USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1139 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 647 MET CE :methyl 180:sc= -0.121 (180deg=-0.121) USER MOD Set 1.2: A 648 MET CE :methyl -162:sc= 0 (180deg=0) USER MOD Set 2.1: A 593 THR OG1 : rot 180:sc= -0.183 USER MOD Set 2.2: A 596 ASN : amide:sc= -0.296 K(o=-0.67,f=-2.7!) USER MOD Set 2.3: A 599 MET CE :methyl -162:sc= -0.188 (180deg=-1.03) USER MOD Set 3.1: A 580 LYS NZ :NH3+ -174:sc=-0.000633 (180deg=-0.0513) USER MOD Set 3.2: A 582 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 559 LYS NZ :NH3+ 176:sc= 1.19 (180deg=0) USER MOD Set 4.2: A 637 ASN : amide:sc= 2 K(o=3.2,f=-4.6!) USER MOD Set 5.1: A 542 MET CE :methyl 171:sc= 0 (180deg=-0.0833) USER MOD Set 5.2: A 581 MET CE :methyl 146:sc= -1.9 (180deg=-3.19) USER MOD Single : A 534 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 535 CYS SG : rot 180:sc= -0.051 USER MOD Single : A 537 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0122) USER MOD Single : A 541 SER OG : rot 180:sc= 0 USER MOD Single : A 547 ASN : amide:sc= -0.0473 X(o=-0.047,f=0) USER MOD Single : A 551 ASN : amide:sc= 1.06 K(o=1.1,f=-0.0065) USER MOD Single : A 554 THR OG1 : rot 85:sc= 1.26 USER MOD Single : A 556 MET CE :methyl -170:sc= -0.742 (180deg=-1.03) USER MOD Single : A 558 THR OG1 : rot 180:sc= 0 USER MOD Single : A 561 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 566 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.13) USER MOD Single : A 570 TYR OH : rot 180:sc= 0 USER MOD Single : A 576 THR OG1 : rot 180:sc= -0.0154 USER MOD Single : A 579 LYS NZ :NH3+ 161:sc= 1.37 (180deg=1.11) USER MOD Single : A 585 GLN : amide:sc= -0.198 X(o=-0.2,f=-0.2) USER MOD Single : A 586 HIS : no HD1:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 590 SER OG : rot 91:sc= 1.12 USER MOD Single : A 594 LYS NZ :NH3+ 161:sc= 1.02 (180deg=0.707) USER MOD Single : A 597 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 600 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 605 SER OG : rot 91:sc= 1.09 USER MOD Single : A 606 TYR OH : rot 180:sc= 0 USER MOD Single : A 611 CYS SG : rot 17:sc= 0.926 USER MOD Single : A 614 THR OG1 : rot 180:sc= 0 USER MOD Single : A 619 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 SER OG : rot 180:sc= 0 USER MOD Single : A 626 THR OG1 : rot 180:sc= -0.148 USER MOD Single : A 627 TYR OH : rot 180:sc= 0.0467 USER MOD Single : A 628 CYS SG : rot 9:sc= -0.46 USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 632 SER OG : rot 180:sc= -0.0258 USER MOD Single : A 634 SER OG : rot 180:sc= 0.0491 USER MOD Single : A 639 ASN : amide:sc= -0.0585 X(o=-0.059,f=-0.38) USER MOD Single : A 645 TYR OH : rot 180:sc= 0 USER MOD Single : A 654 THR OG1 : rot 180:sc= 0 USER MOD Single : A 665 LYS NZ :NH3+ -172:sc= 3.11 (180deg=2.9) USER MOD Single : A 666 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 668 SER OG : rot 180:sc= 0.173 USER MOD Single : A 672 HIS : no HD1:sc= 0 X(o=0,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 534 7.697 13.655 6.032 1.00 4.23 N ATOM 2 CA ASN A 534 7.278 12.445 6.740 1.00 4.25 C ATOM 3 C ASN A 534 7.060 11.209 5.853 1.00 3.15 C ATOM 4 O ASN A 534 7.036 10.091 6.372 1.00 3.57 O ATOM 5 CB ASN A 534 5.993 12.799 7.515 1.00 5.11 C ATOM 6 CG ASN A 534 6.266 13.759 8.654 1.00 6.34 C ATOM 7 OD1 ASN A 534 7.212 13.604 9.420 1.00 7.07 O ATOM 8 ND2 ASN A 534 5.480 14.793 8.796 1.00 7.16 N ATOM 0 HA ASN A 534 8.092 12.147 7.400 1.00 4.25 H new ATOM 0 HB2 ASN A 534 5.268 13.243 6.832 1.00 5.11 H new ATOM 0 HB3 ASN A 534 5.544 11.887 7.909 1.00 5.11 H new ATOM 0 HD21 ASN A 534 5.654 15.467 9.541 1.00 7.16 H new ATOM 0 HD22 ASN A 534 4.692 14.926 8.162 1.00 7.16 H new ATOM 15 N CYS A 535 6.882 11.386 4.545 1.00 2.39 N ATOM 16 CA CYS A 535 6.256 10.391 3.675 1.00 1.76 C ATOM 17 C CYS A 535 7.050 9.071 3.560 1.00 1.40 C ATOM 18 O CYS A 535 6.462 7.990 3.665 1.00 1.26 O ATOM 19 CB CYS A 535 6.019 11.082 2.329 1.00 2.74 C ATOM 20 SG CYS A 535 4.943 10.090 1.265 1.00 3.55 S ATOM 0 H CYS A 535 7.171 12.232 4.054 1.00 2.39 H new ATOM 0 HA CYS A 535 5.311 10.059 4.105 1.00 1.76 H new ATOM 0 HB2 CYS A 535 5.569 12.061 2.494 1.00 2.74 H new ATOM 0 HB3 CYS A 535 6.974 11.250 1.830 1.00 2.74 H new ATOM 0 HG CYS A 535 4.762 10.707 0.135 1.00 3.55 H new ATOM 26 N ARG A 536 8.386 9.116 3.440 1.00 1.56 N ATOM 27 CA ARG A 536 9.213 7.896 3.308 1.00 1.62 C ATOM 28 C ARG A 536 9.142 6.987 4.529 1.00 1.59 C ATOM 29 O ARG A 536 9.102 5.774 4.376 1.00 1.67 O ATOM 30 CB ARG A 536 10.657 8.227 2.869 1.00 2.18 C ATOM 31 CG ARG A 536 11.689 8.464 3.981 1.00 2.50 C ATOM 32 CD ARG A 536 11.497 9.762 4.776 1.00 2.57 C ATOM 33 NE ARG A 536 12.206 9.661 6.058 1.00 3.53 N ATOM 34 CZ ARG A 536 11.907 10.272 7.186 1.00 4.54 C ATOM 35 NH1 ARG A 536 11.078 11.271 7.260 1.00 5.14 N ATOM 36 NH2 ARG A 536 12.433 9.845 8.289 1.00 5.75 N ATOM 0 H ARG A 536 8.922 9.984 3.431 1.00 1.56 H new ATOM 0 HA ARG A 536 8.775 7.308 2.501 1.00 1.62 H new ATOM 0 HB2 ARG A 536 11.016 7.410 2.243 1.00 2.18 H new ATOM 0 HB3 ARG A 536 10.624 9.118 2.242 1.00 2.18 H new ATOM 0 HG2 ARG A 536 11.655 7.623 4.673 1.00 2.50 H new ATOM 0 HG3 ARG A 536 12.684 8.471 3.537 1.00 2.50 H new ATOM 0 HD2 ARG A 536 11.875 10.610 4.205 1.00 2.57 H new ATOM 0 HD3 ARG A 536 10.436 9.942 4.948 1.00 2.57 H new ATOM 0 HE ARG A 536 13.022 9.049 6.077 1.00 3.53 H new ATOM 0 HH11 ARG A 536 10.622 11.619 6.416 1.00 5.14 H new ATOM 0 HH12 ARG A 536 10.884 11.707 8.162 1.00 5.14 H new ATOM 0 HH21 ARG A 536 13.068 9.047 8.276 1.00 5.75 H new ATOM 0 HH22 ARG A 536 12.212 10.307 9.171 1.00 5.75 H new ATOM 50 N LYS A 537 9.022 7.560 5.729 1.00 1.59 N ATOM 51 CA LYS A 537 8.848 6.843 6.996 1.00 1.54 C ATOM 52 C LYS A 537 7.478 6.144 7.106 1.00 1.22 C ATOM 53 O LYS A 537 7.321 5.235 7.922 1.00 1.26 O ATOM 54 CB LYS A 537 9.138 7.855 8.120 1.00 1.78 C ATOM 55 CG LYS A 537 9.097 7.302 9.548 1.00 2.46 C ATOM 56 CD LYS A 537 10.278 6.360 9.828 1.00 4.04 C ATOM 57 CE LYS A 537 10.056 5.538 11.102 1.00 4.58 C ATOM 58 NZ LYS A 537 9.105 4.429 10.865 1.00 5.66 N ATOM 0 H LYS A 537 9.044 8.573 5.850 1.00 1.59 H new ATOM 0 HA LYS A 537 9.547 6.010 7.072 1.00 1.54 H new ATOM 0 HB2 LYS A 537 10.123 8.287 7.947 1.00 1.78 H new ATOM 0 HB3 LYS A 537 8.416 8.668 8.045 1.00 1.78 H new ATOM 0 HG2 LYS A 537 9.115 8.128 10.259 1.00 2.46 H new ATOM 0 HG3 LYS A 537 8.160 6.767 9.704 1.00 2.46 H new ATOM 0 HD2 LYS A 537 10.417 5.688 8.981 1.00 4.04 H new ATOM 0 HD3 LYS A 537 11.194 6.943 9.926 1.00 4.04 H new ATOM 0 HE2 LYS A 537 11.008 5.136 11.449 1.00 4.58 H new ATOM 0 HE3 LYS A 537 9.675 6.184 11.893 1.00 4.58 H new ATOM 0 HZ1 LYS A 537 9.052 3.830 11.714 1.00 5.66 H new ATOM 0 HZ2 LYS A 537 8.163 4.818 10.656 1.00 5.66 H new ATOM 0 HZ3 LYS A 537 9.431 3.859 10.059 1.00 5.66 H new ATOM 72 N LEU A 538 6.500 6.527 6.278 1.00 1.09 N ATOM 73 CA LEU A 538 5.194 5.859 6.181 1.00 1.01 C ATOM 74 C LEU A 538 5.262 4.662 5.217 1.00 0.97 C ATOM 75 O LEU A 538 4.836 3.568 5.578 1.00 1.08 O ATOM 76 CB LEU A 538 4.090 6.856 5.774 1.00 1.07 C ATOM 77 CG LEU A 538 3.978 8.134 6.627 1.00 1.76 C ATOM 78 CD1 LEU A 538 2.839 9.007 6.100 1.00 2.87 C ATOM 79 CD2 LEU A 538 3.719 7.841 8.105 1.00 2.31 C ATOM 0 H LEU A 538 6.593 7.322 5.646 1.00 1.09 H new ATOM 0 HA LEU A 538 4.935 5.473 7.167 1.00 1.01 H new ATOM 0 HB2 LEU A 538 4.259 7.150 4.738 1.00 1.07 H new ATOM 0 HB3 LEU A 538 3.132 6.338 5.806 1.00 1.07 H new ATOM 0 HG LEU A 538 4.937 8.647 6.549 1.00 1.76 H new ATOM 0 HD11 LEU A 538 2.763 9.910 6.706 1.00 2.87 H new ATOM 0 HD12 LEU A 538 3.040 9.281 5.064 1.00 2.87 H new ATOM 0 HD13 LEU A 538 1.901 8.454 6.154 1.00 2.87 H new ATOM 0 HD21 LEU A 538 3.650 8.779 8.655 1.00 2.31 H new ATOM 0 HD22 LEU A 538 2.784 7.290 8.208 1.00 2.31 H new ATOM 0 HD23 LEU A 538 4.538 7.245 8.507 1.00 2.31 H new ATOM 91 N VAL A 539 5.883 4.821 4.041 1.00 0.91 N ATOM 92 CA VAL A 539 6.119 3.700 3.104 1.00 0.95 C ATOM 93 C VAL A 539 7.086 2.663 3.708 1.00 1.17 C ATOM 94 O VAL A 539 6.815 1.466 3.670 1.00 1.33 O ATOM 95 CB VAL A 539 6.502 4.231 1.702 1.00 0.86 C ATOM 96 CG1 VAL A 539 7.985 4.120 1.345 1.00 1.14 C ATOM 97 CG2 VAL A 539 5.679 3.511 0.634 1.00 0.89 C ATOM 0 H VAL A 539 6.235 5.719 3.709 1.00 0.91 H new ATOM 0 HA VAL A 539 5.193 3.146 2.950 1.00 0.95 H new ATOM 0 HB VAL A 539 6.281 5.298 1.733 1.00 0.86 H new ATOM 0 HG11 VAL A 539 8.149 4.519 0.344 1.00 1.14 H new ATOM 0 HG12 VAL A 539 8.576 4.689 2.063 1.00 1.14 H new ATOM 0 HG13 VAL A 539 8.289 3.074 1.373 1.00 1.14 H new ATOM 0 HG21 VAL A 539 5.952 3.888 -0.352 1.00 0.89 H new ATOM 0 HG22 VAL A 539 5.879 2.441 0.681 1.00 0.89 H new ATOM 0 HG23 VAL A 539 4.618 3.690 0.810 1.00 0.89 H new ATOM 107 N ALA A 540 8.129 3.112 4.418 1.00 1.27 N ATOM 108 CA ALA A 540 9.038 2.283 5.223 1.00 1.55 C ATOM 109 C ALA A 540 8.388 1.631 6.459 1.00 1.65 C ATOM 110 O ALA A 540 9.072 0.937 7.218 1.00 1.83 O ATOM 111 CB ALA A 540 10.217 3.147 5.675 1.00 1.69 C ATOM 0 H ALA A 540 8.373 4.102 4.449 1.00 1.27 H new ATOM 0 HA ALA A 540 9.352 1.460 4.581 1.00 1.55 H new ATOM 0 HB1 ALA A 540 10.901 2.545 6.274 1.00 1.69 H new ATOM 0 HB2 ALA A 540 10.743 3.531 4.801 1.00 1.69 H new ATOM 0 HB3 ALA A 540 9.849 3.981 6.273 1.00 1.69 H new ATOM 117 N SER A 541 7.090 1.855 6.691 1.00 1.64 N ATOM 118 CA SER A 541 6.347 1.238 7.790 1.00 1.89 C ATOM 119 C SER A 541 5.779 -0.131 7.390 1.00 1.95 C ATOM 120 O SER A 541 5.455 -0.956 8.242 1.00 2.13 O ATOM 121 CB SER A 541 5.246 2.177 8.260 1.00 2.00 C ATOM 122 OG SER A 541 4.843 1.857 9.571 1.00 3.03 O ATOM 0 H SER A 541 6.522 2.476 6.114 1.00 1.64 H new ATOM 0 HA SER A 541 7.036 1.065 8.617 1.00 1.89 H new ATOM 0 HB2 SER A 541 5.601 3.207 8.225 1.00 2.00 H new ATOM 0 HB3 SER A 541 4.392 2.110 7.586 1.00 2.00 H new ATOM 0 HG SER A 541 4.136 2.473 9.855 1.00 3.03 H new ATOM 128 N MET A 542 5.712 -0.411 6.084 1.00 1.83 N ATOM 129 CA MET A 542 5.456 -1.742 5.545 1.00 1.79 C ATOM 130 C MET A 542 6.700 -2.641 5.667 1.00 1.68 C ATOM 131 O MET A 542 7.822 -2.168 5.448 1.00 1.63 O ATOM 132 CB MET A 542 5.043 -1.630 4.075 1.00 1.78 C ATOM 133 CG MET A 542 3.554 -1.341 3.901 1.00 1.93 C ATOM 134 SD MET A 542 3.031 -1.233 2.169 1.00 2.68 S ATOM 135 CE MET A 542 3.126 -2.975 1.671 1.00 1.83 C ATOM 0 H MET A 542 5.837 0.298 5.362 1.00 1.83 H new ATOM 0 HA MET A 542 4.650 -2.196 6.122 1.00 1.79 H new ATOM 0 HB2 MET A 542 5.621 -0.838 3.599 1.00 1.78 H new ATOM 0 HB3 MET A 542 5.291 -2.558 3.561 1.00 1.78 H new ATOM 0 HG2 MET A 542 2.980 -2.124 4.396 1.00 1.93 H new ATOM 0 HG3 MET A 542 3.314 -0.404 4.403 1.00 1.93 H new ATOM 0 HE1 MET A 542 2.684 -3.095 0.682 1.00 1.83 H new ATOM 0 HE2 MET A 542 4.169 -3.289 1.642 1.00 1.83 H new ATOM 0 HE3 MET A 542 2.582 -3.589 2.389 1.00 1.83 H new ATOM 145 N PRO A 543 6.543 -3.948 5.945 1.00 1.70 N ATOM 146 CA PRO A 543 7.663 -4.868 6.149 1.00 1.66 C ATOM 147 C PRO A 543 8.454 -5.110 4.850 1.00 1.55 C ATOM 148 O PRO A 543 9.678 -5.235 4.880 1.00 1.49 O ATOM 149 CB PRO A 543 7.023 -6.134 6.732 1.00 1.79 C ATOM 150 CG PRO A 543 5.612 -6.132 6.155 1.00 1.87 C ATOM 151 CD PRO A 543 5.275 -4.643 6.085 1.00 1.83 C ATOM 0 HA PRO A 543 8.417 -4.469 6.828 1.00 1.66 H new ATOM 0 HB2 PRO A 543 7.572 -7.029 6.441 1.00 1.79 H new ATOM 0 HB3 PRO A 543 7.009 -6.109 7.822 1.00 1.79 H new ATOM 0 HG2 PRO A 543 5.577 -6.601 5.172 1.00 1.87 H new ATOM 0 HG3 PRO A 543 4.914 -6.675 6.792 1.00 1.87 H new ATOM 0 HD2 PRO A 543 4.619 -4.431 5.240 1.00 1.83 H new ATOM 0 HD3 PRO A 543 4.751 -4.320 6.984 1.00 1.83 H new ATOM 159 N LEU A 544 7.788 -5.039 3.688 1.00 1.58 N ATOM 160 CA LEU A 544 8.398 -5.084 2.351 1.00 1.55 C ATOM 161 C LEU A 544 9.455 -3.982 2.109 1.00 1.49 C ATOM 162 O LEU A 544 10.379 -4.186 1.322 1.00 1.50 O ATOM 163 CB LEU A 544 7.230 -5.060 1.341 1.00 1.61 C ATOM 164 CG LEU A 544 7.597 -5.129 -0.157 1.00 1.59 C ATOM 165 CD1 LEU A 544 6.432 -5.767 -0.914 1.00 1.67 C ATOM 166 CD2 LEU A 544 7.801 -3.746 -0.786 1.00 2.53 C ATOM 0 H LEU A 544 6.773 -4.945 3.652 1.00 1.58 H new ATOM 0 HA LEU A 544 8.984 -5.996 2.232 1.00 1.55 H new ATOM 0 HB2 LEU A 544 6.570 -5.897 1.567 1.00 1.61 H new ATOM 0 HB3 LEU A 544 6.657 -4.148 1.508 1.00 1.61 H new ATOM 0 HG LEU A 544 8.525 -5.696 -0.226 1.00 1.59 H new ATOM 0 HD11 LEU A 544 6.675 -5.823 -1.975 1.00 1.67 H new ATOM 0 HD12 LEU A 544 6.254 -6.771 -0.529 1.00 1.67 H new ATOM 0 HD13 LEU A 544 5.535 -5.162 -0.779 1.00 1.67 H new ATOM 0 HD21 LEU A 544 8.057 -3.860 -1.839 1.00 2.53 H new ATOM 0 HD22 LEU A 544 6.882 -3.166 -0.696 1.00 2.53 H new ATOM 0 HD23 LEU A 544 8.609 -3.227 -0.270 1.00 2.53 H new ATOM 178 N PHE A 545 9.377 -2.851 2.818 1.00 1.47 N ATOM 179 CA PHE A 545 10.296 -1.707 2.719 1.00 1.45 C ATOM 180 C PHE A 545 11.222 -1.545 3.945 1.00 1.48 C ATOM 181 O PHE A 545 12.015 -0.601 3.988 1.00 1.46 O ATOM 182 CB PHE A 545 9.480 -0.420 2.541 1.00 1.46 C ATOM 183 CG PHE A 545 8.588 -0.292 1.320 1.00 1.48 C ATOM 184 CD1 PHE A 545 7.311 -0.879 1.324 1.00 2.84 C ATOM 185 CD2 PHE A 545 8.954 0.562 0.262 1.00 1.65 C ATOM 186 CE1 PHE A 545 6.371 -0.548 0.336 1.00 2.93 C ATOM 187 CE2 PHE A 545 8.014 0.899 -0.727 1.00 1.61 C ATOM 188 CZ PHE A 545 6.714 0.369 -0.671 1.00 1.60 C ATOM 0 H PHE A 545 8.640 -2.699 3.507 1.00 1.47 H new ATOM 0 HA PHE A 545 10.939 -1.898 1.860 1.00 1.45 H new ATOM 0 HB2 PHE A 545 8.852 -0.300 3.424 1.00 1.46 H new ATOM 0 HB3 PHE A 545 10.178 0.417 2.531 1.00 1.46 H new ATOM 0 HD1 PHE A 545 7.051 -1.591 2.094 1.00 2.84 H new ATOM 0 HD2 PHE A 545 9.957 0.958 0.210 1.00 1.65 H new ATOM 0 HE1 PHE A 545 5.389 -0.996 0.350 1.00 2.93 H new ATOM 0 HE2 PHE A 545 8.291 1.566 -1.530 1.00 1.61 H new ATOM 0 HZ PHE A 545 5.978 0.667 -1.403 1.00 1.60 H new ATOM 198 N ALA A 546 11.144 -2.430 4.948 1.00 1.59 N ATOM 199 CA ALA A 546 11.803 -2.273 6.252 1.00 1.77 C ATOM 200 C ALA A 546 13.328 -2.154 6.134 1.00 1.73 C ATOM 201 O ALA A 546 14.001 -1.462 6.901 1.00 1.81 O ATOM 202 CB ALA A 546 11.482 -3.539 7.054 1.00 2.04 C ATOM 0 H ALA A 546 10.609 -3.295 4.874 1.00 1.59 H new ATOM 0 HA ALA A 546 11.444 -1.358 6.724 1.00 1.77 H new ATOM 0 HB1 ALA A 546 11.949 -3.475 8.037 1.00 2.04 H new ATOM 0 HB2 ALA A 546 10.402 -3.632 7.171 1.00 2.04 H new ATOM 0 HB3 ALA A 546 11.866 -4.412 6.525 1.00 2.04 H new ATOM 208 N ASN A 547 13.852 -2.888 5.160 1.00 1.72 N ATOM 209 CA ASN A 547 15.246 -3.223 4.947 1.00 1.88 C ATOM 210 C ASN A 547 15.734 -2.784 3.543 1.00 1.89 C ATOM 211 O ASN A 547 16.913 -2.936 3.207 1.00 1.98 O ATOM 212 CB ASN A 547 15.315 -4.731 5.230 1.00 2.35 C ATOM 213 CG ASN A 547 15.459 -5.040 6.705 1.00 3.00 C ATOM 214 OD1 ASN A 547 16.514 -4.873 7.302 1.00 3.71 O ATOM 215 ND2 ASN A 547 14.416 -5.491 7.355 1.00 3.29 N ATOM 0 H ASN A 547 13.257 -3.297 4.439 1.00 1.72 H new ATOM 0 HA ASN A 547 15.933 -2.689 5.603 1.00 1.88 H new ATOM 0 HB2 ASN A 547 14.413 -5.210 4.848 1.00 2.35 H new ATOM 0 HB3 ASN A 547 16.158 -5.160 4.689 1.00 2.35 H new ATOM 0 HD21 ASN A 547 14.487 -5.700 8.351 1.00 3.29 H new ATOM 0 HD22 ASN A 547 13.532 -5.633 6.866 1.00 3.29 H new ATOM 222 N ALA A 548 14.836 -2.175 2.760 1.00 1.94 N ATOM 223 CA ALA A 548 15.107 -1.451 1.516 1.00 1.94 C ATOM 224 C ALA A 548 16.128 -0.310 1.714 1.00 1.90 C ATOM 225 O ALA A 548 16.234 0.258 2.807 1.00 1.96 O ATOM 226 CB ALA A 548 13.770 -0.890 0.999 1.00 2.00 C ATOM 0 H ALA A 548 13.843 -2.175 2.993 1.00 1.94 H new ATOM 0 HA ALA A 548 15.549 -2.137 0.793 1.00 1.94 H new ATOM 0 HB1 ALA A 548 13.939 -0.344 0.071 1.00 2.00 H new ATOM 0 HB2 ALA A 548 13.077 -1.711 0.816 1.00 2.00 H new ATOM 0 HB3 ALA A 548 13.346 -0.217 1.744 1.00 2.00 H new ATOM 232 N ASP A 549 16.838 0.075 0.649 1.00 1.83 N ATOM 233 CA ASP A 549 17.689 1.274 0.651 1.00 1.81 C ATOM 234 C ASP A 549 16.819 2.540 0.861 1.00 1.79 C ATOM 235 O ASP A 549 15.896 2.774 0.076 1.00 1.59 O ATOM 236 CB ASP A 549 18.504 1.318 -0.656 1.00 1.68 C ATOM 237 CG ASP A 549 19.460 2.513 -0.762 1.00 1.71 C ATOM 238 OD1 ASP A 549 19.009 3.664 -0.584 1.00 2.02 O ATOM 239 OD2 ASP A 549 20.669 2.315 -1.038 1.00 2.70 O ATOM 0 H ASP A 549 16.841 -0.432 -0.236 1.00 1.83 H new ATOM 0 HA ASP A 549 18.397 1.240 1.479 1.00 1.81 H new ATOM 0 HB2 ASP A 549 19.081 0.397 -0.742 1.00 1.68 H new ATOM 0 HB3 ASP A 549 17.815 1.343 -1.500 1.00 1.68 H new ATOM 244 N PRO A 550 17.086 3.376 1.886 1.00 2.02 N ATOM 245 CA PRO A 550 16.212 4.491 2.283 1.00 2.10 C ATOM 246 C PRO A 550 16.080 5.594 1.215 1.00 1.91 C ATOM 247 O PRO A 550 15.181 6.436 1.278 1.00 1.91 O ATOM 248 CB PRO A 550 16.835 5.040 3.570 1.00 2.43 C ATOM 249 CG PRO A 550 18.314 4.713 3.396 1.00 2.42 C ATOM 250 CD PRO A 550 18.263 3.342 2.736 1.00 2.23 C ATOM 0 HA PRO A 550 15.190 4.138 2.420 1.00 2.10 H new ATOM 0 HB2 PRO A 550 16.667 6.112 3.675 1.00 2.43 H new ATOM 0 HB3 PRO A 550 16.417 4.564 4.457 1.00 2.43 H new ATOM 0 HG2 PRO A 550 18.823 5.447 2.771 1.00 2.42 H new ATOM 0 HG3 PRO A 550 18.840 4.687 4.350 1.00 2.42 H new ATOM 0 HD2 PRO A 550 19.164 3.151 2.154 1.00 2.23 H new ATOM 0 HD3 PRO A 550 18.190 2.549 3.480 1.00 2.23 H new ATOM 258 N ASN A 551 16.949 5.584 0.207 1.00 1.77 N ATOM 259 CA ASN A 551 16.976 6.559 -0.884 1.00 1.63 C ATOM 260 C ASN A 551 16.093 6.059 -2.037 1.00 1.28 C ATOM 261 O ASN A 551 15.267 6.801 -2.560 1.00 1.24 O ATOM 262 CB ASN A 551 18.435 6.809 -1.311 1.00 1.79 C ATOM 263 CG ASN A 551 19.373 7.074 -0.143 1.00 2.31 C ATOM 264 OD1 ASN A 551 19.485 8.177 0.382 1.00 2.45 O ATOM 265 ND2 ASN A 551 20.053 6.065 0.341 1.00 3.19 N ATOM 0 H ASN A 551 17.678 4.875 0.123 1.00 1.77 H new ATOM 0 HA ASN A 551 16.568 7.516 -0.558 1.00 1.63 H new ATOM 0 HB2 ASN A 551 18.796 5.944 -1.867 1.00 1.79 H new ATOM 0 HB3 ASN A 551 18.465 7.660 -1.991 1.00 1.79 H new ATOM 0 HD21 ASN A 551 20.666 6.202 1.145 1.00 3.19 H new ATOM 0 HD22 ASN A 551 19.970 5.142 -0.086 1.00 3.19 H new ATOM 272 N PHE A 552 16.168 4.757 -2.330 1.00 1.14 N ATOM 273 CA PHE A 552 15.268 4.048 -3.247 1.00 0.92 C ATOM 274 C PHE A 552 13.797 4.163 -2.818 1.00 0.95 C ATOM 275 O PHE A 552 12.942 4.513 -3.634 1.00 0.85 O ATOM 276 CB PHE A 552 15.728 2.583 -3.322 1.00 0.93 C ATOM 277 CG PHE A 552 14.692 1.570 -3.762 1.00 0.93 C ATOM 278 CD1 PHE A 552 14.312 1.458 -5.111 1.00 2.13 C ATOM 279 CD2 PHE A 552 14.111 0.726 -2.797 1.00 1.96 C ATOM 280 CE1 PHE A 552 13.350 0.505 -5.489 1.00 2.27 C ATOM 281 CE2 PHE A 552 13.157 -0.232 -3.175 1.00 1.91 C ATOM 282 CZ PHE A 552 12.783 -0.344 -4.524 1.00 1.14 C ATOM 0 H PHE A 552 16.878 4.148 -1.923 1.00 1.14 H new ATOM 0 HA PHE A 552 15.320 4.504 -4.235 1.00 0.92 H new ATOM 0 HB2 PHE A 552 16.573 2.526 -4.008 1.00 0.93 H new ATOM 0 HB3 PHE A 552 16.095 2.290 -2.338 1.00 0.93 H new ATOM 0 HD1 PHE A 552 14.758 2.102 -5.855 1.00 2.13 H new ATOM 0 HD2 PHE A 552 14.401 0.816 -1.760 1.00 1.96 H new ATOM 0 HE1 PHE A 552 13.047 0.426 -6.522 1.00 2.27 H new ATOM 0 HE2 PHE A 552 12.713 -0.879 -2.433 1.00 1.91 H new ATOM 0 HZ PHE A 552 12.056 -1.086 -4.821 1.00 1.14 H new ATOM 292 N VAL A 553 13.494 3.943 -1.531 1.00 1.13 N ATOM 293 CA VAL A 553 12.099 4.031 -1.038 1.00 1.18 C ATOM 294 C VAL A 553 11.537 5.452 -1.116 1.00 1.15 C ATOM 295 O VAL A 553 10.348 5.654 -1.337 1.00 1.09 O ATOM 296 CB VAL A 553 11.909 3.475 0.378 1.00 1.50 C ATOM 297 CG1 VAL A 553 12.549 2.102 0.460 1.00 2.35 C ATOM 298 CG2 VAL A 553 12.518 4.289 1.512 1.00 1.66 C ATOM 0 H VAL A 553 14.181 3.705 -0.815 1.00 1.13 H new ATOM 0 HA VAL A 553 11.533 3.394 -1.717 1.00 1.18 H new ATOM 0 HB VAL A 553 10.828 3.484 0.521 1.00 1.50 H new ATOM 0 HG11 VAL A 553 12.418 1.699 1.464 1.00 2.35 H new ATOM 0 HG12 VAL A 553 12.076 1.436 -0.262 1.00 2.35 H new ATOM 0 HG13 VAL A 553 13.613 2.183 0.237 1.00 2.35 H new ATOM 0 HG21 VAL A 553 12.318 3.795 2.463 1.00 1.66 H new ATOM 0 HG22 VAL A 553 13.595 4.369 1.365 1.00 1.66 H new ATOM 0 HG23 VAL A 553 12.078 5.286 1.521 1.00 1.66 H new ATOM 308 N THR A 554 12.420 6.438 -0.971 1.00 1.25 N ATOM 309 CA THR A 554 12.133 7.877 -1.085 1.00 1.29 C ATOM 310 C THR A 554 11.938 8.321 -2.532 1.00 1.18 C ATOM 311 O THR A 554 10.987 9.050 -2.827 1.00 1.20 O ATOM 312 CB THR A 554 13.252 8.707 -0.437 1.00 1.46 C ATOM 313 OG1 THR A 554 13.383 8.389 0.933 1.00 1.60 O ATOM 314 CG2 THR A 554 12.939 10.195 -0.534 1.00 1.57 C ATOM 0 H THR A 554 13.401 6.253 -0.761 1.00 1.25 H new ATOM 0 HA THR A 554 11.196 8.050 -0.556 1.00 1.29 H new ATOM 0 HB THR A 554 14.175 8.475 -0.969 1.00 1.46 H new ATOM 0 HG1 THR A 554 13.956 7.600 1.032 1.00 1.60 H new ATOM 0 HG21 THR A 554 13.743 10.767 -0.070 1.00 1.57 H new ATOM 0 HG22 THR A 554 12.849 10.480 -1.582 1.00 1.57 H new ATOM 0 HG23 THR A 554 12.001 10.404 -0.019 1.00 1.57 H new ATOM 322 N ALA A 555 12.778 7.865 -3.461 1.00 1.07 N ATOM 323 CA ALA A 555 12.651 8.198 -4.879 1.00 1.02 C ATOM 324 C ALA A 555 11.320 7.699 -5.485 1.00 0.94 C ATOM 325 O ALA A 555 10.842 8.221 -6.492 1.00 0.97 O ATOM 326 CB ALA A 555 13.865 7.610 -5.603 1.00 0.99 C ATOM 0 H ALA A 555 13.567 7.253 -3.251 1.00 1.07 H new ATOM 0 HA ALA A 555 12.630 9.281 -5.000 1.00 1.02 H new ATOM 0 HB1 ALA A 555 13.801 7.841 -6.666 1.00 0.99 H new ATOM 0 HB2 ALA A 555 14.778 8.041 -5.192 1.00 0.99 H new ATOM 0 HB3 ALA A 555 13.881 6.529 -5.467 1.00 0.99 H new ATOM 332 N MET A 556 10.676 6.727 -4.832 1.00 0.90 N ATOM 333 CA MET A 556 9.366 6.176 -5.201 1.00 0.87 C ATOM 334 C MET A 556 8.178 7.122 -4.933 1.00 0.90 C ATOM 335 O MET A 556 7.080 6.897 -5.440 1.00 1.00 O ATOM 336 CB MET A 556 9.215 4.872 -4.409 1.00 0.98 C ATOM 337 CG MET A 556 8.213 3.894 -5.023 1.00 0.85 C ATOM 338 SD MET A 556 8.185 2.257 -4.242 1.00 1.05 S ATOM 339 CE MET A 556 9.957 1.843 -4.104 1.00 0.95 C ATOM 0 H MET A 556 11.067 6.285 -4.000 1.00 0.90 H new ATOM 0 HA MET A 556 9.339 6.018 -6.279 1.00 0.87 H new ATOM 0 HB2 MET A 556 10.188 4.385 -4.338 1.00 0.98 H new ATOM 0 HB3 MET A 556 8.902 5.109 -3.392 1.00 0.98 H new ATOM 0 HG2 MET A 556 7.215 4.329 -4.962 1.00 0.85 H new ATOM 0 HG3 MET A 556 8.444 3.774 -6.082 1.00 0.85 H new ATOM 0 HE1 MET A 556 10.065 0.799 -3.808 1.00 0.95 H new ATOM 0 HE2 MET A 556 10.443 1.999 -5.067 1.00 0.95 H new ATOM 0 HE3 MET A 556 10.423 2.483 -3.354 1.00 0.95 H new ATOM 349 N LEU A 557 8.373 8.167 -4.120 1.00 0.88 N ATOM 350 CA LEU A 557 7.316 9.061 -3.617 1.00 0.92 C ATOM 351 C LEU A 557 7.061 10.298 -4.493 1.00 0.95 C ATOM 352 O LEU A 557 6.098 11.031 -4.259 1.00 1.04 O ATOM 353 CB LEU A 557 7.674 9.515 -2.192 1.00 1.04 C ATOM 354 CG LEU A 557 8.171 8.408 -1.251 1.00 1.06 C ATOM 355 CD1 LEU A 557 8.603 9.028 0.064 1.00 1.18 C ATOM 356 CD2 LEU A 557 7.122 7.334 -0.981 1.00 1.06 C ATOM 0 H LEU A 557 9.300 8.424 -3.781 1.00 0.88 H new ATOM 0 HA LEU A 557 6.393 8.481 -3.635 1.00 0.92 H new ATOM 0 HB2 LEU A 557 8.443 10.285 -2.257 1.00 1.04 H new ATOM 0 HB3 LEU A 557 6.795 9.980 -1.746 1.00 1.04 H new ATOM 0 HG LEU A 557 9.008 7.918 -1.748 1.00 1.06 H new ATOM 0 HD11 LEU A 557 8.957 8.246 0.736 1.00 1.18 H new ATOM 0 HD12 LEU A 557 9.406 9.742 -0.117 1.00 1.18 H new ATOM 0 HD13 LEU A 557 7.757 9.542 0.519 1.00 1.18 H new ATOM 0 HD21 LEU A 557 7.536 6.582 -0.310 1.00 1.06 H new ATOM 0 HD22 LEU A 557 6.246 7.789 -0.520 1.00 1.06 H new ATOM 0 HD23 LEU A 557 6.834 6.863 -1.921 1.00 1.06 H new ATOM 368 N THR A 558 7.933 10.581 -5.463 1.00 0.95 N ATOM 369 CA THR A 558 7.935 11.871 -6.189 1.00 1.07 C ATOM 370 C THR A 558 6.633 12.217 -6.927 1.00 1.06 C ATOM 371 O THR A 558 6.360 13.404 -7.120 1.00 1.28 O ATOM 372 CB THR A 558 9.113 11.983 -7.170 1.00 1.09 C ATOM 373 OG1 THR A 558 9.090 10.972 -8.149 1.00 1.56 O ATOM 374 CG2 THR A 558 10.450 11.875 -6.447 1.00 1.89 C ATOM 0 H THR A 558 8.657 9.933 -5.773 1.00 0.95 H new ATOM 0 HA THR A 558 8.040 12.602 -5.388 1.00 1.07 H new ATOM 0 HB THR A 558 9.006 12.959 -7.642 1.00 1.09 H new ATOM 0 HG1 THR A 558 9.855 11.083 -8.752 1.00 1.56 H new ATOM 0 HG21 THR A 558 11.262 11.958 -7.169 1.00 1.89 H new ATOM 0 HG22 THR A 558 10.533 12.677 -5.714 1.00 1.89 H new ATOM 0 HG23 THR A 558 10.513 10.912 -5.940 1.00 1.89 H new ATOM 382 N LYS A 559 5.800 11.233 -7.291 1.00 0.95 N ATOM 383 CA LYS A 559 4.479 11.426 -7.929 1.00 1.10 C ATOM 384 C LYS A 559 3.288 10.814 -7.173 1.00 1.11 C ATOM 385 O LYS A 559 2.230 10.610 -7.769 1.00 1.28 O ATOM 386 CB LYS A 559 4.554 11.059 -9.426 1.00 1.21 C ATOM 387 CG LYS A 559 5.108 9.652 -9.726 1.00 1.25 C ATOM 388 CD LYS A 559 4.144 8.755 -10.509 1.00 1.55 C ATOM 389 CE LYS A 559 2.947 8.298 -9.673 1.00 1.74 C ATOM 390 NZ LYS A 559 2.108 7.351 -10.436 1.00 2.48 N ATOM 0 H LYS A 559 6.028 10.249 -7.148 1.00 0.95 H new ATOM 0 HA LYS A 559 4.247 12.489 -7.863 1.00 1.10 H new ATOM 0 HB2 LYS A 559 3.555 11.138 -9.854 1.00 1.21 H new ATOM 0 HB3 LYS A 559 5.178 11.794 -9.934 1.00 1.21 H new ATOM 0 HG2 LYS A 559 6.035 9.751 -10.291 1.00 1.25 H new ATOM 0 HG3 LYS A 559 5.359 9.163 -8.784 1.00 1.25 H new ATOM 0 HD2 LYS A 559 3.784 9.294 -11.386 1.00 1.55 H new ATOM 0 HD3 LYS A 559 4.683 7.880 -10.872 1.00 1.55 H new ATOM 0 HE2 LYS A 559 3.297 7.824 -8.756 1.00 1.74 H new ATOM 0 HE3 LYS A 559 2.352 9.162 -9.378 1.00 1.74 H new ATOM 0 HZ1 LYS A 559 1.340 7.001 -9.829 1.00 2.48 H new ATOM 0 HZ2 LYS A 559 1.703 7.835 -11.263 1.00 2.48 H new ATOM 0 HZ3 LYS A 559 2.690 6.550 -10.754 1.00 2.48 H new ATOM 404 N LEU A 560 3.442 10.540 -5.873 1.00 1.05 N ATOM 405 CA LEU A 560 2.474 9.794 -5.055 1.00 1.05 C ATOM 406 C LEU A 560 1.039 10.343 -5.171 1.00 0.92 C ATOM 407 O LEU A 560 0.818 11.559 -5.124 1.00 1.13 O ATOM 408 CB LEU A 560 2.918 9.803 -3.573 1.00 1.32 C ATOM 409 CG LEU A 560 3.207 8.413 -2.984 1.00 1.04 C ATOM 410 CD1 LEU A 560 3.681 8.561 -1.545 1.00 2.74 C ATOM 411 CD2 LEU A 560 1.969 7.523 -2.966 1.00 1.45 C ATOM 0 H LEU A 560 4.263 10.837 -5.346 1.00 1.05 H new ATOM 0 HA LEU A 560 2.458 8.774 -5.438 1.00 1.05 H new ATOM 0 HB2 LEU A 560 3.814 10.416 -3.479 1.00 1.32 H new ATOM 0 HB3 LEU A 560 2.141 10.281 -2.977 1.00 1.32 H new ATOM 0 HG LEU A 560 3.966 7.952 -3.617 1.00 1.04 H new ATOM 0 HD11 LEU A 560 3.886 7.576 -1.126 1.00 2.74 H new ATOM 0 HD12 LEU A 560 4.590 9.162 -1.521 1.00 2.74 H new ATOM 0 HD13 LEU A 560 2.906 9.052 -0.955 1.00 2.74 H new ATOM 0 HD21 LEU A 560 2.225 6.552 -2.541 1.00 1.45 H new ATOM 0 HD22 LEU A 560 1.193 7.991 -2.360 1.00 1.45 H new ATOM 0 HD23 LEU A 560 1.603 7.388 -3.984 1.00 1.45 H new ATOM 423 N LYS A 561 0.060 9.443 -5.282 1.00 0.75 N ATOM 424 CA LYS A 561 -1.366 9.759 -5.435 1.00 0.82 C ATOM 425 C LYS A 561 -2.126 9.722 -4.108 1.00 0.71 C ATOM 426 O LYS A 561 -1.721 9.033 -3.167 1.00 0.78 O ATOM 427 CB LYS A 561 -1.994 8.838 -6.497 1.00 1.20 C ATOM 428 CG LYS A 561 -2.893 9.578 -7.498 1.00 1.22 C ATOM 429 CD LYS A 561 -2.132 10.190 -8.684 1.00 1.53 C ATOM 430 CE LYS A 561 -1.064 11.231 -8.317 1.00 1.50 C ATOM 431 NZ LYS A 561 -0.400 11.748 -9.534 1.00 1.90 N ATOM 0 H LYS A 561 0.242 8.439 -5.268 1.00 0.75 H new ATOM 0 HA LYS A 561 -1.448 10.789 -5.782 1.00 0.82 H new ATOM 0 HB2 LYS A 561 -1.198 8.331 -7.042 1.00 1.20 H new ATOM 0 HB3 LYS A 561 -2.580 8.067 -5.997 1.00 1.20 H new ATOM 0 HG2 LYS A 561 -3.643 8.885 -7.879 1.00 1.22 H new ATOM 0 HG3 LYS A 561 -3.428 10.370 -6.974 1.00 1.22 H new ATOM 0 HD2 LYS A 561 -1.653 9.384 -9.241 1.00 1.53 H new ATOM 0 HD3 LYS A 561 -2.854 10.656 -9.355 1.00 1.53 H new ATOM 0 HE2 LYS A 561 -1.524 12.054 -7.770 1.00 1.50 H new ATOM 0 HE3 LYS A 561 -0.323 10.782 -7.655 1.00 1.50 H new ATOM 0 HZ1 LYS A 561 0.319 12.450 -9.266 1.00 1.90 H new ATOM 0 HZ2 LYS A 561 0.056 10.963 -10.041 1.00 1.90 H new ATOM 0 HZ3 LYS A 561 -1.107 12.195 -10.152 1.00 1.90 H new ATOM 445 N PHE A 562 -3.210 10.490 -4.020 1.00 0.98 N ATOM 446 CA PHE A 562 -4.062 10.597 -2.833 1.00 0.98 C ATOM 447 C PHE A 562 -5.561 10.516 -3.194 1.00 0.95 C ATOM 448 O PHE A 562 -6.027 11.132 -4.157 1.00 1.00 O ATOM 449 CB PHE A 562 -3.662 11.859 -2.042 1.00 1.23 C ATOM 450 CG PHE A 562 -4.788 12.826 -1.760 1.00 1.30 C ATOM 451 CD1 PHE A 562 -5.086 13.851 -2.676 1.00 2.50 C ATOM 452 CD2 PHE A 562 -5.576 12.659 -0.612 1.00 1.71 C ATOM 453 CE1 PHE A 562 -6.177 14.703 -2.443 1.00 2.77 C ATOM 454 CE2 PHE A 562 -6.666 13.516 -0.378 1.00 1.90 C ATOM 455 CZ PHE A 562 -6.975 14.534 -1.295 1.00 1.97 C ATOM 0 H PHE A 562 -3.531 11.072 -4.794 1.00 0.98 H new ATOM 0 HA PHE A 562 -3.902 9.741 -2.177 1.00 0.98 H new ATOM 0 HB2 PHE A 562 -3.224 11.550 -1.093 1.00 1.23 H new ATOM 0 HB3 PHE A 562 -2.884 12.384 -2.596 1.00 1.23 H new ATOM 0 HD1 PHE A 562 -4.476 13.982 -3.558 1.00 2.50 H new ATOM 0 HD2 PHE A 562 -5.346 11.873 0.092 1.00 1.71 H new ATOM 0 HE1 PHE A 562 -6.405 15.490 -3.146 1.00 2.77 H new ATOM 0 HE2 PHE A 562 -7.268 13.391 0.510 1.00 1.90 H new ATOM 0 HZ PHE A 562 -7.820 15.184 -1.121 1.00 1.97 H new ATOM 465 N GLU A 563 -6.328 9.758 -2.409 1.00 0.92 N ATOM 466 CA GLU A 563 -7.744 9.431 -2.638 1.00 0.97 C ATOM 467 C GLU A 563 -8.539 9.477 -1.316 1.00 0.97 C ATOM 468 O GLU A 563 -7.992 9.266 -0.237 1.00 0.95 O ATOM 469 CB GLU A 563 -7.811 8.052 -3.329 1.00 0.94 C ATOM 470 CG GLU A 563 -9.210 7.543 -3.710 1.00 1.66 C ATOM 471 CD GLU A 563 -9.945 8.473 -4.682 1.00 2.17 C ATOM 472 OE1 GLU A 563 -10.592 9.438 -4.201 1.00 3.42 O ATOM 473 OE2 GLU A 563 -9.917 8.240 -5.915 1.00 2.80 O ATOM 0 H GLU A 563 -5.966 9.333 -1.555 1.00 0.92 H new ATOM 0 HA GLU A 563 -8.210 10.170 -3.289 1.00 0.97 H new ATOM 0 HB2 GLU A 563 -7.205 8.094 -4.234 1.00 0.94 H new ATOM 0 HB3 GLU A 563 -7.349 7.317 -2.670 1.00 0.94 H new ATOM 0 HG2 GLU A 563 -9.120 6.554 -4.160 1.00 1.66 H new ATOM 0 HG3 GLU A 563 -9.807 7.428 -2.805 1.00 1.66 H new ATOM 480 N VAL A 564 -9.835 9.784 -1.376 1.00 1.06 N ATOM 481 CA VAL A 564 -10.692 10.037 -0.204 1.00 1.03 C ATOM 482 C VAL A 564 -11.988 9.236 -0.256 1.00 0.98 C ATOM 483 O VAL A 564 -12.554 9.006 -1.328 1.00 1.04 O ATOM 484 CB VAL A 564 -11.004 11.541 -0.078 1.00 1.21 C ATOM 485 CG1 VAL A 564 -11.788 11.897 1.180 1.00 1.33 C ATOM 486 CG2 VAL A 564 -9.713 12.359 -0.061 1.00 1.26 C ATOM 0 H VAL A 564 -10.336 9.867 -2.261 1.00 1.06 H new ATOM 0 HA VAL A 564 -10.138 9.709 0.675 1.00 1.03 H new ATOM 0 HB VAL A 564 -11.617 11.780 -0.947 1.00 1.21 H new ATOM 0 HG11 VAL A 564 -11.972 12.971 1.202 1.00 1.33 H new ATOM 0 HG12 VAL A 564 -12.740 11.366 1.178 1.00 1.33 H new ATOM 0 HG13 VAL A 564 -11.214 11.609 2.060 1.00 1.33 H new ATOM 0 HG21 VAL A 564 -9.955 13.418 0.028 1.00 1.26 H new ATOM 0 HG22 VAL A 564 -9.100 12.054 0.787 1.00 1.26 H new ATOM 0 HG23 VAL A 564 -9.163 12.189 -0.986 1.00 1.26 H new ATOM 496 N PHE A 565 -12.477 8.866 0.926 1.00 0.96 N ATOM 497 CA PHE A 565 -13.805 8.302 1.155 1.00 0.97 C ATOM 498 C PHE A 565 -14.453 8.965 2.378 1.00 0.96 C ATOM 499 O PHE A 565 -13.761 9.313 3.336 1.00 0.94 O ATOM 500 CB PHE A 565 -13.690 6.786 1.349 1.00 0.96 C ATOM 501 CG PHE A 565 -13.066 6.049 0.179 1.00 0.90 C ATOM 502 CD1 PHE A 565 -11.665 6.003 0.007 1.00 1.51 C ATOM 503 CD2 PHE A 565 -13.908 5.405 -0.746 1.00 2.16 C ATOM 504 CE1 PHE A 565 -11.117 5.325 -1.097 1.00 1.54 C ATOM 505 CE2 PHE A 565 -13.352 4.701 -1.829 1.00 2.14 C ATOM 506 CZ PHE A 565 -11.959 4.666 -2.008 1.00 0.91 C ATOM 0 H PHE A 565 -11.936 8.955 1.786 1.00 0.96 H new ATOM 0 HA PHE A 565 -14.439 8.495 0.290 1.00 0.97 H new ATOM 0 HB2 PHE A 565 -13.098 6.590 2.243 1.00 0.96 H new ATOM 0 HB3 PHE A 565 -14.685 6.379 1.530 1.00 0.96 H new ATOM 0 HD1 PHE A 565 -11.016 6.487 0.721 1.00 1.51 H new ATOM 0 HD2 PHE A 565 -14.980 5.451 -0.624 1.00 2.16 H new ATOM 0 HE1 PHE A 565 -10.047 5.311 -1.244 1.00 1.54 H new ATOM 0 HE2 PHE A 565 -13.998 4.186 -2.525 1.00 2.14 H new ATOM 0 HZ PHE A 565 -11.536 4.132 -2.846 1.00 0.91 H new ATOM 516 N GLN A 566 -15.775 9.129 2.361 1.00 1.01 N ATOM 517 CA GLN A 566 -16.554 9.643 3.497 1.00 0.97 C ATOM 518 C GLN A 566 -17.126 8.472 4.345 1.00 0.97 C ATOM 519 O GLN A 566 -17.202 7.342 3.844 1.00 1.08 O ATOM 520 CB GLN A 566 -17.629 10.620 2.979 1.00 1.12 C ATOM 521 CG GLN A 566 -17.138 11.978 2.485 1.00 1.39 C ATOM 522 CD GLN A 566 -16.549 11.911 1.101 1.00 1.50 C ATOM 523 OE1 GLN A 566 -17.155 11.455 0.137 1.00 2.80 O ATOM 524 NE2 GLN A 566 -15.340 12.362 0.941 1.00 1.37 N ATOM 0 H GLN A 566 -16.348 8.906 1.547 1.00 1.01 H new ATOM 0 HA GLN A 566 -15.911 10.207 4.173 1.00 0.97 H new ATOM 0 HB2 GLN A 566 -18.166 10.135 2.164 1.00 1.12 H new ATOM 0 HB3 GLN A 566 -18.350 10.789 3.779 1.00 1.12 H new ATOM 0 HG2 GLN A 566 -17.968 12.684 2.489 1.00 1.39 H new ATOM 0 HG3 GLN A 566 -16.389 12.363 3.177 1.00 1.39 H new ATOM 0 HE21 GLN A 566 -14.828 12.743 1.737 1.00 1.37 H new ATOM 0 HE22 GLN A 566 -14.903 12.335 0.020 1.00 1.37 H new ATOM 533 N PRO A 567 -17.545 8.688 5.612 1.00 0.91 N ATOM 534 CA PRO A 567 -17.866 7.605 6.552 1.00 0.89 C ATOM 535 C PRO A 567 -18.878 6.585 6.003 1.00 0.89 C ATOM 536 O PRO A 567 -19.921 6.980 5.482 1.00 0.98 O ATOM 537 CB PRO A 567 -18.433 8.283 7.808 1.00 0.95 C ATOM 538 CG PRO A 567 -17.977 9.739 7.727 1.00 0.98 C ATOM 539 CD PRO A 567 -17.711 9.990 6.249 1.00 0.94 C ATOM 0 HA PRO A 567 -16.962 7.029 6.752 1.00 0.89 H new ATOM 0 HB2 PRO A 567 -19.520 8.213 7.835 1.00 0.95 H new ATOM 0 HB3 PRO A 567 -18.061 7.805 8.714 1.00 0.95 H new ATOM 0 HG2 PRO A 567 -18.743 10.414 8.110 1.00 0.98 H new ATOM 0 HG3 PRO A 567 -17.079 9.905 8.323 1.00 0.98 H new ATOM 0 HD2 PRO A 567 -18.539 10.537 5.797 1.00 0.94 H new ATOM 0 HD3 PRO A 567 -16.817 10.599 6.117 1.00 0.94 H new ATOM 547 N GLY A 568 -18.595 5.284 6.120 1.00 0.84 N ATOM 548 CA GLY A 568 -19.510 4.182 5.813 1.00 0.90 C ATOM 549 C GLY A 568 -19.184 3.438 4.519 1.00 0.87 C ATOM 550 O GLY A 568 -19.672 2.326 4.324 1.00 1.02 O ATOM 0 H GLY A 568 -17.685 4.957 6.444 1.00 0.84 H new ATOM 0 HA2 GLY A 568 -19.496 3.472 6.640 1.00 0.90 H new ATOM 0 HA3 GLY A 568 -20.525 4.575 5.747 1.00 0.90 H new ATOM 554 N ASP A 569 -18.348 4.003 3.649 1.00 0.81 N ATOM 555 CA ASP A 569 -18.167 3.514 2.289 1.00 0.86 C ATOM 556 C ASP A 569 -17.177 2.344 2.214 1.00 0.86 C ATOM 557 O ASP A 569 -16.069 2.430 2.742 1.00 0.79 O ATOM 558 CB ASP A 569 -17.740 4.685 1.387 1.00 0.88 C ATOM 559 CG ASP A 569 -18.147 4.523 -0.079 1.00 1.05 C ATOM 560 OD1 ASP A 569 -18.231 3.380 -0.583 1.00 1.68 O ATOM 561 OD2 ASP A 569 -18.401 5.560 -0.738 1.00 1.87 O ATOM 0 H ASP A 569 -17.776 4.817 3.872 1.00 0.81 H new ATOM 0 HA ASP A 569 -19.117 3.116 1.934 1.00 0.86 H new ATOM 0 HB2 ASP A 569 -18.176 5.606 1.774 1.00 0.88 H new ATOM 0 HB3 ASP A 569 -16.657 4.797 1.442 1.00 0.88 H new ATOM 566 N TYR A 570 -17.556 1.253 1.551 1.00 1.02 N ATOM 567 CA TYR A 570 -16.639 0.142 1.241 1.00 1.03 C ATOM 568 C TYR A 570 -15.539 0.609 0.276 1.00 1.04 C ATOM 569 O TYR A 570 -15.787 0.861 -0.909 1.00 1.21 O ATOM 570 CB TYR A 570 -17.400 -1.072 0.694 1.00 1.19 C ATOM 571 CG TYR A 570 -18.032 -1.936 1.771 1.00 1.27 C ATOM 572 CD1 TYR A 570 -17.287 -2.979 2.358 1.00 2.27 C ATOM 573 CD2 TYR A 570 -19.358 -1.706 2.185 1.00 2.15 C ATOM 574 CE1 TYR A 570 -17.870 -3.801 3.342 1.00 2.52 C ATOM 575 CE2 TYR A 570 -19.949 -2.538 3.156 1.00 2.15 C ATOM 576 CZ TYR A 570 -19.210 -3.595 3.734 1.00 1.68 C ATOM 577 OH TYR A 570 -19.785 -4.421 4.651 1.00 1.95 O ATOM 0 H TYR A 570 -18.507 1.108 1.211 1.00 1.02 H new ATOM 0 HA TYR A 570 -16.158 -0.176 2.166 1.00 1.03 H new ATOM 0 HB2 TYR A 570 -18.180 -0.725 0.016 1.00 1.19 H new ATOM 0 HB3 TYR A 570 -16.715 -1.683 0.106 1.00 1.19 H new ATOM 0 HD1 TYR A 570 -16.265 -3.148 2.052 1.00 2.27 H new ATOM 0 HD2 TYR A 570 -19.923 -0.891 1.758 1.00 2.15 H new ATOM 0 HE1 TYR A 570 -17.290 -4.590 3.797 1.00 2.52 H new ATOM 0 HE2 TYR A 570 -20.971 -2.367 3.460 1.00 2.15 H new ATOM 0 HH TYR A 570 -20.710 -4.140 4.810 1.00 1.95 H new ATOM 587 N ILE A 571 -14.312 0.725 0.791 1.00 0.94 N ATOM 588 CA ILE A 571 -13.214 1.439 0.124 1.00 1.00 C ATOM 589 C ILE A 571 -12.620 0.657 -1.058 1.00 1.09 C ATOM 590 O ILE A 571 -12.249 1.252 -2.071 1.00 1.40 O ATOM 591 CB ILE A 571 -12.129 1.863 1.137 1.00 0.91 C ATOM 592 CG1 ILE A 571 -11.567 0.687 1.957 1.00 0.85 C ATOM 593 CG2 ILE A 571 -12.654 2.930 2.113 1.00 0.89 C ATOM 594 CD1 ILE A 571 -10.203 1.014 2.543 1.00 0.97 C ATOM 0 H ILE A 571 -14.048 0.323 1.691 1.00 0.94 H new ATOM 0 HA ILE A 571 -13.644 2.344 -0.304 1.00 1.00 H new ATOM 0 HB ILE A 571 -11.322 2.273 0.530 1.00 0.91 H new ATOM 0 HG12 ILE A 571 -12.260 0.440 2.762 1.00 0.85 H new ATOM 0 HG13 ILE A 571 -11.489 -0.195 1.322 1.00 0.85 H new ATOM 0 HG21 ILE A 571 -11.864 3.205 2.811 1.00 0.89 H new ATOM 0 HG22 ILE A 571 -12.967 3.812 1.554 1.00 0.89 H new ATOM 0 HG23 ILE A 571 -13.504 2.530 2.666 1.00 0.89 H new ATOM 0 HD11 ILE A 571 -9.839 0.161 3.115 1.00 0.97 H new ATOM 0 HD12 ILE A 571 -9.504 1.235 1.736 1.00 0.97 H new ATOM 0 HD13 ILE A 571 -10.287 1.881 3.199 1.00 0.97 H new ATOM 606 N ILE A 572 -12.549 -0.672 -0.945 1.00 0.93 N ATOM 607 CA ILE A 572 -11.740 -1.551 -1.798 1.00 0.92 C ATOM 608 C ILE A 572 -12.586 -2.622 -2.508 1.00 1.11 C ATOM 609 O ILE A 572 -13.516 -3.195 -1.931 1.00 1.51 O ATOM 610 CB ILE A 572 -10.602 -2.139 -0.921 1.00 1.07 C ATOM 611 CG1 ILE A 572 -9.518 -1.054 -0.731 1.00 1.48 C ATOM 612 CG2 ILE A 572 -9.979 -3.417 -1.492 1.00 1.17 C ATOM 613 CD1 ILE A 572 -8.425 -1.379 0.294 1.00 1.22 C ATOM 0 H ILE A 572 -13.070 -1.184 -0.234 1.00 0.93 H new ATOM 0 HA ILE A 572 -11.300 -0.982 -2.617 1.00 0.92 H new ATOM 0 HB ILE A 572 -11.041 -2.428 0.034 1.00 1.07 H new ATOM 0 HG12 ILE A 572 -9.043 -0.868 -1.694 1.00 1.48 H new ATOM 0 HG13 ILE A 572 -10.007 -0.127 -0.432 1.00 1.48 H new ATOM 0 HG21 ILE A 572 -9.192 -3.768 -0.824 1.00 1.17 H new ATOM 0 HG22 ILE A 572 -10.746 -4.186 -1.584 1.00 1.17 H new ATOM 0 HG23 ILE A 572 -9.555 -3.208 -2.474 1.00 1.17 H new ATOM 0 HD11 ILE A 572 -7.718 -0.551 0.347 1.00 1.22 H new ATOM 0 HD12 ILE A 572 -8.879 -1.532 1.273 1.00 1.22 H new ATOM 0 HD13 ILE A 572 -7.900 -2.285 -0.009 1.00 1.22 H new ATOM 625 N ARG A 573 -12.205 -2.922 -3.754 1.00 1.16 N ATOM 626 CA ARG A 573 -12.636 -4.065 -4.567 1.00 1.52 C ATOM 627 C ARG A 573 -11.421 -4.650 -5.300 1.00 1.21 C ATOM 628 O ARG A 573 -10.556 -3.900 -5.756 1.00 1.42 O ATOM 629 CB ARG A 573 -13.710 -3.569 -5.560 1.00 2.27 C ATOM 630 CG ARG A 573 -14.309 -4.649 -6.472 1.00 3.50 C ATOM 631 CD ARG A 573 -15.276 -5.584 -5.734 1.00 4.14 C ATOM 632 NE ARG A 573 -15.753 -6.658 -6.620 1.00 5.54 N ATOM 633 CZ ARG A 573 -16.673 -6.589 -7.565 1.00 6.41 C ATOM 634 NH1 ARG A 573 -17.397 -5.532 -7.783 1.00 6.48 N ATOM 635 NH2 ARG A 573 -16.862 -7.616 -8.335 1.00 7.85 N ATOM 0 H ARG A 573 -11.541 -2.332 -4.256 1.00 1.16 H new ATOM 0 HA ARG A 573 -13.063 -4.853 -3.946 1.00 1.52 H new ATOM 0 HB2 ARG A 573 -14.518 -3.106 -4.994 1.00 2.27 H new ATOM 0 HB3 ARG A 573 -13.272 -2.791 -6.185 1.00 2.27 H new ATOM 0 HG2 ARG A 573 -14.834 -4.170 -7.298 1.00 3.50 H new ATOM 0 HG3 ARG A 573 -13.502 -5.239 -6.907 1.00 3.50 H new ATOM 0 HD2 ARG A 573 -14.777 -6.018 -4.867 1.00 4.14 H new ATOM 0 HD3 ARG A 573 -16.125 -5.012 -5.360 1.00 4.14 H new ATOM 0 HE ARG A 573 -15.318 -7.571 -6.487 1.00 5.54 H new ATOM 0 HH11 ARG A 573 -17.269 -4.699 -7.209 1.00 6.48 H new ATOM 0 HH12 ARG A 573 -18.094 -5.536 -8.528 1.00 6.48 H new ATOM 0 HH21 ARG A 573 -16.304 -8.460 -8.206 1.00 7.85 H new ATOM 0 HH22 ARG A 573 -17.569 -7.579 -9.070 1.00 7.85 H new ATOM 649 N GLU A 574 -11.337 -5.972 -5.416 1.00 1.58 N ATOM 650 CA GLU A 574 -10.383 -6.660 -6.296 1.00 1.46 C ATOM 651 C GLU A 574 -10.989 -6.954 -7.683 1.00 1.86 C ATOM 652 O GLU A 574 -12.172 -7.273 -7.805 1.00 2.85 O ATOM 653 CB GLU A 574 -9.836 -7.922 -5.604 1.00 2.55 C ATOM 654 CG GLU A 574 -8.767 -8.661 -6.423 1.00 2.82 C ATOM 655 CD GLU A 574 -7.554 -7.780 -6.738 1.00 3.88 C ATOM 656 OE1 GLU A 574 -7.635 -6.943 -7.672 1.00 4.58 O ATOM 657 OE2 GLU A 574 -6.557 -7.898 -5.997 1.00 4.98 O ATOM 0 H GLU A 574 -11.938 -6.611 -4.895 1.00 1.58 H new ATOM 0 HA GLU A 574 -9.539 -5.995 -6.479 1.00 1.46 H new ATOM 0 HB2 GLU A 574 -9.413 -7.642 -4.639 1.00 2.55 H new ATOM 0 HB3 GLU A 574 -10.663 -8.603 -5.404 1.00 2.55 H new ATOM 0 HG2 GLU A 574 -8.438 -9.543 -5.873 1.00 2.82 H new ATOM 0 HG3 GLU A 574 -9.208 -9.013 -7.356 1.00 2.82 H new ATOM 664 N GLY A 575 -10.163 -6.887 -8.728 1.00 1.94 N ATOM 665 CA GLY A 575 -10.561 -7.103 -10.118 1.00 3.01 C ATOM 666 C GLY A 575 -9.423 -7.302 -11.132 1.00 2.85 C ATOM 667 O GLY A 575 -9.726 -7.344 -12.327 1.00 3.85 O ATOM 0 H GLY A 575 -9.170 -6.675 -8.627 1.00 1.94 H new ATOM 0 HA2 GLY A 575 -11.209 -7.979 -10.156 1.00 3.01 H new ATOM 0 HA3 GLY A 575 -11.159 -6.250 -10.439 1.00 3.01 H new ATOM 671 N THR A 576 -8.144 -7.398 -10.723 1.00 1.88 N ATOM 672 CA THR A 576 -7.016 -7.615 -11.660 1.00 1.92 C ATOM 673 C THR A 576 -5.761 -8.225 -11.017 1.00 1.44 C ATOM 674 O THR A 576 -5.653 -8.322 -9.799 1.00 1.46 O ATOM 675 CB THR A 576 -6.677 -6.309 -12.402 1.00 2.51 C ATOM 676 OG1 THR A 576 -5.897 -6.558 -13.550 1.00 2.81 O ATOM 677 CG2 THR A 576 -5.961 -5.268 -11.541 1.00 3.07 C ATOM 0 H THR A 576 -7.861 -7.329 -9.745 1.00 1.88 H new ATOM 0 HA THR A 576 -7.362 -8.364 -12.373 1.00 1.92 H new ATOM 0 HB THR A 576 -7.645 -5.893 -12.681 1.00 2.51 H new ATOM 0 HG1 THR A 576 -5.699 -5.711 -14.001 1.00 2.81 H new ATOM 0 HG21 THR A 576 -5.758 -4.379 -12.138 1.00 3.07 H new ATOM 0 HG22 THR A 576 -6.592 -5.000 -10.694 1.00 3.07 H new ATOM 0 HG23 THR A 576 -5.021 -5.682 -11.176 1.00 3.07 H new ATOM 685 N ILE A 577 -4.804 -8.653 -11.847 1.00 1.53 N ATOM 686 CA ILE A 577 -3.494 -9.195 -11.446 1.00 1.49 C ATOM 687 C ILE A 577 -2.428 -8.093 -11.540 1.00 1.75 C ATOM 688 O ILE A 577 -2.397 -7.337 -12.516 1.00 2.02 O ATOM 689 CB ILE A 577 -3.134 -10.417 -12.328 1.00 1.65 C ATOM 690 CG1 ILE A 577 -3.965 -11.679 -12.015 1.00 1.67 C ATOM 691 CG2 ILE A 577 -1.657 -10.835 -12.182 1.00 1.99 C ATOM 692 CD1 ILE A 577 -5.474 -11.602 -12.243 1.00 1.89 C ATOM 0 H ILE A 577 -4.922 -8.632 -12.860 1.00 1.53 H new ATOM 0 HA ILE A 577 -3.537 -9.535 -10.411 1.00 1.49 H new ATOM 0 HB ILE A 577 -3.352 -10.067 -13.337 1.00 1.65 H new ATOM 0 HG12 ILE A 577 -3.574 -12.498 -12.619 1.00 1.67 H new ATOM 0 HG13 ILE A 577 -3.795 -11.944 -10.971 1.00 1.67 H new ATOM 0 HG21 ILE A 577 -1.458 -11.695 -12.821 1.00 1.99 H new ATOM 0 HG22 ILE A 577 -1.013 -10.006 -12.478 1.00 1.99 H new ATOM 0 HG23 ILE A 577 -1.454 -11.099 -11.144 1.00 1.99 H new ATOM 0 HD11 ILE A 577 -5.930 -12.557 -11.983 1.00 1.89 H new ATOM 0 HD12 ILE A 577 -5.897 -10.816 -11.618 1.00 1.89 H new ATOM 0 HD13 ILE A 577 -5.673 -11.378 -13.291 1.00 1.89 H new ATOM 704 N GLY A 578 -1.508 -8.019 -10.571 1.00 1.92 N ATOM 705 CA GLY A 578 -0.405 -7.042 -10.588 1.00 2.29 C ATOM 706 C GLY A 578 -0.896 -5.625 -10.282 1.00 2.05 C ATOM 707 O GLY A 578 -0.750 -4.714 -11.103 1.00 2.13 O ATOM 0 H GLY A 578 -1.504 -8.631 -9.755 1.00 1.92 H new ATOM 0 HA2 GLY A 578 0.348 -7.332 -9.856 1.00 2.29 H new ATOM 0 HA3 GLY A 578 0.078 -7.056 -11.565 1.00 2.29 H new ATOM 711 N LYS A 579 -1.566 -5.469 -9.135 1.00 1.97 N ATOM 712 CA LYS A 579 -2.320 -4.266 -8.764 1.00 1.73 C ATOM 713 C LYS A 579 -1.494 -3.174 -8.077 1.00 1.52 C ATOM 714 O LYS A 579 -0.415 -3.436 -7.548 1.00 1.72 O ATOM 715 CB LYS A 579 -3.572 -4.649 -7.982 1.00 1.83 C ATOM 716 CG LYS A 579 -3.341 -5.049 -6.520 1.00 3.54 C ATOM 717 CD LYS A 579 -4.736 -5.131 -5.912 1.00 3.51 C ATOM 718 CE LYS A 579 -4.737 -5.577 -4.448 1.00 5.47 C ATOM 719 NZ LYS A 579 -6.097 -6.002 -4.062 1.00 5.90 N ATOM 0 H LYS A 579 -1.600 -6.195 -8.420 1.00 1.97 H new ATOM 0 HA LYS A 579 -2.626 -3.794 -9.698 1.00 1.73 H new ATOM 0 HB2 LYS A 579 -4.265 -3.808 -8.005 1.00 1.83 H new ATOM 0 HB3 LYS A 579 -4.060 -5.478 -8.495 1.00 1.83 H new ATOM 0 HG2 LYS A 579 -2.822 -6.005 -6.449 1.00 3.54 H new ATOM 0 HG3 LYS A 579 -2.726 -4.313 -6.001 1.00 3.54 H new ATOM 0 HD2 LYS A 579 -5.215 -4.155 -5.987 1.00 3.51 H new ATOM 0 HD3 LYS A 579 -5.338 -5.827 -6.496 1.00 3.51 H new ATOM 0 HE2 LYS A 579 -4.034 -6.398 -4.307 1.00 5.47 H new ATOM 0 HE3 LYS A 579 -4.405 -4.760 -3.808 1.00 5.47 H new ATOM 0 HZ1 LYS A 579 -6.047 -6.592 -3.207 1.00 5.90 H new ATOM 0 HZ2 LYS A 579 -6.681 -5.163 -3.870 1.00 5.90 H new ATOM 0 HZ3 LYS A 579 -6.522 -6.550 -4.837 1.00 5.90 H new ATOM 733 N LYS A 580 -2.059 -1.966 -8.010 1.00 1.30 N ATOM 734 CA LYS A 580 -1.515 -0.833 -7.240 1.00 1.12 C ATOM 735 C LYS A 580 -1.951 -0.902 -5.775 1.00 1.00 C ATOM 736 O LYS A 580 -2.950 -1.543 -5.451 1.00 1.19 O ATOM 737 CB LYS A 580 -1.908 0.498 -7.909 1.00 1.22 C ATOM 738 CG LYS A 580 -3.415 0.826 -7.909 1.00 1.49 C ATOM 739 CD LYS A 580 -3.829 1.706 -6.718 1.00 2.84 C ATOM 740 CE LYS A 580 -5.326 2.029 -6.683 1.00 3.73 C ATOM 741 NZ LYS A 580 -5.777 2.742 -7.897 1.00 3.81 N ATOM 0 H LYS A 580 -2.925 -1.738 -8.498 1.00 1.30 H new ATOM 0 HA LYS A 580 -0.427 -0.893 -7.241 1.00 1.12 H new ATOM 0 HB2 LYS A 580 -1.379 1.307 -7.405 1.00 1.22 H new ATOM 0 HB3 LYS A 580 -1.558 0.482 -8.941 1.00 1.22 H new ATOM 0 HG2 LYS A 580 -3.672 1.334 -8.838 1.00 1.49 H new ATOM 0 HG3 LYS A 580 -3.985 -0.103 -7.885 1.00 1.49 H new ATOM 0 HD2 LYS A 580 -3.553 1.202 -5.792 1.00 2.84 H new ATOM 0 HD3 LYS A 580 -3.266 2.638 -6.753 1.00 2.84 H new ATOM 0 HE2 LYS A 580 -5.892 1.104 -6.577 1.00 3.73 H new ATOM 0 HE3 LYS A 580 -5.543 2.638 -5.805 1.00 3.73 H new ATOM 0 HZ1 LYS A 580 -6.770 3.028 -7.783 1.00 3.81 H new ATOM 0 HZ2 LYS A 580 -5.188 3.587 -8.042 1.00 3.81 H new ATOM 0 HZ3 LYS A 580 -5.690 2.114 -8.721 1.00 3.81 H new ATOM 755 N MET A 581 -1.210 -0.237 -4.896 1.00 0.90 N ATOM 756 CA MET A 581 -1.393 -0.299 -3.442 1.00 0.94 C ATOM 757 C MET A 581 -2.368 0.766 -2.907 1.00 0.97 C ATOM 758 O MET A 581 -2.378 1.876 -3.433 1.00 0.99 O ATOM 759 CB MET A 581 0.004 -0.179 -2.803 1.00 1.16 C ATOM 760 CG MET A 581 0.009 -0.284 -1.276 1.00 1.60 C ATOM 761 SD MET A 581 -0.865 -1.730 -0.632 1.00 2.80 S ATOM 762 CE MET A 581 -0.492 -1.498 1.117 1.00 2.22 C ATOM 0 H MET A 581 -0.445 0.377 -5.177 1.00 0.90 H new ATOM 0 HA MET A 581 -1.858 -1.248 -3.174 1.00 0.94 H new ATOM 0 HB2 MET A 581 0.646 -0.960 -3.211 1.00 1.16 H new ATOM 0 HB3 MET A 581 0.442 0.777 -3.091 1.00 1.16 H new ATOM 0 HG2 MET A 581 1.042 -0.312 -0.928 1.00 1.60 H new ATOM 0 HG3 MET A 581 -0.443 0.616 -0.859 1.00 1.60 H new ATOM 0 HE1 MET A 581 -1.335 -1.840 1.717 1.00 2.22 H new ATOM 0 HE2 MET A 581 0.397 -2.072 1.379 1.00 2.22 H new ATOM 0 HE3 MET A 581 -0.312 -0.441 1.314 1.00 2.22 H new ATOM 772 N TYR A 582 -3.111 0.463 -1.829 1.00 1.06 N ATOM 773 CA TYR A 582 -3.774 1.458 -0.967 1.00 0.99 C ATOM 774 C TYR A 582 -3.330 1.329 0.500 1.00 0.99 C ATOM 775 O TYR A 582 -3.256 0.236 1.077 1.00 1.12 O ATOM 776 CB TYR A 582 -5.311 1.391 -1.017 1.00 1.00 C ATOM 777 CG TYR A 582 -5.997 1.900 -2.269 1.00 1.43 C ATOM 778 CD1 TYR A 582 -6.100 3.288 -2.490 1.00 2.93 C ATOM 779 CD2 TYR A 582 -6.645 1.001 -3.139 1.00 1.94 C ATOM 780 CE1 TYR A 582 -6.870 3.776 -3.565 1.00 3.65 C ATOM 781 CE2 TYR A 582 -7.415 1.484 -4.214 1.00 2.31 C ATOM 782 CZ TYR A 582 -7.542 2.875 -4.417 1.00 2.89 C ATOM 783 OH TYR A 582 -8.298 3.360 -5.435 1.00 3.68 O ATOM 0 H TYR A 582 -3.271 -0.498 -1.526 1.00 1.06 H new ATOM 0 HA TYR A 582 -3.462 2.421 -1.371 1.00 0.99 H new ATOM 0 HB2 TYR A 582 -5.607 0.352 -0.871 1.00 1.00 H new ATOM 0 HB3 TYR A 582 -5.699 1.955 -0.169 1.00 1.00 H new ATOM 0 HD1 TYR A 582 -5.589 3.978 -1.835 1.00 2.93 H new ATOM 0 HD2 TYR A 582 -6.551 -0.063 -2.981 1.00 1.94 H new ATOM 0 HE1 TYR A 582 -6.945 4.840 -3.736 1.00 3.65 H new ATOM 0 HE2 TYR A 582 -7.907 0.792 -4.881 1.00 2.31 H new ATOM 0 HH TYR A 582 -8.695 2.614 -5.932 1.00 3.68 H new ATOM 793 N PHE A 583 -3.112 2.478 1.136 1.00 0.90 N ATOM 794 CA PHE A 583 -2.739 2.582 2.546 1.00 0.93 C ATOM 795 C PHE A 583 -3.205 3.911 3.172 1.00 0.83 C ATOM 796 O PHE A 583 -3.623 4.824 2.457 1.00 0.84 O ATOM 797 CB PHE A 583 -1.252 2.199 2.728 1.00 1.06 C ATOM 798 CG PHE A 583 -0.153 2.591 1.742 1.00 1.46 C ATOM 799 CD1 PHE A 583 -0.275 3.640 0.810 1.00 2.32 C ATOM 800 CD2 PHE A 583 1.040 1.842 1.764 1.00 2.58 C ATOM 801 CE1 PHE A 583 0.755 3.893 -0.118 1.00 2.84 C ATOM 802 CE2 PHE A 583 2.086 2.118 0.866 1.00 3.19 C ATOM 803 CZ PHE A 583 1.945 3.144 -0.081 1.00 2.87 C ATOM 0 H PHE A 583 -3.192 3.384 0.675 1.00 0.90 H new ATOM 0 HA PHE A 583 -3.284 1.849 3.140 1.00 0.93 H new ATOM 0 HB2 PHE A 583 -0.950 2.595 3.698 1.00 1.06 H new ATOM 0 HB3 PHE A 583 -1.222 1.112 2.804 1.00 1.06 H new ATOM 0 HD1 PHE A 583 -1.163 4.254 0.807 1.00 2.32 H new ATOM 0 HD2 PHE A 583 1.153 1.043 2.482 1.00 2.58 H new ATOM 0 HE1 PHE A 583 0.630 4.666 -0.862 1.00 2.84 H new ATOM 0 HE2 PHE A 583 2.998 1.541 0.905 1.00 3.19 H new ATOM 0 HZ PHE A 583 2.744 3.357 -0.776 1.00 2.87 H new ATOM 813 N ILE A 584 -3.282 3.988 4.507 1.00 0.81 N ATOM 814 CA ILE A 584 -4.096 5.005 5.208 1.00 0.82 C ATOM 815 C ILE A 584 -3.245 6.227 5.575 1.00 0.91 C ATOM 816 O ILE A 584 -2.414 6.127 6.477 1.00 0.95 O ATOM 817 CB ILE A 584 -4.810 4.393 6.448 1.00 0.82 C ATOM 818 CG1 ILE A 584 -5.479 3.048 6.084 1.00 0.78 C ATOM 819 CG2 ILE A 584 -5.875 5.383 6.993 1.00 0.83 C ATOM 820 CD1 ILE A 584 -6.268 2.408 7.223 1.00 0.83 C ATOM 0 H ILE A 584 -2.787 3.354 5.134 1.00 0.81 H new ATOM 0 HA ILE A 584 -4.877 5.348 4.529 1.00 0.82 H new ATOM 0 HB ILE A 584 -4.062 4.211 7.220 1.00 0.82 H new ATOM 0 HG12 ILE A 584 -6.148 3.206 5.238 1.00 0.78 H new ATOM 0 HG13 ILE A 584 -4.709 2.350 5.755 1.00 0.78 H new ATOM 0 HG21 ILE A 584 -6.369 4.945 7.860 1.00 0.83 H new ATOM 0 HG22 ILE A 584 -5.390 6.315 7.283 1.00 0.83 H new ATOM 0 HG23 ILE A 584 -6.615 5.585 6.218 1.00 0.83 H new ATOM 0 HD11 ILE A 584 -6.704 1.469 6.881 1.00 0.83 H new ATOM 0 HD12 ILE A 584 -5.601 2.214 8.063 1.00 0.83 H new ATOM 0 HD13 ILE A 584 -7.063 3.083 7.539 1.00 0.83 H new ATOM 832 N GLN A 585 -3.447 7.383 4.917 1.00 0.97 N ATOM 833 CA GLN A 585 -2.666 8.590 5.219 1.00 1.06 C ATOM 834 C GLN A 585 -3.183 9.269 6.497 1.00 1.05 C ATOM 835 O GLN A 585 -2.404 9.571 7.397 1.00 1.11 O ATOM 836 CB GLN A 585 -2.690 9.527 3.995 1.00 1.17 C ATOM 837 CG GLN A 585 -1.478 10.469 3.925 1.00 1.35 C ATOM 838 CD GLN A 585 -1.522 11.611 4.935 1.00 1.51 C ATOM 839 OE1 GLN A 585 -0.787 11.641 5.910 1.00 2.79 O ATOM 840 NE2 GLN A 585 -2.371 12.591 4.745 1.00 1.91 N ATOM 0 H GLN A 585 -4.140 7.504 4.178 1.00 0.97 H new ATOM 0 HA GLN A 585 -1.628 8.322 5.416 1.00 1.06 H new ATOM 0 HB2 GLN A 585 -2.726 8.926 3.087 1.00 1.17 H new ATOM 0 HB3 GLN A 585 -3.603 10.122 4.020 1.00 1.17 H new ATOM 0 HG2 GLN A 585 -0.570 9.889 4.087 1.00 1.35 H new ATOM 0 HG3 GLN A 585 -1.414 10.888 2.921 1.00 1.35 H new ATOM 0 HE21 GLN A 585 -2.991 12.579 3.935 1.00 1.91 H new ATOM 0 HE22 GLN A 585 -2.412 13.366 5.407 1.00 1.91 H new ATOM 849 N HIS A 586 -4.501 9.449 6.602 1.00 1.00 N ATOM 850 CA HIS A 586 -5.187 9.997 7.776 1.00 1.05 C ATOM 851 C HIS A 586 -6.623 9.447 7.864 1.00 0.94 C ATOM 852 O HIS A 586 -7.367 9.525 6.886 1.00 0.96 O ATOM 853 CB HIS A 586 -5.187 11.527 7.649 1.00 1.23 C ATOM 854 CG HIS A 586 -5.560 12.269 8.906 1.00 1.56 C ATOM 855 ND1 HIS A 586 -6.812 12.353 9.471 1.00 2.79 N ATOM 856 CD2 HIS A 586 -4.733 13.066 9.651 1.00 2.06 C ATOM 857 CE1 HIS A 586 -6.737 13.172 10.531 1.00 2.90 C ATOM 858 NE2 HIS A 586 -5.484 13.640 10.684 1.00 2.38 N ATOM 0 H HIS A 586 -5.143 9.209 5.847 1.00 1.00 H new ATOM 0 HA HIS A 586 -4.673 9.703 8.691 1.00 1.05 H new ATOM 0 HB2 HIS A 586 -4.195 11.851 7.335 1.00 1.23 H new ATOM 0 HB3 HIS A 586 -5.881 11.811 6.858 1.00 1.23 H new ATOM 0 HD2 HIS A 586 -3.680 13.225 9.472 1.00 2.06 H new ATOM 0 HE1 HIS A 586 -7.568 13.422 11.174 1.00 2.90 H new ATOM 0 HE2 HIS A 586 -5.150 14.281 11.404 1.00 2.38 H new ATOM 866 N GLY A 587 -7.038 8.882 9.001 1.00 0.98 N ATOM 867 CA GLY A 587 -8.411 8.477 9.267 1.00 0.98 C ATOM 868 C GLY A 587 -8.458 7.109 9.933 1.00 0.93 C ATOM 869 O GLY A 587 -7.437 6.571 10.373 1.00 0.98 O ATOM 0 H GLY A 587 -6.407 8.691 9.780 1.00 0.98 H new ATOM 0 HA2 GLY A 587 -8.893 9.214 9.909 1.00 0.98 H new ATOM 0 HA3 GLY A 587 -8.973 8.450 8.334 1.00 0.98 H new ATOM 873 N VAL A 588 -9.658 6.535 9.980 1.00 0.90 N ATOM 874 CA VAL A 588 -9.924 5.226 10.577 1.00 0.89 C ATOM 875 C VAL A 588 -10.832 4.418 9.637 1.00 0.83 C ATOM 876 O VAL A 588 -11.649 4.977 8.896 1.00 0.82 O ATOM 877 CB VAL A 588 -10.539 5.364 11.996 1.00 0.95 C ATOM 878 CG1 VAL A 588 -10.678 4.027 12.740 1.00 0.94 C ATOM 879 CG2 VAL A 588 -9.702 6.275 12.902 1.00 1.10 C ATOM 0 H VAL A 588 -10.493 6.977 9.595 1.00 0.90 H new ATOM 0 HA VAL A 588 -8.983 4.691 10.701 1.00 0.89 H new ATOM 0 HB VAL A 588 -11.526 5.787 11.809 1.00 0.95 H new ATOM 0 HG11 VAL A 588 -11.114 4.202 13.723 1.00 0.94 H new ATOM 0 HG12 VAL A 588 -11.323 3.359 12.170 1.00 0.94 H new ATOM 0 HG13 VAL A 588 -9.695 3.571 12.855 1.00 0.94 H new ATOM 0 HG21 VAL A 588 -10.171 6.342 13.884 1.00 1.10 H new ATOM 0 HG22 VAL A 588 -8.699 5.862 13.006 1.00 1.10 H new ATOM 0 HG23 VAL A 588 -9.641 7.270 12.461 1.00 1.10 H new ATOM 889 N VAL A 589 -10.710 3.095 9.670 1.00 0.83 N ATOM 890 CA VAL A 589 -11.565 2.137 8.956 1.00 0.82 C ATOM 891 C VAL A 589 -12.104 1.065 9.903 1.00 0.96 C ATOM 892 O VAL A 589 -11.468 0.723 10.898 1.00 1.11 O ATOM 893 CB VAL A 589 -10.852 1.510 7.748 1.00 0.78 C ATOM 894 CG1 VAL A 589 -10.521 2.567 6.688 1.00 0.80 C ATOM 895 CG2 VAL A 589 -9.577 0.779 8.158 1.00 0.83 C ATOM 0 H VAL A 589 -9.982 2.635 10.217 1.00 0.83 H new ATOM 0 HA VAL A 589 -12.414 2.697 8.565 1.00 0.82 H new ATOM 0 HB VAL A 589 -11.543 0.783 7.321 1.00 0.78 H new ATOM 0 HG11 VAL A 589 -10.017 2.093 5.846 1.00 0.80 H new ATOM 0 HG12 VAL A 589 -11.442 3.036 6.342 1.00 0.80 H new ATOM 0 HG13 VAL A 589 -9.868 3.325 7.121 1.00 0.80 H new ATOM 0 HG21 VAL A 589 -9.103 0.350 7.275 1.00 0.83 H new ATOM 0 HG22 VAL A 589 -8.892 1.481 8.633 1.00 0.83 H new ATOM 0 HG23 VAL A 589 -9.824 -0.017 8.860 1.00 0.83 H new ATOM 905 N SER A 590 -13.262 0.513 9.559 1.00 0.96 N ATOM 906 CA SER A 590 -13.855 -0.679 10.175 1.00 1.18 C ATOM 907 C SER A 590 -13.846 -1.755 9.096 1.00 1.26 C ATOM 908 O SER A 590 -14.204 -1.549 7.938 1.00 1.15 O ATOM 909 CB SER A 590 -15.293 -0.434 10.636 1.00 1.35 C ATOM 910 OG SER A 590 -15.340 0.171 11.915 1.00 1.37 O ATOM 0 H SER A 590 -13.841 0.896 8.812 1.00 0.96 H new ATOM 0 HA SER A 590 -13.287 -0.965 11.061 1.00 1.18 H new ATOM 0 HB2 SER A 590 -15.802 0.204 9.914 1.00 1.35 H new ATOM 0 HB3 SER A 590 -15.833 -1.381 10.662 1.00 1.35 H new ATOM 0 HG SER A 590 -15.345 1.146 11.816 1.00 1.37 H new ATOM 916 N VAL A 591 -13.287 -2.882 9.463 1.00 1.44 N ATOM 917 CA VAL A 591 -12.471 -3.723 8.609 1.00 1.28 C ATOM 918 C VAL A 591 -12.800 -5.163 8.968 1.00 1.05 C ATOM 919 O VAL A 591 -13.152 -5.450 10.118 1.00 1.06 O ATOM 920 CB VAL A 591 -11.004 -3.332 8.884 1.00 1.67 C ATOM 921 CG1 VAL A 591 -10.708 -3.201 10.364 1.00 3.13 C ATOM 922 CG2 VAL A 591 -9.983 -4.364 8.530 1.00 1.12 C ATOM 0 H VAL A 591 -13.390 -3.258 10.405 1.00 1.44 H new ATOM 0 HA VAL A 591 -12.654 -3.602 7.541 1.00 1.28 H new ATOM 0 HB VAL A 591 -10.928 -2.422 8.288 1.00 1.67 H new ATOM 0 HG11 VAL A 591 -9.663 -2.925 10.503 1.00 3.13 H new ATOM 0 HG12 VAL A 591 -11.347 -2.431 10.796 1.00 3.13 H new ATOM 0 HG13 VAL A 591 -10.900 -4.153 10.859 1.00 3.13 H new ATOM 0 HG21 VAL A 591 -8.988 -3.986 8.764 1.00 1.12 H new ATOM 0 HG22 VAL A 591 -10.170 -5.272 9.103 1.00 1.12 H new ATOM 0 HG23 VAL A 591 -10.046 -4.587 7.465 1.00 1.12 H new ATOM 932 N LEU A 592 -12.654 -6.080 8.022 1.00 1.04 N ATOM 933 CA LEU A 592 -12.494 -7.485 8.364 1.00 1.37 C ATOM 934 C LEU A 592 -11.184 -7.976 7.773 1.00 1.66 C ATOM 935 O LEU A 592 -10.932 -7.792 6.578 1.00 1.55 O ATOM 936 CB LEU A 592 -13.672 -8.339 7.859 1.00 1.65 C ATOM 937 CG LEU A 592 -15.031 -8.037 8.514 1.00 1.90 C ATOM 938 CD1 LEU A 592 -15.838 -6.978 7.760 1.00 2.02 C ATOM 939 CD2 LEU A 592 -15.871 -9.314 8.577 1.00 3.67 C ATOM 0 H LEU A 592 -12.643 -5.879 7.022 1.00 1.04 H new ATOM 0 HA LEU A 592 -12.480 -7.585 9.449 1.00 1.37 H new ATOM 0 HB2 LEU A 592 -13.767 -8.197 6.782 1.00 1.65 H new ATOM 0 HB3 LEU A 592 -13.434 -9.390 8.023 1.00 1.65 H new ATOM 0 HG LEU A 592 -14.812 -7.652 9.510 1.00 1.90 H new ATOM 0 HD11 LEU A 592 -16.786 -6.810 8.272 1.00 2.02 H new ATOM 0 HD12 LEU A 592 -15.274 -6.046 7.726 1.00 2.02 H new ATOM 0 HD13 LEU A 592 -16.031 -7.322 6.744 1.00 2.02 H new ATOM 0 HD21 LEU A 592 -16.832 -9.095 9.042 1.00 3.67 H new ATOM 0 HD22 LEU A 592 -16.034 -9.693 7.568 1.00 3.67 H new ATOM 0 HD23 LEU A 592 -15.346 -10.066 9.166 1.00 3.67 H new ATOM 951 N THR A 593 -10.358 -8.635 8.579 1.00 2.18 N ATOM 952 CA THR A 593 -9.225 -9.390 8.013 1.00 2.60 C ATOM 953 C THR A 593 -9.697 -10.771 7.534 1.00 2.79 C ATOM 954 O THR A 593 -10.466 -11.444 8.224 1.00 2.78 O ATOM 955 CB THR A 593 -8.006 -9.383 8.948 1.00 2.87 C ATOM 956 OG1 THR A 593 -8.371 -9.390 10.306 1.00 2.67 O ATOM 957 CG2 THR A 593 -7.223 -8.085 8.744 1.00 3.04 C ATOM 0 H THR A 593 -10.439 -8.668 9.595 1.00 2.18 H new ATOM 0 HA THR A 593 -8.854 -8.888 7.119 1.00 2.60 H new ATOM 0 HB THR A 593 -7.430 -10.277 8.710 1.00 2.87 H new ATOM 0 HG1 THR A 593 -7.564 -9.387 10.862 1.00 2.67 H new ATOM 0 HG21 THR A 593 -6.357 -8.075 9.405 1.00 3.04 H new ATOM 0 HG22 THR A 593 -6.890 -8.020 7.708 1.00 3.04 H new ATOM 0 HG23 THR A 593 -7.864 -7.234 8.973 1.00 3.04 H new ATOM 965 N LYS A 594 -9.332 -11.167 6.303 1.00 3.02 N ATOM 966 CA LYS A 594 -9.983 -12.259 5.539 1.00 3.17 C ATOM 967 C LYS A 594 -10.017 -13.629 6.227 1.00 3.32 C ATOM 968 O LYS A 594 -11.015 -14.337 6.106 1.00 3.24 O ATOM 969 CB LYS A 594 -9.420 -12.374 4.104 1.00 3.41 C ATOM 970 CG LYS A 594 -7.935 -12.756 3.972 1.00 3.78 C ATOM 971 CD LYS A 594 -7.017 -11.528 3.929 1.00 3.91 C ATOM 972 CE LYS A 594 -5.532 -11.861 4.097 1.00 4.46 C ATOM 973 NZ LYS A 594 -5.034 -12.818 3.085 1.00 4.72 N ATOM 0 H LYS A 594 -8.561 -10.732 5.796 1.00 3.02 H new ATOM 0 HA LYS A 594 -11.027 -11.949 5.492 1.00 3.17 H new ATOM 0 HB2 LYS A 594 -10.011 -13.115 3.565 1.00 3.41 H new ATOM 0 HB3 LYS A 594 -9.571 -11.419 3.602 1.00 3.41 H new ATOM 0 HG2 LYS A 594 -7.650 -13.390 4.811 1.00 3.78 H new ATOM 0 HG3 LYS A 594 -7.793 -13.344 3.065 1.00 3.78 H new ATOM 0 HD2 LYS A 594 -7.159 -11.013 2.979 1.00 3.91 H new ATOM 0 HD3 LYS A 594 -7.316 -10.835 4.715 1.00 3.91 H new ATOM 0 HE2 LYS A 594 -4.950 -10.941 4.036 1.00 4.46 H new ATOM 0 HE3 LYS A 594 -5.369 -12.276 5.092 1.00 4.46 H new ATOM 0 HZ1 LYS A 594 -3.997 -12.763 3.036 1.00 4.72 H new ATOM 0 HZ2 LYS A 594 -5.317 -13.783 3.350 1.00 4.72 H new ATOM 0 HZ3 LYS A 594 -5.437 -12.582 2.156 1.00 4.72 H new ATOM 987 N GLY A 595 -8.981 -13.982 6.990 1.00 4.37 N ATOM 988 CA GLY A 595 -8.927 -15.205 7.803 1.00 4.58 C ATOM 989 C GLY A 595 -9.718 -15.139 9.110 1.00 4.15 C ATOM 990 O GLY A 595 -9.896 -16.146 9.802 1.00 4.36 O ATOM 0 H GLY A 595 -8.136 -13.415 7.064 1.00 4.37 H new ATOM 0 HA2 GLY A 595 -9.303 -16.037 7.208 1.00 4.58 H new ATOM 0 HA3 GLY A 595 -7.885 -15.425 8.036 1.00 4.58 H new ATOM 994 N ASN A 596 -10.107 -13.928 9.497 1.00 3.61 N ATOM 995 CA ASN A 596 -10.130 -13.494 10.882 1.00 3.30 C ATOM 996 C ASN A 596 -11.419 -12.695 11.199 1.00 2.83 C ATOM 997 O ASN A 596 -12.502 -13.022 10.695 1.00 2.91 O ATOM 998 CB ASN A 596 -8.855 -12.663 11.139 1.00 3.29 C ATOM 999 CG ASN A 596 -7.504 -13.222 10.735 1.00 3.81 C ATOM 1000 OD1 ASN A 596 -7.289 -14.420 10.602 1.00 4.25 O ATOM 1001 ND2 ASN A 596 -6.512 -12.377 10.643 1.00 3.89 N ATOM 0 H ASN A 596 -10.420 -13.211 8.842 1.00 3.61 H new ATOM 0 HA ASN A 596 -10.141 -14.357 11.548 1.00 3.30 H new ATOM 0 HB2 ASN A 596 -8.979 -11.708 10.628 1.00 3.29 H new ATOM 0 HB3 ASN A 596 -8.814 -12.450 12.207 1.00 3.29 H new ATOM 0 HD21 ASN A 596 -5.568 -12.717 10.462 1.00 3.89 H new ATOM 0 HD22 ASN A 596 -6.682 -11.377 10.752 1.00 3.89 H new ATOM 1008 N LYS A 597 -11.316 -11.726 12.122 1.00 2.49 N ATOM 1009 CA LYS A 597 -12.423 -11.002 12.738 1.00 2.11 C ATOM 1010 C LYS A 597 -12.626 -9.569 12.245 1.00 1.68 C ATOM 1011 O LYS A 597 -11.804 -8.977 11.546 1.00 1.77 O ATOM 1012 CB LYS A 597 -12.315 -11.067 14.281 1.00 2.19 C ATOM 1013 CG LYS A 597 -12.120 -12.456 14.925 1.00 2.65 C ATOM 1014 CD LYS A 597 -10.656 -12.944 15.006 1.00 3.06 C ATOM 1015 CE LYS A 597 -10.344 -14.079 14.029 1.00 2.98 C ATOM 1016 NZ LYS A 597 -10.203 -15.391 14.699 1.00 3.59 N ATOM 0 H LYS A 597 -10.410 -11.416 12.472 1.00 2.49 H new ATOM 0 HA LYS A 597 -13.325 -11.519 12.411 1.00 2.11 H new ATOM 0 HB2 LYS A 597 -11.481 -10.435 14.586 1.00 2.19 H new ATOM 0 HB3 LYS A 597 -13.219 -10.626 14.700 1.00 2.19 H new ATOM 0 HG2 LYS A 597 -12.535 -12.433 15.933 1.00 2.65 H new ATOM 0 HG3 LYS A 597 -12.699 -13.186 14.359 1.00 2.65 H new ATOM 0 HD2 LYS A 597 -9.989 -12.106 14.804 1.00 3.06 H new ATOM 0 HD3 LYS A 597 -10.448 -13.280 16.022 1.00 3.06 H new ATOM 0 HE2 LYS A 597 -11.138 -14.140 13.285 1.00 2.98 H new ATOM 0 HE3 LYS A 597 -9.423 -13.849 13.494 1.00 2.98 H new ATOM 0 HZ1 LYS A 597 -9.992 -16.122 13.990 1.00 3.59 H new ATOM 0 HZ2 LYS A 597 -9.428 -15.346 15.391 1.00 3.59 H new ATOM 0 HZ3 LYS A 597 -11.090 -15.628 15.188 1.00 3.59 H new ATOM 1030 N GLU A 598 -13.752 -9.006 12.671 1.00 1.45 N ATOM 1031 CA GLU A 598 -14.070 -7.586 12.572 1.00 1.22 C ATOM 1032 C GLU A 598 -13.168 -6.758 13.484 1.00 1.13 C ATOM 1033 O GLU A 598 -13.209 -6.874 14.712 1.00 1.30 O ATOM 1034 CB GLU A 598 -15.539 -7.346 12.946 1.00 1.66 C ATOM 1035 CG GLU A 598 -16.465 -7.803 11.820 1.00 2.51 C ATOM 1036 CD GLU A 598 -17.835 -8.205 12.362 1.00 3.01 C ATOM 1037 OE1 GLU A 598 -18.593 -7.308 12.814 1.00 3.21 O ATOM 1038 OE2 GLU A 598 -18.144 -9.424 12.378 1.00 4.06 O ATOM 0 H GLU A 598 -14.496 -9.547 13.111 1.00 1.45 H new ATOM 0 HA GLU A 598 -13.902 -7.274 11.541 1.00 1.22 H new ATOM 0 HB2 GLU A 598 -15.779 -7.885 13.862 1.00 1.66 H new ATOM 0 HB3 GLU A 598 -15.700 -6.287 13.148 1.00 1.66 H new ATOM 0 HG2 GLU A 598 -16.580 -7.000 11.092 1.00 2.51 H new ATOM 0 HG3 GLU A 598 -16.016 -8.647 11.296 1.00 2.51 H new ATOM 1045 N MET A 599 -12.396 -5.870 12.874 1.00 1.04 N ATOM 1046 CA MET A 599 -11.524 -4.900 13.545 1.00 1.24 C ATOM 1047 C MET A 599 -11.895 -3.450 13.219 1.00 1.44 C ATOM 1048 O MET A 599 -12.775 -3.175 12.397 1.00 1.87 O ATOM 1049 CB MET A 599 -10.048 -5.228 13.290 1.00 1.48 C ATOM 1050 CG MET A 599 -9.657 -6.635 13.754 1.00 1.57 C ATOM 1051 SD MET A 599 -7.898 -7.013 13.533 1.00 2.20 S ATOM 1052 CE MET A 599 -7.710 -6.549 11.793 1.00 2.43 C ATOM 0 H MET A 599 -12.354 -5.798 11.857 1.00 1.04 H new ATOM 0 HA MET A 599 -11.686 -4.992 14.619 1.00 1.24 H new ATOM 0 HB2 MET A 599 -9.839 -5.132 12.224 1.00 1.48 H new ATOM 0 HB3 MET A 599 -9.425 -4.496 13.804 1.00 1.48 H new ATOM 0 HG2 MET A 599 -9.913 -6.745 14.808 1.00 1.57 H new ATOM 0 HG3 MET A 599 -10.249 -7.367 13.204 1.00 1.57 H new ATOM 0 HE1 MET A 599 -6.802 -7.000 11.392 1.00 2.43 H new ATOM 0 HE2 MET A 599 -8.572 -6.903 11.227 1.00 2.43 H new ATOM 0 HE3 MET A 599 -7.643 -5.464 11.711 1.00 2.43 H new ATOM 1062 N LYS A 600 -11.194 -2.515 13.865 1.00 1.30 N ATOM 1063 CA LYS A 600 -10.736 -1.268 13.270 1.00 1.14 C ATOM 1064 C LYS A 600 -9.264 -1.301 12.876 1.00 1.09 C ATOM 1065 O LYS A 600 -8.453 -2.039 13.436 1.00 1.18 O ATOM 1066 CB LYS A 600 -10.947 -0.083 14.247 1.00 1.28 C ATOM 1067 CG LYS A 600 -12.328 0.576 14.269 1.00 1.31 C ATOM 1068 CD LYS A 600 -13.497 -0.387 14.444 1.00 1.33 C ATOM 1069 CE LYS A 600 -13.464 -1.193 15.755 1.00 1.44 C ATOM 1070 NZ LYS A 600 -13.806 -0.370 16.943 1.00 2.67 N ATOM 0 H LYS A 600 -10.924 -2.612 14.844 1.00 1.30 H new ATOM 0 HA LYS A 600 -11.332 -1.136 12.367 1.00 1.14 H new ATOM 0 HB2 LYS A 600 -10.726 -0.434 15.255 1.00 1.28 H new ATOM 0 HB3 LYS A 600 -10.211 0.685 14.008 1.00 1.28 H new ATOM 0 HG2 LYS A 600 -12.353 1.306 15.078 1.00 1.31 H new ATOM 0 HG3 LYS A 600 -12.466 1.127 13.339 1.00 1.31 H new ATOM 0 HD2 LYS A 600 -14.428 0.179 14.403 1.00 1.33 H new ATOM 0 HD3 LYS A 600 -13.509 -1.082 13.604 1.00 1.33 H new ATOM 0 HE2 LYS A 600 -14.163 -2.026 15.682 1.00 1.44 H new ATOM 0 HE3 LYS A 600 -12.471 -1.621 15.889 1.00 1.44 H new ATOM 0 HZ1 LYS A 600 -13.769 -0.962 17.798 1.00 2.67 H new ATOM 0 HZ2 LYS A 600 -13.125 0.411 17.032 1.00 2.67 H new ATOM 0 HZ3 LYS A 600 -14.765 0.018 16.832 1.00 2.67 H new ATOM 1084 N LEU A 601 -8.968 -0.418 11.931 1.00 1.04 N ATOM 1085 CA LEU A 601 -7.624 -0.024 11.485 1.00 1.02 C ATOM 1086 C LEU A 601 -7.503 1.510 11.473 1.00 0.95 C ATOM 1087 O LEU A 601 -8.471 2.194 11.150 1.00 0.91 O ATOM 1088 CB LEU A 601 -7.336 -0.608 10.082 1.00 1.06 C ATOM 1089 CG LEU A 601 -6.169 -1.592 9.998 1.00 1.04 C ATOM 1090 CD1 LEU A 601 -6.520 -2.905 10.685 1.00 1.00 C ATOM 1091 CD2 LEU A 601 -5.868 -1.900 8.529 1.00 1.10 C ATOM 0 H LEU A 601 -9.699 0.076 11.420 1.00 1.04 H new ATOM 0 HA LEU A 601 -6.886 -0.423 12.180 1.00 1.02 H new ATOM 0 HB2 LEU A 601 -8.236 -1.110 9.726 1.00 1.06 H new ATOM 0 HB3 LEU A 601 -7.140 0.218 9.398 1.00 1.06 H new ATOM 0 HG LEU A 601 -5.308 -1.138 10.488 1.00 1.04 H new ATOM 0 HD11 LEU A 601 -5.675 -3.590 10.613 1.00 1.00 H new ATOM 0 HD12 LEU A 601 -6.747 -2.717 11.734 1.00 1.00 H new ATOM 0 HD13 LEU A 601 -7.389 -3.349 10.200 1.00 1.00 H new ATOM 0 HD21 LEU A 601 -5.036 -2.602 8.467 1.00 1.10 H new ATOM 0 HD22 LEU A 601 -6.749 -2.340 8.062 1.00 1.10 H new ATOM 0 HD23 LEU A 601 -5.604 -0.978 8.011 1.00 1.10 H new ATOM 1103 N SER A 602 -6.325 2.060 11.770 1.00 1.00 N ATOM 1104 CA SER A 602 -6.088 3.516 11.847 1.00 1.00 C ATOM 1105 C SER A 602 -4.864 3.977 11.055 1.00 0.95 C ATOM 1106 O SER A 602 -4.093 3.165 10.544 1.00 0.95 O ATOM 1107 CB SER A 602 -6.009 3.962 13.309 1.00 1.24 C ATOM 1108 OG SER A 602 -4.897 3.400 13.981 1.00 1.59 O ATOM 0 H SER A 602 -5.492 1.505 11.968 1.00 1.00 H new ATOM 0 HA SER A 602 -6.941 4.000 11.372 1.00 1.00 H new ATOM 0 HB2 SER A 602 -5.946 5.049 13.352 1.00 1.24 H new ATOM 0 HB3 SER A 602 -6.926 3.675 13.824 1.00 1.24 H new ATOM 0 HG SER A 602 -4.884 3.712 14.910 1.00 1.59 H new ATOM 1114 N ASP A 603 -4.698 5.293 10.907 1.00 1.03 N ATOM 1115 CA ASP A 603 -3.705 5.888 10.001 1.00 1.12 C ATOM 1116 C ASP A 603 -2.265 5.379 10.211 1.00 1.14 C ATOM 1117 O ASP A 603 -1.833 5.123 11.341 1.00 1.26 O ATOM 1118 CB ASP A 603 -3.777 7.417 10.029 1.00 1.40 C ATOM 1119 CG ASP A 603 -2.923 8.038 11.130 1.00 1.60 C ATOM 1120 OD1 ASP A 603 -3.357 8.060 12.304 1.00 1.91 O ATOM 1121 OD2 ASP A 603 -1.819 8.542 10.823 1.00 2.33 O ATOM 0 H ASP A 603 -5.251 5.983 11.415 1.00 1.03 H new ATOM 0 HA ASP A 603 -3.979 5.546 9.003 1.00 1.12 H new ATOM 0 HB2 ASP A 603 -3.454 7.807 9.064 1.00 1.40 H new ATOM 0 HB3 ASP A 603 -4.814 7.723 10.166 1.00 1.40 H new ATOM 1126 N GLY A 604 -1.532 5.210 9.109 1.00 1.10 N ATOM 1127 CA GLY A 604 -0.268 4.467 9.076 1.00 1.14 C ATOM 1128 C GLY A 604 -0.425 2.946 8.922 1.00 1.10 C ATOM 1129 O GLY A 604 0.575 2.236 8.820 1.00 1.20 O ATOM 0 H GLY A 604 -1.802 5.590 8.202 1.00 1.10 H new ATOM 0 HA2 GLY A 604 0.338 4.842 8.251 1.00 1.14 H new ATOM 0 HA3 GLY A 604 0.283 4.671 9.994 1.00 1.14 H new ATOM 1133 N SER A 605 -1.659 2.434 8.888 1.00 1.04 N ATOM 1134 CA SER A 605 -1.986 1.066 8.455 1.00 1.02 C ATOM 1135 C SER A 605 -2.087 0.953 6.930 1.00 0.97 C ATOM 1136 O SER A 605 -2.169 1.960 6.221 1.00 0.91 O ATOM 1137 CB SER A 605 -3.319 0.629 9.050 1.00 0.99 C ATOM 1138 OG SER A 605 -3.248 0.589 10.459 1.00 1.01 O ATOM 0 H SER A 605 -2.481 2.970 9.167 1.00 1.04 H new ATOM 0 HA SER A 605 -1.177 0.425 8.805 1.00 1.02 H new ATOM 0 HB2 SER A 605 -4.104 1.318 8.740 1.00 0.99 H new ATOM 0 HB3 SER A 605 -3.589 -0.355 8.667 1.00 0.99 H new ATOM 0 HG SER A 605 -3.517 1.457 10.825 1.00 1.01 H new ATOM 1144 N TYR A 606 -2.122 -0.274 6.410 1.00 1.03 N ATOM 1145 CA TYR A 606 -2.065 -0.545 4.973 1.00 1.00 C ATOM 1146 C TYR A 606 -2.895 -1.773 4.554 1.00 1.03 C ATOM 1147 O TYR A 606 -3.077 -2.693 5.351 1.00 1.15 O ATOM 1148 CB TYR A 606 -0.583 -0.663 4.592 1.00 1.11 C ATOM 1149 CG TYR A 606 0.151 -1.854 5.162 1.00 1.36 C ATOM 1150 CD1 TYR A 606 0.713 -1.786 6.448 1.00 2.71 C ATOM 1151 CD2 TYR A 606 0.294 -3.014 4.383 1.00 2.02 C ATOM 1152 CE1 TYR A 606 1.409 -2.898 6.965 1.00 3.34 C ATOM 1153 CE2 TYR A 606 1.005 -4.114 4.882 1.00 2.56 C ATOM 1154 CZ TYR A 606 1.554 -4.068 6.185 1.00 2.85 C ATOM 1155 OH TYR A 606 2.237 -5.132 6.688 1.00 3.69 O ATOM 0 H TYR A 606 -2.191 -1.117 6.980 1.00 1.03 H new ATOM 0 HA TYR A 606 -2.527 0.275 4.423 1.00 1.00 H new ATOM 0 HB2 TYR A 606 -0.509 -0.701 3.505 1.00 1.11 H new ATOM 0 HB3 TYR A 606 -0.071 0.244 4.915 1.00 1.11 H new ATOM 0 HD1 TYR A 606 0.612 -0.887 7.037 1.00 2.71 H new ATOM 0 HD2 TYR A 606 -0.145 -3.058 3.397 1.00 2.02 H new ATOM 0 HE1 TYR A 606 1.832 -2.856 7.958 1.00 3.34 H new ATOM 0 HE2 TYR A 606 1.134 -4.996 4.272 1.00 2.56 H new ATOM 0 HH TYR A 606 2.245 -5.857 6.028 1.00 3.69 H new ATOM 1165 N PHE A 607 -3.427 -1.793 3.324 1.00 0.97 N ATOM 1166 CA PHE A 607 -4.404 -2.810 2.882 1.00 1.11 C ATOM 1167 C PHE A 607 -3.851 -3.942 1.993 1.00 1.44 C ATOM 1168 O PHE A 607 -2.667 -3.993 1.659 1.00 2.02 O ATOM 1169 CB PHE A 607 -5.552 -2.090 2.162 1.00 1.36 C ATOM 1170 CG PHE A 607 -6.260 -1.062 3.009 1.00 1.00 C ATOM 1171 CD1 PHE A 607 -6.948 -1.471 4.164 1.00 1.93 C ATOM 1172 CD2 PHE A 607 -6.268 0.288 2.625 1.00 1.93 C ATOM 1173 CE1 PHE A 607 -7.646 -0.528 4.931 1.00 2.23 C ATOM 1174 CE2 PHE A 607 -6.982 1.227 3.383 1.00 1.75 C ATOM 1175 CZ PHE A 607 -7.670 0.821 4.537 1.00 1.25 C ATOM 0 H PHE A 607 -3.196 -1.108 2.605 1.00 0.97 H new ATOM 0 HA PHE A 607 -4.733 -3.322 3.786 1.00 1.11 H new ATOM 0 HB2 PHE A 607 -5.158 -1.602 1.270 1.00 1.36 H new ATOM 0 HB3 PHE A 607 -6.278 -2.831 1.826 1.00 1.36 H new ATOM 0 HD1 PHE A 607 -6.939 -2.510 4.460 1.00 1.93 H new ATOM 0 HD2 PHE A 607 -5.725 0.603 1.746 1.00 1.93 H new ATOM 0 HE1 PHE A 607 -8.166 -0.838 5.825 1.00 2.23 H new ATOM 0 HE2 PHE A 607 -7.003 2.263 3.079 1.00 1.75 H new ATOM 0 HZ PHE A 607 -8.218 1.545 5.122 1.00 1.25 H new ATOM 1185 N GLY A 608 -4.739 -4.850 1.579 1.00 1.59 N ATOM 1186 CA GLY A 608 -4.713 -5.455 0.241 1.00 1.87 C ATOM 1187 C GLY A 608 -3.811 -6.675 0.021 1.00 2.10 C ATOM 1188 O GLY A 608 -3.796 -7.185 -1.094 1.00 2.84 O ATOM 0 H GLY A 608 -5.502 -5.189 2.165 1.00 1.59 H new ATOM 0 HA2 GLY A 608 -5.733 -5.743 -0.015 1.00 1.87 H new ATOM 0 HA3 GLY A 608 -4.411 -4.684 -0.468 1.00 1.87 H new ATOM 1192 N GLU A 609 -3.105 -7.154 1.053 1.00 2.68 N ATOM 1193 CA GLU A 609 -2.177 -8.302 1.032 1.00 3.05 C ATOM 1194 C GLU A 609 -1.006 -8.181 0.019 1.00 2.30 C ATOM 1195 O GLU A 609 -0.868 -7.187 -0.698 1.00 2.54 O ATOM 1196 CB GLU A 609 -2.989 -9.619 0.965 1.00 4.15 C ATOM 1197 CG GLU A 609 -2.308 -10.916 1.449 1.00 5.25 C ATOM 1198 CD GLU A 609 -2.039 -10.976 2.960 1.00 6.33 C ATOM 1199 OE1 GLU A 609 -1.456 -10.030 3.545 1.00 6.93 O ATOM 1200 OE2 GLU A 609 -2.414 -11.997 3.583 1.00 7.11 O ATOM 0 H GLU A 609 -3.166 -6.730 1.979 1.00 2.68 H new ATOM 0 HA GLU A 609 -1.626 -8.309 1.973 1.00 3.05 H new ATOM 0 HB2 GLU A 609 -3.898 -9.481 1.550 1.00 4.15 H new ATOM 0 HB3 GLU A 609 -3.296 -9.769 -0.070 1.00 4.15 H new ATOM 0 HG2 GLU A 609 -2.934 -11.764 1.172 1.00 5.25 H new ATOM 0 HG3 GLU A 609 -1.362 -11.032 0.921 1.00 5.25 H new ATOM 1207 N ILE A 610 -0.081 -9.148 0.017 1.00 2.88 N ATOM 1208 CA ILE A 610 1.148 -9.101 -0.780 1.00 2.75 C ATOM 1209 C ILE A 610 0.836 -9.285 -2.272 1.00 2.34 C ATOM 1210 O ILE A 610 0.458 -10.369 -2.720 1.00 3.48 O ATOM 1211 CB ILE A 610 2.214 -10.129 -0.313 1.00 3.91 C ATOM 1212 CG1 ILE A 610 2.637 -10.006 1.171 1.00 5.26 C ATOM 1213 CG2 ILE A 610 3.485 -9.938 -1.165 1.00 4.02 C ATOM 1214 CD1 ILE A 610 1.686 -10.668 2.174 1.00 6.13 C ATOM 0 H ILE A 610 -0.167 -9.996 0.577 1.00 2.88 H new ATOM 0 HA ILE A 610 1.580 -8.112 -0.625 1.00 2.75 H new ATOM 0 HB ILE A 610 1.749 -11.108 -0.432 1.00 3.91 H new ATOM 0 HG12 ILE A 610 3.628 -10.446 1.288 1.00 5.26 H new ATOM 0 HG13 ILE A 610 2.726 -8.949 1.421 1.00 5.26 H new ATOM 0 HG21 ILE A 610 4.245 -10.653 -0.850 1.00 4.02 H new ATOM 0 HG22 ILE A 610 3.246 -10.101 -2.216 1.00 4.02 H new ATOM 0 HG23 ILE A 610 3.863 -8.924 -1.032 1.00 4.02 H new ATOM 0 HD11 ILE A 610 2.068 -10.528 3.185 1.00 6.13 H new ATOM 0 HD12 ILE A 610 0.698 -10.214 2.093 1.00 6.13 H new ATOM 0 HD13 ILE A 610 1.614 -11.734 1.958 1.00 6.13 H new ATOM 1226 N CYS A 611 1.099 -8.235 -3.046 1.00 1.97 N ATOM 1227 CA CYS A 611 1.305 -8.270 -4.495 1.00 2.27 C ATOM 1228 C CYS A 611 2.712 -7.697 -4.779 1.00 1.75 C ATOM 1229 O CYS A 611 3.650 -8.075 -4.080 1.00 2.70 O ATOM 1230 CB CYS A 611 0.119 -7.549 -5.148 1.00 3.70 C ATOM 1231 SG CYS A 611 0.132 -7.756 -6.957 1.00 5.13 S ATOM 0 H CYS A 611 1.178 -7.292 -2.664 1.00 1.97 H new ATOM 0 HA CYS A 611 1.309 -9.268 -4.934 1.00 2.27 H new ATOM 0 HB2 CYS A 611 -0.814 -7.939 -4.742 1.00 3.70 H new ATOM 0 HB3 CYS A 611 0.155 -6.488 -4.901 1.00 3.70 H new ATOM 0 HG CYS A 611 0.910 -8.748 -7.275 1.00 5.13 H new ATOM 1237 N LEU A 612 2.874 -6.773 -5.736 1.00 1.80 N ATOM 1238 CA LEU A 612 4.086 -5.980 -6.047 1.00 1.53 C ATOM 1239 C LEU A 612 5.267 -6.816 -6.589 1.00 1.54 C ATOM 1240 O LEU A 612 5.717 -6.591 -7.710 1.00 1.70 O ATOM 1241 CB LEU A 612 4.412 -5.108 -4.806 1.00 2.04 C ATOM 1242 CG LEU A 612 5.496 -4.016 -4.888 1.00 1.32 C ATOM 1243 CD1 LEU A 612 6.903 -4.558 -5.117 1.00 2.04 C ATOM 1244 CD2 LEU A 612 5.215 -2.976 -5.964 1.00 1.16 C ATOM 0 H LEU A 612 2.106 -6.538 -6.365 1.00 1.80 H new ATOM 0 HA LEU A 612 3.886 -5.321 -6.892 1.00 1.53 H new ATOM 0 HB2 LEU A 612 3.486 -4.621 -4.501 1.00 2.04 H new ATOM 0 HB3 LEU A 612 4.696 -5.786 -4.001 1.00 2.04 H new ATOM 0 HG LEU A 612 5.454 -3.549 -3.904 1.00 1.32 H new ATOM 0 HD11 LEU A 612 7.609 -3.729 -5.163 1.00 2.04 H new ATOM 0 HD12 LEU A 612 7.175 -5.222 -4.296 1.00 2.04 H new ATOM 0 HD13 LEU A 612 6.931 -5.111 -6.056 1.00 2.04 H new ATOM 0 HD21 LEU A 612 6.014 -2.235 -5.971 1.00 1.16 H new ATOM 0 HD22 LEU A 612 5.164 -3.464 -6.937 1.00 1.16 H new ATOM 0 HD23 LEU A 612 4.265 -2.483 -5.755 1.00 1.16 H new ATOM 1256 N LEU A 613 5.726 -7.806 -5.822 1.00 1.70 N ATOM 1257 CA LEU A 613 6.753 -8.799 -6.170 1.00 2.07 C ATOM 1258 C LEU A 613 6.191 -10.212 -6.444 1.00 1.98 C ATOM 1259 O LEU A 613 6.954 -11.138 -6.717 1.00 2.47 O ATOM 1260 CB LEU A 613 7.860 -8.781 -5.098 1.00 2.65 C ATOM 1261 CG LEU A 613 7.428 -8.872 -3.617 1.00 3.06 C ATOM 1262 CD1 LEU A 613 6.459 -10.015 -3.314 1.00 2.97 C ATOM 1263 CD2 LEU A 613 8.663 -9.051 -2.733 1.00 4.02 C ATOM 0 H LEU A 613 5.369 -7.948 -4.877 1.00 1.70 H new ATOM 0 HA LEU A 613 7.189 -8.511 -7.127 1.00 2.07 H new ATOM 0 HB2 LEU A 613 8.537 -9.611 -5.301 1.00 2.65 H new ATOM 0 HB3 LEU A 613 8.434 -7.863 -5.224 1.00 2.65 H new ATOM 0 HG LEU A 613 6.904 -7.940 -3.406 1.00 3.06 H new ATOM 0 HD11 LEU A 613 6.207 -10.007 -2.254 1.00 2.97 H new ATOM 0 HD12 LEU A 613 5.551 -9.888 -3.904 1.00 2.97 H new ATOM 0 HD13 LEU A 613 6.927 -10.966 -3.568 1.00 2.97 H new ATOM 0 HD21 LEU A 613 8.357 -9.115 -1.689 1.00 4.02 H new ATOM 0 HD22 LEU A 613 9.183 -9.966 -3.015 1.00 4.02 H new ATOM 0 HD23 LEU A 613 9.331 -8.199 -2.864 1.00 4.02 H new ATOM 1275 N THR A 614 4.867 -10.374 -6.376 1.00 1.58 N ATOM 1276 CA THR A 614 4.124 -11.602 -6.720 1.00 1.67 C ATOM 1277 C THR A 614 2.892 -11.273 -7.554 1.00 1.62 C ATOM 1278 O THR A 614 2.208 -10.271 -7.311 1.00 1.90 O ATOM 1279 CB THR A 614 3.726 -12.420 -5.480 1.00 2.14 C ATOM 1280 OG1 THR A 614 3.065 -13.620 -5.821 1.00 2.89 O ATOM 1281 CG2 THR A 614 2.791 -11.686 -4.525 1.00 2.33 C ATOM 0 H THR A 614 4.251 -9.622 -6.066 1.00 1.58 H new ATOM 0 HA THR A 614 4.800 -12.221 -7.310 1.00 1.67 H new ATOM 0 HB THR A 614 4.681 -12.610 -4.991 1.00 2.14 H new ATOM 0 HG1 THR A 614 2.832 -14.109 -5.004 1.00 2.89 H new ATOM 0 HG21 THR A 614 2.558 -12.330 -3.677 1.00 2.33 H new ATOM 0 HG22 THR A 614 3.276 -10.777 -4.168 1.00 2.33 H new ATOM 0 HG23 THR A 614 1.870 -11.425 -5.046 1.00 2.33 H new ATOM 1289 N ARG A 615 2.606 -12.128 -8.536 1.00 1.92 N ATOM 1290 CA ARG A 615 1.439 -12.011 -9.424 1.00 2.04 C ATOM 1291 C ARG A 615 0.256 -12.831 -8.902 1.00 1.88 C ATOM 1292 O ARG A 615 0.381 -14.033 -8.668 1.00 2.29 O ATOM 1293 CB ARG A 615 1.823 -12.289 -10.895 1.00 2.77 C ATOM 1294 CG ARG A 615 2.004 -13.769 -11.286 1.00 2.97 C ATOM 1295 CD ARG A 615 2.480 -13.933 -12.738 1.00 3.74 C ATOM 1296 NE ARG A 615 3.878 -13.495 -12.932 1.00 4.55 N ATOM 1297 CZ ARG A 615 4.327 -12.460 -13.619 1.00 5.48 C ATOM 1298 NH1 ARG A 615 3.548 -11.653 -14.283 1.00 5.83 N ATOM 1299 NH2 ARG A 615 5.602 -12.224 -13.634 1.00 6.68 N ATOM 0 H ARG A 615 3.188 -12.939 -8.744 1.00 1.92 H new ATOM 0 HA ARG A 615 1.089 -10.979 -9.415 1.00 2.04 H new ATOM 0 HB2 ARG A 615 1.055 -11.857 -11.536 1.00 2.77 H new ATOM 0 HB3 ARG A 615 2.752 -11.762 -11.111 1.00 2.77 H new ATOM 0 HG2 ARG A 615 2.725 -14.235 -10.614 1.00 2.97 H new ATOM 0 HG3 ARG A 615 1.059 -14.296 -11.154 1.00 2.97 H new ATOM 0 HD2 ARG A 615 2.387 -14.979 -13.031 1.00 3.74 H new ATOM 0 HD3 ARG A 615 1.829 -13.359 -13.397 1.00 3.74 H new ATOM 0 HE ARG A 615 4.589 -14.067 -12.476 1.00 4.55 H new ATOM 0 HH11 ARG A 615 2.540 -11.807 -14.288 1.00 5.83 H new ATOM 0 HH12 ARG A 615 3.947 -10.868 -14.798 1.00 5.83 H new ATOM 0 HH21 ARG A 615 6.239 -12.833 -13.121 1.00 6.68 H new ATOM 0 HH22 ARG A 615 5.967 -11.429 -14.159 1.00 6.68 H new ATOM 1313 N GLY A 616 -0.884 -12.164 -8.733 1.00 1.93 N ATOM 1314 CA GLY A 616 -2.177 -12.760 -8.398 1.00 2.02 C ATOM 1315 C GLY A 616 -3.196 -11.723 -7.904 1.00 1.84 C ATOM 1316 O GLY A 616 -2.816 -10.609 -7.539 1.00 2.20 O ATOM 0 H GLY A 616 -0.935 -11.150 -8.830 1.00 1.93 H new ATOM 0 HA2 GLY A 616 -2.577 -13.267 -9.276 1.00 2.02 H new ATOM 0 HA3 GLY A 616 -2.035 -13.519 -7.629 1.00 2.02 H new ATOM 1320 N ARG A 617 -4.480 -12.097 -7.889 1.00 1.75 N ATOM 1321 CA ARG A 617 -5.595 -11.395 -7.220 1.00 1.74 C ATOM 1322 C ARG A 617 -5.418 -11.441 -5.697 1.00 1.90 C ATOM 1323 O ARG A 617 -5.081 -12.497 -5.154 1.00 2.18 O ATOM 1324 CB ARG A 617 -6.921 -12.102 -7.575 1.00 1.92 C ATOM 1325 CG ARG A 617 -7.288 -12.106 -9.069 1.00 1.81 C ATOM 1326 CD ARG A 617 -8.051 -10.856 -9.520 1.00 2.10 C ATOM 1327 NE ARG A 617 -9.457 -10.916 -9.084 1.00 2.91 N ATOM 1328 CZ ARG A 617 -10.547 -10.832 -9.818 1.00 3.30 C ATOM 1329 NH1 ARG A 617 -10.565 -10.659 -11.108 1.00 3.32 N ATOM 1330 NH2 ARG A 617 -11.701 -10.932 -9.237 1.00 4.41 N ATOM 0 H ARG A 617 -4.792 -12.942 -8.367 1.00 1.75 H new ATOM 0 HA ARG A 617 -5.607 -10.358 -7.554 1.00 1.74 H new ATOM 0 HB2 ARG A 617 -6.867 -13.134 -7.229 1.00 1.92 H new ATOM 0 HB3 ARG A 617 -7.728 -11.622 -7.021 1.00 1.92 H new ATOM 0 HG2 ARG A 617 -6.375 -12.196 -9.658 1.00 1.81 H new ATOM 0 HG3 ARG A 617 -7.893 -12.987 -9.283 1.00 1.81 H new ATOM 0 HD2 ARG A 617 -7.575 -9.966 -9.108 1.00 2.10 H new ATOM 0 HD3 ARG A 617 -8.006 -10.768 -10.606 1.00 2.10 H new ATOM 0 HE ARG A 617 -9.606 -11.039 -8.082 1.00 2.91 H new ATOM 0 HH11 ARG A 617 -9.689 -10.578 -11.624 1.00 3.32 H new ATOM 0 HH12 ARG A 617 -11.455 -10.604 -11.603 1.00 3.32 H new ATOM 0 HH21 ARG A 617 -11.754 -11.073 -8.228 1.00 4.41 H new ATOM 0 HH22 ARG A 617 -12.557 -10.869 -9.788 1.00 4.41 H new ATOM 1344 N ARG A 618 -5.696 -10.350 -4.982 1.00 1.93 N ATOM 1345 CA ARG A 618 -5.643 -10.288 -3.509 1.00 2.16 C ATOM 1346 C ARG A 618 -6.921 -9.683 -2.928 1.00 2.37 C ATOM 1347 O ARG A 618 -7.117 -8.469 -2.945 1.00 3.24 O ATOM 1348 CB ARG A 618 -4.388 -9.521 -3.063 1.00 2.42 C ATOM 1349 CG ARG A 618 -3.050 -10.164 -3.467 1.00 2.79 C ATOM 1350 CD ARG A 618 -2.820 -11.516 -2.780 1.00 2.78 C ATOM 1351 NE ARG A 618 -1.609 -12.182 -3.290 1.00 4.00 N ATOM 1352 CZ ARG A 618 -1.549 -13.223 -4.099 1.00 4.90 C ATOM 1353 NH1 ARG A 618 -2.590 -13.709 -4.712 1.00 5.32 N ATOM 1354 NH2 ARG A 618 -0.411 -13.807 -4.326 1.00 6.19 N ATOM 0 H ARG A 618 -5.970 -9.466 -5.411 1.00 1.93 H new ATOM 0 HA ARG A 618 -5.577 -11.303 -3.118 1.00 2.16 H new ATOM 0 HB2 ARG A 618 -4.430 -8.515 -3.479 1.00 2.42 H new ATOM 0 HB3 ARG A 618 -4.411 -9.418 -1.978 1.00 2.42 H new ATOM 0 HG2 ARG A 618 -3.027 -10.300 -4.548 1.00 2.79 H new ATOM 0 HG3 ARG A 618 -2.234 -9.487 -3.214 1.00 2.79 H new ATOM 0 HD2 ARG A 618 -2.729 -11.368 -1.704 1.00 2.78 H new ATOM 0 HD3 ARG A 618 -3.685 -12.159 -2.941 1.00 2.78 H new ATOM 0 HE ARG A 618 -0.716 -11.795 -2.983 1.00 4.00 H new ATOM 0 HH11 ARG A 618 -3.507 -13.282 -4.577 1.00 5.32 H new ATOM 0 HH12 ARG A 618 -2.489 -14.516 -5.327 1.00 5.32 H new ATOM 0 HH21 ARG A 618 0.438 -13.461 -3.879 1.00 6.19 H new ATOM 0 HH22 ARG A 618 -0.366 -14.611 -4.952 1.00 6.19 H new ATOM 1368 N THR A 619 -7.800 -10.538 -2.416 1.00 1.87 N ATOM 1369 CA THR A 619 -9.158 -10.169 -1.971 1.00 1.80 C ATOM 1370 C THR A 619 -9.216 -9.850 -0.469 1.00 1.54 C ATOM 1371 O THR A 619 -8.610 -10.562 0.334 1.00 1.56 O ATOM 1372 CB THR A 619 -10.141 -11.280 -2.364 1.00 2.10 C ATOM 1373 OG1 THR A 619 -10.085 -11.450 -3.767 1.00 3.08 O ATOM 1374 CG2 THR A 619 -11.588 -10.969 -1.993 1.00 2.87 C ATOM 0 H THR A 619 -7.593 -11.529 -2.292 1.00 1.87 H new ATOM 0 HA THR A 619 -9.449 -9.248 -2.476 1.00 1.80 H new ATOM 0 HB THR A 619 -9.844 -12.175 -1.818 1.00 2.10 H new ATOM 0 HG1 THR A 619 -10.707 -12.158 -4.036 1.00 3.08 H new ATOM 0 HG21 THR A 619 -12.228 -11.796 -2.300 1.00 2.87 H new ATOM 0 HG22 THR A 619 -11.665 -10.831 -0.915 1.00 2.87 H new ATOM 0 HG23 THR A 619 -11.906 -10.058 -2.499 1.00 2.87 H new ATOM 1382 N ALA A 620 -9.937 -8.779 -0.107 1.00 1.48 N ATOM 1383 CA ALA A 620 -10.187 -8.309 1.264 1.00 1.35 C ATOM 1384 C ALA A 620 -11.443 -7.400 1.375 1.00 1.25 C ATOM 1385 O ALA A 620 -11.808 -6.698 0.422 1.00 1.57 O ATOM 1386 CB ALA A 620 -8.944 -7.547 1.744 1.00 1.78 C ATOM 0 H ALA A 620 -10.387 -8.184 -0.802 1.00 1.48 H new ATOM 0 HA ALA A 620 -10.383 -9.179 1.890 1.00 1.35 H new ATOM 0 HB1 ALA A 620 -9.107 -7.188 2.760 1.00 1.78 H new ATOM 0 HB2 ALA A 620 -8.081 -8.212 1.728 1.00 1.78 H new ATOM 0 HB3 ALA A 620 -8.760 -6.698 1.085 1.00 1.78 H new ATOM 1392 N SER A 621 -12.069 -7.373 2.559 1.00 1.12 N ATOM 1393 CA SER A 621 -13.338 -6.686 2.877 1.00 1.12 C ATOM 1394 C SER A 621 -13.168 -5.591 3.948 1.00 1.01 C ATOM 1395 O SER A 621 -12.951 -5.889 5.125 1.00 1.06 O ATOM 1396 CB SER A 621 -14.337 -7.742 3.363 1.00 1.31 C ATOM 1397 OG SER A 621 -15.651 -7.226 3.499 1.00 2.47 O ATOM 0 H SER A 621 -11.685 -7.857 3.371 1.00 1.12 H new ATOM 0 HA SER A 621 -13.696 -6.185 1.977 1.00 1.12 H new ATOM 0 HB2 SER A 621 -14.349 -8.576 2.661 1.00 1.31 H new ATOM 0 HB3 SER A 621 -14.004 -8.137 4.323 1.00 1.31 H new ATOM 0 HG SER A 621 -16.251 -7.936 3.809 1.00 2.47 H new ATOM 1403 N VAL A 622 -13.250 -4.309 3.568 1.00 0.90 N ATOM 1404 CA VAL A 622 -13.133 -3.175 4.514 1.00 0.85 C ATOM 1405 C VAL A 622 -13.887 -1.909 4.068 1.00 0.81 C ATOM 1406 O VAL A 622 -13.987 -1.603 2.876 1.00 0.83 O ATOM 1407 CB VAL A 622 -11.645 -2.912 4.852 1.00 0.94 C ATOM 1408 CG1 VAL A 622 -10.732 -2.853 3.630 1.00 0.96 C ATOM 1409 CG2 VAL A 622 -11.408 -1.640 5.667 1.00 0.96 C ATOM 0 H VAL A 622 -13.399 -4.022 2.601 1.00 0.90 H new ATOM 0 HA VAL A 622 -13.641 -3.468 5.433 1.00 0.85 H new ATOM 0 HB VAL A 622 -11.387 -3.782 5.455 1.00 0.94 H new ATOM 0 HG11 VAL A 622 -9.707 -2.666 3.950 1.00 0.96 H new ATOM 0 HG12 VAL A 622 -10.777 -3.802 3.096 1.00 0.96 H new ATOM 0 HG13 VAL A 622 -11.059 -2.049 2.970 1.00 0.96 H new ATOM 0 HG21 VAL A 622 -10.342 -1.527 5.863 1.00 0.96 H new ATOM 0 HG22 VAL A 622 -11.768 -0.777 5.107 1.00 0.96 H new ATOM 0 HG23 VAL A 622 -11.945 -1.709 6.613 1.00 0.96 H new ATOM 1419 N ARG A 623 -14.404 -1.140 5.042 1.00 0.80 N ATOM 1420 CA ARG A 623 -15.130 0.124 4.836 1.00 0.77 C ATOM 1421 C ARG A 623 -14.631 1.267 5.725 1.00 0.76 C ATOM 1422 O ARG A 623 -14.001 1.069 6.762 1.00 0.76 O ATOM 1423 CB ARG A 623 -16.647 -0.117 4.972 1.00 0.85 C ATOM 1424 CG ARG A 623 -17.120 -0.281 6.425 1.00 0.94 C ATOM 1425 CD ARG A 623 -18.505 -0.930 6.518 1.00 1.36 C ATOM 1426 NE ARG A 623 -19.542 -0.118 5.861 1.00 2.25 N ATOM 1427 CZ ARG A 623 -20.841 -0.338 5.859 1.00 3.05 C ATOM 1428 NH1 ARG A 623 -21.390 -1.357 6.450 1.00 3.10 N ATOM 1429 NH2 ARG A 623 -21.606 0.497 5.231 1.00 4.21 N ATOM 0 H ARG A 623 -14.325 -1.390 6.028 1.00 0.80 H new ATOM 0 HA ARG A 623 -14.923 0.461 3.820 1.00 0.77 H new ATOM 0 HB2 ARG A 623 -17.180 0.718 4.518 1.00 0.85 H new ATOM 0 HB3 ARG A 623 -16.916 -1.011 4.409 1.00 0.85 H new ATOM 0 HG2 ARG A 623 -16.399 -0.889 6.973 1.00 0.94 H new ATOM 0 HG3 ARG A 623 -17.146 0.696 6.908 1.00 0.94 H new ATOM 0 HD2 ARG A 623 -18.474 -1.918 6.059 1.00 1.36 H new ATOM 0 HD3 ARG A 623 -18.768 -1.074 7.566 1.00 1.36 H new ATOM 0 HE ARG A 623 -19.220 0.705 5.352 1.00 2.25 H new ATOM 0 HH11 ARG A 623 -20.809 -2.033 6.946 1.00 3.10 H new ATOM 0 HH12 ARG A 623 -22.402 -1.481 6.418 1.00 3.10 H new ATOM 0 HH21 ARG A 623 -21.199 1.301 4.754 1.00 4.21 H new ATOM 0 HH22 ARG A 623 -22.615 0.350 5.214 1.00 4.21 H new ATOM 1443 N ALA A 624 -14.937 2.489 5.318 1.00 0.81 N ATOM 1444 CA ALA A 624 -14.550 3.702 6.021 1.00 0.82 C ATOM 1445 C ALA A 624 -15.271 3.810 7.379 1.00 0.76 C ATOM 1446 O ALA A 624 -16.498 3.696 7.447 1.00 0.83 O ATOM 1447 CB ALA A 624 -14.822 4.893 5.094 1.00 0.99 C ATOM 0 H ALA A 624 -15.474 2.669 4.470 1.00 0.81 H new ATOM 0 HA ALA A 624 -13.487 3.687 6.262 1.00 0.82 H new ATOM 0 HB1 ALA A 624 -14.540 5.818 5.597 1.00 0.99 H new ATOM 0 HB2 ALA A 624 -14.237 4.784 4.181 1.00 0.99 H new ATOM 0 HB3 ALA A 624 -15.882 4.925 4.844 1.00 0.99 H new ATOM 1453 N ASP A 625 -14.528 4.053 8.463 1.00 0.75 N ATOM 1454 CA ASP A 625 -15.123 4.386 9.768 1.00 0.80 C ATOM 1455 C ASP A 625 -15.629 5.826 9.772 1.00 0.89 C ATOM 1456 O ASP A 625 -16.628 6.157 10.405 1.00 1.02 O ATOM 1457 CB ASP A 625 -14.075 4.269 10.888 1.00 0.96 C ATOM 1458 CG ASP A 625 -14.727 3.955 12.229 1.00 1.37 C ATOM 1459 OD1 ASP A 625 -15.381 2.890 12.318 1.00 1.68 O ATOM 1460 OD2 ASP A 625 -14.628 4.775 13.168 1.00 2.60 O ATOM 0 H ASP A 625 -13.508 4.026 8.466 1.00 0.75 H new ATOM 0 HA ASP A 625 -15.943 3.688 9.937 1.00 0.80 H new ATOM 0 HB2 ASP A 625 -13.359 3.486 10.638 1.00 0.96 H new ATOM 0 HB3 ASP A 625 -13.515 5.201 10.963 1.00 0.96 H new ATOM 1465 N THR A 626 -14.880 6.668 9.061 1.00 0.86 N ATOM 1466 CA THR A 626 -14.921 8.127 9.133 1.00 0.92 C ATOM 1467 C THR A 626 -14.540 8.684 7.754 1.00 0.92 C ATOM 1468 O THR A 626 -14.364 7.914 6.810 1.00 0.99 O ATOM 1469 CB THR A 626 -13.999 8.591 10.275 1.00 1.01 C ATOM 1470 OG1 THR A 626 -14.008 9.995 10.395 1.00 1.13 O ATOM 1471 CG2 THR A 626 -12.557 8.100 10.120 1.00 1.02 C ATOM 0 H THR A 626 -14.193 6.333 8.385 1.00 0.86 H new ATOM 0 HA THR A 626 -15.916 8.507 9.367 1.00 0.92 H new ATOM 0 HB THR A 626 -14.402 8.143 11.183 1.00 1.01 H new ATOM 0 HG1 THR A 626 -13.416 10.264 11.128 1.00 1.13 H new ATOM 0 HG21 THR A 626 -11.958 8.461 10.956 1.00 1.02 H new ATOM 0 HG22 THR A 626 -12.543 7.010 10.107 1.00 1.02 H new ATOM 0 HG23 THR A 626 -12.142 8.479 9.186 1.00 1.02 H new ATOM 1479 N TYR A 627 -14.425 10.001 7.592 1.00 0.91 N ATOM 1480 CA TYR A 627 -13.683 10.577 6.469 1.00 0.84 C ATOM 1481 C TYR A 627 -12.245 10.024 6.491 1.00 0.83 C ATOM 1482 O TYR A 627 -11.425 10.417 7.323 1.00 0.91 O ATOM 1483 CB TYR A 627 -13.775 12.108 6.554 1.00 0.88 C ATOM 1484 CG TYR A 627 -12.649 12.916 5.927 1.00 1.11 C ATOM 1485 CD1 TYR A 627 -12.427 12.886 4.535 1.00 2.16 C ATOM 1486 CD2 TYR A 627 -11.861 13.754 6.745 1.00 2.06 C ATOM 1487 CE1 TYR A 627 -11.402 13.687 3.980 1.00 2.41 C ATOM 1488 CE2 TYR A 627 -10.855 14.562 6.185 1.00 2.45 C ATOM 1489 CZ TYR A 627 -10.618 14.526 4.796 1.00 2.05 C ATOM 1490 OH TYR A 627 -9.661 15.308 4.228 1.00 2.56 O ATOM 0 H TYR A 627 -14.835 10.690 8.223 1.00 0.91 H new ATOM 0 HA TYR A 627 -14.106 10.295 5.505 1.00 0.84 H new ATOM 0 HB2 TYR A 627 -14.710 12.415 6.086 1.00 0.88 H new ATOM 0 HB3 TYR A 627 -13.840 12.383 7.607 1.00 0.88 H new ATOM 0 HD1 TYR A 627 -13.033 12.258 3.899 1.00 2.16 H new ATOM 0 HD2 TYR A 627 -12.032 13.775 7.811 1.00 2.06 H new ATOM 0 HE1 TYR A 627 -11.218 13.655 2.916 1.00 2.41 H new ATOM 0 HE2 TYR A 627 -10.265 15.209 6.818 1.00 2.45 H new ATOM 0 HH TYR A 627 -9.208 15.829 4.924 1.00 2.56 H new ATOM 1500 N CYS A 628 -11.965 9.050 5.619 1.00 0.85 N ATOM 1501 CA CYS A 628 -10.662 8.402 5.503 1.00 0.89 C ATOM 1502 C CYS A 628 -9.955 8.938 4.253 1.00 0.94 C ATOM 1503 O CYS A 628 -10.485 8.889 3.135 1.00 0.99 O ATOM 1504 CB CYS A 628 -10.779 6.860 5.600 1.00 0.88 C ATOM 1505 SG CYS A 628 -11.102 6.030 4.024 1.00 2.53 S ATOM 0 H CYS A 628 -12.655 8.685 4.962 1.00 0.85 H new ATOM 0 HA CYS A 628 -10.025 8.656 6.350 1.00 0.89 H new ATOM 0 HB2 CYS A 628 -9.855 6.464 6.022 1.00 0.88 H new ATOM 0 HB3 CYS A 628 -11.579 6.612 6.297 1.00 0.88 H new ATOM 0 HG CYS A 628 -10.997 6.887 3.052 1.00 2.53 H new ATOM 1511 N ARG A 629 -8.749 9.465 4.456 1.00 0.96 N ATOM 1512 CA ARG A 629 -7.856 9.962 3.418 1.00 1.03 C ATOM 1513 C ARG A 629 -6.711 8.970 3.246 1.00 0.88 C ATOM 1514 O ARG A 629 -5.912 8.673 4.142 1.00 0.90 O ATOM 1515 CB ARG A 629 -7.429 11.383 3.784 1.00 1.39 C ATOM 1516 CG ARG A 629 -6.395 11.924 2.814 1.00 1.96 C ATOM 1517 CD ARG A 629 -6.281 13.444 2.921 1.00 1.47 C ATOM 1518 NE ARG A 629 -5.580 13.916 4.134 1.00 1.66 N ATOM 1519 CZ ARG A 629 -6.092 14.193 5.321 1.00 2.49 C ATOM 1520 NH1 ARG A 629 -7.361 14.138 5.587 1.00 3.46 N ATOM 1521 NH2 ARG A 629 -5.344 14.542 6.318 1.00 3.29 N ATOM 0 H ARG A 629 -8.353 9.560 5.391 1.00 0.96 H new ATOM 0 HA ARG A 629 -8.340 10.034 2.444 1.00 1.03 H new ATOM 0 HB2 ARG A 629 -8.302 12.036 3.788 1.00 1.39 H new ATOM 0 HB3 ARG A 629 -7.020 11.392 4.794 1.00 1.39 H new ATOM 0 HG2 ARG A 629 -5.426 11.468 3.019 1.00 1.96 H new ATOM 0 HG3 ARG A 629 -6.668 11.648 1.796 1.00 1.96 H new ATOM 0 HD2 ARG A 629 -5.757 13.820 2.043 1.00 1.47 H new ATOM 0 HD3 ARG A 629 -7.282 13.874 2.903 1.00 1.47 H new ATOM 0 HE ARG A 629 -4.572 14.044 4.044 1.00 1.66 H new ATOM 0 HH11 ARG A 629 -8.023 13.869 4.859 1.00 3.46 H new ATOM 0 HH12 ARG A 629 -7.696 14.364 6.524 1.00 3.46 H new ATOM 0 HH21 ARG A 629 -4.333 14.609 6.198 1.00 3.29 H new ATOM 0 HH22 ARG A 629 -5.765 14.750 7.223 1.00 3.29 H new ATOM 1535 N LEU A 630 -6.697 8.404 2.059 1.00 0.82 N ATOM 1536 CA LEU A 630 -5.888 7.257 1.688 1.00 0.77 C ATOM 1537 C LEU A 630 -4.868 7.696 0.639 1.00 0.78 C ATOM 1538 O LEU A 630 -5.052 8.688 -0.068 1.00 0.92 O ATOM 1539 CB LEU A 630 -6.789 6.090 1.224 1.00 0.73 C ATOM 1540 CG LEU A 630 -7.954 5.710 2.171 1.00 0.76 C ATOM 1541 CD1 LEU A 630 -8.623 4.424 1.683 1.00 0.76 C ATOM 1542 CD2 LEU A 630 -7.544 5.455 3.625 1.00 0.86 C ATOM 0 H LEU A 630 -7.274 8.744 1.290 1.00 0.82 H new ATOM 0 HA LEU A 630 -5.333 6.879 2.547 1.00 0.77 H new ATOM 0 HB2 LEU A 630 -7.208 6.346 0.251 1.00 0.73 H new ATOM 0 HB3 LEU A 630 -6.163 5.209 1.080 1.00 0.73 H new ATOM 0 HG LEU A 630 -8.616 6.576 2.150 1.00 0.76 H new ATOM 0 HD11 LEU A 630 -9.441 4.163 2.354 1.00 0.76 H new ATOM 0 HD12 LEU A 630 -9.013 4.576 0.677 1.00 0.76 H new ATOM 0 HD13 LEU A 630 -7.892 3.616 1.670 1.00 0.76 H new ATOM 0 HD21 LEU A 630 -8.425 5.196 4.211 1.00 0.86 H new ATOM 0 HD22 LEU A 630 -6.829 4.633 3.663 1.00 0.86 H new ATOM 0 HD23 LEU A 630 -7.086 6.354 4.037 1.00 0.86 H new ATOM 1554 N TYR A 631 -3.773 6.959 0.546 1.00 0.68 N ATOM 1555 CA TYR A 631 -2.722 7.215 -0.428 1.00 0.67 C ATOM 1556 C TYR A 631 -2.477 5.958 -1.271 1.00 0.63 C ATOM 1557 O TYR A 631 -2.780 4.847 -0.822 1.00 0.80 O ATOM 1558 CB TYR A 631 -1.522 7.888 0.266 1.00 1.06 C ATOM 1559 CG TYR A 631 -0.551 7.096 1.126 1.00 1.94 C ATOM 1560 CD1 TYR A 631 -0.951 6.566 2.367 1.00 3.60 C ATOM 1561 CD2 TYR A 631 0.806 7.026 0.750 1.00 2.76 C ATOM 1562 CE1 TYR A 631 -0.020 5.911 3.201 1.00 4.97 C ATOM 1563 CE2 TYR A 631 1.745 6.390 1.584 1.00 4.10 C ATOM 1564 CZ TYR A 631 1.331 5.809 2.800 1.00 4.96 C ATOM 1565 OH TYR A 631 2.239 5.159 3.572 1.00 6.48 O ATOM 0 H TYR A 631 -3.586 6.158 1.150 1.00 0.68 H new ATOM 0 HA TYR A 631 -3.007 7.952 -1.179 1.00 0.67 H new ATOM 0 HB2 TYR A 631 -0.933 8.368 -0.516 1.00 1.06 H new ATOM 0 HB3 TYR A 631 -1.925 8.682 0.894 1.00 1.06 H new ATOM 0 HD1 TYR A 631 -1.979 6.661 2.684 1.00 3.60 H new ATOM 0 HD2 TYR A 631 1.127 7.463 -0.184 1.00 2.76 H new ATOM 0 HE1 TYR A 631 -0.339 5.489 4.143 1.00 4.97 H new ATOM 0 HE2 TYR A 631 2.784 6.347 1.292 1.00 4.10 H new ATOM 0 HH TYR A 631 3.117 5.188 3.138 1.00 6.48 H new ATOM 1575 N SER A 632 -2.050 6.121 -2.528 1.00 0.61 N ATOM 1576 CA SER A 632 -1.926 4.994 -3.466 1.00 0.72 C ATOM 1577 C SER A 632 -0.683 5.070 -4.353 1.00 0.71 C ATOM 1578 O SER A 632 -0.295 6.144 -4.822 1.00 0.88 O ATOM 1579 CB SER A 632 -3.211 4.807 -4.295 1.00 0.93 C ATOM 1580 OG SER A 632 -3.311 5.745 -5.350 1.00 1.81 O ATOM 0 H SER A 632 -1.783 7.023 -2.922 1.00 0.61 H new ATOM 0 HA SER A 632 -1.791 4.105 -2.850 1.00 0.72 H new ATOM 0 HB2 SER A 632 -3.232 3.798 -4.706 1.00 0.93 H new ATOM 0 HB3 SER A 632 -4.079 4.903 -3.643 1.00 0.93 H new ATOM 0 HG SER A 632 -4.139 5.588 -5.850 1.00 1.81 H new ATOM 1586 N LEU A 633 -0.042 3.917 -4.578 1.00 0.64 N ATOM 1587 CA LEU A 633 1.232 3.807 -5.300 1.00 0.67 C ATOM 1588 C LEU A 633 1.221 2.619 -6.273 1.00 0.68 C ATOM 1589 O LEU A 633 0.875 1.498 -5.892 1.00 0.67 O ATOM 1590 CB LEU A 633 2.396 3.745 -4.284 1.00 0.73 C ATOM 1591 CG LEU A 633 3.617 4.611 -4.658 1.00 0.94 C ATOM 1592 CD1 LEU A 633 4.639 4.578 -3.521 1.00 1.21 C ATOM 1593 CD2 LEU A 633 4.313 4.170 -5.947 1.00 1.35 C ATOM 0 H LEU A 633 -0.401 3.017 -4.258 1.00 0.64 H new ATOM 0 HA LEU A 633 1.378 4.693 -5.918 1.00 0.67 H new ATOM 0 HB2 LEU A 633 2.027 4.061 -3.308 1.00 0.73 H new ATOM 0 HB3 LEU A 633 2.719 2.709 -4.183 1.00 0.73 H new ATOM 0 HG LEU A 633 3.233 5.618 -4.824 1.00 0.94 H new ATOM 0 HD11 LEU A 633 5.500 5.190 -3.788 1.00 1.21 H new ATOM 0 HD12 LEU A 633 4.184 4.969 -2.611 1.00 1.21 H new ATOM 0 HD13 LEU A 633 4.963 3.551 -3.352 1.00 1.21 H new ATOM 0 HD21 LEU A 633 5.161 4.825 -6.145 1.00 1.35 H new ATOM 0 HD22 LEU A 633 4.665 3.144 -5.838 1.00 1.35 H new ATOM 0 HD23 LEU A 633 3.610 4.226 -6.778 1.00 1.35 H new ATOM 1605 N SER A 634 1.591 2.869 -7.531 1.00 0.80 N ATOM 1606 CA SER A 634 1.611 1.844 -8.587 1.00 0.83 C ATOM 1607 C SER A 634 2.925 1.057 -8.676 1.00 0.85 C ATOM 1608 O SER A 634 4.021 1.619 -8.602 1.00 0.82 O ATOM 1609 CB SER A 634 1.262 2.455 -9.943 1.00 0.85 C ATOM 1610 OG SER A 634 1.278 1.433 -10.916 1.00 2.05 O ATOM 0 H SER A 634 1.887 3.791 -7.851 1.00 0.80 H new ATOM 0 HA SER A 634 0.848 1.119 -8.304 1.00 0.83 H new ATOM 0 HB2 SER A 634 0.279 2.925 -9.904 1.00 0.85 H new ATOM 0 HB3 SER A 634 1.978 3.235 -10.202 1.00 0.85 H new ATOM 0 HG SER A 634 1.054 1.812 -11.792 1.00 2.05 H new ATOM 1616 N VAL A 635 2.818 -0.252 -8.935 1.00 0.98 N ATOM 1617 CA VAL A 635 3.969 -1.126 -9.223 1.00 1.15 C ATOM 1618 C VAL A 635 4.643 -0.808 -10.564 1.00 1.16 C ATOM 1619 O VAL A 635 5.844 -1.023 -10.712 1.00 1.36 O ATOM 1620 CB VAL A 635 3.664 -2.619 -9.046 1.00 1.28 C ATOM 1621 CG1 VAL A 635 2.302 -3.053 -9.506 1.00 1.59 C ATOM 1622 CG2 VAL A 635 4.699 -3.549 -9.677 1.00 2.20 C ATOM 0 H VAL A 635 1.923 -0.742 -8.951 1.00 0.98 H new ATOM 0 HA VAL A 635 4.706 -0.890 -8.455 1.00 1.15 H new ATOM 0 HB VAL A 635 3.704 -2.717 -7.961 1.00 1.28 H new ATOM 0 HG11 VAL A 635 2.185 -4.124 -9.338 1.00 1.59 H new ATOM 0 HG12 VAL A 635 1.539 -2.513 -8.945 1.00 1.59 H new ATOM 0 HG13 VAL A 635 2.191 -2.838 -10.569 1.00 1.59 H new ATOM 0 HG21 VAL A 635 4.409 -4.586 -9.506 1.00 2.20 H new ATOM 0 HG22 VAL A 635 4.753 -3.359 -10.749 1.00 2.20 H new ATOM 0 HG23 VAL A 635 5.675 -3.367 -9.226 1.00 2.20 H new ATOM 1632 N ASP A 636 3.945 -0.199 -11.525 1.00 1.08 N ATOM 1633 CA ASP A 636 4.626 0.260 -12.741 1.00 1.26 C ATOM 1634 C ASP A 636 5.639 1.382 -12.439 1.00 1.17 C ATOM 1635 O ASP A 636 6.668 1.477 -13.104 1.00 1.41 O ATOM 1636 CB ASP A 636 3.604 0.756 -13.769 1.00 1.40 C ATOM 1637 CG ASP A 636 3.029 -0.352 -14.657 1.00 1.92 C ATOM 1638 OD1 ASP A 636 3.796 -1.213 -15.151 1.00 2.78 O ATOM 1639 OD2 ASP A 636 1.817 -0.307 -14.975 1.00 2.37 O ATOM 0 H ASP A 636 2.942 -0.016 -11.491 1.00 1.08 H new ATOM 0 HA ASP A 636 5.172 -0.591 -13.148 1.00 1.26 H new ATOM 0 HB2 ASP A 636 2.786 1.249 -13.244 1.00 1.40 H new ATOM 0 HB3 ASP A 636 4.076 1.508 -14.402 1.00 1.40 H new ATOM 1644 N ASN A 637 5.386 2.199 -11.410 1.00 0.92 N ATOM 1645 CA ASN A 637 6.354 3.170 -10.897 1.00 0.84 C ATOM 1646 C ASN A 637 7.407 2.499 -10.008 1.00 0.77 C ATOM 1647 O ASN A 637 8.572 2.867 -10.102 1.00 0.94 O ATOM 1648 CB ASN A 637 5.609 4.315 -10.201 1.00 0.94 C ATOM 1649 CG ASN A 637 4.738 5.052 -11.196 1.00 1.31 C ATOM 1650 OD1 ASN A 637 3.519 5.029 -11.142 1.00 2.16 O ATOM 1651 ND2 ASN A 637 5.327 5.723 -12.148 1.00 1.41 N ATOM 0 H ASN A 637 4.498 2.204 -10.908 1.00 0.92 H new ATOM 0 HA ASN A 637 6.913 3.600 -11.728 1.00 0.84 H new ATOM 0 HB2 ASN A 637 4.995 3.920 -9.391 1.00 0.94 H new ATOM 0 HB3 ASN A 637 6.324 5.004 -9.752 1.00 0.94 H new ATOM 0 HD21 ASN A 637 4.769 6.223 -12.840 1.00 1.41 H new ATOM 0 HD22 ASN A 637 6.345 5.747 -12.200 1.00 1.41 H new ATOM 1658 N PHE A 638 7.041 1.461 -9.243 1.00 0.73 N ATOM 1659 CA PHE A 638 7.992 0.620 -8.493 1.00 0.85 C ATOM 1660 C PHE A 638 9.090 0.054 -9.411 1.00 0.99 C ATOM 1661 O PHE A 638 10.280 0.248 -9.171 1.00 0.97 O ATOM 1662 CB PHE A 638 7.264 -0.518 -7.771 1.00 1.19 C ATOM 1663 CG PHE A 638 8.209 -1.408 -6.999 1.00 1.75 C ATOM 1664 CD1 PHE A 638 8.557 -1.076 -5.680 1.00 1.63 C ATOM 1665 CD2 PHE A 638 8.774 -2.539 -7.616 1.00 3.58 C ATOM 1666 CE1 PHE A 638 9.531 -1.824 -5.004 1.00 2.01 C ATOM 1667 CE2 PHE A 638 9.745 -3.290 -6.939 1.00 4.17 C ATOM 1668 CZ PHE A 638 10.152 -2.902 -5.652 1.00 3.01 C ATOM 0 H PHE A 638 6.069 1.177 -9.125 1.00 0.73 H new ATOM 0 HA PHE A 638 8.470 1.255 -7.748 1.00 0.85 H new ATOM 0 HB2 PHE A 638 6.526 -0.098 -7.088 1.00 1.19 H new ATOM 0 HB3 PHE A 638 6.719 -1.117 -8.500 1.00 1.19 H new ATOM 0 HD1 PHE A 638 8.075 -0.245 -5.187 1.00 1.63 H new ATOM 0 HD2 PHE A 638 8.461 -2.828 -8.608 1.00 3.58 H new ATOM 0 HE1 PHE A 638 9.802 -1.572 -3.989 1.00 2.01 H new ATOM 0 HE2 PHE A 638 10.178 -4.163 -7.405 1.00 4.17 H new ATOM 0 HZ PHE A 638 10.949 -3.438 -5.158 1.00 3.01 H new ATOM 1678 N ASN A 639 8.691 -0.586 -10.514 1.00 1.18 N ATOM 1679 CA ASN A 639 9.601 -1.179 -11.498 1.00 1.37 C ATOM 1680 C ASN A 639 10.384 -0.135 -12.324 1.00 1.37 C ATOM 1681 O ASN A 639 11.331 -0.488 -13.028 1.00 1.63 O ATOM 1682 CB ASN A 639 8.782 -2.137 -12.380 1.00 1.49 C ATOM 1683 CG ASN A 639 8.363 -3.389 -11.628 1.00 1.60 C ATOM 1684 OD1 ASN A 639 9.151 -3.991 -10.912 1.00 1.89 O ATOM 1685 ND2 ASN A 639 7.144 -3.850 -11.764 1.00 1.79 N ATOM 0 H ASN A 639 7.707 -0.709 -10.752 1.00 1.18 H new ATOM 0 HA ASN A 639 10.380 -1.731 -10.972 1.00 1.37 H new ATOM 0 HB2 ASN A 639 7.895 -1.621 -12.748 1.00 1.49 H new ATOM 0 HB3 ASN A 639 9.371 -2.419 -13.253 1.00 1.49 H new ATOM 0 HD21 ASN A 639 6.863 -4.700 -11.276 1.00 1.79 H new ATOM 0 HD22 ASN A 639 6.476 -3.358 -12.358 1.00 1.79 H new ATOM 1692 N GLU A 640 10.016 1.142 -12.220 1.00 1.17 N ATOM 1693 CA GLU A 640 10.693 2.300 -12.815 1.00 1.24 C ATOM 1694 C GLU A 640 11.797 2.860 -11.901 1.00 1.14 C ATOM 1695 O GLU A 640 12.900 3.148 -12.371 1.00 1.28 O ATOM 1696 CB GLU A 640 9.612 3.330 -13.185 1.00 1.22 C ATOM 1697 CG GLU A 640 9.960 4.790 -12.911 1.00 2.60 C ATOM 1698 CD GLU A 640 8.857 5.737 -13.377 1.00 3.70 C ATOM 1699 OE1 GLU A 640 8.784 6.046 -14.586 1.00 3.94 O ATOM 1700 OE2 GLU A 640 8.047 6.204 -12.542 1.00 5.23 O ATOM 0 H GLU A 640 9.190 1.414 -11.688 1.00 1.17 H new ATOM 0 HA GLU A 640 11.226 2.009 -13.720 1.00 1.24 H new ATOM 0 HB2 GLU A 640 9.385 3.224 -14.246 1.00 1.22 H new ATOM 0 HB3 GLU A 640 8.702 3.085 -12.638 1.00 1.22 H new ATOM 0 HG2 GLU A 640 10.130 4.928 -11.843 1.00 2.60 H new ATOM 0 HG3 GLU A 640 10.892 5.042 -13.417 1.00 2.60 H new ATOM 1707 N VAL A 641 11.515 3.002 -10.602 1.00 0.94 N ATOM 1708 CA VAL A 641 12.487 3.457 -9.583 1.00 0.83 C ATOM 1709 C VAL A 641 13.513 2.377 -9.232 1.00 0.85 C ATOM 1710 O VAL A 641 14.671 2.693 -8.970 1.00 0.88 O ATOM 1711 CB VAL A 641 11.772 4.007 -8.332 1.00 0.68 C ATOM 1712 CG1 VAL A 641 10.858 2.993 -7.648 1.00 0.69 C ATOM 1713 CG2 VAL A 641 12.753 4.508 -7.270 1.00 0.66 C ATOM 0 H VAL A 641 10.592 2.803 -10.215 1.00 0.94 H new ATOM 0 HA VAL A 641 13.051 4.279 -10.024 1.00 0.83 H new ATOM 0 HB VAL A 641 11.172 4.828 -8.724 1.00 0.68 H new ATOM 0 HG11 VAL A 641 10.391 3.453 -6.777 1.00 0.69 H new ATOM 0 HG12 VAL A 641 10.085 2.671 -8.346 1.00 0.69 H new ATOM 0 HG13 VAL A 641 11.444 2.130 -7.332 1.00 0.69 H new ATOM 0 HG21 VAL A 641 12.198 4.884 -6.411 1.00 0.66 H new ATOM 0 HG22 VAL A 641 13.398 3.688 -6.955 1.00 0.66 H new ATOM 0 HG23 VAL A 641 13.363 5.309 -7.687 1.00 0.66 H new ATOM 1723 N LEU A 642 13.125 1.103 -9.313 1.00 0.92 N ATOM 1724 CA LEU A 642 14.006 -0.066 -9.220 1.00 1.06 C ATOM 1725 C LEU A 642 15.247 0.063 -10.124 1.00 1.19 C ATOM 1726 O LEU A 642 16.351 -0.250 -9.681 1.00 1.25 O ATOM 1727 CB LEU A 642 13.098 -1.286 -9.448 1.00 1.21 C ATOM 1728 CG LEU A 642 13.772 -2.656 -9.309 1.00 2.32 C ATOM 1729 CD1 LEU A 642 12.736 -3.750 -9.078 1.00 2.16 C ATOM 1730 CD2 LEU A 642 14.537 -2.984 -10.579 1.00 4.32 C ATOM 0 H LEU A 642 12.148 0.845 -9.451 1.00 0.92 H new ATOM 0 HA LEU A 642 14.478 -0.173 -8.243 1.00 1.06 H new ATOM 0 HB2 LEU A 642 12.270 -1.236 -8.741 1.00 1.21 H new ATOM 0 HB3 LEU A 642 12.668 -1.213 -10.447 1.00 1.21 H new ATOM 0 HG LEU A 642 14.449 -2.612 -8.456 1.00 2.32 H new ATOM 0 HD11 LEU A 642 13.238 -4.713 -8.983 1.00 2.16 H new ATOM 0 HD12 LEU A 642 12.181 -3.538 -8.164 1.00 2.16 H new ATOM 0 HD13 LEU A 642 12.047 -3.783 -9.922 1.00 2.16 H new ATOM 0 HD21 LEU A 642 15.014 -3.959 -10.475 1.00 4.32 H new ATOM 0 HD22 LEU A 642 13.848 -3.006 -11.423 1.00 4.32 H new ATOM 0 HD23 LEU A 642 15.299 -2.224 -10.752 1.00 4.32 H new ATOM 1742 N GLU A 643 15.116 0.612 -11.335 1.00 1.30 N ATOM 1743 CA GLU A 643 16.239 0.786 -12.255 1.00 1.47 C ATOM 1744 C GLU A 643 17.300 1.802 -11.786 1.00 1.32 C ATOM 1745 O GLU A 643 18.438 1.739 -12.252 1.00 1.40 O ATOM 1746 CB GLU A 643 15.679 1.214 -13.616 1.00 1.79 C ATOM 1747 CG GLU A 643 14.625 0.251 -14.188 1.00 1.95 C ATOM 1748 CD GLU A 643 15.241 -0.923 -14.962 1.00 2.17 C ATOM 1749 OE1 GLU A 643 15.902 -0.710 -16.006 1.00 2.98 O ATOM 1750 OE2 GLU A 643 15.064 -2.084 -14.524 1.00 2.64 O ATOM 0 H GLU A 643 14.226 0.948 -11.704 1.00 1.30 H new ATOM 0 HA GLU A 643 16.759 -0.170 -12.308 1.00 1.47 H new ATOM 0 HB2 GLU A 643 15.237 2.206 -13.520 1.00 1.79 H new ATOM 0 HB3 GLU A 643 16.502 1.299 -14.326 1.00 1.79 H new ATOM 0 HG2 GLU A 643 14.016 -0.139 -13.372 1.00 1.95 H new ATOM 0 HG3 GLU A 643 13.957 0.804 -14.848 1.00 1.95 H new ATOM 1757 N GLU A 644 16.991 2.725 -10.864 1.00 1.16 N ATOM 1758 CA GLU A 644 17.965 3.694 -10.334 1.00 1.15 C ATOM 1759 C GLU A 644 18.964 3.061 -9.347 1.00 1.01 C ATOM 1760 O GLU A 644 20.054 3.603 -9.138 1.00 1.06 O ATOM 1761 CB GLU A 644 17.216 4.840 -9.647 1.00 1.14 C ATOM 1762 CG GLU A 644 16.420 5.740 -10.596 1.00 1.42 C ATOM 1763 CD GLU A 644 17.052 7.127 -10.771 1.00 1.98 C ATOM 1764 OE1 GLU A 644 17.948 7.290 -11.636 1.00 2.03 O ATOM 1765 OE2 GLU A 644 16.652 8.079 -10.054 1.00 3.13 O ATOM 0 H GLU A 644 16.058 2.822 -10.463 1.00 1.16 H new ATOM 0 HA GLU A 644 18.546 4.065 -11.178 1.00 1.15 H new ATOM 0 HB2 GLU A 644 16.534 4.419 -8.908 1.00 1.14 H new ATOM 0 HB3 GLU A 644 17.935 5.453 -9.104 1.00 1.14 H new ATOM 0 HG2 GLU A 644 16.343 5.256 -11.569 1.00 1.42 H new ATOM 0 HG3 GLU A 644 15.405 5.854 -10.215 1.00 1.42 H new ATOM 1772 N TYR A 645 18.608 1.912 -8.768 1.00 0.92 N ATOM 1773 CA TYR A 645 19.301 1.256 -7.653 1.00 0.89 C ATOM 1774 C TYR A 645 19.608 -0.215 -7.990 1.00 1.09 C ATOM 1775 O TYR A 645 18.914 -1.126 -7.526 1.00 1.21 O ATOM 1776 CB TYR A 645 18.467 1.409 -6.371 1.00 0.80 C ATOM 1777 CG TYR A 645 18.258 2.850 -5.956 1.00 0.73 C ATOM 1778 CD1 TYR A 645 17.183 3.569 -6.501 1.00 1.74 C ATOM 1779 CD2 TYR A 645 19.139 3.475 -5.052 1.00 2.15 C ATOM 1780 CE1 TYR A 645 17.021 4.934 -6.211 1.00 1.68 C ATOM 1781 CE2 TYR A 645 18.951 4.829 -4.715 1.00 2.32 C ATOM 1782 CZ TYR A 645 17.908 5.567 -5.315 1.00 1.05 C ATOM 1783 OH TYR A 645 17.783 6.891 -5.052 1.00 1.34 O ATOM 0 H TYR A 645 17.790 1.387 -9.078 1.00 0.92 H new ATOM 0 HA TYR A 645 20.263 1.738 -7.482 1.00 0.89 H new ATOM 0 HB2 TYR A 645 17.496 0.937 -6.520 1.00 0.80 H new ATOM 0 HB3 TYR A 645 18.960 0.873 -5.560 1.00 0.80 H new ATOM 0 HD1 TYR A 645 16.476 3.070 -7.147 1.00 1.74 H new ATOM 0 HD2 TYR A 645 19.956 2.917 -4.619 1.00 2.15 H new ATOM 0 HE1 TYR A 645 16.222 5.496 -6.671 1.00 1.68 H new ATOM 0 HE2 TYR A 645 19.605 5.303 -3.998 1.00 2.32 H new ATOM 0 HH TYR A 645 18.474 7.164 -4.413 1.00 1.34 H new ATOM 1793 N PRO A 646 20.638 -0.492 -8.809 1.00 1.27 N ATOM 1794 CA PRO A 646 20.953 -1.843 -9.275 1.00 1.53 C ATOM 1795 C PRO A 646 21.229 -2.903 -8.193 1.00 1.54 C ATOM 1796 O PRO A 646 21.039 -4.085 -8.494 1.00 1.79 O ATOM 1797 CB PRO A 646 22.131 -1.684 -10.239 1.00 1.76 C ATOM 1798 CG PRO A 646 22.718 -0.322 -9.890 1.00 1.62 C ATOM 1799 CD PRO A 646 21.474 0.469 -9.510 1.00 1.34 C ATOM 0 HA PRO A 646 20.062 -2.254 -9.750 1.00 1.53 H new ATOM 0 HB2 PRO A 646 22.864 -2.480 -10.106 1.00 1.76 H new ATOM 0 HB3 PRO A 646 21.803 -1.722 -11.278 1.00 1.76 H new ATOM 0 HG2 PRO A 646 23.430 -0.383 -9.067 1.00 1.62 H new ATOM 0 HG3 PRO A 646 23.244 0.124 -10.734 1.00 1.62 H new ATOM 0 HD2 PRO A 646 21.722 1.319 -8.874 1.00 1.34 H new ATOM 0 HD3 PRO A 646 20.970 0.866 -10.391 1.00 1.34 H new ATOM 1807 N MET A 647 21.583 -2.569 -6.940 1.00 1.33 N ATOM 1808 CA MET A 647 21.655 -3.600 -5.890 1.00 1.44 C ATOM 1809 C MET A 647 20.250 -3.979 -5.382 1.00 1.42 C ATOM 1810 O MET A 647 20.023 -5.107 -4.948 1.00 1.50 O ATOM 1811 CB MET A 647 22.607 -3.169 -4.763 1.00 1.51 C ATOM 1812 CG MET A 647 21.851 -2.450 -3.658 1.00 1.56 C ATOM 1813 SD MET A 647 22.811 -1.580 -2.413 1.00 1.62 S ATOM 1814 CE MET A 647 21.327 -0.963 -1.585 1.00 1.32 C ATOM 0 H MET A 647 21.817 -1.624 -6.635 1.00 1.33 H new ATOM 0 HA MET A 647 22.076 -4.507 -6.323 1.00 1.44 H new ATOM 0 HB2 MET A 647 23.112 -4.044 -4.354 1.00 1.51 H new ATOM 0 HB3 MET A 647 23.380 -2.514 -5.165 1.00 1.51 H new ATOM 0 HG2 MET A 647 21.179 -1.730 -4.126 1.00 1.56 H new ATOM 0 HG3 MET A 647 21.227 -3.184 -3.147 1.00 1.56 H new ATOM 0 HE1 MET A 647 21.615 -0.356 -0.726 1.00 1.32 H new ATOM 0 HE2 MET A 647 20.748 -0.356 -2.281 1.00 1.32 H new ATOM 0 HE3 MET A 647 20.722 -1.805 -1.248 1.00 1.32 H new ATOM 1824 N MET A 648 19.296 -3.044 -5.455 1.00 1.33 N ATOM 1825 CA MET A 648 17.881 -3.243 -5.128 1.00 1.38 C ATOM 1826 C MET A 648 17.127 -3.936 -6.280 1.00 1.58 C ATOM 1827 O MET A 648 16.262 -4.768 -6.002 1.00 1.73 O ATOM 1828 CB MET A 648 17.246 -1.904 -4.706 1.00 1.19 C ATOM 1829 CG MET A 648 17.590 -1.481 -3.273 1.00 1.19 C ATOM 1830 SD MET A 648 16.730 -2.409 -1.969 1.00 1.54 S ATOM 1831 CE MET A 648 18.133 -3.192 -1.130 1.00 2.55 C ATOM 0 H MET A 648 19.497 -2.090 -5.756 1.00 1.33 H new ATOM 0 HA MET A 648 17.803 -3.921 -4.278 1.00 1.38 H new ATOM 0 HB2 MET A 648 17.574 -1.124 -5.394 1.00 1.19 H new ATOM 0 HB3 MET A 648 16.163 -1.980 -4.803 1.00 1.19 H new ATOM 0 HG2 MET A 648 18.665 -1.590 -3.127 1.00 1.19 H new ATOM 0 HG3 MET A 648 17.358 -0.422 -3.157 1.00 1.19 H new ATOM 0 HE1 MET A 648 17.776 -4.027 -0.528 1.00 2.55 H new ATOM 0 HE2 MET A 648 18.843 -3.557 -1.872 1.00 2.55 H new ATOM 0 HE3 MET A 648 18.624 -2.463 -0.485 1.00 2.55 H new ATOM 1841 N ARG A 649 17.538 -3.729 -7.549 1.00 1.68 N ATOM 1842 CA ARG A 649 17.159 -4.575 -8.711 1.00 2.00 C ATOM 1843 C ARG A 649 17.342 -6.046 -8.369 1.00 2.04 C ATOM 1844 O ARG A 649 16.392 -6.812 -8.478 1.00 2.26 O ATOM 1845 CB ARG A 649 17.989 -4.185 -9.960 1.00 2.15 C ATOM 1846 CG ARG A 649 17.600 -4.746 -11.347 1.00 2.60 C ATOM 1847 CD ARG A 649 17.656 -6.265 -11.609 1.00 2.61 C ATOM 1848 NE ARG A 649 17.375 -6.522 -13.039 1.00 3.22 N ATOM 1849 CZ ARG A 649 17.551 -7.634 -13.733 1.00 3.85 C ATOM 1850 NH1 ARG A 649 17.877 -8.767 -13.190 1.00 4.15 N ATOM 1851 NH2 ARG A 649 17.377 -7.632 -15.022 1.00 4.79 N ATOM 0 H ARG A 649 18.154 -2.957 -7.804 1.00 1.68 H new ATOM 0 HA ARG A 649 16.107 -4.406 -8.942 1.00 2.00 H new ATOM 0 HB2 ARG A 649 17.974 -3.098 -10.033 1.00 2.15 H new ATOM 0 HB3 ARG A 649 19.021 -4.478 -9.769 1.00 2.15 H new ATOM 0 HG2 ARG A 649 16.581 -4.419 -11.555 1.00 2.60 H new ATOM 0 HG3 ARG A 649 18.245 -4.266 -12.083 1.00 2.60 H new ATOM 0 HD2 ARG A 649 18.638 -6.656 -11.343 1.00 2.61 H new ATOM 0 HD3 ARG A 649 16.927 -6.781 -10.984 1.00 2.61 H new ATOM 0 HE ARG A 649 16.993 -5.733 -13.561 1.00 3.22 H new ATOM 0 HH11 ARG A 649 18.010 -8.829 -12.181 1.00 4.15 H new ATOM 0 HH12 ARG A 649 18.000 -9.595 -13.773 1.00 4.15 H new ATOM 0 HH21 ARG A 649 17.105 -6.772 -15.499 1.00 4.79 H new ATOM 0 HH22 ARG A 649 17.513 -8.490 -15.556 1.00 4.79 H new ATOM 1865 N ARG A 650 18.535 -6.407 -7.885 1.00 1.89 N ATOM 1866 CA ARG A 650 18.907 -7.740 -7.385 1.00 1.93 C ATOM 1867 C ARG A 650 18.127 -8.135 -6.126 1.00 1.92 C ATOM 1868 O ARG A 650 17.549 -9.220 -6.082 1.00 2.08 O ATOM 1869 CB ARG A 650 20.432 -7.721 -7.184 1.00 1.92 C ATOM 1870 CG ARG A 650 21.030 -8.944 -6.472 1.00 2.11 C ATOM 1871 CD ARG A 650 22.561 -8.797 -6.372 1.00 2.57 C ATOM 1872 NE ARG A 650 23.203 -8.756 -7.700 1.00 3.98 N ATOM 1873 CZ ARG A 650 23.208 -9.717 -8.603 1.00 5.49 C ATOM 1874 NH1 ARG A 650 22.867 -10.941 -8.329 1.00 6.09 N ATOM 1875 NH2 ARG A 650 23.532 -9.436 -9.827 1.00 7.00 N ATOM 0 H ARG A 650 19.309 -5.745 -7.827 1.00 1.89 H new ATOM 0 HA ARG A 650 18.638 -8.515 -8.103 1.00 1.93 H new ATOM 0 HB2 ARG A 650 20.907 -7.625 -8.161 1.00 1.92 H new ATOM 0 HB3 ARG A 650 20.693 -6.829 -6.614 1.00 1.92 H new ATOM 0 HG2 ARG A 650 20.600 -9.042 -5.475 1.00 2.11 H new ATOM 0 HG3 ARG A 650 20.778 -9.853 -7.019 1.00 2.11 H new ATOM 0 HD2 ARG A 650 22.802 -7.886 -5.825 1.00 2.57 H new ATOM 0 HD3 ARG A 650 22.968 -9.630 -5.799 1.00 2.57 H new ATOM 0 HE ARG A 650 23.693 -7.896 -7.945 1.00 3.98 H new ATOM 0 HH11 ARG A 650 22.580 -11.191 -7.383 1.00 6.09 H new ATOM 0 HH12 ARG A 650 22.886 -11.652 -9.060 1.00 6.09 H new ATOM 0 HH21 ARG A 650 23.779 -8.480 -10.082 1.00 7.00 H new ATOM 0 HH22 ARG A 650 23.539 -10.171 -10.534 1.00 7.00 H new ATOM 1889 N ALA A 651 18.056 -7.252 -5.127 1.00 1.78 N ATOM 1890 CA ALA A 651 17.440 -7.543 -3.829 1.00 1.78 C ATOM 1891 C ALA A 651 15.955 -7.954 -3.890 1.00 1.81 C ATOM 1892 O ALA A 651 15.509 -8.644 -2.979 1.00 1.91 O ATOM 1893 CB ALA A 651 17.620 -6.345 -2.889 1.00 1.62 C ATOM 0 H ALA A 651 18.428 -6.305 -5.197 1.00 1.78 H new ATOM 0 HA ALA A 651 17.963 -8.419 -3.446 1.00 1.78 H new ATOM 0 HB1 ALA A 651 17.160 -6.566 -1.926 1.00 1.62 H new ATOM 0 HB2 ALA A 651 18.683 -6.150 -2.748 1.00 1.62 H new ATOM 0 HB3 ALA A 651 17.145 -5.466 -3.325 1.00 1.62 H new ATOM 1899 N PHE A 652 15.201 -7.566 -4.929 1.00 1.74 N ATOM 1900 CA PHE A 652 13.773 -7.908 -5.092 1.00 1.75 C ATOM 1901 C PHE A 652 13.457 -9.183 -5.884 1.00 1.89 C ATOM 1902 O PHE A 652 12.396 -9.785 -5.705 1.00 2.12 O ATOM 1903 CB PHE A 652 13.044 -6.723 -5.728 1.00 1.66 C ATOM 1904 CG PHE A 652 12.379 -5.872 -4.682 1.00 1.42 C ATOM 1905 CD1 PHE A 652 13.116 -4.887 -4.010 1.00 2.28 C ATOM 1906 CD2 PHE A 652 11.044 -6.130 -4.336 1.00 1.87 C ATOM 1907 CE1 PHE A 652 12.492 -4.118 -3.006 1.00 2.16 C ATOM 1908 CE2 PHE A 652 10.419 -5.365 -3.336 1.00 1.82 C ATOM 1909 CZ PHE A 652 11.137 -4.346 -2.684 1.00 1.14 C ATOM 0 H PHE A 652 15.568 -6.998 -5.693 1.00 1.74 H new ATOM 0 HA PHE A 652 13.424 -8.123 -4.082 1.00 1.75 H new ATOM 0 HB2 PHE A 652 13.752 -6.119 -6.296 1.00 1.66 H new ATOM 0 HB3 PHE A 652 12.297 -7.088 -6.433 1.00 1.66 H new ATOM 0 HD1 PHE A 652 14.153 -4.718 -4.259 1.00 2.28 H new ATOM 0 HD2 PHE A 652 10.497 -6.915 -4.837 1.00 1.87 H new ATOM 0 HE1 PHE A 652 13.051 -3.355 -2.484 1.00 2.16 H new ATOM 0 HE2 PHE A 652 9.391 -5.559 -3.069 1.00 1.82 H new ATOM 0 HZ PHE A 652 10.651 -3.737 -1.936 1.00 1.14 H new ATOM 1919 N GLU A 653 14.353 -9.626 -6.755 1.00 1.88 N ATOM 1920 CA GLU A 653 14.212 -10.890 -7.491 1.00 2.08 C ATOM 1921 C GLU A 653 14.754 -12.066 -6.671 1.00 2.20 C ATOM 1922 O GLU A 653 14.104 -13.109 -6.582 1.00 2.22 O ATOM 1923 CB GLU A 653 14.839 -10.787 -8.889 1.00 2.39 C ATOM 1924 CG GLU A 653 16.221 -10.129 -8.884 1.00 1.80 C ATOM 1925 CD GLU A 653 16.765 -9.945 -10.300 1.00 2.90 C ATOM 1926 OE1 GLU A 653 16.119 -9.240 -11.108 1.00 3.48 O ATOM 1927 OE2 GLU A 653 17.857 -10.475 -10.622 1.00 4.10 O ATOM 0 H GLU A 653 15.209 -9.118 -6.978 1.00 1.88 H new ATOM 0 HA GLU A 653 13.151 -11.088 -7.646 1.00 2.08 H new ATOM 0 HB2 GLU A 653 14.921 -11.786 -9.318 1.00 2.39 H new ATOM 0 HB3 GLU A 653 14.174 -10.216 -9.537 1.00 2.39 H new ATOM 0 HG2 GLU A 653 16.161 -9.160 -8.389 1.00 1.80 H new ATOM 0 HG3 GLU A 653 16.913 -10.741 -8.305 1.00 1.80 H new ATOM 1934 N THR A 654 15.860 -11.833 -5.954 1.00 2.39 N ATOM 1935 CA THR A 654 16.603 -12.805 -5.127 1.00 2.65 C ATOM 1936 C THR A 654 15.845 -13.256 -3.867 1.00 2.62 C ATOM 1937 O THR A 654 16.276 -14.141 -3.131 1.00 2.93 O ATOM 1938 CB THR A 654 17.947 -12.163 -4.755 1.00 2.91 C ATOM 1939 OG1 THR A 654 18.932 -13.140 -4.526 1.00 3.55 O ATOM 1940 CG2 THR A 654 17.835 -11.253 -3.531 1.00 2.59 C ATOM 0 H THR A 654 16.289 -10.908 -5.931 1.00 2.39 H new ATOM 0 HA THR A 654 16.743 -13.715 -5.710 1.00 2.65 H new ATOM 0 HB THR A 654 18.240 -11.550 -5.608 1.00 2.91 H new ATOM 0 HG1 THR A 654 19.778 -12.703 -4.293 1.00 3.55 H new ATOM 0 HG21 THR A 654 18.811 -10.822 -3.307 1.00 2.59 H new ATOM 0 HG22 THR A 654 17.124 -10.453 -3.736 1.00 2.59 H new ATOM 0 HG23 THR A 654 17.490 -11.834 -2.676 1.00 2.59 H new ATOM 1948 N VAL A 655 14.716 -12.599 -3.601 1.00 2.44 N ATOM 1949 CA VAL A 655 13.815 -12.799 -2.461 1.00 2.48 C ATOM 1950 C VAL A 655 12.491 -13.415 -2.903 1.00 2.41 C ATOM 1951 O VAL A 655 11.998 -14.342 -2.266 1.00 2.62 O ATOM 1952 CB VAL A 655 13.622 -11.465 -1.713 1.00 2.49 C ATOM 1953 CG1 VAL A 655 13.069 -10.367 -2.614 1.00 2.22 C ATOM 1954 CG2 VAL A 655 12.732 -11.621 -0.480 1.00 2.69 C ATOM 0 H VAL A 655 14.381 -11.860 -4.219 1.00 2.44 H new ATOM 0 HA VAL A 655 14.266 -13.510 -1.769 1.00 2.48 H new ATOM 0 HB VAL A 655 14.617 -11.165 -1.385 1.00 2.49 H new ATOM 0 HG11 VAL A 655 12.952 -9.449 -2.039 1.00 2.22 H new ATOM 0 HG12 VAL A 655 13.759 -10.192 -3.440 1.00 2.22 H new ATOM 0 HG13 VAL A 655 12.100 -10.674 -3.009 1.00 2.22 H new ATOM 0 HG21 VAL A 655 12.624 -10.656 0.015 1.00 2.69 H new ATOM 0 HG22 VAL A 655 11.750 -11.985 -0.784 1.00 2.69 H new ATOM 0 HG23 VAL A 655 13.186 -12.333 0.209 1.00 2.69 H new ATOM 1964 N ALA A 656 11.945 -12.978 -4.039 1.00 2.23 N ATOM 1965 CA ALA A 656 10.705 -13.517 -4.598 1.00 2.31 C ATOM 1966 C ALA A 656 10.819 -15.019 -4.920 1.00 2.58 C ATOM 1967 O ALA A 656 9.838 -15.752 -4.782 1.00 2.78 O ATOM 1968 CB ALA A 656 10.330 -12.692 -5.830 1.00 2.29 C ATOM 0 H ALA A 656 12.355 -12.233 -4.602 1.00 2.23 H new ATOM 0 HA ALA A 656 9.911 -13.438 -3.855 1.00 2.31 H new ATOM 0 HB1 ALA A 656 9.407 -13.080 -6.261 1.00 2.29 H new ATOM 0 HB2 ALA A 656 10.186 -11.651 -5.541 1.00 2.29 H new ATOM 0 HB3 ALA A 656 11.130 -12.756 -6.568 1.00 2.29 H new ATOM 1974 N ILE A 657 12.028 -15.497 -5.240 1.00 2.75 N ATOM 1975 CA ILE A 657 12.324 -16.922 -5.452 1.00 3.08 C ATOM 1976 C ILE A 657 12.184 -17.806 -4.198 1.00 3.12 C ATOM 1977 O ILE A 657 12.211 -19.026 -4.329 1.00 3.54 O ATOM 1978 CB ILE A 657 13.681 -17.122 -6.171 1.00 3.23 C ATOM 1979 CG1 ILE A 657 14.934 -16.508 -5.506 1.00 4.26 C ATOM 1980 CG2 ILE A 657 13.588 -16.548 -7.591 1.00 3.86 C ATOM 1981 CD1 ILE A 657 15.259 -17.063 -4.121 1.00 4.83 C ATOM 0 H ILE A 657 12.843 -14.895 -5.361 1.00 2.75 H new ATOM 0 HA ILE A 657 11.538 -17.280 -6.117 1.00 3.08 H new ATOM 0 HB ILE A 657 13.832 -18.201 -6.134 1.00 3.23 H new ATOM 0 HG12 ILE A 657 15.792 -16.672 -6.158 1.00 4.26 H new ATOM 0 HG13 ILE A 657 14.795 -15.430 -5.427 1.00 4.26 H new ATOM 0 HG21 ILE A 657 14.541 -16.686 -8.102 1.00 3.86 H new ATOM 0 HG22 ILE A 657 12.802 -17.065 -8.142 1.00 3.86 H new ATOM 0 HG23 ILE A 657 13.355 -15.485 -7.539 1.00 3.86 H new ATOM 0 HD11 ILE A 657 16.153 -16.574 -3.734 1.00 4.83 H new ATOM 0 HD12 ILE A 657 14.422 -16.875 -3.448 1.00 4.83 H new ATOM 0 HD13 ILE A 657 15.434 -18.136 -4.191 1.00 4.83 H new ATOM 1993 N ASP A 658 11.995 -17.249 -2.996 1.00 2.86 N ATOM 1994 CA ASP A 658 11.855 -18.027 -1.749 1.00 3.08 C ATOM 1995 C ASP A 658 10.784 -17.492 -0.778 1.00 3.09 C ATOM 1996 O ASP A 658 10.279 -18.243 0.054 1.00 3.38 O ATOM 1997 CB ASP A 658 13.229 -18.083 -1.065 1.00 3.23 C ATOM 1998 CG ASP A 658 13.336 -19.220 -0.053 1.00 3.76 C ATOM 1999 OD1 ASP A 658 13.563 -20.372 -0.486 1.00 4.73 O ATOM 2000 OD2 ASP A 658 13.298 -18.960 1.171 1.00 3.87 O ATOM 0 H ASP A 658 11.934 -16.241 -2.855 1.00 2.86 H new ATOM 0 HA ASP A 658 11.505 -19.022 -2.023 1.00 3.08 H new ATOM 0 HB2 ASP A 658 14.003 -18.202 -1.823 1.00 3.23 H new ATOM 0 HB3 ASP A 658 13.419 -17.135 -0.562 1.00 3.23 H new ATOM 2005 N ARG A 659 10.414 -16.209 -0.868 1.00 2.92 N ATOM 2006 CA ARG A 659 9.358 -15.584 -0.051 1.00 3.11 C ATOM 2007 C ARG A 659 7.954 -15.979 -0.517 1.00 3.44 C ATOM 2008 O ARG A 659 7.071 -16.164 0.320 1.00 3.68 O ATOM 2009 CB ARG A 659 9.571 -14.060 -0.076 1.00 3.01 C ATOM 2010 CG ARG A 659 8.652 -13.289 0.885 1.00 3.59 C ATOM 2011 CD ARG A 659 8.942 -11.788 0.794 1.00 3.62 C ATOM 2012 NE ARG A 659 8.264 -11.032 1.863 1.00 4.52 N ATOM 2013 CZ ARG A 659 8.828 -10.250 2.767 1.00 5.85 C ATOM 2014 NH1 ARG A 659 10.117 -10.130 2.867 1.00 6.72 N ATOM 2015 NH2 ARG A 659 8.082 -9.585 3.592 1.00 6.76 N ATOM 0 H ARG A 659 10.848 -15.559 -1.524 1.00 2.92 H new ATOM 0 HA ARG A 659 9.431 -15.945 0.975 1.00 3.11 H new ATOM 0 HB2 ARG A 659 10.609 -13.843 0.177 1.00 3.01 H new ATOM 0 HB3 ARG A 659 9.407 -13.696 -1.090 1.00 3.01 H new ATOM 0 HG2 ARG A 659 7.608 -13.482 0.637 1.00 3.59 H new ATOM 0 HG3 ARG A 659 8.806 -13.637 1.907 1.00 3.59 H new ATOM 0 HD2 ARG A 659 10.017 -11.621 0.857 1.00 3.62 H new ATOM 0 HD3 ARG A 659 8.618 -11.414 -0.177 1.00 3.62 H new ATOM 0 HE ARG A 659 7.249 -11.122 1.910 1.00 4.52 H new ATOM 0 HH11 ARG A 659 10.728 -10.648 2.236 1.00 6.72 H new ATOM 0 HH12 ARG A 659 10.519 -9.517 3.577 1.00 6.72 H new ATOM 0 HH21 ARG A 659 7.067 -9.667 3.541 1.00 6.76 H new ATOM 0 HH22 ARG A 659 8.510 -8.980 4.292 1.00 6.76 H new ATOM 2029 N LEU A 660 7.762 -16.121 -1.833 1.00 3.65 N ATOM 2030 CA LEU A 660 6.479 -16.437 -2.474 1.00 4.16 C ATOM 2031 C LEU A 660 6.048 -17.875 -2.134 1.00 4.47 C ATOM 2032 O LEU A 660 5.074 -18.077 -1.408 1.00 4.85 O ATOM 2033 CB LEU A 660 6.636 -16.164 -3.988 1.00 4.50 C ATOM 2034 CG LEU A 660 5.341 -16.054 -4.812 1.00 5.03 C ATOM 2035 CD1 LEU A 660 5.702 -15.685 -6.252 1.00 5.28 C ATOM 2036 CD2 LEU A 660 4.514 -17.339 -4.852 1.00 5.25 C ATOM 0 H LEU A 660 8.522 -16.016 -2.505 1.00 3.65 H new ATOM 0 HA LEU A 660 5.672 -15.807 -2.100 1.00 4.16 H new ATOM 0 HB2 LEU A 660 7.196 -15.237 -4.110 1.00 4.50 H new ATOM 0 HB3 LEU A 660 7.244 -16.961 -4.416 1.00 4.50 H new ATOM 0 HG LEU A 660 4.733 -15.294 -4.322 1.00 5.03 H new ATOM 0 HD11 LEU A 660 4.792 -15.604 -6.846 1.00 5.28 H new ATOM 0 HD12 LEU A 660 6.228 -14.730 -6.262 1.00 5.28 H new ATOM 0 HD13 LEU A 660 6.344 -16.457 -6.675 1.00 5.28 H new ATOM 0 HD21 LEU A 660 3.619 -17.177 -5.452 1.00 5.25 H new ATOM 0 HD22 LEU A 660 5.107 -18.140 -5.294 1.00 5.25 H new ATOM 0 HD23 LEU A 660 4.226 -17.618 -3.838 1.00 5.25 H new ATOM 2048 N ASP A 661 6.837 -18.851 -2.581 1.00 4.70 N ATOM 2049 CA ASP A 661 6.806 -20.259 -2.178 1.00 5.21 C ATOM 2050 C ASP A 661 8.236 -20.671 -1.794 1.00 5.85 C ATOM 2051 O ASP A 661 9.171 -20.404 -2.558 1.00 6.66 O ATOM 2052 CB ASP A 661 6.304 -21.140 -3.337 1.00 6.18 C ATOM 2053 CG ASP A 661 4.786 -21.129 -3.516 1.00 7.36 C ATOM 2054 OD1 ASP A 661 4.068 -21.516 -2.568 1.00 7.56 O ATOM 2055 OD2 ASP A 661 4.282 -20.829 -4.624 1.00 8.60 O ATOM 0 H ASP A 661 7.560 -18.670 -3.277 1.00 4.70 H new ATOM 0 HA ASP A 661 6.128 -20.390 -1.335 1.00 5.21 H new ATOM 0 HB2 ASP A 661 6.771 -20.804 -4.263 1.00 6.18 H new ATOM 0 HB3 ASP A 661 6.632 -22.166 -3.168 1.00 6.18 H new ATOM 2060 N ARG A 662 8.429 -21.323 -0.639 1.00 6.25 N ATOM 2061 CA ARG A 662 9.772 -21.686 -0.155 1.00 7.63 C ATOM 2062 C ARG A 662 10.415 -22.825 -0.943 1.00 8.63 C ATOM 2063 O ARG A 662 11.589 -22.718 -1.280 1.00 10.13 O ATOM 2064 CB ARG A 662 9.729 -21.982 1.350 1.00 8.26 C ATOM 2065 CG ARG A 662 9.702 -20.684 2.169 1.00 8.72 C ATOM 2066 CD ARG A 662 9.433 -20.999 3.640 1.00 9.43 C ATOM 2067 NE ARG A 662 9.774 -19.861 4.515 1.00 10.52 N ATOM 2068 CZ ARG A 662 9.146 -19.473 5.607 1.00 11.29 C ATOM 2069 NH1 ARG A 662 7.999 -19.946 5.991 1.00 11.17 N ATOM 2070 NH2 ARG A 662 9.692 -18.570 6.359 1.00 12.58 N ATOM 0 H ARG A 662 7.671 -21.611 -0.020 1.00 6.25 H new ATOM 0 HA ARG A 662 10.418 -20.824 -0.324 1.00 7.63 H new ATOM 0 HB2 ARG A 662 8.847 -22.580 1.581 1.00 8.26 H new ATOM 0 HB3 ARG A 662 10.599 -22.575 1.632 1.00 8.26 H new ATOM 0 HG2 ARG A 662 10.653 -20.161 2.069 1.00 8.72 H new ATOM 0 HG3 ARG A 662 8.930 -20.018 1.784 1.00 8.72 H new ATOM 0 HD2 ARG A 662 8.382 -21.256 3.770 1.00 9.43 H new ATOM 0 HD3 ARG A 662 10.014 -21.873 3.937 1.00 9.43 H new ATOM 0 HE ARG A 662 10.589 -19.311 4.244 1.00 10.52 H new ATOM 0 HH11 ARG A 662 7.531 -20.662 5.435 1.00 11.17 H new ATOM 0 HH12 ARG A 662 7.567 -19.602 6.848 1.00 11.17 H new ATOM 0 HH21 ARG A 662 10.595 -18.170 6.102 1.00 12.58 H new ATOM 0 HH22 ARG A 662 9.219 -18.259 7.207 1.00 12.58 H new ATOM 2084 N ILE A 663 9.678 -23.881 -1.301 1.00 8.32 N ATOM 2085 CA ILE A 663 10.151 -25.073 -2.047 1.00 9.68 C ATOM 2086 C ILE A 663 11.170 -25.957 -1.291 1.00 10.99 C ATOM 2087 O ILE A 663 11.117 -27.182 -1.408 1.00 11.68 O ATOM 2088 CB ILE A 663 10.651 -24.672 -3.462 1.00 10.37 C ATOM 2089 CG1 ILE A 663 9.712 -23.721 -4.230 1.00 9.52 C ATOM 2090 CG2 ILE A 663 10.947 -25.904 -4.323 1.00 11.91 C ATOM 2091 CD1 ILE A 663 8.286 -24.233 -4.415 1.00 9.46 C ATOM 0 H ILE A 663 8.686 -23.940 -1.072 1.00 8.32 H new ATOM 0 HA ILE A 663 9.279 -25.718 -2.153 1.00 9.68 H new ATOM 0 HB ILE A 663 11.570 -24.117 -3.276 1.00 10.37 H new ATOM 0 HG12 ILE A 663 9.674 -22.768 -3.703 1.00 9.52 H new ATOM 0 HG13 ILE A 663 10.142 -23.525 -5.212 1.00 9.52 H new ATOM 0 HG21 ILE A 663 11.295 -25.586 -5.306 1.00 11.91 H new ATOM 0 HG22 ILE A 663 11.718 -26.507 -3.843 1.00 11.91 H new ATOM 0 HG23 ILE A 663 10.039 -26.497 -4.434 1.00 11.91 H new ATOM 0 HD11 ILE A 663 7.703 -23.495 -4.966 1.00 9.46 H new ATOM 0 HD12 ILE A 663 8.305 -25.170 -4.972 1.00 9.46 H new ATOM 0 HD13 ILE A 663 7.830 -24.401 -3.439 1.00 9.46 H new ATOM 2103 N GLY A 664 12.054 -25.372 -0.477 1.00 11.68 N ATOM 2104 CA GLY A 664 12.964 -26.072 0.438 1.00 13.17 C ATOM 2105 C GLY A 664 14.389 -26.217 -0.097 1.00 14.49 C ATOM 2106 O GLY A 664 14.831 -27.324 -0.424 1.00 15.67 O ATOM 0 H GLY A 664 12.160 -24.358 -0.435 1.00 11.68 H new ATOM 0 HA2 GLY A 664 12.995 -25.535 1.386 1.00 13.17 H new ATOM 0 HA3 GLY A 664 12.562 -27.063 0.647 1.00 13.17 H new ATOM 2110 N LYS A 665 15.111 -25.094 -0.189 1.00 14.57 N ATOM 2111 CA LYS A 665 16.490 -24.996 -0.713 1.00 15.99 C ATOM 2112 C LYS A 665 17.289 -23.870 -0.031 1.00 17.02 C ATOM 2113 O LYS A 665 16.726 -23.113 0.766 1.00 16.97 O ATOM 2114 CB LYS A 665 16.446 -24.873 -2.255 1.00 15.88 C ATOM 2115 CG LYS A 665 16.159 -23.497 -2.849 1.00 15.32 C ATOM 2116 CD LYS A 665 14.778 -22.986 -2.451 1.00 14.07 C ATOM 2117 CE LYS A 665 14.334 -21.979 -3.495 1.00 14.43 C ATOM 2118 NZ LYS A 665 13.099 -21.303 -3.065 1.00 13.56 N ATOM 0 H LYS A 665 14.742 -24.191 0.109 1.00 14.57 H new ATOM 0 HA LYS A 665 17.033 -25.909 -0.469 1.00 15.99 H new ATOM 0 HB2 LYS A 665 17.405 -25.214 -2.646 1.00 15.88 H new ATOM 0 HB3 LYS A 665 15.687 -25.563 -2.625 1.00 15.88 H new ATOM 0 HG2 LYS A 665 16.919 -22.791 -2.514 1.00 15.32 H new ATOM 0 HG3 LYS A 665 16.229 -23.548 -3.936 1.00 15.32 H new ATOM 0 HD2 LYS A 665 14.069 -23.811 -2.391 1.00 14.07 H new ATOM 0 HD3 LYS A 665 14.812 -22.523 -1.465 1.00 14.07 H new ATOM 0 HE2 LYS A 665 15.121 -21.243 -3.657 1.00 14.43 H new ATOM 0 HE3 LYS A 665 14.168 -22.483 -4.447 1.00 14.43 H new ATOM 0 HZ1 LYS A 665 12.734 -20.719 -3.844 1.00 13.56 H new ATOM 0 HZ2 LYS A 665 12.387 -22.014 -2.803 1.00 13.56 H new ATOM 0 HZ3 LYS A 665 13.302 -20.698 -2.244 1.00 13.56 H new ATOM 2132 N LYS A 666 18.585 -23.735 -0.331 1.00 18.19 N ATOM 2133 CA LYS A 666 19.497 -22.715 0.234 1.00 19.49 C ATOM 2134 C LYS A 666 19.972 -21.712 -0.824 1.00 20.25 C ATOM 2135 O LYS A 666 20.056 -22.032 -2.012 1.00 20.50 O ATOM 2136 CB LYS A 666 20.701 -23.398 0.914 1.00 20.63 C ATOM 2137 CG LYS A 666 20.338 -24.365 2.056 1.00 20.74 C ATOM 2138 CD LYS A 666 19.746 -23.715 3.313 1.00 20.73 C ATOM 2139 CE LYS A 666 20.820 -22.980 4.123 1.00 22.05 C ATOM 2140 NZ LYS A 666 20.252 -22.425 5.371 1.00 22.24 N ATOM 0 H LYS A 666 19.052 -24.351 -0.997 1.00 18.19 H new ATOM 0 HA LYS A 666 18.937 -22.151 0.979 1.00 19.49 H new ATOM 0 HB2 LYS A 666 21.264 -23.946 0.158 1.00 20.63 H new ATOM 0 HB3 LYS A 666 21.363 -22.627 1.307 1.00 20.63 H new ATOM 0 HG2 LYS A 666 19.624 -25.096 1.676 1.00 20.74 H new ATOM 0 HG3 LYS A 666 21.235 -24.915 2.341 1.00 20.74 H new ATOM 0 HD2 LYS A 666 18.961 -23.015 3.027 1.00 20.73 H new ATOM 0 HD3 LYS A 666 19.280 -24.480 3.934 1.00 20.73 H new ATOM 0 HE2 LYS A 666 21.633 -23.665 4.362 1.00 22.05 H new ATOM 0 HE3 LYS A 666 21.246 -22.176 3.524 1.00 22.05 H new ATOM 0 HZ1 LYS A 666 20.998 -21.932 5.903 1.00 22.24 H new ATOM 0 HZ2 LYS A 666 19.492 -21.755 5.138 1.00 22.24 H new ATOM 0 HZ3 LYS A 666 19.867 -23.198 5.951 1.00 22.24 H new ATOM 2154 N ASN A 667 20.313 -20.504 -0.380 1.00 20.87 N ATOM 2155 CA ASN A 667 20.853 -19.411 -1.198 1.00 21.85 C ATOM 2156 C ASN A 667 22.009 -18.700 -0.466 1.00 23.21 C ATOM 2157 O ASN A 667 22.341 -19.059 0.666 1.00 23.56 O ATOM 2158 CB ASN A 667 19.701 -18.450 -1.560 1.00 21.56 C ATOM 2159 CG ASN A 667 19.089 -17.761 -0.350 1.00 21.63 C ATOM 2160 OD1 ASN A 667 19.643 -16.832 0.217 1.00 22.33 O ATOM 2161 ND2 ASN A 667 17.966 -18.235 0.131 1.00 21.17 N ATOM 0 H ASN A 667 20.218 -20.245 0.602 1.00 20.87 H new ATOM 0 HA ASN A 667 21.276 -19.804 -2.122 1.00 21.85 H new ATOM 0 HB2 ASN A 667 20.072 -17.693 -2.251 1.00 21.56 H new ATOM 0 HB3 ASN A 667 18.924 -19.007 -2.084 1.00 21.56 H new ATOM 0 HD21 ASN A 667 17.560 -17.828 0.974 1.00 21.17 H new ATOM 0 HD22 ASN A 667 17.498 -19.011 -0.337 1.00 21.17 H new ATOM 2168 N SER A 668 22.627 -17.685 -1.078 1.00 24.16 N ATOM 2169 CA SER A 668 23.576 -16.808 -0.377 1.00 25.54 C ATOM 2170 C SER A 668 22.855 -15.947 0.669 1.00 25.63 C ATOM 2171 O SER A 668 22.870 -16.270 1.863 1.00 25.72 O ATOM 2172 CB SER A 668 24.403 -15.967 -1.365 1.00 26.49 C ATOM 2173 OG SER A 668 23.585 -15.253 -2.278 1.00 26.02 O ATOM 0 H SER A 668 22.488 -17.448 -2.060 1.00 24.16 H new ATOM 0 HA SER A 668 24.286 -17.436 0.161 1.00 25.54 H new ATOM 0 HB2 SER A 668 25.024 -15.264 -0.810 1.00 26.49 H new ATOM 0 HB3 SER A 668 25.078 -16.620 -1.919 1.00 26.49 H new ATOM 0 HG SER A 668 24.151 -14.732 -2.885 1.00 26.02 H new ATOM 2179 N ILE A 669 22.198 -14.880 0.217 1.00 25.78 N ATOM 2180 CA ILE A 669 21.495 -13.874 1.023 1.00 26.18 C ATOM 2181 C ILE A 669 20.217 -13.407 0.311 1.00 25.49 C ATOM 2182 O ILE A 669 20.134 -13.419 -0.924 1.00 25.10 O ATOM 2183 CB ILE A 669 22.427 -12.682 1.362 1.00 27.69 C ATOM 2184 CG1 ILE A 669 22.942 -11.957 0.099 1.00 28.11 C ATOM 2185 CG2 ILE A 669 23.581 -13.163 2.267 1.00 28.55 C ATOM 2186 CD1 ILE A 669 23.851 -10.762 0.404 1.00 29.67 C ATOM 0 H ILE A 669 22.137 -14.680 -0.781 1.00 25.78 H new ATOM 0 HA ILE A 669 21.201 -14.335 1.966 1.00 26.18 H new ATOM 0 HB ILE A 669 21.844 -11.940 1.908 1.00 27.69 H new ATOM 0 HG12 ILE A 669 23.487 -12.669 -0.521 1.00 28.11 H new ATOM 0 HG13 ILE A 669 22.089 -11.613 -0.486 1.00 28.11 H new ATOM 0 HG21 ILE A 669 24.233 -12.322 2.503 1.00 28.55 H new ATOM 0 HG22 ILE A 669 23.172 -13.575 3.190 1.00 28.55 H new ATOM 0 HG23 ILE A 669 24.154 -13.932 1.749 1.00 28.55 H new ATOM 0 HD11 ILE A 669 24.174 -10.303 -0.530 1.00 29.67 H new ATOM 0 HD12 ILE A 669 23.303 -10.030 0.998 1.00 29.67 H new ATOM 0 HD13 ILE A 669 24.724 -11.102 0.962 1.00 29.67 H new ATOM 2198 N LEU A 670 19.222 -12.976 1.087 1.00 25.57 N ATOM 2199 CA LEU A 670 17.938 -12.460 0.589 1.00 25.26 C ATOM 2200 C LEU A 670 17.341 -11.394 1.514 1.00 26.10 C ATOM 2201 O LEU A 670 17.621 -11.372 2.714 1.00 26.85 O ATOM 2202 CB LEU A 670 16.939 -13.608 0.315 1.00 24.41 C ATOM 2203 CG LEU A 670 16.194 -14.219 1.523 1.00 24.27 C ATOM 2204 CD1 LEU A 670 15.157 -15.221 1.013 1.00 23.69 C ATOM 2205 CD2 LEU A 670 17.119 -14.954 2.492 1.00 24.52 C ATOM 0 H LEU A 670 19.284 -12.974 2.105 1.00 25.57 H new ATOM 0 HA LEU A 670 18.140 -11.966 -0.361 1.00 25.26 H new ATOM 0 HB2 LEU A 670 16.192 -13.241 -0.388 1.00 24.41 H new ATOM 0 HB3 LEU A 670 17.480 -14.411 -0.185 1.00 24.41 H new ATOM 0 HG LEU A 670 15.735 -13.390 2.062 1.00 24.27 H new ATOM 0 HD11 LEU A 670 14.626 -15.658 1.859 1.00 23.69 H new ATOM 0 HD12 LEU A 670 14.446 -14.710 0.363 1.00 23.69 H new ATOM 0 HD13 LEU A 670 15.658 -16.010 0.453 1.00 23.69 H new ATOM 0 HD21 LEU A 670 16.534 -15.359 3.317 1.00 24.52 H new ATOM 0 HD22 LEU A 670 17.621 -15.768 1.969 1.00 24.52 H new ATOM 0 HD23 LEU A 670 17.863 -14.260 2.882 1.00 24.52 H new ATOM 2217 N LEU A 671 16.492 -10.526 0.960 1.00 26.16 N ATOM 2218 CA LEU A 671 15.809 -9.467 1.706 1.00 27.11 C ATOM 2219 C LEU A 671 14.830 -10.043 2.750 1.00 27.07 C ATOM 2220 O LEU A 671 14.091 -10.986 2.465 1.00 26.12 O ATOM 2221 CB LEU A 671 15.140 -8.518 0.692 1.00 27.18 C ATOM 2222 CG LEU A 671 14.385 -7.314 1.288 1.00 28.19 C ATOM 2223 CD1 LEU A 671 15.262 -6.474 2.219 1.00 29.58 C ATOM 2224 CD2 LEU A 671 13.897 -6.424 0.142 1.00 28.33 C ATOM 0 H LEU A 671 16.256 -10.539 -0.032 1.00 26.16 H new ATOM 0 HA LEU A 671 16.528 -8.893 2.291 1.00 27.11 H new ATOM 0 HB2 LEU A 671 15.908 -8.141 0.016 1.00 27.18 H new ATOM 0 HB3 LEU A 671 14.441 -9.097 0.089 1.00 27.18 H new ATOM 0 HG LEU A 671 13.554 -7.704 1.876 1.00 28.19 H new ATOM 0 HD11 LEU A 671 14.681 -5.639 2.611 1.00 29.58 H new ATOM 0 HD12 LEU A 671 15.612 -7.093 3.045 1.00 29.58 H new ATOM 0 HD13 LEU A 671 16.119 -6.091 1.664 1.00 29.58 H new ATOM 0 HD21 LEU A 671 13.360 -5.567 0.550 1.00 28.33 H new ATOM 0 HD22 LEU A 671 14.752 -6.075 -0.437 1.00 28.33 H new ATOM 0 HD23 LEU A 671 13.231 -6.995 -0.504 1.00 28.33 H new ATOM 2236 N HIS A 672 14.851 -9.443 3.943 1.00 28.31 N ATOM 2237 CA HIS A 672 14.138 -9.792 5.183 1.00 28.91 C ATOM 2238 C HIS A 672 12.645 -10.117 5.009 1.00 28.37 C ATOM 2239 O HIS A 672 12.262 -11.311 5.116 1.00 27.91 O ATOM 2240 CB HIS A 672 14.362 -8.596 6.123 1.00 30.41 C ATOM 2241 CG HIS A 672 14.005 -8.825 7.572 1.00 31.47 C ATOM 2242 ND1 HIS A 672 12.759 -9.092 8.095 1.00 31.57 N ATOM 2243 CD2 HIS A 672 14.850 -8.671 8.636 1.00 32.74 C ATOM 2244 CE1 HIS A 672 12.851 -9.095 9.433 1.00 32.88 C ATOM 2245 NE2 HIS A 672 14.113 -8.833 9.818 1.00 33.61 N ATOM 0 H HIS A 672 15.427 -8.613 4.083 1.00 28.31 H new ATOM 0 HA HIS A 672 14.534 -10.726 5.583 1.00 28.91 H new ATOM 0 HB2 HIS A 672 15.411 -8.306 6.068 1.00 30.41 H new ATOM 0 HB3 HIS A 672 13.779 -7.753 5.753 1.00 30.41 H new ATOM 0 HD2 HIS A 672 15.907 -8.460 8.576 1.00 32.74 H new ATOM 0 HE1 HIS A 672 12.028 -9.282 10.107 1.00 32.88 H new ATOM 0 HE2 HIS A 672 14.462 -8.766 10.774 1.00 33.61 H new TER 2253 HIS A 672