 H new ATOM 0 HE1 PHE B 224 -10.795 13.898 3.618 1.00 0.00 H new ATOM 0 HE2 PHE B 224 -6.837 15.455 3.421 1.00 0.00 H new ATOM 0 HZ PHE B 224 -8.702 14.533 4.742 1.00 0.00 H new ATOM 1487 N ALA B 225 -8.898 16.879 -3.026 1.00 0.00 N ATOM 1488 CA ALA B 225 -8.744 16.999 -4.451 1.00 0.00 C ATOM 1489 C ALA B 225 -7.400 16.462 -4.867 1.00 0.00 C ATOM 1490 O ALA B 225 -6.407 17.184 -4.865 1.00 0.00 O ATOM 1491 CB ALA B 225 -8.917 18.446 -4.905 1.00 0.00 C ATOM 0 H ALA B 225 -8.103 17.219 -2.485 1.00 0.00 H new ATOM 0 HA ALA B 225 -9.523 16.410 -4.935 1.00 0.00 H new ATOM 0 HB1 ALA B 225 -8.795 18.505 -5.987 1.00 0.00 H new ATOM 0 HB2 ALA B 225 -9.913 18.796 -4.632 1.00 0.00 H new ATOM 0 HB3 ALA B 225 -8.167 19.071 -4.421 1.00 0.00 H new ATOM 1497 N ILE B 226 -7.348 15.177 -5.103 1.00 0.00 N ATOM 1498 CA ILE B 226 -6.133 14.526 -5.549 1.00 0.00 C ATOM 1499 C ILE B 226 -6.402 13.710 -6.810 1.00 0.00 C ATOM 1500 O ILE B 226 -7.351 12.905 -6.855 1.00 0.00 O ATOM 1501 CB ILE B 226 -5.485 13.600 -4.453 1.00 0.00 C ATOM 1502 CG1 ILE B 226 -4.971 14.385 -3.249 1.00 0.00 C ATOM 1503 CG2 ILE B 226 -4.365 12.767 -5.012 1.00 0.00 C ATOM 1504 CD1 ILE B 226 -6.006 14.693 -2.203 1.00 0.00 C ATOM 0 H ILE B 226 -8.144 14.548 -4.993 1.00 0.00 H new ATOM 0 HA ILE B 226 -5.419 15.323 -5.759 1.00 0.00 H new ATOM 0 HB ILE B 226 -6.288 12.943 -4.119 1.00 0.00 H new ATOM 0 HG12 ILE B 226 -4.163 13.820 -2.784 1.00 0.00 H new ATOM 0 HG13 ILE B 226 -4.542 15.323 -3.602 1.00 0.00 H new ATOM 0 HG21 ILE B 226 -3.946 12.143 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE B 226 -4.748 12.132 -5.811 1.00 0.00 H new ATOM 0 HG23 ILE B 226 -3.588 13.421 -5.408 1.00 0.00 H new ATOM 0 HD11 ILE B 226 -5.545 15.252 -1.389 1.00 0.00 H new ATOM 0 HD12 ILE B 226 -6.805 15.288 -2.646 1.00 0.00 H new ATOM 0 HD13 ILE B 226 -6.419 13.762 -1.815 1.00 0.00 H new ATOM 1516 N MET B 227 -5.594 13.937 -7.830 1.00 0.00 N ATOM 1517 CA MET B 227 -5.690 13.192 -9.076 1.00 0.00 C ATOM 1518 C MET B 227 -5.316 11.740 -8.858 1.00 0.00 C ATOM 1519 O MET B 227 -4.353 11.445 -8.136 1.00 0.00 O ATOM 1520 CB MET B 227 -4.797 13.806 -10.147 1.00 0.00 C ATOM 1521 CG MET B 227 -5.283 15.143 -10.645 1.00 0.00 C ATOM 1522 SD MET B 227 -6.825 15.026 -11.593 1.00 0.00 S ATOM 1523 CE MET B 227 -6.302 14.030 -13.000 1.00 0.00 C ATOM 0 H MET B 227 -4.855 14.640 -7.820 1.00 0.00 H new ATOM 0 HA MET B 227 -6.724 13.242 -9.418 1.00 0.00 H new ATOM 0 HB2 MET B 227 -3.790 13.921 -9.746 1.00 0.00 H new ATOM 0 HB3 MET B 227 -4.728 13.117 -10.989 1.00 0.00 H new ATOM 0 HG2 MET B 227 -5.435 15.808 -9.795 1.00 0.00 H new ATOM 0 HG3 MET B 227 -4.512 15.594 -11.269 1.00 0.00 H new ATOM 0 HE1 MET B 227 -6.631 14.505 -13.924 1.00 0.00 H new ATOM 0 HE2 MET B 227 -5.215 13.946 -13.002 1.00 0.00 H new ATOM 0 HE3 MET B 227 -6.742 13.036 -12.926 1.00 0.00 H new ATOM 1533 N PRO B 228 -6.074 10.821 -9.467 1.00 0.00 N ATOM 1534 CA PRO B 228 -5.855 9.385 -9.317 1.00 0.00 C ATOM 1535 C PRO B 228 -4.530 8.910 -9.924 1.00 0.00 C ATOM 1536 O PRO B 228 -3.955 9.563 -10.818 1.00 0.00 O ATOM 1537 CB PRO B 228 -7.040 8.756 -10.064 1.00 0.00 C ATOM 1538 CG PRO B 228 -7.477 9.800 -11.030 1.00 0.00 C ATOM 1539 CD PRO B 228 -7.220 11.110 -10.356 1.00 0.00 C ATOM 0 HA PRO B 228 -5.794 9.103 -8.266 1.00 0.00 H new ATOM 0 HB2 PRO B 228 -6.744 7.841 -10.577 1.00 0.00 H new ATOM 0 HB3 PRO B 228 -7.844 8.490 -9.378 1.00 0.00 H new ATOM 0 HG2 PRO B 228 -6.921 9.725 -11.965 1.00 0.00 H new ATOM 0 HG3 PRO B 228 -8.533 9.687 -11.277 1.00 0.00 H new ATOM 0 HD2 PRO B 228 -6.982 11.892 -11.077 1.00 0.00 H new ATOM 0 HD3 PRO B 228 -8.089 11.449 -9.793 1.00 0.00 H new ATOM 1547 N GLY B 229 -4.058 7.784 -9.437 1.00 0.00 N ATOM 1548 CA GLY B 229 -2.831 7.197 -9.907 1.00 0.00 C ATOM 1549 C GLY B 229 -2.981 6.579 -11.279 1.00 0.00 C ATOM 1550 O GLY B 229 -4.101 6.421 -11.787 1.00 0.00 O ATOM 0 H GLY B 229 -4.519 7.250 -8.700 1.00 0.00 H new ATOM 0 HA2 GLY B 229 -2.054 7.960 -9.938 1.00 0.00 H new ATOM 0 HA3 GLY B 229 -2.501 6.435 -9.201 1.00 0.00 H new ATOM 1554 N SER B 230 -1.877 6.199 -11.863 1.00 0.00 N ATOM 1555 CA SER B 230 -1.859 5.633 -13.194 1.00 0.00 C ATOM 1556 C SER B 230 -2.313 4.173 -13.181 1.00 0.00 C ATOM 1557 O SER B 230 -2.739 3.629 -14.203 1.00 0.00 O ATOM 1558 CB SER B 230 -0.456 5.763 -13.770 1.00 0.00 C ATOM 1559 OG SER B 230 -0.020 7.125 -13.723 1.00 0.00 O ATOM 0 H SER B 230 -0.956 6.272 -11.430 1.00 0.00 H new ATOM 0 HA SER B 230 -2.560 6.180 -13.824 1.00 0.00 H new ATOM 0 HB2 SER B 230 0.234 5.134 -13.208 1.00 0.00 H new ATOM 0 HB3 SER B 230 -0.445 5.407 -14.800 1.00 0.00 H new ATOM 0 HG SER B 230 0.884 7.192 -14.095 1.00 0.00 H new ATOM 1565 N ARG B 231 -2.279 3.567 -12.012 1.00 0.00 N ATOM 1566 CA ARG B 231 -2.661 2.169 -11.855 1.00 0.00 C ATOM 1567 C ARG B 231 -4.179 2.030 -11.808 1.00 0.00 C ATOM 1568 O ARG B 231 -4.704 0.929 -11.837 1.00 0.00 O ATOM 1569 CB ARG B 231 -2.077 1.613 -10.556 1.00 0.00 C ATOM 1570 CG ARG B 231 -0.580 1.738 -10.430 1.00 0.00 C ATOM 1571 CD ARG B 231 0.154 0.913 -11.457 1.00 0.00 C ATOM 1572 NE ARG B 231 1.601 1.079 -11.333 1.00 0.00 N ATOM 1573 CZ ARG B 231 2.520 0.430 -12.052 1.00 0.00 C ATOM 1574 NH1 ARG B 231 2.154 -0.372 -13.051 1.00 0.00 N ATOM 1575 NH2 ARG B 231 3.804 0.618 -11.797 1.00 0.00 N ATOM 0 H ARG B 231 -1.989 4.021 -11.146 1.00 0.00 H new ATOM 0 HA ARG B 231 -2.273 1.612 -12.708 1.00 0.00 H new ATOM 0 HB2 ARG B 231 -2.542 2.128 -9.716 1.00 0.00 H new ATOM 0 HB3 ARG B 231 -2.348 0.560 -10.474 1.00 0.00 H new ATOM 0 HG2 ARG B 231 -0.295 2.785 -10.538 1.00 0.00 H new ATOM 0 HG3 ARG B 231 -0.275 1.426 -9.431 1.00 0.00 H new ATOM 0 HD2 ARG B 231 -0.106 -0.139 -11.336 1.00 0.00 H new ATOM 0 HD3 ARG B 231 -0.164 1.206 -12.458 1.00 0.00 H new ATOM 0 HE ARG B 231 1.937 1.747 -10.639 1.00 0.00 H new ATOM 0 HH11 ARG B 231 1.166 -0.494 -13.271 1.00 0.00 H new ATOM 0 HH12 ARG B 231 2.862 -0.864 -13.596 1.00 0.00 H new ATOM 0 HH21 ARG B 231 4.088 1.256 -11.054 1.00 0.00 H new ATOM 0 HH22 ARG B 231 4.510 0.125 -12.343 1.00 0.00 H new ATOM 1589 N TRP B 232 -4.871 3.154 -11.744 1.00 0.00 N ATOM 1590 CA TRP B 232 -6.305 3.154 -11.611 1.00 0.00 C ATOM 1591 C TRP B 232 -7.015 2.761 -12.880 1.00 0.00 C ATOM 1592 O TRP B 232 -6.852 3.374 -13.949 1.00 0.00 O ATOM 1593 CB TRP B 232 -6.837 4.495 -11.094 1.00 0.00 C ATOM 1594 CG TRP B 232 -8.317 4.490 -10.798 1.00 0.00 C ATOM 1595 CD1 TRP B 232 -9.007 3.554 -10.074 1.00 0.00 C ATOM 1596 CD2 TRP B 232 -9.283 5.469 -11.192 1.00 0.00 C ATOM 1597 NE1 TRP B 232 -10.321 3.898 -9.990 1.00 0.00 N ATOM 1598 CE2 TRP B 232 -10.522 5.064 -10.662 1.00 0.00 C ATOM 1599 CE3 TRP B 232 -9.224 6.650 -11.936 1.00 0.00 C ATOM 1600 CZ2 TRP B 232 -11.683 5.788 -10.848 1.00 0.00 C ATOM 1601 CZ3 TRP B 232 -10.386 7.373 -12.121 1.00 0.00 C ATOM 1602 CH2 TRP B 232 -11.602 6.940 -11.578 1.00 0.00 C ATOM 0 H TRP B 232 -4.452 4.083 -11.783 1.00 0.00 H new ATOM 0 HA TRP B 232 -6.526 2.389 -10.867 1.00 0.00 H new ATOM 0 HB2 TRP B 232 -6.296 4.765 -10.187 1.00 0.00 H new ATOM 0 HB3 TRP B 232 -6.626 5.268 -11.833 1.00 0.00 H new ATOM 0 HD1 TRP B 232 -8.571 2.670 -9.633 1.00 0.00 H new ATOM 0 HE1 TRP B 232 -11.041 3.366 -9.501 1.00 0.00 H new ATOM 0 HE3 TRP B 232 -8.290 6.990 -12.357 1.00 0.00 H new ATOM 0 HZ2 TRP B 232 -12.622 5.455 -10.431 1.00 0.00 H new ATOM 0 HZ3 TRP B 232 -10.356 8.288 -12.694 1.00 0.00 H new ATOM 0 HH2 TRP B 232 -12.493 7.528 -11.739 1.00 0.00 H new ATOM 1613 N ASP B 233 -7.787 1.757 -12.727 1.00 0.00 N ATOM 1614 CA ASP B 233 -8.689 1.248 -13.699 1.00 0.00 C ATOM 1615 C ASP B 233 -9.983 1.382 -12.975 1.00 0.00 C ATOM 1616 O ASP B 233 -9.953 1.173 -11.792 1.00 0.00 O ATOM 1617 CB ASP B 233 -8.384 -0.234 -13.977 1.00 0.00 C ATOM 1618 CG ASP B 233 -9.122 -0.795 -15.174 1.00 0.00 C ATOM 1619 OD1 ASP B 233 -10.327 -1.053 -15.086 1.00 0.00 O ATOM 1620 OD2 ASP B 233 -8.487 -1.017 -16.230 1.00 0.00 O ATOM 0 H ASP B 233 -7.812 1.225 -11.857 1.00 0.00 H new ATOM 0 HA ASP B 233 -8.654 1.751 -14.665 1.00 0.00 H new ATOM 0 HB2 ASP B 233 -7.312 -0.351 -14.135 1.00 0.00 H new ATOM 0 HB3 ASP B 233 -8.642 -0.820 -13.095 1.00 0.00 H new ATOM 1625 N GLY B 234 -11.032 1.840 -13.665 1.00 0.00 N ATOM 1626 CA GLY B 234 -12.428 2.159 -13.175 1.00 0.00 C ATOM 1627 C GLY B 234 -13.038 1.265 -12.093 1.00 0.00 C ATOM 1628 O GLY B 234 -14.146 0.726 -12.229 1.00 0.00 O ATOM 0 H GLY B 234 -10.947 2.021 -14.665 1.00 0.00 H new ATOM 0 HA2 GLY B 234 -12.423 3.182 -12.798 1.00 0.00 H new ATOM 0 HA3 GLY B 234 -13.095 2.141 -14.037 1.00 0.00 H new ATOM 1632 N VAL B 235 -12.329 1.158 -11.069 1.00 0.00 N ATOM 1633 CA VAL B 235 -12.639 0.462 -9.867 1.00 0.00 C ATOM 1634 C VAL B 235 -13.000 1.491 -8.827 1.00 0.00 C ATOM 1635 O VAL B 235 -12.205 2.380 -8.550 1.00 0.00 O ATOM 1636 CB VAL B 235 -11.384 -0.341 -9.409 1.00 0.00 C ATOM 1637 CG1 VAL B 235 -11.520 -0.888 -8.014 1.00 0.00 C ATOM 1638 CG2 VAL B 235 -11.097 -1.464 -10.378 1.00 0.00 C ATOM 0 H VAL B 235 -11.409 1.596 -11.022 1.00 0.00 H new ATOM 0 HA VAL B 235 -13.467 -0.232 -10.014 1.00 0.00 H new ATOM 0 HB VAL B 235 -10.549 0.359 -9.399 1.00 0.00 H new ATOM 0 HG11 VAL B 235 -10.617 -1.438 -7.749 1.00 0.00 H new ATOM 0 HG12 VAL B 235 -11.663 -0.066 -7.313 1.00 0.00 H new ATOM 0 HG13 VAL B 235 -12.379 -1.558 -7.968 1.00 0.00 H new ATOM 0 HG21 VAL B 235 -10.218 -2.016 -10.045 1.00 0.00 H new ATOM 0 HG22 VAL B 235 -11.954 -2.137 -10.419 1.00 0.00 H new ATOM 0 HG23 VAL B 235 -10.912 -1.051 -11.369 1.00 0.00 H new ATOM 1648 N HIS B 236 -14.185 1.382 -8.291 1.00 0.00 N ATOM 1649 CA HIS B 236 -14.668 2.330 -7.314 1.00 0.00 C ATOM 1650 C HIS B 236 -14.797 1.661 -5.956 1.00 0.00 C ATOM 1651 O HIS B 236 -15.586 0.708 -5.780 1.00 0.00 O ATOM 1652 CB HIS B 236 -16.029 2.898 -7.745 1.00 0.00 C ATOM 1653 CG HIS B 236 -16.586 3.958 -6.823 1.00 0.00 C ATOM 1654 ND1 HIS B 236 -17.737 3.808 -6.092 1.00 0.00 N ATOM 1655 CD2 HIS B 236 -16.144 5.209 -6.560 1.00 0.00 C ATOM 1656 CE1 HIS B 236 -17.962 4.936 -5.427 1.00 0.00 C ATOM 1657 NE2 HIS B 236 -17.023 5.829 -5.674 1.00 0.00 N ATOM 0 H HIS B 236 -14.844 0.637 -8.516 1.00 0.00 H new ATOM 0 HA HIS B 236 -13.952 3.148 -7.243 1.00 0.00 H new ATOM 0 HB2 HIS B 236 -15.932 3.319 -8.746 1.00 0.00 H new ATOM 0 HB3 HIS B 236 -16.746 2.079 -7.812 1.00 0.00 H new ATOM 0 HD2 HIS B 236 -15.251 5.656 -6.971 1.00 0.00 H new ATOM 0 HE1 HIS B 236 -18.803 5.100 -4.770 1.00 0.00 H new ATOM 0 HE2 HIS B 236 -16.955 6.774 -5.296 1.00 0.00 H new ATOM 1665 N ARG B 237 -14.025 2.111 -5.013 1.00 0.00 N ATOM 1666 CA ARG B 237 -14.102 1.605 -3.656 1.00 0.00 C ATOM 1667 C ARG B 237 -14.466 2.716 -2.706 1.00 0.00 C ATOM 1668 O ARG B 237 -13.682 3.625 -2.462 1.00 0.00 O ATOM 1669 CB ARG B 237 -12.795 0.904 -3.209 1.00 0.00 C ATOM 1670 CG ARG B 237 -12.732 -0.595 -3.511 1.00 0.00 C ATOM 1671 CD ARG B 237 -12.867 -0.899 -4.968 1.00 0.00 C ATOM 1672 NE ARG B 237 -13.087 -2.322 -5.215 1.00 0.00 N ATOM 1673 CZ ARG B 237 -14.283 -2.882 -5.442 1.00 0.00 C ATOM 1674 NH1 ARG B 237 -15.371 -2.117 -5.569 1.00 0.00 N ATOM 1675 NH2 ARG B 237 -14.373 -4.201 -5.593 1.00 0.00 N ATOM 0 H ARG B 237 -13.322 2.837 -5.152 1.00 0.00 H new ATOM 0 HA ARG B 237 -14.885 0.847 -3.636 1.00 0.00 H new ATOM 0 HB2 ARG B 237 -11.952 1.394 -3.697 1.00 0.00 H new ATOM 0 HB3 ARG B 237 -12.671 1.049 -2.136 1.00 0.00 H new ATOM 0 HG2 ARG B 237 -11.785 -0.995 -3.147 1.00 0.00 H new ATOM 0 HG3 ARG B 237 -13.525 -1.105 -2.963 1.00 0.00 H new ATOM 0 HD2 ARG B 237 -13.698 -0.327 -5.382 1.00 0.00 H new ATOM 0 HD3 ARG B 237 -11.966 -0.576 -5.490 1.00 0.00 H new ATOM 0 HE ARG B 237 -12.271 -2.934 -5.215 1.00 0.00 H new ATOM 0 HH11 ARG B 237 -15.293 -1.103 -5.493 1.00 0.00 H new ATOM 0 HH12 ARG B 237 -16.280 -2.547 -5.742 1.00 0.00 H new ATOM 0 HH21 ARG B 237 -13.535 -4.779 -5.536 1.00 0.00 H new ATOM 0 HH22 ARG B 237 -15.280 -4.634 -5.766 1.00 0.00 H new ATOM 1689 N SER B 238 -15.652 2.663 -2.194 1.00 0.00 N ATOM 1690 CA SER B 238 -16.109 3.644 -1.279 1.00 0.00 C ATOM 1691 C SER B 238 -16.912 2.987 -0.201 1.00 0.00 C ATOM 1692 O SER B 238 -17.812 2.182 -0.480 1.00 0.00 O ATOM 1693 CB SER B 238 -16.957 4.697 -2.001 1.00 0.00 C ATOM 1694 OG SER B 238 -17.434 5.697 -1.101 1.00 0.00 O ATOM 0 H SER B 238 -16.331 1.932 -2.403 1.00 0.00 H new ATOM 0 HA SER B 238 -15.248 4.143 -0.834 1.00 0.00 H new ATOM 0 HB2 SER B 238 -16.364 5.167 -2.786 1.00 0.00 H new ATOM 0 HB3 SER B 238 -17.803 4.212 -2.488 1.00 0.00 H new ATOM 0 HG SER B 238 -17.969 6.353 -1.595 1.00 0.00 H new ATOM 1700 N ASN B 239 -16.582 3.307 1.012 1.00 0.00 N ATOM 1701 CA ASN B 239 -17.321 2.840 2.150 1.00 0.00 C ATOM 1702 C ASN B 239 -18.429 3.845 2.436 1.00 0.00 C ATOM 1703 O ASN B 239 -18.654 4.783 1.635 1.00 0.00 O ATOM 1704 CB ASN B 239 -16.414 2.702 3.387 1.00 0.00 C ATOM 1705 CG ASN B 239 -15.896 4.032 3.940 1.00 0.00 C ATOM 1706 OD1 ASN B 239 -15.618 4.988 3.197 1.00 0.00 O ATOM 1707 ND2 ASN B 239 -15.832 4.128 5.233 1.00 0.00 N ATOM 0 H ASN B 239 -15.788 3.903 1.245 1.00 0.00 H new ATOM 0 HA ASN B 239 -17.735 1.855 1.932 1.00 0.00 H new ATOM 0 HB2 ASN B 239 -16.966 2.186 4.172 1.00 0.00 H new ATOM 0 HB3 ASN B 239 -15.562 2.072 3.130 1.00 0.00 H new ATOM 0 HD21 ASN B 239 -15.547 5.007 5.666 1.00 0.00 H new ATOM 0 HD22 ASN B 239 -16.067 3.325 5.816 1.00 0.00 H new ATOM 1714 N GLY B 240 -19.093 3.684 3.544 1.00 0.00 N ATOM 1715 CA GLY B 240 -20.153 4.573 3.897 1.00 0.00 C ATOM 1716 C GLY B 240 -21.344 3.815 4.381 1.00 0.00 C ATOM 1717 O GLY B 240 -22.274 4.381 4.882 1.00 0.00 O ATOM 0 H GLY B 240 -18.915 2.940 4.219 1.00 0.00 H new ATOM 0 HA2 GLY B 240 -19.814 5.260 4.673 1.00 0.00 H new ATOM 0 HA3 GLY B 240 -20.428 5.178 3.033 1.00 0.00 H new ATOM 1721 N PHE B 241 -21.317 2.533 4.193 1.00 0.00 N ATOM 1722 CA PHE B 241 -22.380 1.663 4.650 1.00 0.00 C ATOM 1723 C PHE B 241 -22.293 1.406 6.163 1.00 0.00 C ATOM 1724 O PHE B 241 -23.314 1.310 6.850 1.00 0.00 O ATOM 1725 CB PHE B 241 -22.409 0.347 3.840 1.00 0.00 C ATOM 1726 CG PHE B 241 -21.094 -0.406 3.801 1.00 0.00 C ATOM 1727 CD1 PHE B 241 -20.144 -0.129 2.826 1.00 0.00 C ATOM 1728 CD2 PHE B 241 -20.814 -1.386 4.730 1.00 0.00 C ATOM 1729 CE1 PHE B 241 -18.948 -0.815 2.789 1.00 0.00 C ATOM 1730 CE2 PHE B 241 -19.621 -2.073 4.698 1.00 0.00 C ATOM 1731 CZ PHE B 241 -18.687 -1.786 3.727 1.00 0.00 C ATOM 0 H PHE B 241 -20.557 2.048 3.716 1.00 0.00 H new ATOM 0 HA PHE B 241 -23.326 2.175 4.473 1.00 0.00 H new ATOM 0 HB2 PHE B 241 -23.173 -0.306 4.262 1.00 0.00 H new ATOM 0 HB3 PHE B 241 -22.712 0.573 2.818 1.00 0.00 H new ATOM 0 HD1 PHE B 241 -20.344 0.633 2.088 1.00 0.00 H new ATOM 0 HD2 PHE B 241 -21.541 -1.618 5.494 1.00 0.00 H new ATOM 0 HE1 PHE B 241 -18.218 -0.590 2.025 1.00 0.00 H new ATOM 0 HE2 PHE B 241 -19.418 -2.837 5.434 1.00 0.00 H new ATOM 0 HZ PHE B 241 -17.750 -2.323 3.702 1.00 0.00 H new ATOM 1741 N GLU B 242 -21.068 1.347 6.675 1.00 0.00 N ATOM 1742 CA GLU B 242 -20.809 1.002 8.077 1.00 0.00 C ATOM 1743 C GLU B 242 -21.425 2.033 8.998 1.00 0.00 C ATOM 1744 O GLU B 242 -22.035 1.686 10.024 1.00 0.00 O ATOM 1745 CB GLU B 242 -19.306 0.923 8.398 1.00 0.00 C ATOM 1746 CG GLU B 242 -18.411 0.391 7.297 1.00 0.00 C ATOM 1747 CD GLU B 242 -18.053 1.479 6.326 1.00 0.00 C ATOM 1748 OE1 GLU B 242 -17.094 2.217 6.602 1.00 0.00 O ATOM 1749 OE2 GLU B 242 -18.765 1.663 5.322 1.00 0.00 O ATOM 0 H GLU B 242 -20.224 1.536 6.134 1.00 0.00 H new ATOM 0 HA GLU B 242 -21.255 0.020 8.234 1.00 0.00 H new ATOM 0 HB2 GLU B 242 -18.961 1.921 8.667 1.00 0.00 H new ATOM 0 HB3 GLU B 242 -19.177 0.293 9.278 1.00 0.00 H new ATOM 0 HG2 GLU B 242 -17.503 -0.028 7.731 1.00 0.00 H new ATOM 0 HG3 GLU B 242 -18.916 -0.419 6.772 1.00 0.00 H new ATOM 1756 N GLU B 243 -21.285 3.295 8.611 1.00 0.00 N ATOM 1757 CA GLU B 243 -21.790 4.412 9.390 1.00 0.00 C ATOM 1758 C GLU B 243 -23.298 4.344 9.502 1.00 0.00 C ATOM 1759 O GLU B 243 -23.851 4.672 10.527 1.00 0.00 O ATOM 1760 CB GLU B 243 -21.374 5.761 8.782 1.00 0.00 C ATOM 1761 CG GLU B 243 -21.823 5.937 7.354 1.00 0.00 C ATOM 1762 CD GLU B 243 -21.571 7.301 6.789 1.00 0.00 C ATOM 1763 OE1 GLU B 243 -20.431 7.585 6.356 1.00 0.00 O ATOM 1764 OE2 GLU B 243 -22.522 8.103 6.720 1.00 0.00 O ATOM 0 H GLU B 243 -20.817 3.570 7.747 1.00 0.00 H new ATOM 0 HA GLU B 243 -21.352 4.338 10.385 1.00 0.00 H new ATOM 0 HB2 GLU B 243 -21.788 6.567 9.387 1.00 0.00 H new ATOM 0 HB3 GLU B 243 -20.289 5.853 8.828 1.00 0.00 H new ATOM 0 HG2 GLU B 243 -21.314 5.200 6.733 1.00 0.00 H new ATOM 0 HG3 GLU B 243 -22.890 5.723 7.293 1.00 0.00 H new ATOM 1771 N LYS B 244 -23.949 3.877 8.443 1.00 0.00 N ATOM 1772 CA LYS B 244 -25.385 3.809 8.390 1.00 0.00 C ATOM 1773 C LYS B 244 -25.880 2.816 9.406 1.00 0.00 C ATOM 1774 O LYS B 244 -26.835 3.084 10.135 1.00 0.00 O ATOM 1775 CB LYS B 244 -25.822 3.399 6.997 1.00 0.00 C ATOM 1776 CG LYS B 244 -25.121 4.176 5.897 1.00 0.00 C ATOM 1777 CD LYS B 244 -25.382 5.668 5.974 1.00 0.00 C ATOM 1778 CE LYS B 244 -24.714 6.415 4.826 1.00 0.00 C ATOM 1779 NZ LYS B 244 -24.733 7.878 5.028 1.00 0.00 N ATOM 0 H LYS B 244 -23.485 3.537 7.601 1.00 0.00 H new ATOM 0 HA LYS B 244 -25.807 4.788 8.619 1.00 0.00 H new ATOM 0 HB2 LYS B 244 -25.629 2.335 6.861 1.00 0.00 H new ATOM 0 HB3 LYS B 244 -26.899 3.542 6.904 1.00 0.00 H new ATOM 0 HG2 LYS B 244 -24.048 3.996 5.958 1.00 0.00 H new ATOM 0 HG3 LYS B 244 -25.452 3.803 4.928 1.00 0.00 H new ATOM 0 HD2 LYS B 244 -26.456 5.852 5.952 1.00 0.00 H new ATOM 0 HD3 LYS B 244 -25.012 6.054 6.924 1.00 0.00 H new ATOM 0 HE2 LYS B 244 -23.683 6.077 4.726 1.00 0.00 H new ATOM 0 HE3 LYS B 244 -25.221 6.172 3.892 1.00 0.00 H new ATOM 0 HZ1 LYS B 244 -24.642 8.357 4.109 1.00 0.00 H new ATOM 0 HZ2 LYS B 244 -25.630 8.155 5.475 1.00 0.00 H new ATOM 0 HZ3 LYS B 244 -23.940 8.154 5.642 1.00 0.00 H new ATOM 1793 N TRP B 245 -25.199 1.692 9.478 1.00 0.00 N ATOM 1794 CA TRP B 245 -25.523 0.648 10.432 1.00 0.00 C ATOM 1795 C TRP B 245 -25.282 1.151 11.841 1.00 0.00 C ATOM 1796 O TRP B 245 -26.102 0.965 12.722 1.00 0.00 O ATOM 1797 CB TRP B 245 -24.689 -0.607 10.172 1.00 0.00 C ATOM 1798 CG TRP B 245 -24.856 -1.175 8.794 1.00 0.00 C ATOM 1799 CD1 TRP B 245 -25.900 -0.971 7.939 1.00 0.00 C ATOM 1800 CD2 TRP B 245 -23.964 -2.067 8.126 1.00 0.00 C ATOM 1801 NE1 TRP B 245 -25.697 -1.654 6.776 1.00 0.00 N ATOM 1802 CE2 TRP B 245 -24.520 -2.346 6.866 1.00 0.00 C ATOM 1803 CE3 TRP B 245 -22.745 -2.651 8.468 1.00 0.00 C ATOM 1804 CZ2 TRP B 245 -23.899 -3.187 5.951 1.00 0.00 C ATOM 1805 CZ3 TRP B 245 -22.133 -3.484 7.560 1.00 0.00 C ATOM 1806 CH2 TRP B 245 -22.710 -3.747 6.317 1.00 0.00 C ATOM 0 H TRP B 245 -24.404 1.474 8.877 1.00 0.00 H new ATOM 0 HA TRP B 245 -26.575 0.386 10.316 1.00 0.00 H new ATOM 0 HB2 TRP B 245 -23.637 -0.371 10.332 1.00 0.00 H new ATOM 0 HB3 TRP B 245 -24.960 -1.369 10.903 1.00 0.00 H new ATOM 0 HD1 TRP B 245 -26.763 -0.357 8.153 1.00 0.00 H new ATOM 0 HE1 TRP B 245 -26.322 -1.650 5.970 1.00 0.00 H new ATOM 0 HE3 TRP B 245 -22.290 -2.453 9.427 1.00 0.00 H new ATOM 0 HZ2 TRP B 245 -24.341 -3.390 4.987 1.00 0.00 H new ATOM 0 HZ3 TRP B 245 -21.189 -3.943 7.814 1.00 0.00 H new ATOM 0 HH2 TRP B 245 -22.204 -4.409 5.629 1.00 0.00 H new ATOM 1817 N PHE B 246 -24.185 1.855 12.014 1.00 0.00 N ATOM 1818 CA PHE B 246 -23.803 2.435 13.290 1.00 0.00 C ATOM 1819 C PHE B 246 -24.792 3.542 13.711 1.00 0.00 C ATOM 1820 O PHE B 246 -25.024 3.791 14.900 1.00 0.00 O ATOM 1821 CB PHE B 246 -22.349 2.950 13.180 1.00 0.00 C ATOM 1822 CG PHE B 246 -21.993 4.076 14.102 1.00 0.00 C ATOM 1823 CD1 PHE B 246 -21.552 3.843 15.390 1.00 0.00 C ATOM 1824 CD2 PHE B 246 -22.115 5.381 13.658 1.00 0.00 C ATOM 1825 CE1 PHE B 246 -21.240 4.901 16.225 1.00 0.00 C ATOM 1826 CE2 PHE B 246 -21.809 6.440 14.479 1.00 0.00 C ATOM 1827 CZ PHE B 246 -21.371 6.203 15.769 1.00 0.00 C ATOM 0 H PHE B 246 -23.521 2.045 11.263 1.00 0.00 H new ATOM 0 HA PHE B 246 -23.845 1.680 14.075 1.00 0.00 H new ATOM 0 HB2 PHE B 246 -21.672 2.118 13.372 1.00 0.00 H new ATOM 0 HB3 PHE B 246 -22.173 3.274 12.154 1.00 0.00 H new ATOM 0 HD1 PHE B 246 -21.450 2.829 15.747 1.00 0.00 H new ATOM 0 HD2 PHE B 246 -22.456 5.570 12.651 1.00 0.00 H new ATOM 0 HE1 PHE B 246 -20.895 4.712 17.231 1.00 0.00 H new ATOM 0 HE2 PHE B 246 -21.910 7.453 14.118 1.00 0.00 H new ATOM 0 HZ PHE B 246 -21.131 7.031 16.420 1.00 0.00 H new ATOM 1837 N ALA B 247 -25.357 4.192 12.744 1.00 0.00 N ATOM 1838 CA ALA B 247 -26.311 5.224 12.995 1.00 0.00 C ATOM 1839 C ALA B 247 -27.672 4.645 13.364 1.00 0.00 C ATOM 1840 O ALA B 247 -28.328 5.130 14.278 1.00 0.00 O ATOM 1841 CB ALA B 247 -26.411 6.145 11.795 1.00 0.00 C ATOM 0 H ALA B 247 -25.169 4.022 11.756 1.00 0.00 H new ATOM 0 HA ALA B 247 -25.969 5.807 13.850 1.00 0.00 H new ATOM 0 HB1 ALA B 247 -27.141 6.928 11.997 1.00 0.00 H new ATOM 0 HB2 ALA B 247 -25.438 6.597 11.601 1.00 0.00 H new ATOM 0 HB3 ALA B 247 -26.725 5.573 10.922 1.00 0.00 H new ATOM 1847 N LYS B 248 -28.068 3.575 12.706 1.00 0.00 N ATOM 1848 CA LYS B 248 -29.395 3.010 12.911 1.00 0.00 C ATOM 1849 C LYS B 248 -29.417 2.023 14.075 1.00 0.00 C ATOM 1850 O LYS B 248 -30.473 1.693 14.606 1.00 0.00 O ATOM 1851 CB LYS B 248 -29.909 2.368 11.614 1.00 0.00 C ATOM 1852 CG LYS B 248 -29.128 1.144 11.131 1.00 0.00 C ATOM 1853 CD LYS B 248 -29.763 -0.158 11.596 1.00 0.00 C ATOM 1854 CE LYS B 248 -31.060 -0.420 10.853 1.00 0.00 C ATOM 1855 NZ LYS B 248 -31.801 -1.560 11.399 1.00 0.00 N ATOM 0 H LYS B 248 -27.495 3.077 12.025 1.00 0.00 H new ATOM 0 HA LYS B 248 -30.070 3.823 13.178 1.00 0.00 H new ATOM 0 HB2 LYS B 248 -30.950 2.079 11.760 1.00 0.00 H new ATOM 0 HB3 LYS B 248 -29.895 3.121 10.826 1.00 0.00 H new ATOM 0 HG2 LYS B 248 -29.076 1.153 10.042 1.00 0.00 H new ATOM 0 HG3 LYS B 248 -28.104 1.199 11.499 1.00 0.00 H new ATOM 0 HD2 LYS B 248 -29.071 -0.984 11.432 1.00 0.00 H new ATOM 0 HD3 LYS B 248 -29.956 -0.112 12.668 1.00 0.00 H new ATOM 0 HE2 LYS B 248 -31.686 0.471 10.898 1.00 0.00 H new ATOM 0 HE3 LYS B 248 -30.841 -0.604 9.801 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 -32.509 -1.878 10.706 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 -31.141 -2.338 11.602 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 -32.280 -1.275 12.277 1.00 0.00 H new ATOM 1869 N GLN B 249 -28.239 1.594 14.498 1.00 0.00 N ATOM 1870 CA GLN B 249 -28.097 0.628 15.598 1.00 0.00 C ATOM 1871 C GLN B 249 -28.439 1.253 16.950 1.00 0.00 C ATOM 1872 O GLN B 249 -28.326 0.606 17.996 1.00 0.00 O ATOM 1873 CB GLN B 249 -26.692 0.037 15.633 1.00 0.00 C ATOM 1874 CG GLN B 249 -25.610 1.018 16.008 1.00 0.00 C ATOM 1875 CD GLN B 249 -24.224 0.408 16.058 1.00 0.00 C ATOM 1876 OE1 GLN B 249 -23.982 -0.602 15.254 1.00 0.00 O flip ATOM 1877 NE2 GLN B 249 -23.368 0.865 16.815 1.00 0.00 N flip ATOM 0 H GLN B 249 -27.352 1.898 14.097 1.00 0.00 H new ATOM 0 HA GLN B 249 -28.809 -0.175 15.409 1.00 0.00 H new ATOM 0 HB2 GLN B 249 -26.677 -0.790 16.343 1.00 0.00 H new ATOM 0 HB3 GLN B 249 -26.463 -0.380 14.653 1.00 0.00 H new ATOM 0 HG2 GLN B 249 -25.611 1.838 15.290 1.00 0.00 H new ATOM 0 HG3 GLN B 249 -25.843 1.448 16.982 1.00 0.00 H new ATOM 0 HE21 GLN B 249 -23.594 1.651 17.425 1.00 0.00 H new ATOM 0 HE22 GLN B 249 -22.433 0.458 16.832 1.00 0.00 H new ATOM 1886 N ASN B 250 -28.832 2.513 16.912 1.00 0.00 N ATOM 1887 CA ASN B 250 -29.275 3.228 18.101 1.00 0.00 C ATOM 1888 C ASN B 250 -30.558 2.586 18.609 1.00 0.00 C ATOM 1889 O ASN B 250 -30.849 2.596 19.806 1.00 0.00 O ATOM 1890 CB ASN B 250 -29.508 4.729 17.826 1.00 0.00 C ATOM 1891 CG ASN B 250 -30.743 5.016 16.999 1.00 0.00 C ATOM 1892 OD1 ASN B 250 -31.823 5.242 17.524 1.00 0.00 O ATOM 1893 ND2 ASN B 250 -30.592 4.996 15.723 1.00 0.00 N ATOM 0 H ASN B 250 -28.854 3.071 16.059 1.00 0.00 H new ATOM 0 HA ASN B 250 -28.489 3.160 18.854 1.00 0.00 H new ATOM 0 HB2 ASN B 250 -29.590 5.254 18.778 1.00 0.00 H new ATOM 0 HB3 ASN B 250 -28.636 5.134 17.312 1.00 0.00 H new ATOM 0 HD21 ASN B 250 -31.390 5.173 15.112 1.00 0.00 H new ATOM 0 HD22 ASN B 250 -29.675 4.804 15.321 1.00 0.00 H new ATOM 1900 N GLU B 251 -31.308 2.020 17.682 1.00 0.00 N ATOM 1901 CA GLU B 251 -32.504 1.309 17.995 1.00 0.00 C ATOM 1902 C GLU B 251 -32.122 -0.065 18.511 1.00 0.00 C ATOM 1903 O GLU B 251 -31.574 -0.892 17.783 1.00 0.00 O ATOM 1904 CB GLU B 251 -33.432 1.249 16.780 1.00 0.00 C ATOM 1905 CG GLU B 251 -33.954 2.628 16.371 1.00 0.00 C ATOM 1906 CD GLU B 251 -34.781 2.636 15.103 1.00 0.00 C ATOM 1907 OE1 GLU B 251 -35.916 2.109 15.093 1.00 0.00 O ATOM 1908 OE2 GLU B 251 -34.337 3.228 14.089 1.00 0.00 O ATOM 0 H GLU B 251 -31.090 2.049 16.686 1.00 0.00 H new ATOM 0 HA GLU B 251 -33.064 1.826 18.774 1.00 0.00 H new ATOM 0 HB2 GLU B 251 -32.898 0.803 15.941 1.00 0.00 H new ATOM 0 HB3 GLU B 251 -34.276 0.597 17.004 1.00 0.00 H new ATOM 0 HG2 GLU B 251 -34.557 3.030 17.185 1.00 0.00 H new ATOM 0 HG3 GLU B 251 -33.105 3.300 16.240 1.00 0.00 H new ATOM 1915 N ILE B 252 -32.379 -0.276 19.771 1.00 0.00 N ATOM 1916 CA ILE B 252 -31.933 -1.460 20.463 1.00 0.00 C ATOM 1917 C ILE B 252 -33.055 -2.447 20.665 1.00 0.00 C ATOM 1918 O ILE B 252 -32.845 -3.656 20.622 1.00 0.00 O ATOM 1919 CB ILE B 252 -31.279 -1.108 21.825 1.00 0.00 C ATOM 1920 CG1 ILE B 252 -32.240 -0.297 22.712 1.00 0.00 C ATOM 1921 CG2 ILE B 252 -29.991 -0.335 21.599 1.00 0.00 C ATOM 1922 CD1 ILE B 252 -31.680 0.039 24.070 1.00 0.00 C ATOM 0 H ILE B 252 -32.908 0.372 20.355 1.00 0.00 H new ATOM 0 HA ILE B 252 -31.180 -1.929 19.829 1.00 0.00 H new ATOM 0 HB ILE B 252 -31.051 -2.039 22.343 1.00 0.00 H new ATOM 0 HG12 ILE B 252 -32.500 0.628 22.198 1.00 0.00 H new ATOM 0 HG13 ILE B 252 -33.164 -0.861 22.840 1.00 0.00 H new ATOM 0 HG21 ILE B 252 -29.539 -0.092 22.561 1.00 0.00 H new ATOM 0 HG22 ILE B 252 -29.299 -0.943 21.016 1.00 0.00 H new ATOM 0 HG23 ILE B 252 -30.209 0.586 21.058 1.00 0.00 H new ATOM 0 HD11 ILE B 252 -32.416 0.611 24.636 1.00 0.00 H new ATOM 0 HD12 ILE B 252 -31.446 -0.881 24.605 1.00 0.00 H new ATOM 0 HD13 ILE B 252 -30.772 0.631 23.953 1.00 0.00 H new ATOM 1934 N ASN B 253 -34.246 -1.936 20.872 1.00 0.00 N ATOM 1935 CA ASN B 253 -35.402 -2.791 21.074 1.00 0.00 C ATOM 1936 C ASN B 253 -36.175 -2.862 19.794 1.00 0.00 C ATOM 1937 O ASN B 253 -37.044 -3.717 19.596 1.00 0.00 O ATOM 1938 CB ASN B 253 -36.295 -2.276 22.208 1.00 0.00 C ATOM 1939 CG ASN B 253 -36.985 -0.962 21.908 1.00 0.00 C ATOM 1940 OD1 ASN B 253 -38.074 -0.931 21.328 1.00 0.00 O ATOM 1941 ND2 ASN B 253 -36.403 0.120 22.341 1.00 0.00 N ATOM 0 H ASN B 253 -34.444 -0.936 20.906 1.00 0.00 H new ATOM 0 HA ASN B 253 -35.059 -3.785 21.362 1.00 0.00 H new ATOM 0 HB2 ASN B 253 -37.052 -3.028 22.429 1.00 0.00 H new ATOM 0 HB3 ASN B 253 -35.690 -2.159 23.107 1.00 0.00 H new ATOM 0 HD21 ASN B 253 -36.848 1.028 22.204 1.00 0.00 H new ATOM 0 HD22 ASN B 253 -35.503 0.059 22.817 1.00 0.00 H new ATOM 1948 N GLU B 254 -35.857 -1.947 18.941 1.00 0.00 N ATOM 1949 CA GLU B 254 -36.423 -1.857 17.645 1.00 0.00 C ATOM 1950 C GLU B 254 -35.497 -2.481 16.616 1.00 0.00 C ATOM 1951 O GLU B 254 -34.525 -3.162 16.962 1.00 0.00 O ATOM 1952 CB GLU B 254 -36.727 -0.400 17.304 1.00 0.00 C ATOM 1953 CG GLU B 254 -38.191 -0.029 17.428 1.00 0.00 C ATOM 1954 CD GLU B 254 -39.046 -0.828 16.482 1.00 0.00 C ATOM 1955 OE1 GLU B 254 -38.875 -0.694 15.245 1.00 0.00 O ATOM 1956 OE2 GLU B 254 -39.866 -1.644 16.940 1.00 0.00 O ATOM 0 H GLU B 254 -35.172 -1.218 19.138 1.00 0.00 H new ATOM 0 HA GLU B 254 -37.361 -2.412 17.629 1.00 0.00 H new ATOM 0 HB2 GLU B 254 -36.143 0.245 17.960 1.00 0.00 H new ATOM 0 HB3 GLU B 254 -36.397 -0.200 16.284 1.00 0.00 H new ATOM 0 HG2 GLU B 254 -38.524 -0.198 18.452 1.00 0.00 H new ATOM 0 HG3 GLU B 254 -38.316 1.034 17.223 1.00 0.00 H new ATOM 1963 N LYS B 255 -35.832 -2.263 15.383 1.00 0.00 N ATOM 1964 CA LYS B 255 -35.132 -2.782 14.223 1.00 0.00 C ATOM 1965 C LYS B 255 -33.639 -2.415 14.167 1.00 0.00 C ATOM 1966 O LYS B 255 -33.252 -1.286 13.840 1.00 0.00 O ATOM 1967 CB LYS B 255 -35.879 -2.331 12.960 1.00 0.00 C ATOM 1968 CG LYS B 255 -36.156 -0.835 12.941 1.00 0.00 C ATOM 1969 CD LYS B 255 -37.235 -0.467 11.962 1.00 0.00 C ATOM 1970 CE LYS B 255 -37.636 0.985 12.143 1.00 0.00 C ATOM 1971 NZ LYS B 255 -37.978 1.292 13.562 1.00 0.00 N ATOM 0 H LYS B 255 -36.639 -1.692 15.133 1.00 0.00 H new ATOM 0 HA LYS B 255 -35.134 -3.870 14.296 1.00 0.00 H new ATOM 0 HB2 LYS B 255 -35.292 -2.598 12.081 1.00 0.00 H new ATOM 0 HB3 LYS B 255 -36.823 -2.872 12.889 1.00 0.00 H new ATOM 0 HG2 LYS B 255 -36.448 -0.509 13.939 1.00 0.00 H new ATOM 0 HG3 LYS B 255 -35.240 -0.301 12.687 1.00 0.00 H new ATOM 0 HD2 LYS B 255 -36.883 -0.630 10.943 1.00 0.00 H new ATOM 0 HD3 LYS B 255 -38.102 -1.112 12.106 1.00 0.00 H new ATOM 0 HE2 LYS B 255 -36.820 1.631 11.818 1.00 0.00 H new ATOM 0 HE3 LYS B 255 -38.492 1.208 11.506 1.00 0.00 H new ATOM 0 HZ1 LYS B 255 -38.624 2.106 13.595 1.00 0.00 H new ATOM 0 HZ2 LYS B 255 -38.439 0.466 13.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 255 -37.109 1.518 14.087 1.00 0.00 H new ATOM 1985 N LYS B 256 -32.818 -3.361 14.498 1.00 0.00 N ATOM 1986 CA LYS B 256 -31.405 -3.208 14.381 1.00 0.00 C ATOM 1987 C LYS B 256 -30.936 -4.204 13.358 1.00 0.00 C ATOM 1988 O LYS B 256 -30.649 -3.805 12.223 1.00 0.00 O ATOM 1989 CB LYS B 256 -30.679 -3.431 15.708 1.00 0.00 C ATOM 1990 CG LYS B 256 -29.174 -3.182 15.602 1.00 0.00 C ATOM 1991 CD LYS B 256 -28.429 -3.527 16.880 1.00 0.00 C ATOM 1992 CE LYS B 256 -28.878 -2.687 18.062 1.00 0.00 C ATOM 1993 NZ LYS B 256 -28.141 -3.055 19.279 1.00 0.00 N ATOM 1994 OXT LYS B 256 -30.950 -5.406 13.651 1.00 0.00 O ATOM 0 H LYS B 256 -33.113 -4.268 14.860 1.00 0.00 H new ATOM 0 HA LYS B 256 -31.177 -2.185 14.080 1.00 0.00 H new ATOM 0 HB2 LYS B 256 -31.101 -2.770 16.465 1.00 0.00 H new ATOM 0 HB3 LYS B 256 -30.852 -4.453 16.046 1.00 0.00 H new ATOM 0 HG2 LYS B 256 -28.770 -3.773 14.780 1.00 0.00 H new ATOM 0 HG3 LYS B 256 -29.000 -2.134 15.357 1.00 0.00 H new ATOM 0 HD2 LYS B 256 -28.579 -4.582 17.110 1.00 0.00 H new ATOM 0 HD3 LYS B 256 -27.360 -3.384 16.723 1.00 0.00 H new ATOM 0 HE2 LYS B 256 -28.721 -1.631 17.843 1.00 0.00 H new ATOM 0 HE3 LYS B 256 -29.947 -2.823 18.225 1.00 0.00 H new ATOM 0 HZ1 LYS B 256 -28.709 -2.812 20.116 1.00 0.00 H new ATOM 0 HZ2 LYS B 256 -27.951 -4.078 19.274 1.00 0.00 H new ATOM 0 HZ3 LYS B 256 -27.240 -2.536 19.310 1.00 0.00 H new TER 2008 LYS B 256