USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 579 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 572 THR OG1 : rot -61:sc= 0.332 USER MOD Set 1.2: A 574 SER OG : rot 180:sc= -0.0036 USER MOD Set 1.3: A 575 SER OG : rot 180:sc= 0.0126 USER MOD Single : A 561 THR OG1 : rot 180:sc= 0 USER MOD Single : A 564 THR OG1 : rot 180:sc= -0.0844 USER MOD Single : A 565 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 568 SER OG : rot 180:sc= 0 USER MOD Single : A 569 THR OG1 : rot 180:sc= 0.319 USER MOD Single : A 571 GLN : amide:sc= -1.28 K(o=-1.3,f=-0.5) USER MOD Single : A 573 THR OG1 : rot 180:sc= 0 USER MOD Single : A 577 THR OG1 : rot 75:sc= 0.627 USER MOD Single : A 579 SER OG : rot 180:sc= 0 USER MOD Single : A 581 THR OG1 : rot 83:sc= 1.12 USER MOD Single : A 583 SER OG : rot -80:sc= 0.119 USER MOD Single : A 584 THR OG1 : rot 180:sc= 0.00955 USER MOD Single : A 586 ASN : amide:sc= -0.361 K(o=-0.36,f=-2.1) USER MOD Single : A 590 THR OG1 : rot 180:sc= 0 USER MOD Single : A 592 TYR OH : rot 30:sc= -0.0187 USER MOD Single : A 595 TYR OH : rot 180:sc= 0 USER MOD Single : A 596 ASN : amide:sc= -0.719 K(o=-0.72,f=-0.073) USER MOD Single : A 598 THR OG1 : rot 30:sc= 0.34 USER MOD Single : A 602 THR OG1 : rot 167:sc= 0.278 USER MOD Single : A 603 THR OG1 : rot 180:sc= 0 USER MOD Single : A 605 THR OG1 : rot 180:sc= 0 USER MOD Single : A 607 THR OG1 : rot 180:sc= 0.018 USER MOD Single : A 608 THR OG1 : rot 180:sc= 0 USER MOD Single : A 610 THR OG1 : rot 180:sc= 0 USER MOD Single : A 612 SER OG : rot 180:sc= 0 USER MOD Single : A 618 THR OG1 : rot 89:sc= 0.566 USER MOD Single : A 619 SER OG : rot 180:sc= 0 USER MOD Single : A 620 TYR OH : rot 100:sc= -0.126 USER MOD Single : A 621 THR OG1 : rot 39:sc= 0.169 USER MOD Single : A 623 THR OG1 : rot 180:sc= 0 USER MOD Single : A 625 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 627 LYS NZ :NH3+ -164:sc= -1.01 (180deg=-1.1) USER MOD Single : A 632 ASN : amide:sc= -0.276 X(o=-0.28,f=-0.44) USER MOD Single : A 634 SER OG : rot 70:sc= -1.85! USER MOD Single : A 637 SER OG : rot -50:sc= 0 USER MOD Single : A 638 ASN : amide:sc= -0.0933 X(o=-0.093,f=0) USER MOD Single : A 641 SER OG : rot 60:sc= -0.533 USER MOD Single : A 643 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 644 THR OG1 : rot 174:sc= 1.39 USER MOD ----------------------------------------------------------------- ATOM 38 N ALA A 559 -17.174 4.150 3.954 1.00 0.00 N ATOM 39 CA ALA A 559 -15.840 3.818 3.466 1.00 0.00 C ATOM 40 C ALA A 559 -15.617 2.306 3.449 1.00 0.00 C ATOM 41 O ALA A 559 -16.237 1.573 4.218 1.00 0.00 O ATOM 42 CB ALA A 559 -14.787 4.502 4.323 1.00 0.00 C ATOM 0 HA ALA A 559 -15.752 4.178 2.441 1.00 0.00 H new ATOM 0 HB1 ALA A 559 -13.794 4.248 3.951 1.00 0.00 H new ATOM 0 HB2 ALA A 559 -14.926 5.582 4.278 1.00 0.00 H new ATOM 0 HB3 ALA A 559 -14.884 4.167 5.356 1.00 0.00 H new ATOM 48 N PRO A 560 -14.721 1.817 2.569 1.00 0.00 N ATOM 49 CA PRO A 560 -14.422 0.385 2.462 1.00 0.00 C ATOM 50 C PRO A 560 -13.604 -0.126 3.643 1.00 0.00 C ATOM 51 O PRO A 560 -13.491 0.546 4.668 1.00 0.00 O ATOM 52 CB PRO A 560 -13.612 0.292 1.170 1.00 0.00 C ATOM 53 CG PRO A 560 -12.957 1.622 1.042 1.00 0.00 C ATOM 54 CD PRO A 560 -13.929 2.619 1.612 1.00 0.00 C ATOM 0 HA PRO A 560 -15.326 -0.223 2.460 1.00 0.00 H new ATOM 0 HB2 PRO A 560 -12.875 -0.510 1.221 1.00 0.00 H new ATOM 0 HB3 PRO A 560 -14.253 0.082 0.314 1.00 0.00 H new ATOM 0 HG2 PRO A 560 -12.011 1.645 1.584 1.00 0.00 H new ATOM 0 HG3 PRO A 560 -12.733 1.848 -0.000 1.00 0.00 H new ATOM 0 HD2 PRO A 560 -13.415 3.443 2.107 1.00 0.00 H new ATOM 0 HD3 PRO A 560 -14.558 3.055 0.836 1.00 0.00 H new ATOM 62 N THR A 561 -13.037 -1.320 3.494 1.00 0.00 N ATOM 63 CA THR A 561 -12.229 -1.920 4.549 1.00 0.00 C ATOM 64 C THR A 561 -10.749 -1.613 4.351 1.00 0.00 C ATOM 65 O THR A 561 -10.232 -1.685 3.237 1.00 0.00 O ATOM 66 CB THR A 561 -12.422 -3.447 4.611 1.00 0.00 C ATOM 67 OG1 THR A 561 -13.817 -3.765 4.646 1.00 0.00 O ATOM 68 CG2 THR A 561 -11.734 -4.030 5.837 1.00 0.00 C ATOM 0 H THR A 561 -13.123 -1.890 2.653 1.00 0.00 H new ATOM 0 HA THR A 561 -12.566 -1.483 5.489 1.00 0.00 H new ATOM 0 HB THR A 561 -11.973 -3.883 3.719 1.00 0.00 H new ATOM 0 HG1 THR A 561 -13.930 -4.738 4.684 1.00 0.00 H new ATOM 0 HG21 THR A 561 -11.884 -5.109 5.860 1.00 0.00 H new ATOM 0 HG22 THR A 561 -10.667 -3.813 5.793 1.00 0.00 H new ATOM 0 HG23 THR A 561 -12.158 -3.586 6.738 1.00 0.00 H new ATOM 76 N ALA A 562 -10.074 -1.270 5.444 1.00 0.00 N ATOM 77 CA ALA A 562 -8.653 -0.948 5.402 1.00 0.00 C ATOM 78 C ALA A 562 -7.807 -2.210 5.227 1.00 0.00 C ATOM 79 O ALA A 562 -7.980 -3.182 5.963 1.00 0.00 O ATOM 80 CB ALA A 562 -8.247 -0.220 6.673 1.00 0.00 C ATOM 0 H ALA A 562 -10.491 -1.208 6.373 1.00 0.00 H new ATOM 0 HA ALA A 562 -8.476 -0.300 4.544 1.00 0.00 H new ATOM 0 HB1 ALA A 562 -7.184 0.017 6.633 1.00 0.00 H new ATOM 0 HB2 ALA A 562 -8.821 0.702 6.763 1.00 0.00 H new ATOM 0 HB3 ALA A 562 -8.445 -0.856 7.536 1.00 0.00 H new ATOM 86 N PRO A 563 -6.876 -2.209 4.252 1.00 0.00 N ATOM 87 CA PRO A 563 -6.002 -3.359 3.996 1.00 0.00 C ATOM 88 C PRO A 563 -5.400 -3.918 5.281 1.00 0.00 C ATOM 89 O PRO A 563 -5.136 -3.175 6.227 1.00 0.00 O ATOM 90 CB PRO A 563 -4.908 -2.770 3.103 1.00 0.00 C ATOM 91 CG PRO A 563 -5.577 -1.653 2.380 1.00 0.00 C ATOM 92 CD PRO A 563 -6.601 -1.088 3.331 1.00 0.00 C ATOM 0 HA PRO A 563 -6.537 -4.194 3.545 1.00 0.00 H new ATOM 0 HB2 PRO A 563 -4.064 -2.412 3.693 1.00 0.00 H new ATOM 0 HB3 PRO A 563 -4.518 -3.515 2.409 1.00 0.00 H new ATOM 0 HG2 PRO A 563 -4.855 -0.891 2.088 1.00 0.00 H new ATOM 0 HG3 PRO A 563 -6.051 -2.010 1.465 1.00 0.00 H new ATOM 0 HD2 PRO A 563 -6.217 -0.217 3.863 1.00 0.00 H new ATOM 0 HD3 PRO A 563 -7.502 -0.770 2.807 1.00 0.00 H new ATOM 100 N THR A 564 -5.191 -5.230 5.316 1.00 0.00 N ATOM 101 CA THR A 564 -4.629 -5.878 6.496 1.00 0.00 C ATOM 102 C THR A 564 -3.524 -6.862 6.125 1.00 0.00 C ATOM 103 O THR A 564 -3.500 -7.400 5.017 1.00 0.00 O ATOM 104 CB THR A 564 -5.712 -6.621 7.301 1.00 0.00 C ATOM 105 OG1 THR A 564 -5.119 -7.672 8.074 1.00 0.00 O ATOM 106 CG2 THR A 564 -6.771 -7.203 6.378 1.00 0.00 C ATOM 0 H THR A 564 -5.401 -5.863 4.545 1.00 0.00 H new ATOM 0 HA THR A 564 -4.206 -5.084 7.111 1.00 0.00 H new ATOM 0 HB THR A 564 -6.188 -5.903 7.969 1.00 0.00 H new ATOM 0 HG1 THR A 564 -5.816 -8.137 8.583 1.00 0.00 H new ATOM 0 HG21 THR A 564 -7.524 -7.723 6.970 1.00 0.00 H new ATOM 0 HG22 THR A 564 -7.244 -6.399 5.814 1.00 0.00 H new ATOM 0 HG23 THR A 564 -6.305 -7.905 5.687 1.00 0.00 H new ATOM 114 N ASN A 565 -2.615 -7.093 7.069 1.00 0.00 N ATOM 115 CA ASN A 565 -1.501 -8.015 6.867 1.00 0.00 C ATOM 116 C ASN A 565 -0.682 -7.640 5.635 1.00 0.00 C ATOM 117 O ASN A 565 -0.703 -8.347 4.626 1.00 0.00 O ATOM 118 CB ASN A 565 -2.016 -9.449 6.737 1.00 0.00 C ATOM 119 CG ASN A 565 -1.805 -10.258 8.003 1.00 0.00 C ATOM 120 OD1 ASN A 565 -1.140 -11.294 7.989 1.00 0.00 O ATOM 121 ND2 ASN A 565 -2.374 -9.788 9.107 1.00 0.00 N ATOM 0 H ASN A 565 -2.629 -6.651 7.988 1.00 0.00 H new ATOM 0 HA ASN A 565 -0.850 -7.945 7.738 1.00 0.00 H new ATOM 0 HB2 ASN A 565 -3.079 -9.430 6.495 1.00 0.00 H new ATOM 0 HB3 ASN A 565 -1.509 -9.940 5.907 1.00 0.00 H new ATOM 0 HD21 ASN A 565 -2.268 -10.290 9.989 1.00 0.00 H new ATOM 0 HD22 ASN A 565 -2.917 -8.925 9.073 1.00 0.00 H new ATOM 128 N LEU A 566 0.047 -6.532 5.725 1.00 0.00 N ATOM 129 CA LEU A 566 0.880 -6.079 4.617 1.00 0.00 C ATOM 130 C LEU A 566 2.225 -6.796 4.636 1.00 0.00 C ATOM 131 O LEU A 566 2.639 -7.328 5.667 1.00 0.00 O ATOM 132 CB LEU A 566 1.090 -4.563 4.684 1.00 0.00 C ATOM 133 CG LEU A 566 2.153 -4.017 3.729 1.00 0.00 C ATOM 134 CD1 LEU A 566 1.657 -4.065 2.292 1.00 0.00 C ATOM 135 CD2 LEU A 566 2.539 -2.601 4.113 1.00 0.00 C ATOM 0 H LEU A 566 0.078 -5.933 6.550 1.00 0.00 H new ATOM 0 HA LEU A 566 0.368 -6.317 3.685 1.00 0.00 H new ATOM 0 HB2 LEU A 566 0.142 -4.070 4.469 1.00 0.00 H new ATOM 0 HB3 LEU A 566 1.366 -4.294 5.704 1.00 0.00 H new ATOM 0 HG LEU A 566 3.039 -4.647 3.807 1.00 0.00 H new ATOM 0 HD11 LEU A 566 2.427 -3.672 1.628 1.00 0.00 H new ATOM 0 HD12 LEU A 566 1.433 -5.096 2.019 1.00 0.00 H new ATOM 0 HD13 LEU A 566 0.755 -3.461 2.198 1.00 0.00 H new ATOM 0 HD21 LEU A 566 3.296 -2.230 3.422 1.00 0.00 H new ATOM 0 HD22 LEU A 566 1.660 -1.959 4.066 1.00 0.00 H new ATOM 0 HD23 LEU A 566 2.939 -2.595 5.127 1.00 0.00 H new ATOM 147 N ALA A 567 2.905 -6.810 3.494 1.00 0.00 N ATOM 148 CA ALA A 567 4.202 -7.467 3.393 1.00 0.00 C ATOM 149 C ALA A 567 4.993 -6.978 2.184 1.00 0.00 C ATOM 150 O ALA A 567 4.462 -6.280 1.321 1.00 0.00 O ATOM 151 CB ALA A 567 4.020 -8.976 3.331 1.00 0.00 C ATOM 0 H ALA A 567 2.581 -6.376 2.630 1.00 0.00 H new ATOM 0 HA ALA A 567 4.775 -7.210 4.284 1.00 0.00 H new ATOM 0 HB1 ALA A 567 4.995 -9.457 3.256 1.00 0.00 H new ATOM 0 HB2 ALA A 567 3.515 -9.319 4.234 1.00 0.00 H new ATOM 0 HB3 ALA A 567 3.419 -9.235 2.459 1.00 0.00 H new ATOM 157 N SER A 568 6.265 -7.363 2.131 1.00 0.00 N ATOM 158 CA SER A 568 7.144 -6.981 1.031 1.00 0.00 C ATOM 159 C SER A 568 7.759 -8.220 0.386 1.00 0.00 C ATOM 160 O SER A 568 8.228 -9.122 1.081 1.00 0.00 O ATOM 161 CB SER A 568 8.249 -6.049 1.528 1.00 0.00 C ATOM 162 OG SER A 568 8.210 -5.917 2.939 1.00 0.00 O ATOM 0 H SER A 568 6.712 -7.943 2.842 1.00 0.00 H new ATOM 0 HA SER A 568 6.549 -6.454 0.285 1.00 0.00 H new ATOM 0 HB2 SER A 568 9.221 -6.437 1.223 1.00 0.00 H new ATOM 0 HB3 SER A 568 8.138 -5.069 1.065 1.00 0.00 H new ATOM 0 HG SER A 568 8.928 -5.317 3.231 1.00 0.00 H new ATOM 168 N THR A 569 7.748 -8.262 -0.942 1.00 0.00 N ATOM 169 CA THR A 569 8.299 -9.398 -1.672 1.00 0.00 C ATOM 170 C THR A 569 9.590 -9.025 -2.398 1.00 0.00 C ATOM 171 O THR A 569 10.683 -9.166 -1.849 1.00 0.00 O ATOM 172 CB THR A 569 7.285 -9.949 -2.693 1.00 0.00 C ATOM 173 OG1 THR A 569 6.667 -8.869 -3.404 1.00 0.00 O ATOM 174 CG2 THR A 569 6.216 -10.779 -1.997 1.00 0.00 C ATOM 0 H THR A 569 7.365 -7.525 -1.534 1.00 0.00 H new ATOM 0 HA THR A 569 8.520 -10.169 -0.934 1.00 0.00 H new ATOM 0 HB THR A 569 7.821 -10.587 -3.396 1.00 0.00 H new ATOM 0 HG1 THR A 569 6.025 -9.228 -4.052 1.00 0.00 H new ATOM 0 HG21 THR A 569 5.511 -11.158 -2.737 1.00 0.00 H new ATOM 0 HG22 THR A 569 6.685 -11.616 -1.480 1.00 0.00 H new ATOM 0 HG23 THR A 569 5.686 -10.158 -1.275 1.00 0.00 H new ATOM 182 N ALA A 570 9.460 -8.554 -3.636 1.00 0.00 N ATOM 183 CA ALA A 570 10.619 -8.171 -4.433 1.00 0.00 C ATOM 184 C ALA A 570 10.983 -6.706 -4.216 1.00 0.00 C ATOM 185 O ALA A 570 10.369 -5.811 -4.796 1.00 0.00 O ATOM 186 CB ALA A 570 10.357 -8.439 -5.908 1.00 0.00 C ATOM 0 H ALA A 570 8.564 -8.429 -4.107 1.00 0.00 H new ATOM 0 HA ALA A 570 11.465 -8.777 -4.108 1.00 0.00 H new ATOM 0 HB1 ALA A 570 11.231 -8.148 -6.491 1.00 0.00 H new ATOM 0 HB2 ALA A 570 10.159 -9.501 -6.055 1.00 0.00 H new ATOM 0 HB3 ALA A 570 9.493 -7.860 -6.235 1.00 0.00 H new ATOM 192 N GLN A 571 11.990 -6.471 -3.380 1.00 0.00 N ATOM 193 CA GLN A 571 12.444 -5.116 -3.087 1.00 0.00 C ATOM 194 C GLN A 571 13.925 -4.959 -3.423 1.00 0.00 C ATOM 195 O GLN A 571 14.774 -5.667 -2.881 1.00 0.00 O ATOM 196 CB GLN A 571 12.199 -4.785 -1.611 1.00 0.00 C ATOM 197 CG GLN A 571 12.923 -3.538 -1.130 1.00 0.00 C ATOM 198 CD GLN A 571 14.242 -3.855 -0.454 1.00 0.00 C ATOM 199 OE1 GLN A 571 15.302 -3.412 -0.897 1.00 0.00 O ATOM 200 NE2 GLN A 571 14.185 -4.629 0.624 1.00 0.00 N ATOM 0 H GLN A 571 12.508 -7.203 -2.893 1.00 0.00 H new ATOM 0 HA GLN A 571 11.875 -4.421 -3.705 1.00 0.00 H new ATOM 0 HB2 GLN A 571 11.129 -4.656 -1.451 1.00 0.00 H new ATOM 0 HB3 GLN A 571 12.513 -5.633 -1.002 1.00 0.00 H new ATOM 0 HG2 GLN A 571 13.103 -2.877 -1.978 1.00 0.00 H new ATOM 0 HG3 GLN A 571 12.283 -2.996 -0.434 1.00 0.00 H new ATOM 0 HE21 GLN A 571 13.285 -4.974 0.957 1.00 0.00 H new ATOM 0 HE22 GLN A 571 15.041 -4.878 1.119 1.00 0.00 H new ATOM 209 N THR A 572 14.227 -4.026 -4.322 1.00 0.00 N ATOM 210 CA THR A 572 15.603 -3.773 -4.734 1.00 0.00 C ATOM 211 C THR A 572 16.090 -2.423 -4.214 1.00 0.00 C ATOM 212 O THR A 572 15.523 -1.872 -3.270 1.00 0.00 O ATOM 213 CB THR A 572 15.748 -3.806 -6.267 1.00 0.00 C ATOM 214 OG1 THR A 572 15.232 -2.595 -6.834 1.00 0.00 O ATOM 215 CG2 THR A 572 15.013 -5.000 -6.857 1.00 0.00 C ATOM 0 H THR A 572 13.535 -3.432 -4.779 1.00 0.00 H new ATOM 0 HA THR A 572 16.214 -4.567 -4.305 1.00 0.00 H new ATOM 0 HB THR A 572 16.807 -3.898 -6.506 1.00 0.00 H new ATOM 0 HG1 THR A 572 14.281 -2.509 -6.613 1.00 0.00 H new ATOM 0 HG21 THR A 572 15.131 -5.001 -7.941 1.00 0.00 H new ATOM 0 HG22 THR A 572 15.427 -5.921 -6.447 1.00 0.00 H new ATOM 0 HG23 THR A 572 13.954 -4.935 -6.607 1.00 0.00 H new ATOM 223 N THR A 573 17.141 -1.896 -4.835 1.00 0.00 N ATOM 224 CA THR A 573 17.699 -0.609 -4.433 1.00 0.00 C ATOM 225 C THR A 573 17.092 0.530 -5.247 1.00 0.00 C ATOM 226 O THR A 573 17.726 1.564 -5.455 1.00 0.00 O ATOM 227 CB THR A 573 19.230 -0.584 -4.596 1.00 0.00 C ATOM 228 OG1 THR A 573 19.586 -0.875 -5.952 1.00 0.00 O ATOM 229 CG2 THR A 573 19.892 -1.590 -3.666 1.00 0.00 C ATOM 0 H THR A 573 17.623 -2.339 -5.617 1.00 0.00 H new ATOM 0 HA THR A 573 17.453 -0.472 -3.380 1.00 0.00 H new ATOM 0 HB THR A 573 19.582 0.414 -4.335 1.00 0.00 H new ATOM 0 HG1 THR A 573 20.561 -0.855 -6.046 1.00 0.00 H new ATOM 0 HG21 THR A 573 20.973 -1.553 -3.800 1.00 0.00 H new ATOM 0 HG22 THR A 573 19.646 -1.347 -2.632 1.00 0.00 H new ATOM 0 HG23 THR A 573 19.532 -2.592 -3.898 1.00 0.00 H new ATOM 237 N SER A 574 15.859 0.330 -5.706 1.00 0.00 N ATOM 238 CA SER A 574 15.167 1.339 -6.499 1.00 0.00 C ATOM 239 C SER A 574 13.675 1.030 -6.602 1.00 0.00 C ATOM 240 O SER A 574 12.835 1.838 -6.205 1.00 0.00 O ATOM 241 CB SER A 574 15.778 1.422 -7.899 1.00 0.00 C ATOM 242 OG SER A 574 15.919 0.133 -8.470 1.00 0.00 O ATOM 0 H SER A 574 15.320 -0.521 -5.542 1.00 0.00 H new ATOM 0 HA SER A 574 15.285 2.300 -5.997 1.00 0.00 H new ATOM 0 HB2 SER A 574 15.147 2.040 -8.539 1.00 0.00 H new ATOM 0 HB3 SER A 574 16.752 1.908 -7.846 1.00 0.00 H new ATOM 0 HG SER A 574 16.310 0.213 -9.365 1.00 0.00 H new ATOM 248 N SER A 575 13.353 -0.143 -7.138 1.00 0.00 N ATOM 249 CA SER A 575 11.962 -0.559 -7.293 1.00 0.00 C ATOM 250 C SER A 575 11.573 -1.569 -6.220 1.00 0.00 C ATOM 251 O SER A 575 12.271 -2.560 -6.003 1.00 0.00 O ATOM 252 CB SER A 575 11.742 -1.160 -8.683 1.00 0.00 C ATOM 253 OG SER A 575 12.977 -1.468 -9.307 1.00 0.00 O ATOM 0 H SER A 575 14.036 -0.823 -7.473 1.00 0.00 H new ATOM 0 HA SER A 575 11.329 0.321 -7.181 1.00 0.00 H new ATOM 0 HB2 SER A 575 11.137 -2.063 -8.601 1.00 0.00 H new ATOM 0 HB3 SER A 575 11.183 -0.458 -9.302 1.00 0.00 H new ATOM 0 HG SER A 575 12.809 -1.852 -10.193 1.00 0.00 H new ATOM 259 N ILE A 576 10.454 -1.311 -5.546 1.00 0.00 N ATOM 260 CA ILE A 576 9.976 -2.197 -4.491 1.00 0.00 C ATOM 261 C ILE A 576 8.581 -2.732 -4.803 1.00 0.00 C ATOM 262 O ILE A 576 7.736 -2.020 -5.345 1.00 0.00 O ATOM 263 CB ILE A 576 9.946 -1.479 -3.125 1.00 0.00 C ATOM 264 CG1 ILE A 576 9.505 -2.446 -2.022 1.00 0.00 C ATOM 265 CG2 ILE A 576 9.023 -0.270 -3.179 1.00 0.00 C ATOM 266 CD1 ILE A 576 9.714 -1.907 -0.622 1.00 0.00 C ATOM 0 H ILE A 576 9.863 -0.496 -5.713 1.00 0.00 H new ATOM 0 HA ILE A 576 10.676 -3.031 -4.441 1.00 0.00 H new ATOM 0 HB ILE A 576 10.953 -1.131 -2.894 1.00 0.00 H new ATOM 0 HG12 ILE A 576 8.449 -2.681 -2.158 1.00 0.00 H new ATOM 0 HG13 ILE A 576 10.056 -3.380 -2.128 1.00 0.00 H new ATOM 0 HG21 ILE A 576 9.014 0.224 -2.208 1.00 0.00 H new ATOM 0 HG22 ILE A 576 9.380 0.427 -3.937 1.00 0.00 H new ATOM 0 HG23 ILE A 576 8.013 -0.594 -3.431 1.00 0.00 H new ATOM 0 HD11 ILE A 576 9.379 -2.646 0.106 1.00 0.00 H new ATOM 0 HD12 ILE A 576 10.773 -1.698 -0.467 1.00 0.00 H new ATOM 0 HD13 ILE A 576 9.141 -0.988 -0.496 1.00 0.00 H new ATOM 278 N THR A 577 8.348 -3.991 -4.446 1.00 0.00 N ATOM 279 CA THR A 577 7.057 -4.629 -4.673 1.00 0.00 C ATOM 280 C THR A 577 6.414 -5.016 -3.347 1.00 0.00 C ATOM 281 O THR A 577 7.031 -5.691 -2.522 1.00 0.00 O ATOM 282 CB THR A 577 7.195 -5.884 -5.555 1.00 0.00 C ATOM 283 OG1 THR A 577 8.139 -5.644 -6.606 1.00 0.00 O ATOM 284 CG2 THR A 577 5.853 -6.277 -6.153 1.00 0.00 C ATOM 0 H THR A 577 9.040 -4.591 -3.997 1.00 0.00 H new ATOM 0 HA THR A 577 6.425 -3.908 -5.191 1.00 0.00 H new ATOM 0 HB THR A 577 7.549 -6.703 -4.929 1.00 0.00 H new ATOM 0 HG1 THR A 577 9.048 -5.663 -6.240 1.00 0.00 H new ATOM 0 HG21 THR A 577 5.977 -7.166 -6.772 1.00 0.00 H new ATOM 0 HG22 THR A 577 5.145 -6.488 -5.351 1.00 0.00 H new ATOM 0 HG23 THR A 577 5.474 -5.459 -6.765 1.00 0.00 H new ATOM 292 N LEU A 578 5.177 -4.579 -3.141 1.00 0.00 N ATOM 293 CA LEU A 578 4.464 -4.876 -1.903 1.00 0.00 C ATOM 294 C LEU A 578 3.184 -5.659 -2.169 1.00 0.00 C ATOM 295 O LEU A 578 2.519 -5.460 -3.184 1.00 0.00 O ATOM 296 CB LEU A 578 4.130 -3.583 -1.160 1.00 0.00 C ATOM 297 CG LEU A 578 5.326 -2.852 -0.550 1.00 0.00 C ATOM 298 CD1 LEU A 578 4.904 -1.490 -0.024 1.00 0.00 C ATOM 299 CD2 LEU A 578 5.950 -3.682 0.562 1.00 0.00 C ATOM 0 H LEU A 578 4.649 -4.020 -3.811 1.00 0.00 H new ATOM 0 HA LEU A 578 5.119 -5.492 -1.286 1.00 0.00 H new ATOM 0 HB2 LEU A 578 3.625 -2.907 -1.850 1.00 0.00 H new ATOM 0 HB3 LEU A 578 3.422 -3.813 -0.364 1.00 0.00 H new ATOM 0 HG LEU A 578 6.073 -2.705 -1.330 1.00 0.00 H new ATOM 0 HD11 LEU A 578 5.767 -0.983 0.407 1.00 0.00 H new ATOM 0 HD12 LEU A 578 4.503 -0.892 -0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 578 4.138 -1.617 0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 578 6.800 -3.145 0.984 1.00 0.00 H new ATOM 0 HD22 LEU A 578 5.210 -3.860 1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 578 6.288 -4.636 0.158 1.00 0.00 H new ATOM 311 N SER A 579 2.841 -6.539 -1.235 1.00 0.00 N ATOM 312 CA SER A 579 1.634 -7.348 -1.343 1.00 0.00 C ATOM 313 C SER A 579 0.852 -7.295 -0.035 1.00 0.00 C ATOM 314 O SER A 579 1.441 -7.229 1.045 1.00 0.00 O ATOM 315 CB SER A 579 1.992 -8.796 -1.686 1.00 0.00 C ATOM 316 OG SER A 579 1.802 -9.647 -0.569 1.00 0.00 O ATOM 0 H SER A 579 3.386 -6.710 -0.390 1.00 0.00 H new ATOM 0 HA SER A 579 1.013 -6.945 -2.143 1.00 0.00 H new ATOM 0 HB2 SER A 579 1.376 -9.139 -2.517 1.00 0.00 H new ATOM 0 HB3 SER A 579 3.030 -8.849 -2.015 1.00 0.00 H new ATOM 0 HG SER A 579 2.036 -10.566 -0.815 1.00 0.00 H new ATOM 322 N TRP A 580 -0.473 -7.313 -0.131 1.00 0.00 N ATOM 323 CA TRP A 580 -1.323 -7.253 1.055 1.00 0.00 C ATOM 324 C TRP A 580 -2.683 -7.891 0.794 1.00 0.00 C ATOM 325 O TRP A 580 -3.025 -8.206 -0.346 1.00 0.00 O ATOM 326 CB TRP A 580 -1.510 -5.800 1.492 1.00 0.00 C ATOM 327 CG TRP A 580 -2.152 -4.950 0.436 1.00 0.00 C ATOM 328 CD1 TRP A 580 -3.483 -4.682 0.294 1.00 0.00 C ATOM 329 CD2 TRP A 580 -1.489 -4.269 -0.635 1.00 0.00 C ATOM 330 NE1 TRP A 580 -3.688 -3.875 -0.798 1.00 0.00 N ATOM 331 CE2 TRP A 580 -2.479 -3.607 -1.385 1.00 0.00 C ATOM 332 CE3 TRP A 580 -0.155 -4.153 -1.029 1.00 0.00 C ATOM 333 CZ2 TRP A 580 -2.175 -2.842 -2.508 1.00 0.00 C ATOM 334 CZ3 TRP A 580 0.147 -3.393 -2.143 1.00 0.00 C ATOM 335 CH2 TRP A 580 -0.858 -2.747 -2.872 1.00 0.00 C ATOM 0 H TRP A 580 -0.981 -7.368 -1.014 1.00 0.00 H new ATOM 0 HA TRP A 580 -0.830 -7.813 1.850 1.00 0.00 H new ATOM 0 HB2 TRP A 580 -2.121 -5.773 2.394 1.00 0.00 H new ATOM 0 HB3 TRP A 580 -0.540 -5.376 1.752 1.00 0.00 H new ATOM 0 HD1 TRP A 580 -4.261 -5.051 0.946 1.00 0.00 H new ATOM 0 HE1 TRP A 580 -4.593 -3.531 -1.120 1.00 0.00 H new ATOM 0 HE3 TRP A 580 0.627 -4.648 -0.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 580 -2.949 -2.342 -3.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 580 1.176 -3.296 -2.456 1.00 0.00 H new ATOM 0 HH2 TRP A 580 -0.590 -2.162 -3.739 1.00 0.00 H new ATOM 346 N THR A 581 -3.456 -8.071 1.861 1.00 0.00 N ATOM 347 CA THR A 581 -4.785 -8.662 1.752 1.00 0.00 C ATOM 348 C THR A 581 -5.821 -7.603 1.390 1.00 0.00 C ATOM 349 O THR A 581 -5.870 -6.537 2.004 1.00 0.00 O ATOM 350 CB THR A 581 -5.207 -9.349 3.063 1.00 0.00 C ATOM 351 OG1 THR A 581 -4.049 -9.799 3.777 1.00 0.00 O ATOM 352 CG2 THR A 581 -6.126 -10.528 2.784 1.00 0.00 C ATOM 0 H THR A 581 -3.185 -7.816 2.811 1.00 0.00 H new ATOM 0 HA THR A 581 -4.736 -9.411 0.962 1.00 0.00 H new ATOM 0 HB THR A 581 -5.747 -8.622 3.670 1.00 0.00 H new ATOM 0 HG1 THR A 581 -3.673 -9.055 4.293 1.00 0.00 H new ATOM 0 HG21 THR A 581 -6.411 -10.998 3.725 1.00 0.00 H new ATOM 0 HG22 THR A 581 -7.020 -10.178 2.268 1.00 0.00 H new ATOM 0 HG23 THR A 581 -5.607 -11.254 2.159 1.00 0.00 H new ATOM 360 N ALA A 582 -6.642 -7.901 0.387 1.00 0.00 N ATOM 361 CA ALA A 582 -7.673 -6.971 -0.058 1.00 0.00 C ATOM 362 C ALA A 582 -8.710 -6.726 1.033 1.00 0.00 C ATOM 363 O ALA A 582 -8.653 -7.326 2.107 1.00 0.00 O ATOM 364 CB ALA A 582 -8.345 -7.495 -1.319 1.00 0.00 C ATOM 0 H ALA A 582 -6.613 -8.779 -0.132 1.00 0.00 H new ATOM 0 HA ALA A 582 -7.192 -6.018 -0.281 1.00 0.00 H new ATOM 0 HB1 ALA A 582 -9.113 -6.792 -1.641 1.00 0.00 H new ATOM 0 HB2 ALA A 582 -7.601 -7.607 -2.108 1.00 0.00 H new ATOM 0 HB3 ALA A 582 -8.803 -8.462 -1.112 1.00 0.00 H new ATOM 370 N SER A 583 -9.657 -5.837 0.749 1.00 0.00 N ATOM 371 CA SER A 583 -10.710 -5.506 1.702 1.00 0.00 C ATOM 372 C SER A 583 -11.740 -6.628 1.789 1.00 0.00 C ATOM 373 O SER A 583 -12.010 -7.313 0.803 1.00 0.00 O ATOM 374 CB SER A 583 -11.397 -4.199 1.298 1.00 0.00 C ATOM 375 OG SER A 583 -12.337 -4.416 0.261 1.00 0.00 O ATOM 0 H SER A 583 -9.716 -5.332 -0.135 1.00 0.00 H new ATOM 0 HA SER A 583 -10.252 -5.382 2.683 1.00 0.00 H new ATOM 0 HB2 SER A 583 -11.899 -3.766 2.163 1.00 0.00 H new ATOM 0 HB3 SER A 583 -10.649 -3.478 0.970 1.00 0.00 H new ATOM 0 HG SER A 583 -11.869 -4.471 -0.598 1.00 0.00 H new ATOM 381 N THR A 584 -12.310 -6.810 2.976 1.00 0.00 N ATOM 382 CA THR A 584 -13.310 -7.848 3.194 1.00 0.00 C ATOM 383 C THR A 584 -14.671 -7.424 2.653 1.00 0.00 C ATOM 384 O THR A 584 -15.595 -8.232 2.565 1.00 0.00 O ATOM 385 CB THR A 584 -13.449 -8.188 4.689 1.00 0.00 C ATOM 386 OG1 THR A 584 -12.205 -7.962 5.361 1.00 0.00 O ATOM 387 CG2 THR A 584 -13.877 -9.635 4.877 1.00 0.00 C ATOM 0 H THR A 584 -12.096 -6.251 3.802 1.00 0.00 H new ATOM 0 HA THR A 584 -12.968 -8.733 2.657 1.00 0.00 H new ATOM 0 HB THR A 584 -14.215 -7.541 5.116 1.00 0.00 H new ATOM 0 HG1 THR A 584 -12.303 -8.179 6.312 1.00 0.00 H new ATOM 0 HG21 THR A 584 -13.969 -9.852 5.941 1.00 0.00 H new ATOM 0 HG22 THR A 584 -14.839 -9.796 4.390 1.00 0.00 H new ATOM 0 HG23 THR A 584 -13.131 -10.295 4.435 1.00 0.00 H new ATOM 395 N ASP A 585 -14.787 -6.150 2.293 1.00 0.00 N ATOM 396 CA ASP A 585 -16.035 -5.615 1.761 1.00 0.00 C ATOM 397 C ASP A 585 -16.069 -5.717 0.241 1.00 0.00 C ATOM 398 O ASP A 585 -16.911 -6.417 -0.325 1.00 0.00 O ATOM 399 CB ASP A 585 -16.215 -4.160 2.190 1.00 0.00 C ATOM 400 CG ASP A 585 -16.915 -4.032 3.530 1.00 0.00 C ATOM 401 OD1 ASP A 585 -16.881 -5.003 4.315 1.00 0.00 O ATOM 402 OD2 ASP A 585 -17.498 -2.959 3.794 1.00 0.00 O ATOM 0 H ASP A 585 -14.031 -5.468 2.360 1.00 0.00 H new ATOM 0 HA ASP A 585 -16.855 -6.209 2.164 1.00 0.00 H new ATOM 0 HB2 ASP A 585 -15.239 -3.678 2.246 1.00 0.00 H new ATOM 0 HB3 ASP A 585 -16.790 -3.629 1.431 1.00 0.00 H new ATOM 407 N ASN A 586 -15.146 -5.017 -0.414 1.00 0.00 N ATOM 408 CA ASN A 586 -15.061 -5.025 -1.871 1.00 0.00 C ATOM 409 C ASN A 586 -16.388 -4.605 -2.500 1.00 0.00 C ATOM 410 O ASN A 586 -16.729 -5.035 -3.602 1.00 0.00 O ATOM 411 CB ASN A 586 -14.656 -6.411 -2.368 1.00 0.00 C ATOM 412 CG ASN A 586 -14.225 -6.405 -3.822 1.00 0.00 C ATOM 413 OD1 ASN A 586 -14.151 -5.353 -4.457 1.00 0.00 O ATOM 414 ND2 ASN A 586 -13.935 -7.586 -4.358 1.00 0.00 N ATOM 0 H ASN A 586 -14.444 -4.435 0.044 1.00 0.00 H new ATOM 0 HA ASN A 586 -14.300 -4.304 -2.171 1.00 0.00 H new ATOM 0 HB2 ASN A 586 -13.840 -6.790 -1.752 1.00 0.00 H new ATOM 0 HB3 ASN A 586 -15.494 -7.097 -2.244 1.00 0.00 H new ATOM 0 HD21 ASN A 586 -13.638 -7.645 -5.332 1.00 0.00 H new ATOM 0 HD22 ASN A 586 -14.010 -8.434 -3.795 1.00 0.00 H new ATOM 421 N VAL A 587 -17.132 -3.763 -1.790 1.00 0.00 N ATOM 422 CA VAL A 587 -18.422 -3.285 -2.275 1.00 0.00 C ATOM 423 C VAL A 587 -18.250 -2.361 -3.479 1.00 0.00 C ATOM 424 O VAL A 587 -19.157 -2.220 -4.300 1.00 0.00 O ATOM 425 CB VAL A 587 -19.197 -2.542 -1.167 1.00 0.00 C ATOM 426 CG1 VAL A 587 -18.438 -1.304 -0.717 1.00 0.00 C ATOM 427 CG2 VAL A 587 -20.596 -2.176 -1.642 1.00 0.00 C ATOM 0 H VAL A 587 -16.864 -3.397 -0.876 1.00 0.00 H new ATOM 0 HA VAL A 587 -18.994 -4.162 -2.578 1.00 0.00 H new ATOM 0 HB VAL A 587 -19.293 -3.210 -0.311 1.00 0.00 H new ATOM 0 HG11 VAL A 587 -19.002 -0.795 0.065 1.00 0.00 H new ATOM 0 HG12 VAL A 587 -17.463 -1.597 -0.328 1.00 0.00 H new ATOM 0 HG13 VAL A 587 -18.304 -0.631 -1.564 1.00 0.00 H new ATOM 0 HG21 VAL A 587 -21.125 -1.653 -0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 587 -20.526 -1.529 -2.517 1.00 0.00 H new ATOM 0 HG23 VAL A 587 -21.140 -3.083 -1.904 1.00 0.00 H new ATOM 437 N GLY A 588 -17.080 -1.737 -3.579 1.00 0.00 N ATOM 438 CA GLY A 588 -16.811 -0.839 -4.686 1.00 0.00 C ATOM 439 C GLY A 588 -15.332 -0.548 -4.849 1.00 0.00 C ATOM 440 O GLY A 588 -14.943 0.288 -5.664 1.00 0.00 O ATOM 0 H GLY A 588 -16.314 -1.838 -2.913 1.00 0.00 H new ATOM 0 HA2 GLY A 588 -17.196 -1.277 -5.607 1.00 0.00 H new ATOM 0 HA3 GLY A 588 -17.347 0.097 -4.530 1.00 0.00 H new ATOM 444 N VAL A 589 -14.507 -1.241 -4.070 1.00 0.00 N ATOM 445 CA VAL A 589 -13.061 -1.059 -4.127 1.00 0.00 C ATOM 446 C VAL A 589 -12.509 -1.468 -5.489 1.00 0.00 C ATOM 447 O VAL A 589 -12.674 -2.610 -5.918 1.00 0.00 O ATOM 448 CB VAL A 589 -12.351 -1.876 -3.030 1.00 0.00 C ATOM 449 CG1 VAL A 589 -10.887 -1.475 -2.925 1.00 0.00 C ATOM 450 CG2 VAL A 589 -13.057 -1.702 -1.694 1.00 0.00 C ATOM 0 H VAL A 589 -14.817 -1.936 -3.390 1.00 0.00 H new ATOM 0 HA VAL A 589 -12.867 0.001 -3.964 1.00 0.00 H new ATOM 0 HB VAL A 589 -12.394 -2.930 -3.303 1.00 0.00 H new ATOM 0 HG11 VAL A 589 -10.404 -2.063 -2.145 1.00 0.00 H new ATOM 0 HG12 VAL A 589 -10.390 -1.658 -3.878 1.00 0.00 H new ATOM 0 HG13 VAL A 589 -10.817 -0.416 -2.677 1.00 0.00 H new ATOM 0 HG21 VAL A 589 -12.542 -2.286 -0.931 1.00 0.00 H new ATOM 0 HG22 VAL A 589 -13.048 -0.649 -1.412 1.00 0.00 H new ATOM 0 HG23 VAL A 589 -14.088 -2.046 -1.780 1.00 0.00 H new ATOM 460 N THR A 590 -11.853 -0.528 -6.163 1.00 0.00 N ATOM 461 CA THR A 590 -11.278 -0.792 -7.476 1.00 0.00 C ATOM 462 C THR A 590 -9.766 -0.589 -7.469 1.00 0.00 C ATOM 463 O THR A 590 -9.041 -1.233 -8.228 1.00 0.00 O ATOM 464 CB THR A 590 -11.900 0.114 -8.556 1.00 0.00 C ATOM 465 OG1 THR A 590 -11.110 0.067 -9.751 1.00 0.00 O ATOM 466 CG2 THR A 590 -12.002 1.551 -8.068 1.00 0.00 C ATOM 0 H THR A 590 -11.707 0.422 -5.821 1.00 0.00 H new ATOM 0 HA THR A 590 -11.501 -1.833 -7.712 1.00 0.00 H new ATOM 0 HB THR A 590 -12.904 -0.252 -8.769 1.00 0.00 H new ATOM 0 HG1 THR A 590 -11.513 0.644 -10.433 1.00 0.00 H new ATOM 0 HG21 THR A 590 -12.444 2.170 -8.849 1.00 0.00 H new ATOM 0 HG22 THR A 590 -12.628 1.589 -7.177 1.00 0.00 H new ATOM 0 HG23 THR A 590 -11.007 1.925 -7.828 1.00 0.00 H new ATOM 474 N GLY A 591 -9.295 0.312 -6.612 1.00 0.00 N ATOM 475 CA GLY A 591 -7.871 0.582 -6.530 1.00 0.00 C ATOM 476 C GLY A 591 -7.391 0.772 -5.103 1.00 0.00 C ATOM 477 O GLY A 591 -8.191 0.785 -4.168 1.00 0.00 O ATOM 0 H GLY A 591 -9.873 0.859 -5.974 1.00 0.00 H new ATOM 0 HA2 GLY A 591 -7.323 -0.242 -6.987 1.00 0.00 H new ATOM 0 HA3 GLY A 591 -7.641 1.477 -7.108 1.00 0.00 H new ATOM 481 N TYR A 592 -6.079 0.916 -4.941 1.00 0.00 N ATOM 482 CA TYR A 592 -5.480 1.106 -3.624 1.00 0.00 C ATOM 483 C TYR A 592 -4.448 2.230 -3.658 1.00 0.00 C ATOM 484 O TYR A 592 -3.984 2.626 -4.728 1.00 0.00 O ATOM 485 CB TYR A 592 -4.818 -0.190 -3.150 1.00 0.00 C ATOM 486 CG TYR A 592 -5.796 -1.314 -2.889 1.00 0.00 C ATOM 487 CD1 TYR A 592 -6.257 -2.115 -3.926 1.00 0.00 C ATOM 488 CD2 TYR A 592 -6.260 -1.572 -1.605 1.00 0.00 C ATOM 489 CE1 TYR A 592 -7.150 -3.142 -3.690 1.00 0.00 C ATOM 490 CE2 TYR A 592 -7.153 -2.598 -1.362 1.00 0.00 C ATOM 491 CZ TYR A 592 -7.594 -3.381 -2.409 1.00 0.00 C ATOM 492 OH TYR A 592 -8.484 -4.402 -2.170 1.00 0.00 O ATOM 0 H TYR A 592 -5.408 0.905 -5.709 1.00 0.00 H new ATOM 0 HA TYR A 592 -6.272 1.379 -2.926 1.00 0.00 H new ATOM 0 HB2 TYR A 592 -4.097 -0.515 -3.901 1.00 0.00 H new ATOM 0 HB3 TYR A 592 -4.258 0.012 -2.237 1.00 0.00 H new ATOM 0 HD1 TYR A 592 -5.912 -1.932 -4.933 1.00 0.00 H new ATOM 0 HD2 TYR A 592 -5.917 -0.961 -0.783 1.00 0.00 H new ATOM 0 HE1 TYR A 592 -7.499 -3.755 -4.508 1.00 0.00 H new ATOM 0 HE2 TYR A 592 -7.504 -2.786 -0.358 1.00 0.00 H new ATOM 0 HH TYR A 592 -8.345 -5.117 -2.825 1.00 0.00 H new ATOM 502 N ASP A 593 -4.092 2.742 -2.484 1.00 0.00 N ATOM 503 CA ASP A 593 -3.115 3.821 -2.385 1.00 0.00 C ATOM 504 C ASP A 593 -2.066 3.508 -1.323 1.00 0.00 C ATOM 505 O ASP A 593 -2.391 3.344 -0.147 1.00 0.00 O ATOM 506 CB ASP A 593 -3.814 5.139 -2.049 1.00 0.00 C ATOM 507 CG ASP A 593 -5.082 5.343 -2.854 1.00 0.00 C ATOM 508 OD1 ASP A 593 -4.992 5.405 -4.099 1.00 0.00 O ATOM 509 OD2 ASP A 593 -6.165 5.440 -2.241 1.00 0.00 O ATOM 0 H ASP A 593 -4.465 2.427 -1.588 1.00 0.00 H new ATOM 0 HA ASP A 593 -2.616 3.915 -3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 593 -4.055 5.159 -0.986 1.00 0.00 H new ATOM 0 HB3 ASP A 593 -3.131 5.967 -2.236 1.00 0.00 H new ATOM 514 N VAL A 594 -0.806 3.423 -1.742 1.00 0.00 N ATOM 515 CA VAL A 594 0.283 3.126 -0.823 1.00 0.00 C ATOM 516 C VAL A 594 1.022 4.402 -0.419 1.00 0.00 C ATOM 517 O VAL A 594 1.148 5.337 -1.211 1.00 0.00 O ATOM 518 CB VAL A 594 1.268 2.099 -1.432 1.00 0.00 C ATOM 519 CG1 VAL A 594 1.032 1.943 -2.924 1.00 0.00 C ATOM 520 CG2 VAL A 594 2.719 2.472 -1.154 1.00 0.00 C ATOM 0 H VAL A 594 -0.517 3.556 -2.711 1.00 0.00 H new ATOM 0 HA VAL A 594 -0.154 2.684 0.072 1.00 0.00 H new ATOM 0 HB VAL A 594 1.077 1.141 -0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 594 1.736 1.216 -3.330 1.00 0.00 H new ATOM 0 HG12 VAL A 594 0.013 1.597 -3.097 1.00 0.00 H new ATOM 0 HG13 VAL A 594 1.177 2.904 -3.418 1.00 0.00 H new ATOM 0 HG21 VAL A 594 3.378 1.726 -1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 594 2.933 3.449 -1.587 1.00 0.00 H new ATOM 0 HG23 VAL A 594 2.886 2.508 -0.077 1.00 0.00 H new ATOM 530 N TYR A 595 1.504 4.431 0.821 1.00 0.00 N ATOM 531 CA TYR A 595 2.225 5.586 1.342 1.00 0.00 C ATOM 532 C TYR A 595 3.640 5.198 1.762 1.00 0.00 C ATOM 533 O TYR A 595 3.951 4.016 1.915 1.00 0.00 O ATOM 534 CB TYR A 595 1.480 6.187 2.538 1.00 0.00 C ATOM 535 CG TYR A 595 0.046 6.576 2.244 1.00 0.00 C ATOM 536 CD1 TYR A 595 -0.949 5.611 2.151 1.00 0.00 C ATOM 537 CD2 TYR A 595 -0.311 7.905 2.054 1.00 0.00 C ATOM 538 CE1 TYR A 595 -2.258 5.958 1.879 1.00 0.00 C ATOM 539 CE2 TYR A 595 -1.619 8.261 1.781 1.00 0.00 C ATOM 540 CZ TYR A 595 -2.588 7.294 1.711 1.00 0.00 C ATOM 541 OH TYR A 595 -3.890 7.635 1.424 1.00 0.00 O ATOM 0 H TYR A 595 1.407 3.663 1.485 1.00 0.00 H new ATOM 0 HA TYR A 595 2.286 6.330 0.548 1.00 0.00 H new ATOM 0 HB2 TYR A 595 1.489 5.467 3.356 1.00 0.00 H new ATOM 0 HB3 TYR A 595 2.020 7.069 2.883 1.00 0.00 H new ATOM 0 HD1 TYR A 595 -0.695 4.571 2.294 1.00 0.00 H new ATOM 0 HD2 TYR A 595 0.446 8.673 2.121 1.00 0.00 H new ATOM 0 HE1 TYR A 595 -3.018 5.195 1.798 1.00 0.00 H new ATOM 0 HE2 TYR A 595 -1.876 9.298 1.623 1.00 0.00 H new ATOM 0 HH TYR A 595 -3.962 8.608 1.337 1.00 0.00 H new ATOM 551 N ASN A 596 4.490 6.202 1.952 1.00 0.00 N ATOM 552 CA ASN A 596 5.872 5.973 2.361 1.00 0.00 C ATOM 553 C ASN A 596 6.311 7.019 3.380 1.00 0.00 C ATOM 554 O ASN A 596 6.863 8.059 3.019 1.00 0.00 O ATOM 555 CB ASN A 596 6.800 6.006 1.144 1.00 0.00 C ATOM 556 CG ASN A 596 8.261 5.878 1.525 1.00 0.00 C ATOM 557 OD1 ASN A 596 9.025 6.839 1.435 1.00 0.00 O ATOM 558 ND2 ASN A 596 8.660 4.685 1.954 1.00 0.00 N ATOM 0 H ASN A 596 4.246 7.185 1.829 1.00 0.00 H new ATOM 0 HA ASN A 596 5.932 4.988 2.825 1.00 0.00 H new ATOM 0 HB2 ASN A 596 6.533 5.196 0.465 1.00 0.00 H new ATOM 0 HB3 ASN A 596 6.650 6.939 0.602 1.00 0.00 H new ATOM 0 HD21 ASN A 596 9.633 4.539 2.224 1.00 0.00 H new ATOM 0 HD22 ASN A 596 7.993 3.915 2.013 1.00 0.00 H new ATOM 565 N GLY A 597 6.057 6.741 4.655 1.00 0.00 N ATOM 566 CA GLY A 597 6.428 7.674 5.703 1.00 0.00 C ATOM 567 C GLY A 597 5.616 8.952 5.644 1.00 0.00 C ATOM 568 O GLY A 597 6.136 10.006 5.275 1.00 0.00 O ATOM 0 H GLY A 597 5.602 5.888 4.981 1.00 0.00 H new ATOM 0 HA2 GLY A 597 6.288 7.201 6.675 1.00 0.00 H new ATOM 0 HA3 GLY A 597 7.488 7.914 5.615 1.00 0.00 H new ATOM 572 N THR A 598 4.336 8.853 6.002 1.00 0.00 N ATOM 573 CA THR A 598 3.434 10.003 5.987 1.00 0.00 C ATOM 574 C THR A 598 3.550 10.779 4.678 1.00 0.00 C ATOM 575 O THR A 598 3.518 12.011 4.667 1.00 0.00 O ATOM 576 CB THR A 598 3.698 10.955 7.172 1.00 0.00 C ATOM 577 OG1 THR A 598 5.103 11.205 7.305 1.00 0.00 O ATOM 578 CG2 THR A 598 3.159 10.365 8.466 1.00 0.00 C ATOM 0 H THR A 598 3.899 7.983 6.307 1.00 0.00 H new ATOM 0 HA THR A 598 2.423 9.607 6.080 1.00 0.00 H new ATOM 0 HB THR A 598 3.183 11.895 6.973 1.00 0.00 H new ATOM 0 HG1 THR A 598 5.530 11.149 6.425 1.00 0.00 H new ATOM 0 HG21 THR A 598 3.356 11.052 9.289 1.00 0.00 H new ATOM 0 HG22 THR A 598 2.084 10.207 8.374 1.00 0.00 H new ATOM 0 HG23 THR A 598 3.650 9.412 8.664 1.00 0.00 H new ATOM 586 N ALA A 599 3.684 10.047 3.575 1.00 0.00 N ATOM 587 CA ALA A 599 3.804 10.658 2.257 1.00 0.00 C ATOM 588 C ALA A 599 3.463 9.658 1.156 1.00 0.00 C ATOM 589 O ALA A 599 4.277 8.800 0.815 1.00 0.00 O ATOM 590 CB ALA A 599 5.207 11.210 2.059 1.00 0.00 C ATOM 0 H ALA A 599 3.712 9.027 3.570 1.00 0.00 H new ATOM 0 HA ALA A 599 3.091 11.480 2.196 1.00 0.00 H new ATOM 0 HB1 ALA A 599 5.283 11.664 1.071 1.00 0.00 H new ATOM 0 HB2 ALA A 599 5.413 11.962 2.820 1.00 0.00 H new ATOM 0 HB3 ALA A 599 5.932 10.400 2.144 1.00 0.00 H new ATOM 596 N LEU A 600 2.256 9.774 0.609 1.00 0.00 N ATOM 597 CA LEU A 600 1.799 8.878 -0.452 1.00 0.00 C ATOM 598 C LEU A 600 2.839 8.763 -1.561 1.00 0.00 C ATOM 599 O LEU A 600 3.424 9.760 -1.985 1.00 0.00 O ATOM 600 CB LEU A 600 0.473 9.377 -1.031 1.00 0.00 C ATOM 601 CG LEU A 600 -0.087 8.541 -2.184 1.00 0.00 C ATOM 602 CD1 LEU A 600 -1.509 8.095 -1.878 1.00 0.00 C ATOM 603 CD2 LEU A 600 -0.042 9.330 -3.483 1.00 0.00 C ATOM 0 H LEU A 600 1.574 10.481 0.883 1.00 0.00 H new ATOM 0 HA LEU A 600 1.652 7.889 -0.017 1.00 0.00 H new ATOM 0 HB2 LEU A 600 -0.267 9.406 -0.231 1.00 0.00 H new ATOM 0 HB3 LEU A 600 0.608 10.401 -1.378 1.00 0.00 H new ATOM 0 HG LEU A 600 0.534 7.652 -2.299 1.00 0.00 H new ATOM 0 HD11 LEU A 600 -1.891 7.502 -2.709 1.00 0.00 H new ATOM 0 HD12 LEU A 600 -1.514 7.493 -0.970 1.00 0.00 H new ATOM 0 HD13 LEU A 600 -2.142 8.971 -1.736 1.00 0.00 H new ATOM 0 HD21 LEU A 600 -0.444 8.721 -4.293 1.00 0.00 H new ATOM 0 HD22 LEU A 600 -0.639 10.236 -3.379 1.00 0.00 H new ATOM 0 HD23 LEU A 600 0.990 9.600 -3.709 1.00 0.00 H new ATOM 615 N ALA A 601 3.067 7.537 -2.025 1.00 0.00 N ATOM 616 CA ALA A 601 4.039 7.289 -3.083 1.00 0.00 C ATOM 617 C ALA A 601 3.353 6.843 -4.374 1.00 0.00 C ATOM 618 O ALA A 601 2.865 7.672 -5.143 1.00 0.00 O ATOM 619 CB ALA A 601 5.060 6.255 -2.631 1.00 0.00 C ATOM 0 H ALA A 601 2.592 6.701 -1.684 1.00 0.00 H new ATOM 0 HA ALA A 601 4.558 8.225 -3.291 1.00 0.00 H new ATOM 0 HB1 ALA A 601 5.779 6.080 -3.431 1.00 0.00 H new ATOM 0 HB2 ALA A 601 5.582 6.622 -1.747 1.00 0.00 H new ATOM 0 HB3 ALA A 601 4.551 5.322 -2.390 1.00 0.00 H new ATOM 625 N THR A 602 3.326 5.534 -4.614 1.00 0.00 N ATOM 626 CA THR A 602 2.707 4.995 -5.819 1.00 0.00 C ATOM 627 C THR A 602 1.231 4.671 -5.607 1.00 0.00 C ATOM 628 O THR A 602 0.725 4.690 -4.480 1.00 0.00 O ATOM 629 CB THR A 602 3.437 3.731 -6.316 1.00 0.00 C ATOM 630 OG1 THR A 602 3.036 3.431 -7.658 1.00 0.00 O ATOM 631 CG2 THR A 602 3.145 2.539 -5.419 1.00 0.00 C ATOM 0 H THR A 602 3.724 4.831 -3.992 1.00 0.00 H new ATOM 0 HA THR A 602 2.789 5.775 -6.576 1.00 0.00 H new ATOM 0 HB THR A 602 4.509 3.928 -6.288 1.00 0.00 H new ATOM 0 HG1 THR A 602 3.644 2.764 -8.040 1.00 0.00 H new ATOM 0 HG21 THR A 602 3.673 1.663 -5.795 1.00 0.00 H new ATOM 0 HG22 THR A 602 3.479 2.757 -4.404 1.00 0.00 H new ATOM 0 HG23 THR A 602 2.073 2.342 -5.414 1.00 0.00 H new ATOM 639 N THR A 603 0.557 4.360 -6.708 1.00 0.00 N ATOM 640 CA THR A 603 -0.857 4.013 -6.685 1.00 0.00 C ATOM 641 C THR A 603 -1.109 2.811 -7.583 1.00 0.00 C ATOM 642 O THR A 603 -0.558 2.722 -8.680 1.00 0.00 O ATOM 643 CB THR A 603 -1.736 5.187 -7.151 1.00 0.00 C ATOM 644 OG1 THR A 603 -1.188 6.427 -6.688 1.00 0.00 O ATOM 645 CG2 THR A 603 -3.160 5.033 -6.636 1.00 0.00 C ATOM 0 H THR A 603 0.975 4.342 -7.638 1.00 0.00 H new ATOM 0 HA THR A 603 -1.122 3.774 -5.655 1.00 0.00 H new ATOM 0 HB THR A 603 -1.757 5.185 -8.241 1.00 0.00 H new ATOM 0 HG1 THR A 603 -1.753 7.168 -6.991 1.00 0.00 H new ATOM 0 HG21 THR A 603 -3.763 5.874 -6.978 1.00 0.00 H new ATOM 0 HG22 THR A 603 -3.585 4.104 -7.015 1.00 0.00 H new ATOM 0 HG23 THR A 603 -3.152 5.011 -5.546 1.00 0.00 H new ATOM 653 N VAL A 604 -1.923 1.879 -7.109 1.00 0.00 N ATOM 654 CA VAL A 604 -2.217 0.676 -7.875 1.00 0.00 C ATOM 655 C VAL A 604 -3.711 0.385 -7.927 1.00 0.00 C ATOM 656 O VAL A 604 -4.524 1.159 -7.423 1.00 0.00 O ATOM 657 CB VAL A 604 -1.491 -0.541 -7.277 1.00 0.00 C ATOM 658 CG1 VAL A 604 -0.038 -0.566 -7.727 1.00 0.00 C ATOM 659 CG2 VAL A 604 -1.586 -0.520 -5.757 1.00 0.00 C ATOM 0 H VAL A 604 -2.389 1.931 -6.203 1.00 0.00 H new ATOM 0 HA VAL A 604 -1.863 0.856 -8.890 1.00 0.00 H new ATOM 0 HB VAL A 604 -1.975 -1.449 -7.638 1.00 0.00 H new ATOM 0 HG11 VAL A 604 0.462 -1.433 -7.295 1.00 0.00 H new ATOM 0 HG12 VAL A 604 0.005 -0.626 -8.814 1.00 0.00 H new ATOM 0 HG13 VAL A 604 0.462 0.344 -7.394 1.00 0.00 H new ATOM 0 HG21 VAL A 604 -1.068 -1.387 -5.348 1.00 0.00 H new ATOM 0 HG22 VAL A 604 -1.125 0.391 -5.376 1.00 0.00 H new ATOM 0 HG23 VAL A 604 -2.634 -0.549 -5.457 1.00 0.00 H new ATOM 669 N THR A 605 -4.059 -0.742 -8.540 1.00 0.00 N ATOM 670 CA THR A 605 -5.452 -1.152 -8.664 1.00 0.00 C ATOM 671 C THR A 605 -5.629 -2.601 -8.226 1.00 0.00 C ATOM 672 O THR A 605 -6.751 -3.101 -8.135 1.00 0.00 O ATOM 673 CB THR A 605 -5.958 -1.001 -10.112 1.00 0.00 C ATOM 674 OG1 THR A 605 -5.426 -2.049 -10.930 1.00 0.00 O ATOM 675 CG2 THR A 605 -5.562 0.350 -10.688 1.00 0.00 C ATOM 0 H THR A 605 -3.392 -1.389 -8.960 1.00 0.00 H new ATOM 0 HA THR A 605 -6.036 -0.499 -8.016 1.00 0.00 H new ATOM 0 HB THR A 605 -7.046 -1.067 -10.100 1.00 0.00 H new ATOM 0 HG1 THR A 605 -5.754 -1.946 -11.848 1.00 0.00 H new ATOM 0 HG21 THR A 605 -5.931 0.432 -11.710 1.00 0.00 H new ATOM 0 HG22 THR A 605 -5.995 1.145 -10.081 1.00 0.00 H new ATOM 0 HG23 THR A 605 -4.476 0.442 -10.686 1.00 0.00 H new ATOM 683 N GLY A 606 -4.511 -3.270 -7.956 1.00 0.00 N ATOM 684 CA GLY A 606 -4.558 -4.658 -7.531 1.00 0.00 C ATOM 685 C GLY A 606 -4.083 -4.845 -6.103 1.00 0.00 C ATOM 686 O GLY A 606 -4.276 -3.971 -5.258 1.00 0.00 O ATOM 0 H GLY A 606 -3.573 -2.875 -8.024 1.00 0.00 H new ATOM 0 HA2 GLY A 606 -5.579 -5.028 -7.622 1.00 0.00 H new ATOM 0 HA3 GLY A 606 -3.940 -5.260 -8.198 1.00 0.00 H new ATOM 690 N THR A 607 -3.462 -5.991 -5.831 1.00 0.00 N ATOM 691 CA THR A 607 -2.963 -6.293 -4.494 1.00 0.00 C ATOM 692 C THR A 607 -1.461 -6.043 -4.389 1.00 0.00 C ATOM 693 O THR A 607 -0.857 -6.277 -3.343 1.00 0.00 O ATOM 694 CB THR A 607 -3.255 -7.753 -4.102 1.00 0.00 C ATOM 695 OG1 THR A 607 -3.163 -8.598 -5.254 1.00 0.00 O ATOM 696 CG2 THR A 607 -4.639 -7.881 -3.483 1.00 0.00 C ATOM 0 H THR A 607 -3.293 -6.724 -6.519 1.00 0.00 H new ATOM 0 HA THR A 607 -3.486 -5.626 -3.809 1.00 0.00 H new ATOM 0 HB THR A 607 -2.514 -8.062 -3.365 1.00 0.00 H new ATOM 0 HG1 THR A 607 -3.348 -9.525 -4.995 1.00 0.00 H new ATOM 0 HG21 THR A 607 -4.823 -8.921 -3.214 1.00 0.00 H new ATOM 0 HG22 THR A 607 -4.697 -7.260 -2.589 1.00 0.00 H new ATOM 0 HG23 THR A 607 -5.391 -7.554 -4.201 1.00 0.00 H new ATOM 704 N THR A 608 -0.862 -5.565 -5.478 1.00 0.00 N ATOM 705 CA THR A 608 0.570 -5.283 -5.501 1.00 0.00 C ATOM 706 C THR A 608 0.828 -3.787 -5.663 1.00 0.00 C ATOM 707 O THR A 608 -0.074 -3.031 -6.016 1.00 0.00 O ATOM 708 CB THR A 608 1.274 -6.042 -6.643 1.00 0.00 C ATOM 709 OG1 THR A 608 0.511 -5.933 -7.851 1.00 0.00 O ATOM 710 CG2 THR A 608 1.457 -7.507 -6.285 1.00 0.00 C ATOM 0 H THR A 608 -1.346 -5.366 -6.354 1.00 0.00 H new ATOM 0 HA THR A 608 0.977 -5.620 -4.548 1.00 0.00 H new ATOM 0 HB THR A 608 2.256 -5.594 -6.794 1.00 0.00 H new ATOM 0 HG1 THR A 608 0.967 -6.417 -8.571 1.00 0.00 H new ATOM 0 HG21 THR A 608 1.956 -8.023 -7.106 1.00 0.00 H new ATOM 0 HG22 THR A 608 2.064 -7.588 -5.383 1.00 0.00 H new ATOM 0 HG23 THR A 608 0.483 -7.963 -6.109 1.00 0.00 H new ATOM 718 N ALA A 609 2.065 -3.369 -5.403 1.00 0.00 N ATOM 719 CA ALA A 609 2.441 -1.961 -5.520 1.00 0.00 C ATOM 720 C ALA A 609 3.917 -1.818 -5.876 1.00 0.00 C ATOM 721 O ALA A 609 4.773 -2.481 -5.289 1.00 0.00 O ATOM 722 CB ALA A 609 2.137 -1.225 -4.223 1.00 0.00 C ATOM 0 H ALA A 609 2.824 -3.984 -5.110 1.00 0.00 H new ATOM 0 HA ALA A 609 1.853 -1.517 -6.324 1.00 0.00 H new ATOM 0 HB1 ALA A 609 2.422 -0.178 -4.324 1.00 0.00 H new ATOM 0 HB2 ALA A 609 1.071 -1.292 -4.008 1.00 0.00 H new ATOM 0 HB3 ALA A 609 2.701 -1.677 -3.407 1.00 0.00 H new ATOM 728 N THR A 610 4.211 -0.953 -6.842 1.00 0.00 N ATOM 729 CA THR A 610 5.585 -0.729 -7.274 1.00 0.00 C ATOM 730 C THR A 610 5.983 0.737 -7.120 1.00 0.00 C ATOM 731 O THR A 610 5.343 1.625 -7.682 1.00 0.00 O ATOM 732 CB THR A 610 5.790 -1.152 -8.741 1.00 0.00 C ATOM 733 OG1 THR A 610 4.958 -2.277 -9.047 1.00 0.00 O ATOM 734 CG2 THR A 610 7.246 -1.503 -9.007 1.00 0.00 C ATOM 0 H THR A 610 3.516 -0.396 -7.340 1.00 0.00 H new ATOM 0 HA THR A 610 6.218 -1.343 -6.633 1.00 0.00 H new ATOM 0 HB THR A 610 5.515 -0.312 -9.379 1.00 0.00 H new ATOM 0 HG1 THR A 610 5.093 -2.539 -9.982 1.00 0.00 H new ATOM 0 HG21 THR A 610 7.364 -1.798 -10.050 1.00 0.00 H new ATOM 0 HG22 THR A 610 7.873 -0.635 -8.802 1.00 0.00 H new ATOM 0 HG23 THR A 610 7.546 -2.328 -8.360 1.00 0.00 H new ATOM 742 N ILE A 611 7.047 0.978 -6.360 1.00 0.00 N ATOM 743 CA ILE A 611 7.536 2.334 -6.135 1.00 0.00 C ATOM 744 C ILE A 611 8.900 2.533 -6.789 1.00 0.00 C ATOM 745 O ILE A 611 9.821 1.743 -6.583 1.00 0.00 O ATOM 746 CB ILE A 611 7.644 2.650 -4.627 1.00 0.00 C ATOM 747 CG1 ILE A 611 6.252 2.690 -3.995 1.00 0.00 C ATOM 748 CG2 ILE A 611 8.366 3.973 -4.404 1.00 0.00 C ATOM 749 CD1 ILE A 611 5.954 1.497 -3.113 1.00 0.00 C ATOM 0 H ILE A 611 7.587 0.252 -5.890 1.00 0.00 H new ATOM 0 HA ILE A 611 6.815 3.016 -6.586 1.00 0.00 H new ATOM 0 HB ILE A 611 8.224 1.860 -4.150 1.00 0.00 H new ATOM 0 HG12 ILE A 611 6.156 3.601 -3.404 1.00 0.00 H new ATOM 0 HG13 ILE A 611 5.504 2.743 -4.786 1.00 0.00 H new ATOM 0 HG21 ILE A 611 8.431 4.176 -3.335 1.00 0.00 H new ATOM 0 HG22 ILE A 611 9.370 3.915 -4.824 1.00 0.00 H new ATOM 0 HG23 ILE A 611 7.814 4.776 -4.893 1.00 0.00 H new ATOM 0 HD11 ILE A 611 4.950 1.592 -2.699 1.00 0.00 H new ATOM 0 HD12 ILE A 611 6.017 0.583 -3.704 1.00 0.00 H new ATOM 0 HD13 ILE A 611 6.679 1.455 -2.301 1.00 0.00 H new ATOM 761 N SER A 612 9.020 3.595 -7.581 1.00 0.00 N ATOM 762 CA SER A 612 10.270 3.899 -8.267 1.00 0.00 C ATOM 763 C SER A 612 10.953 5.113 -7.646 1.00 0.00 C ATOM 764 O SER A 612 10.301 5.958 -7.030 1.00 0.00 O ATOM 765 CB SER A 612 10.010 4.145 -9.755 1.00 0.00 C ATOM 766 OG SER A 612 10.643 5.335 -10.197 1.00 0.00 O ATOM 0 H SER A 612 8.267 4.258 -7.763 1.00 0.00 H new ATOM 0 HA SER A 612 10.934 3.041 -8.159 1.00 0.00 H new ATOM 0 HB2 SER A 612 10.376 3.298 -10.336 1.00 0.00 H new ATOM 0 HB3 SER A 612 8.937 4.213 -9.933 1.00 0.00 H new ATOM 0 HG SER A 612 10.462 5.467 -11.151 1.00 0.00 H new ATOM 772 N GLY A 613 12.270 5.192 -7.812 1.00 0.00 N ATOM 773 CA GLY A 613 13.025 6.304 -7.262 1.00 0.00 C ATOM 774 C GLY A 613 13.279 6.154 -5.775 1.00 0.00 C ATOM 775 O GLY A 613 12.893 7.013 -4.983 1.00 0.00 O ATOM 0 H GLY A 613 12.829 4.505 -8.318 1.00 0.00 H new ATOM 0 HA2 GLY A 613 13.979 6.385 -7.784 1.00 0.00 H new ATOM 0 HA3 GLY A 613 12.483 7.232 -7.443 1.00 0.00 H new ATOM 779 N LEU A 614 13.930 5.058 -5.396 1.00 0.00 N ATOM 780 CA LEU A 614 14.236 4.798 -3.995 1.00 0.00 C ATOM 781 C LEU A 614 15.741 4.806 -3.752 1.00 0.00 C ATOM 782 O LEU A 614 16.528 4.544 -4.663 1.00 0.00 O ATOM 783 CB LEU A 614 13.649 3.454 -3.561 1.00 0.00 C ATOM 784 CG LEU A 614 12.204 3.505 -3.074 1.00 0.00 C ATOM 785 CD1 LEU A 614 11.480 2.214 -3.415 1.00 0.00 C ATOM 786 CD2 LEU A 614 12.169 3.759 -1.578 1.00 0.00 C ATOM 0 H LEU A 614 14.255 4.337 -6.040 1.00 0.00 H new ATOM 0 HA LEU A 614 13.786 5.594 -3.402 1.00 0.00 H new ATOM 0 HB2 LEU A 614 13.709 2.761 -4.400 1.00 0.00 H new ATOM 0 HB3 LEU A 614 14.270 3.044 -2.765 1.00 0.00 H new ATOM 0 HG LEU A 614 11.692 4.324 -3.579 1.00 0.00 H new ATOM 0 HD11 LEU A 614 10.451 2.269 -3.060 1.00 0.00 H new ATOM 0 HD12 LEU A 614 11.484 2.069 -4.495 1.00 0.00 H new ATOM 0 HD13 LEU A 614 11.985 1.376 -2.935 1.00 0.00 H new ATOM 0 HD21 LEU A 614 11.134 3.794 -1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 614 12.694 2.956 -1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 614 12.655 4.710 -1.359 1.00 0.00 H new ATOM 798 N ALA A 615 16.133 5.105 -2.518 1.00 0.00 N ATOM 799 CA ALA A 615 17.542 5.144 -2.152 1.00 0.00 C ATOM 800 C ALA A 615 17.937 3.900 -1.364 1.00 0.00 C ATOM 801 O ALA A 615 17.147 3.376 -0.579 1.00 0.00 O ATOM 802 CB ALA A 615 17.843 6.398 -1.345 1.00 0.00 C ATOM 0 H ALA A 615 15.493 5.324 -1.754 1.00 0.00 H new ATOM 0 HA ALA A 615 18.130 5.165 -3.069 1.00 0.00 H new ATOM 0 HB1 ALA A 615 18.900 6.414 -1.078 1.00 0.00 H new ATOM 0 HB2 ALA A 615 17.606 7.280 -1.940 1.00 0.00 H new ATOM 0 HB3 ALA A 615 17.240 6.400 -0.437 1.00 0.00 H new ATOM 808 N ALA A 616 19.163 3.433 -1.578 1.00 0.00 N ATOM 809 CA ALA A 616 19.663 2.250 -0.885 1.00 0.00 C ATOM 810 C ALA A 616 20.290 2.626 0.453 1.00 0.00 C ATOM 811 O ALA A 616 20.589 3.793 0.701 1.00 0.00 O ATOM 812 CB ALA A 616 20.671 1.515 -1.756 1.00 0.00 C ATOM 0 H ALA A 616 19.829 3.855 -2.225 1.00 0.00 H new ATOM 0 HA ALA A 616 18.820 1.588 -0.689 1.00 0.00 H new ATOM 0 HB1 ALA A 616 21.036 0.635 -1.227 1.00 0.00 H new ATOM 0 HB2 ALA A 616 20.192 1.207 -2.686 1.00 0.00 H new ATOM 0 HB3 ALA A 616 21.508 2.176 -1.981 1.00 0.00 H new ATOM 818 N ASP A 617 20.484 1.627 1.313 1.00 0.00 N ATOM 819 CA ASP A 617 21.074 1.849 2.630 1.00 0.00 C ATOM 820 C ASP A 617 20.230 2.822 3.446 1.00 0.00 C ATOM 821 O ASP A 617 20.760 3.624 4.217 1.00 0.00 O ATOM 822 CB ASP A 617 22.502 2.383 2.494 1.00 0.00 C ATOM 823 CG ASP A 617 23.530 1.274 2.397 1.00 0.00 C ATOM 824 OD1 ASP A 617 23.981 0.788 3.455 1.00 0.00 O ATOM 825 OD2 ASP A 617 23.885 0.891 1.261 1.00 0.00 O ATOM 0 H ASP A 617 20.241 0.655 1.120 1.00 0.00 H new ATOM 0 HA ASP A 617 21.102 0.893 3.152 1.00 0.00 H new ATOM 0 HB2 ASP A 617 22.568 3.013 1.607 1.00 0.00 H new ATOM 0 HB3 ASP A 617 22.733 3.014 3.352 1.00 0.00 H new ATOM 830 N THR A 618 18.914 2.749 3.272 1.00 0.00 N ATOM 831 CA THR A 618 17.999 3.626 3.991 1.00 0.00 C ATOM 832 C THR A 618 16.776 2.864 4.488 1.00 0.00 C ATOM 833 O THR A 618 16.418 1.819 3.942 1.00 0.00 O ATOM 834 CB THR A 618 17.531 4.797 3.106 1.00 0.00 C ATOM 835 OG1 THR A 618 18.056 4.652 1.781 1.00 0.00 O ATOM 836 CG2 THR A 618 17.977 6.130 3.689 1.00 0.00 C ATOM 0 H THR A 618 18.458 2.091 2.639 1.00 0.00 H new ATOM 0 HA THR A 618 18.550 4.020 4.845 1.00 0.00 H new ATOM 0 HB THR A 618 16.442 4.780 3.069 1.00 0.00 H new ATOM 0 HG1 THR A 618 17.432 4.127 1.237 1.00 0.00 H new ATOM 0 HG21 THR A 618 17.635 6.941 3.046 1.00 0.00 H new ATOM 0 HG22 THR A 618 17.552 6.252 4.685 1.00 0.00 H new ATOM 0 HG23 THR A 618 19.065 6.153 3.754 1.00 0.00 H new ATOM 844 N SER A 619 16.132 3.399 5.521 1.00 0.00 N ATOM 845 CA SER A 619 14.942 2.778 6.091 1.00 0.00 C ATOM 846 C SER A 619 13.681 3.389 5.488 1.00 0.00 C ATOM 847 O SER A 619 13.594 4.605 5.311 1.00 0.00 O ATOM 848 CB SER A 619 14.929 2.947 7.612 1.00 0.00 C ATOM 849 OG SER A 619 13.609 2.876 8.123 1.00 0.00 O ATOM 0 H SER A 619 16.416 4.264 5.981 1.00 0.00 H new ATOM 0 HA SER A 619 14.964 1.714 5.855 1.00 0.00 H new ATOM 0 HB2 SER A 619 15.542 2.172 8.072 1.00 0.00 H new ATOM 0 HB3 SER A 619 15.374 3.906 7.878 1.00 0.00 H new ATOM 0 HG SER A 619 13.629 2.985 9.097 1.00 0.00 H new ATOM 855 N TYR A 620 12.707 2.543 5.167 1.00 0.00 N ATOM 856 CA TYR A 620 11.457 3.010 4.578 1.00 0.00 C ATOM 857 C TYR A 620 10.259 2.267 5.161 1.00 0.00 C ATOM 858 O TYR A 620 10.273 1.042 5.282 1.00 0.00 O ATOM 859 CB TYR A 620 11.483 2.824 3.060 1.00 0.00 C ATOM 860 CG TYR A 620 12.399 3.787 2.339 1.00 0.00 C ATOM 861 CD1 TYR A 620 12.042 5.119 2.169 1.00 0.00 C ATOM 862 CD2 TYR A 620 13.622 3.366 1.833 1.00 0.00 C ATOM 863 CE1 TYR A 620 12.877 6.003 1.516 1.00 0.00 C ATOM 864 CE2 TYR A 620 14.463 4.244 1.178 1.00 0.00 C ATOM 865 CZ TYR A 620 14.081 5.554 1.005 1.00 0.00 C ATOM 866 OH TYR A 620 14.923 6.440 0.372 1.00 0.00 O ATOM 0 H TYR A 620 12.759 1.534 5.304 1.00 0.00 H new ATOM 0 HA TYR A 620 11.356 4.069 4.813 1.00 0.00 H new ATOM 0 HB2 TYR A 620 11.794 1.804 2.834 1.00 0.00 H new ATOM 0 HB3 TYR A 620 10.471 2.941 2.672 1.00 0.00 H new ATOM 0 HD1 TYR A 620 11.095 5.468 2.554 1.00 0.00 H new ATOM 0 HD2 TYR A 620 13.920 2.335 1.954 1.00 0.00 H new ATOM 0 HE1 TYR A 620 12.592 7.039 1.405 1.00 0.00 H new ATOM 0 HE2 TYR A 620 15.417 3.903 0.803 1.00 0.00 H new ATOM 0 HH TYR A 620 15.632 6.715 0.990 1.00 0.00 H new ATOM 876 N THR A 621 9.218 3.021 5.503 1.00 0.00 N ATOM 877 CA THR A 621 7.999 2.442 6.055 1.00 0.00 C ATOM 878 C THR A 621 6.839 2.645 5.088 1.00 0.00 C ATOM 879 O THR A 621 6.565 3.768 4.664 1.00 0.00 O ATOM 880 CB THR A 621 7.637 3.066 7.416 1.00 0.00 C ATOM 881 OG1 THR A 621 7.593 4.493 7.307 1.00 0.00 O ATOM 882 CG2 THR A 621 8.648 2.664 8.480 1.00 0.00 C ATOM 0 H THR A 621 9.195 4.036 5.407 1.00 0.00 H new ATOM 0 HA THR A 621 8.181 1.378 6.203 1.00 0.00 H new ATOM 0 HB THR A 621 6.655 2.696 7.711 1.00 0.00 H new ATOM 0 HG1 THR A 621 7.191 4.743 6.449 1.00 0.00 H new ATOM 0 HG21 THR A 621 8.373 3.116 9.433 1.00 0.00 H new ATOM 0 HG22 THR A 621 8.657 1.579 8.582 1.00 0.00 H new ATOM 0 HG23 THR A 621 9.640 3.009 8.188 1.00 0.00 H new ATOM 890 N PHE A 622 6.171 1.556 4.726 1.00 0.00 N ATOM 891 CA PHE A 622 5.056 1.629 3.790 1.00 0.00 C ATOM 892 C PHE A 622 3.730 1.274 4.454 1.00 0.00 C ATOM 893 O PHE A 622 3.687 0.551 5.449 1.00 0.00 O ATOM 894 CB PHE A 622 5.306 0.703 2.600 1.00 0.00 C ATOM 895 CG PHE A 622 6.449 1.144 1.730 1.00 0.00 C ATOM 896 CD1 PHE A 622 6.276 2.149 0.790 1.00 0.00 C ATOM 897 CD2 PHE A 622 7.695 0.551 1.850 1.00 0.00 C ATOM 898 CE1 PHE A 622 7.326 2.553 -0.012 1.00 0.00 C ATOM 899 CE2 PHE A 622 8.748 0.951 1.051 1.00 0.00 C ATOM 900 CZ PHE A 622 8.561 1.967 0.122 1.00 0.00 C ATOM 0 H PHE A 622 6.381 0.617 5.064 1.00 0.00 H new ATOM 0 HA PHE A 622 4.988 2.660 3.443 1.00 0.00 H new ATOM 0 HB2 PHE A 622 5.507 -0.303 2.968 1.00 0.00 H new ATOM 0 HB3 PHE A 622 4.400 0.647 1.996 1.00 0.00 H new ATOM 0 HD1 PHE A 622 5.310 2.621 0.684 1.00 0.00 H new ATOM 0 HD2 PHE A 622 7.845 -0.233 2.577 1.00 0.00 H new ATOM 0 HE1 PHE A 622 7.175 3.331 -0.746 1.00 0.00 H new ATOM 0 HE2 PHE A 622 9.713 0.476 1.148 1.00 0.00 H new ATOM 0 HZ PHE A 622 9.385 2.295 -0.494 1.00 0.00 H new ATOM 910 N THR A 623 2.650 1.789 3.875 1.00 0.00 N ATOM 911 CA THR A 623 1.301 1.544 4.371 1.00 0.00 C ATOM 912 C THR A 623 0.295 1.718 3.240 1.00 0.00 C ATOM 913 O THR A 623 0.237 2.773 2.612 1.00 0.00 O ATOM 914 CB THR A 623 0.939 2.501 5.523 1.00 0.00 C ATOM 915 OG1 THR A 623 1.657 3.732 5.383 1.00 0.00 O ATOM 916 CG2 THR A 623 1.261 1.870 6.870 1.00 0.00 C ATOM 0 H THR A 623 2.686 2.387 3.050 1.00 0.00 H new ATOM 0 HA THR A 623 1.267 0.522 4.750 1.00 0.00 H new ATOM 0 HB THR A 623 -0.132 2.700 5.478 1.00 0.00 H new ATOM 0 HG1 THR A 623 1.419 4.335 6.118 1.00 0.00 H new ATOM 0 HG21 THR A 623 0.997 2.563 7.669 1.00 0.00 H new ATOM 0 HG22 THR A 623 0.690 0.949 6.986 1.00 0.00 H new ATOM 0 HG23 THR A 623 2.326 1.646 6.921 1.00 0.00 H new ATOM 924 N VAL A 624 -0.485 0.679 2.967 1.00 0.00 N ATOM 925 CA VAL A 624 -1.465 0.734 1.887 1.00 0.00 C ATOM 926 C VAL A 624 -2.868 1.026 2.403 1.00 0.00 C ATOM 927 O VAL A 624 -3.180 0.786 3.569 1.00 0.00 O ATOM 928 CB VAL A 624 -1.497 -0.574 1.071 1.00 0.00 C ATOM 929 CG1 VAL A 624 -1.090 -0.312 -0.370 1.00 0.00 C ATOM 930 CG2 VAL A 624 -0.602 -1.632 1.699 1.00 0.00 C ATOM 0 H VAL A 624 -0.460 -0.206 3.474 1.00 0.00 H new ATOM 0 HA VAL A 624 -1.147 1.551 1.240 1.00 0.00 H new ATOM 0 HB VAL A 624 -2.519 -0.953 1.078 1.00 0.00 H new ATOM 0 HG11 VAL A 624 -1.118 -1.246 -0.932 1.00 0.00 H new ATOM 0 HG12 VAL A 624 -1.780 0.402 -0.819 1.00 0.00 H new ATOM 0 HG13 VAL A 624 -0.079 0.096 -0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 624 -0.643 -2.544 1.103 1.00 0.00 H new ATOM 0 HG22 VAL A 624 0.424 -1.267 1.733 1.00 0.00 H new ATOM 0 HG23 VAL A 624 -0.945 -1.844 2.712 1.00 0.00 H new ATOM 940 N LYS A 625 -3.708 1.544 1.513 1.00 0.00 N ATOM 941 CA LYS A 625 -5.085 1.876 1.849 1.00 0.00 C ATOM 942 C LYS A 625 -6.027 1.428 0.736 1.00 0.00 C ATOM 943 O LYS A 625 -5.590 1.154 -0.382 1.00 0.00 O ATOM 944 CB LYS A 625 -5.225 3.382 2.072 1.00 0.00 C ATOM 945 CG LYS A 625 -4.991 3.810 3.510 1.00 0.00 C ATOM 946 CD LYS A 625 -6.140 4.658 4.026 1.00 0.00 C ATOM 947 CE LYS A 625 -5.699 5.568 5.161 1.00 0.00 C ATOM 948 NZ LYS A 625 -6.322 6.918 5.065 1.00 0.00 N ATOM 0 H LYS A 625 -3.455 1.744 0.545 1.00 0.00 H new ATOM 0 HA LYS A 625 -5.352 1.354 2.768 1.00 0.00 H new ATOM 0 HB2 LYS A 625 -4.517 3.903 1.427 1.00 0.00 H new ATOM 0 HB3 LYS A 625 -6.224 3.694 1.767 1.00 0.00 H new ATOM 0 HG2 LYS A 625 -4.875 2.928 4.140 1.00 0.00 H new ATOM 0 HG3 LYS A 625 -4.061 4.374 3.577 1.00 0.00 H new ATOM 0 HD2 LYS A 625 -6.543 5.260 3.212 1.00 0.00 H new ATOM 0 HD3 LYS A 625 -6.945 4.009 4.371 1.00 0.00 H new ATOM 0 HE2 LYS A 625 -5.964 5.113 6.115 1.00 0.00 H new ATOM 0 HE3 LYS A 625 -4.614 5.667 5.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 625 -5.996 7.508 5.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 625 -6.049 7.363 4.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 625 -7.357 6.826 5.105 1.00 0.00 H new ATOM 962 N ALA A 626 -7.317 1.356 1.042 1.00 0.00 N ATOM 963 CA ALA A 626 -8.312 0.943 0.058 1.00 0.00 C ATOM 964 C ALA A 626 -9.214 2.109 -0.333 1.00 0.00 C ATOM 965 O ALA A 626 -9.702 2.845 0.525 1.00 0.00 O ATOM 966 CB ALA A 626 -9.142 -0.211 0.600 1.00 0.00 C ATOM 0 H ALA A 626 -7.699 1.578 1.962 1.00 0.00 H new ATOM 0 HA ALA A 626 -7.786 0.609 -0.837 1.00 0.00 H new ATOM 0 HB1 ALA A 626 -9.880 -0.509 -0.144 1.00 0.00 H new ATOM 0 HB2 ALA A 626 -8.490 -1.055 0.822 1.00 0.00 H new ATOM 0 HB3 ALA A 626 -9.652 0.104 1.511 1.00 0.00 H new ATOM 972 N LYS A 627 -9.429 2.273 -1.635 1.00 0.00 N ATOM 973 CA LYS A 627 -10.273 3.350 -2.141 1.00 0.00 C ATOM 974 C LYS A 627 -11.364 2.804 -3.056 1.00 0.00 C ATOM 975 O LYS A 627 -11.141 1.852 -3.805 1.00 0.00 O ATOM 976 CB LYS A 627 -9.427 4.380 -2.893 1.00 0.00 C ATOM 977 CG LYS A 627 -8.719 3.810 -4.112 1.00 0.00 C ATOM 978 CD LYS A 627 -7.997 4.893 -4.896 1.00 0.00 C ATOM 979 CE LYS A 627 -8.652 5.135 -6.245 1.00 0.00 C ATOM 980 NZ LYS A 627 -8.748 3.885 -7.050 1.00 0.00 N ATOM 0 H LYS A 627 -9.031 1.674 -2.358 1.00 0.00 H new ATOM 0 HA LYS A 627 -10.749 3.835 -1.289 1.00 0.00 H new ATOM 0 HB2 LYS A 627 -10.067 5.205 -3.207 1.00 0.00 H new ATOM 0 HB3 LYS A 627 -8.684 4.795 -2.212 1.00 0.00 H new ATOM 0 HG2 LYS A 627 -8.004 3.050 -3.796 1.00 0.00 H new ATOM 0 HG3 LYS A 627 -9.445 3.316 -4.757 1.00 0.00 H new ATOM 0 HD2 LYS A 627 -7.994 5.819 -4.321 1.00 0.00 H new ATOM 0 HD3 LYS A 627 -6.956 4.605 -5.042 1.00 0.00 H new ATOM 0 HE2 LYS A 627 -9.650 5.547 -6.095 1.00 0.00 H new ATOM 0 HE3 LYS A 627 -8.079 5.879 -6.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 627 -8.942 4.126 -8.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 627 -7.851 3.363 -6.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 627 -9.519 3.293 -6.681 1.00 0.00 H new ATOM 994 N ASP A 628 -12.544 3.413 -2.990 1.00 0.00 N ATOM 995 CA ASP A 628 -13.670 2.988 -3.812 1.00 0.00 C ATOM 996 C ASP A 628 -13.943 3.999 -4.923 1.00 0.00 C ATOM 997 O ASP A 628 -13.587 5.172 -4.809 1.00 0.00 O ATOM 998 CB ASP A 628 -14.918 2.801 -2.941 1.00 0.00 C ATOM 999 CG ASP A 628 -16.055 3.724 -3.335 1.00 0.00 C ATOM 1000 OD1 ASP A 628 -16.061 4.887 -2.880 1.00 0.00 O ATOM 1001 OD2 ASP A 628 -16.940 3.282 -4.098 1.00 0.00 O ATOM 0 H ASP A 628 -12.744 4.202 -2.376 1.00 0.00 H new ATOM 0 HA ASP A 628 -13.418 2.034 -4.276 1.00 0.00 H new ATOM 0 HB2 ASP A 628 -15.254 1.767 -3.014 1.00 0.00 H new ATOM 0 HB3 ASP A 628 -14.657 2.979 -1.898 1.00 0.00 H new ATOM 1006 N ALA A 629 -14.575 3.534 -5.995 1.00 0.00 N ATOM 1007 CA ALA A 629 -14.897 4.396 -7.126 1.00 0.00 C ATOM 1008 C ALA A 629 -16.179 5.180 -6.871 1.00 0.00 C ATOM 1009 O ALA A 629 -17.170 5.023 -7.587 1.00 0.00 O ATOM 1010 CB ALA A 629 -15.019 3.571 -8.400 1.00 0.00 C ATOM 0 H ALA A 629 -14.874 2.565 -6.104 1.00 0.00 H new ATOM 0 HA ALA A 629 -14.085 5.113 -7.249 1.00 0.00 H new ATOM 0 HB1 ALA A 629 -15.260 4.227 -9.237 1.00 0.00 H new ATOM 0 HB2 ALA A 629 -14.075 3.064 -8.597 1.00 0.00 H new ATOM 0 HB3 ALA A 629 -15.810 2.831 -8.280 1.00 0.00 H new ATOM 1016 N ALA A 630 -16.154 6.027 -5.846 1.00 0.00 N ATOM 1017 CA ALA A 630 -17.312 6.838 -5.494 1.00 0.00 C ATOM 1018 C ALA A 630 -16.895 8.065 -4.689 1.00 0.00 C ATOM 1019 O ALA A 630 -17.435 9.155 -4.877 1.00 0.00 O ATOM 1020 CB ALA A 630 -18.323 6.010 -4.715 1.00 0.00 C ATOM 0 H ALA A 630 -15.342 6.169 -5.245 1.00 0.00 H new ATOM 0 HA ALA A 630 -17.779 7.181 -6.417 1.00 0.00 H new ATOM 0 HB1 ALA A 630 -19.182 6.631 -4.460 1.00 0.00 H new ATOM 0 HB2 ALA A 630 -18.652 5.169 -5.325 1.00 0.00 H new ATOM 0 HB3 ALA A 630 -17.861 5.637 -3.801 1.00 0.00 H new ATOM 1026 N GLY A 631 -15.929 7.879 -3.793 1.00 0.00 N ATOM 1027 CA GLY A 631 -15.454 8.980 -2.974 1.00 0.00 C ATOM 1028 C GLY A 631 -15.319 8.607 -1.510 1.00 0.00 C ATOM 1029 O GLY A 631 -15.718 9.372 -0.631 1.00 0.00 O ATOM 0 H GLY A 631 -15.467 6.986 -3.620 1.00 0.00 H new ATOM 0 HA2 GLY A 631 -14.487 9.316 -3.349 1.00 0.00 H new ATOM 0 HA3 GLY A 631 -16.142 9.820 -3.068 1.00 0.00 H new ATOM 1033 N ASN A 632 -14.755 7.433 -1.247 1.00 0.00 N ATOM 1034 CA ASN A 632 -14.567 6.965 0.123 1.00 0.00 C ATOM 1035 C ASN A 632 -13.237 6.233 0.271 1.00 0.00 C ATOM 1036 O ASN A 632 -12.766 5.589 -0.666 1.00 0.00 O ATOM 1037 CB ASN A 632 -15.718 6.042 0.532 1.00 0.00 C ATOM 1038 CG ASN A 632 -17.075 6.688 0.338 1.00 0.00 C ATOM 1039 OD1 ASN A 632 -17.379 7.715 0.944 1.00 0.00 O ATOM 1040 ND2 ASN A 632 -17.902 6.085 -0.508 1.00 0.00 N ATOM 0 H ASN A 632 -14.420 6.788 -1.963 1.00 0.00 H new ATOM 0 HA ASN A 632 -14.557 7.836 0.779 1.00 0.00 H new ATOM 0 HB2 ASN A 632 -15.669 5.124 -0.053 1.00 0.00 H new ATOM 0 HB3 ASN A 632 -15.599 5.760 1.578 1.00 0.00 H new ATOM 0 HD21 ASN A 632 -18.831 6.472 -0.677 1.00 0.00 H new ATOM 0 HD22 ASN A 632 -17.609 5.235 -0.989 1.00 0.00 H new ATOM 1047 N VAL A 633 -12.637 6.335 1.454 1.00 0.00 N ATOM 1048 CA VAL A 633 -11.362 5.680 1.722 1.00 0.00 C ATOM 1049 C VAL A 633 -11.355 5.028 3.105 1.00 0.00 C ATOM 1050 O VAL A 633 -11.952 5.544 4.050 1.00 0.00 O ATOM 1051 CB VAL A 633 -10.180 6.670 1.601 1.00 0.00 C ATOM 1052 CG1 VAL A 633 -9.865 7.323 2.938 1.00 0.00 C ATOM 1053 CG2 VAL A 633 -8.952 5.965 1.045 1.00 0.00 C ATOM 0 H VAL A 633 -13.013 6.864 2.241 1.00 0.00 H new ATOM 0 HA VAL A 633 -11.238 4.902 0.968 1.00 0.00 H new ATOM 0 HB VAL A 633 -10.473 7.459 0.908 1.00 0.00 H new ATOM 0 HG11 VAL A 633 -9.030 8.013 2.818 1.00 0.00 H new ATOM 0 HG12 VAL A 633 -10.739 7.870 3.291 1.00 0.00 H new ATOM 0 HG13 VAL A 633 -9.600 6.555 3.665 1.00 0.00 H new ATOM 0 HG21 VAL A 633 -8.129 6.675 0.966 1.00 0.00 H new ATOM 0 HG22 VAL A 633 -8.666 5.152 1.712 1.00 0.00 H new ATOM 0 HG23 VAL A 633 -9.179 5.562 0.058 1.00 0.00 H new ATOM 1063 N SER A 634 -10.678 3.890 3.209 1.00 0.00 N ATOM 1064 CA SER A 634 -10.590 3.157 4.467 1.00 0.00 C ATOM 1065 C SER A 634 -9.418 3.661 5.306 1.00 0.00 C ATOM 1066 O SER A 634 -8.870 4.729 5.040 1.00 0.00 O ATOM 1067 CB SER A 634 -10.431 1.660 4.186 1.00 0.00 C ATOM 1068 OG SER A 634 -9.467 1.434 3.171 1.00 0.00 O ATOM 0 H SER A 634 -10.180 3.453 2.433 1.00 0.00 H new ATOM 0 HA SER A 634 -11.509 3.321 5.030 1.00 0.00 H new ATOM 0 HB2 SER A 634 -10.131 1.145 5.099 1.00 0.00 H new ATOM 0 HB3 SER A 634 -11.390 1.239 3.882 1.00 0.00 H new ATOM 0 HG SER A 634 -8.574 1.648 3.514 1.00 0.00 H new ATOM 1074 N ALA A 635 -9.035 2.883 6.316 1.00 0.00 N ATOM 1075 CA ALA A 635 -7.921 3.249 7.182 1.00 0.00 C ATOM 1076 C ALA A 635 -6.608 2.722 6.616 1.00 0.00 C ATOM 1077 O ALA A 635 -6.595 2.048 5.585 1.00 0.00 O ATOM 1078 CB ALA A 635 -8.146 2.718 8.591 1.00 0.00 C ATOM 0 H ALA A 635 -9.480 1.996 6.553 1.00 0.00 H new ATOM 0 HA ALA A 635 -7.863 4.336 7.228 1.00 0.00 H new ATOM 0 HB1 ALA A 635 -7.305 3.000 9.225 1.00 0.00 H new ATOM 0 HB2 ALA A 635 -9.065 3.142 8.997 1.00 0.00 H new ATOM 0 HB3 ALA A 635 -8.230 1.632 8.561 1.00 0.00 H new ATOM 1084 N ALA A 636 -5.503 3.032 7.286 1.00 0.00 N ATOM 1085 CA ALA A 636 -4.192 2.584 6.834 1.00 0.00 C ATOM 1086 C ALA A 636 -3.898 1.167 7.312 1.00 0.00 C ATOM 1087 O ALA A 636 -4.242 0.794 8.433 1.00 0.00 O ATOM 1088 CB ALA A 636 -3.112 3.543 7.312 1.00 0.00 C ATOM 0 H ALA A 636 -5.489 3.589 8.140 1.00 0.00 H new ATOM 0 HA ALA A 636 -4.196 2.575 5.744 1.00 0.00 H new ATOM 0 HB1 ALA A 636 -2.138 3.196 6.967 1.00 0.00 H new ATOM 0 HB2 ALA A 636 -3.305 4.538 6.911 1.00 0.00 H new ATOM 0 HB3 ALA A 636 -3.118 3.584 8.401 1.00 0.00 H new ATOM 1094 N SER A 637 -3.259 0.381 6.450 1.00 0.00 N ATOM 1095 CA SER A 637 -2.917 -0.998 6.777 1.00 0.00 C ATOM 1096 C SER A 637 -1.783 -1.051 7.792 1.00 0.00 C ATOM 1097 O SER A 637 -1.308 -0.016 8.262 1.00 0.00 O ATOM 1098 CB SER A 637 -2.518 -1.758 5.510 1.00 0.00 C ATOM 1099 OG SER A 637 -1.118 -1.702 5.299 1.00 0.00 O ATOM 0 H SER A 637 -2.968 0.677 5.518 1.00 0.00 H new ATOM 0 HA SER A 637 -3.796 -1.470 7.217 1.00 0.00 H new ATOM 0 HB2 SER A 637 -2.835 -2.798 5.591 1.00 0.00 H new ATOM 0 HB3 SER A 637 -3.035 -1.333 4.650 1.00 0.00 H new ATOM 0 HG SER A 637 -0.815 -0.772 5.361 1.00 0.00 H new ATOM 1105 N ASN A 638 -1.350 -2.263 8.125 1.00 0.00 N ATOM 1106 CA ASN A 638 -0.269 -2.452 9.084 1.00 0.00 C ATOM 1107 C ASN A 638 1.003 -1.761 8.605 1.00 0.00 C ATOM 1108 O ASN A 638 1.286 -1.725 7.408 1.00 0.00 O ATOM 1109 CB ASN A 638 -0.007 -3.943 9.304 1.00 0.00 C ATOM 1110 CG ASN A 638 0.337 -4.261 10.746 1.00 0.00 C ATOM 1111 OD1 ASN A 638 1.429 -4.746 11.043 1.00 0.00 O ATOM 1112 ND2 ASN A 638 -0.596 -3.988 11.651 1.00 0.00 N ATOM 0 H ASN A 638 -1.732 -3.129 7.744 1.00 0.00 H new ATOM 0 HA ASN A 638 -0.570 -2.004 10.031 1.00 0.00 H new ATOM 0 HB2 ASN A 638 -0.889 -4.512 9.009 1.00 0.00 H new ATOM 0 HB3 ASN A 638 0.810 -4.265 8.659 1.00 0.00 H new ATOM 0 HD21 ASN A 638 -0.421 -4.180 12.637 1.00 0.00 H new ATOM 0 HD22 ASN A 638 -1.487 -3.586 11.360 1.00 0.00 H new ATOM 1119 N ALA A 639 1.763 -1.211 9.546 1.00 0.00 N ATOM 1120 CA ALA A 639 3.002 -0.517 9.217 1.00 0.00 C ATOM 1121 C ALA A 639 4.142 -1.500 8.982 1.00 0.00 C ATOM 1122 O ALA A 639 4.601 -2.169 9.908 1.00 0.00 O ATOM 1123 CB ALA A 639 3.366 0.463 10.323 1.00 0.00 C ATOM 0 H ALA A 639 1.543 -1.232 10.542 1.00 0.00 H new ATOM 0 HA ALA A 639 2.843 0.036 8.292 1.00 0.00 H new ATOM 0 HB1 ALA A 639 4.293 0.975 10.065 1.00 0.00 H new ATOM 0 HB2 ALA A 639 2.567 1.195 10.438 1.00 0.00 H new ATOM 0 HB3 ALA A 639 3.499 -0.078 11.260 1.00 0.00 H new ATOM 1129 N VAL A 640 4.600 -1.576 7.737 1.00 0.00 N ATOM 1130 CA VAL A 640 5.691 -2.471 7.373 1.00 0.00 C ATOM 1131 C VAL A 640 7.007 -1.704 7.283 1.00 0.00 C ATOM 1132 O VAL A 640 7.057 -0.599 6.742 1.00 0.00 O ATOM 1133 CB VAL A 640 5.398 -3.194 6.033 1.00 0.00 C ATOM 1134 CG1 VAL A 640 6.566 -3.085 5.061 1.00 0.00 C ATOM 1135 CG2 VAL A 640 5.049 -4.654 6.284 1.00 0.00 C ATOM 0 H VAL A 640 4.231 -1.026 6.961 1.00 0.00 H new ATOM 0 HA VAL A 640 5.778 -3.226 8.154 1.00 0.00 H new ATOM 0 HB VAL A 640 4.543 -2.698 5.573 1.00 0.00 H new ATOM 0 HG11 VAL A 640 6.319 -3.605 4.135 1.00 0.00 H new ATOM 0 HG12 VAL A 640 6.763 -2.035 4.846 1.00 0.00 H new ATOM 0 HG13 VAL A 640 7.453 -3.537 5.505 1.00 0.00 H new ATOM 0 HG21 VAL A 640 4.846 -5.148 5.334 1.00 0.00 H new ATOM 0 HG22 VAL A 640 5.885 -5.148 6.779 1.00 0.00 H new ATOM 0 HG23 VAL A 640 4.165 -4.713 6.920 1.00 0.00 H new ATOM 1145 N SER A 641 8.070 -2.294 7.819 1.00 0.00 N ATOM 1146 CA SER A 641 9.384 -1.663 7.799 1.00 0.00 C ATOM 1147 C SER A 641 10.373 -2.487 6.982 1.00 0.00 C ATOM 1148 O SER A 641 10.779 -3.574 7.393 1.00 0.00 O ATOM 1149 CB SER A 641 9.907 -1.483 9.225 1.00 0.00 C ATOM 1150 OG SER A 641 9.513 -0.232 9.761 1.00 0.00 O ATOM 0 H SER A 641 8.047 -3.207 8.272 1.00 0.00 H new ATOM 0 HA SER A 641 9.282 -0.684 7.330 1.00 0.00 H new ATOM 0 HB2 SER A 641 9.531 -2.287 9.857 1.00 0.00 H new ATOM 0 HB3 SER A 641 10.994 -1.557 9.228 1.00 0.00 H new ATOM 0 HG SER A 641 8.535 -0.176 9.776 1.00 0.00 H new ATOM 1156 N VAL A 642 10.756 -1.961 5.824 1.00 0.00 N ATOM 1157 CA VAL A 642 11.698 -2.646 4.947 1.00 0.00 C ATOM 1158 C VAL A 642 12.994 -1.853 4.811 1.00 0.00 C ATOM 1159 O VAL A 642 12.994 -0.624 4.892 1.00 0.00 O ATOM 1160 CB VAL A 642 11.094 -2.879 3.547 1.00 0.00 C ATOM 1161 CG1 VAL A 642 10.929 -1.563 2.801 1.00 0.00 C ATOM 1162 CG2 VAL A 642 11.953 -3.848 2.751 1.00 0.00 C ATOM 0 H VAL A 642 10.428 -1.062 5.471 1.00 0.00 H new ATOM 0 HA VAL A 642 11.915 -3.612 5.402 1.00 0.00 H new ATOM 0 HB VAL A 642 10.105 -3.320 3.671 1.00 0.00 H new ATOM 0 HG11 VAL A 642 10.501 -1.754 1.817 1.00 0.00 H new ATOM 0 HG12 VAL A 642 10.265 -0.906 3.364 1.00 0.00 H new ATOM 0 HG13 VAL A 642 11.902 -1.085 2.687 1.00 0.00 H new ATOM 0 HG21 VAL A 642 11.512 -4.001 1.766 1.00 0.00 H new ATOM 0 HG22 VAL A 642 12.957 -3.437 2.639 1.00 0.00 H new ATOM 0 HG23 VAL A 642 12.007 -4.802 3.276 1.00 0.00 H new ATOM 1172 N LYS A 643 14.097 -2.564 4.604 1.00 0.00 N ATOM 1173 CA LYS A 643 15.400 -1.927 4.456 1.00 0.00 C ATOM 1174 C LYS A 643 15.958 -2.141 3.054 1.00 0.00 C ATOM 1175 O LYS A 643 16.013 -3.268 2.562 1.00 0.00 O ATOM 1176 CB LYS A 643 16.381 -2.472 5.494 1.00 0.00 C ATOM 1177 CG LYS A 643 17.707 -1.728 5.524 1.00 0.00 C ATOM 1178 CD LYS A 643 18.807 -2.571 6.147 1.00 0.00 C ATOM 1179 CE LYS A 643 19.393 -3.553 5.144 1.00 0.00 C ATOM 1180 NZ LYS A 643 20.863 -3.373 4.985 1.00 0.00 N ATOM 0 H LYS A 643 14.115 -3.582 4.535 1.00 0.00 H new ATOM 0 HA LYS A 643 15.269 -0.857 4.616 1.00 0.00 H new ATOM 0 HB2 LYS A 643 15.921 -2.418 6.481 1.00 0.00 H new ATOM 0 HB3 LYS A 643 16.569 -3.525 5.287 1.00 0.00 H new ATOM 0 HG2 LYS A 643 17.992 -1.449 4.509 1.00 0.00 H new ATOM 0 HG3 LYS A 643 17.593 -0.803 6.089 1.00 0.00 H new ATOM 0 HD2 LYS A 643 19.596 -1.920 6.524 1.00 0.00 H new ATOM 0 HD3 LYS A 643 18.408 -3.117 7.002 1.00 0.00 H new ATOM 0 HE2 LYS A 643 19.185 -4.572 5.470 1.00 0.00 H new ATOM 0 HE3 LYS A 643 18.904 -3.421 4.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 643 21.224 -4.061 4.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 643 21.060 -2.408 4.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 643 21.332 -3.524 5.901 1.00 0.00 H new ATOM 1194 N THR A 644 16.372 -1.050 2.416 1.00 0.00 N ATOM 1195 CA THR A 644 16.930 -1.116 1.072 1.00 0.00 C ATOM 1196 C THR A 644 18.431 -1.378 1.115 1.00 0.00 C ATOM 1197 O THR A 644 18.926 -2.130 0.249 1.00 0.00 O ATOM 1198 CB THR A 644 16.670 0.182 0.291 1.00 0.00 C ATOM 1199 OG1 THR A 644 16.979 1.318 1.108 1.00 0.00 O ATOM 1200 CG2 THR A 644 15.220 0.260 -0.166 1.00 0.00 C ATOM 1201 OXT THR A 644 19.101 -0.829 2.015 1.00 0.00 O ATOM 0 H THR A 644 16.331 -0.110 2.810 1.00 0.00 H new ATOM 0 HA THR A 644 16.433 -1.942 0.563 1.00 0.00 H new ATOM 0 HB THR A 644 17.312 0.183 -0.590 1.00 0.00 H new ATOM 0 HG1 THR A 644 16.900 2.136 0.574 1.00 0.00 H new ATOM 0 HG21 THR A 644 15.061 1.187 -0.716 1.00 0.00 H new ATOM 0 HG22 THR A 644 14.996 -0.588 -0.813 1.00 0.00 H new ATOM 0 HG23 THR A 644 14.563 0.237 0.703 1.00 0.00 H new