USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1170 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 64 LYS NZ :NH3+ -177:sc= -1.34 (180deg=-1.38) USER MOD Set 1.2: B 658 GLN : amide:sc= -0.589 K(o=-1.9,f=-4.7!) USER MOD Set 2.1: A 75 ASN :FLIP amide:sc= -0.822 F(o=-1.8,f=-0.94) USER MOD Set 2.2: B 648 THR OG1 : rot 180:sc= -0.115 USER MOD Set 3.1: B 637 GLN : amide:sc= -0.496 X(o=-2.1,f=-2.4) USER MOD Set 3.2: B 641 GLN : amide:sc= -1.6 K(o=-2.1,f=-3!) USER MOD Set 4.1: A 66 ASN : amide:sc= -0.398 K(o=0.84,f=-1.9!) USER MOD Set 4.2: A 67 THR OG1 : rot 72:sc= 1.23 USER MOD Set 5.1: A 40 GLN :FLIP amide:sc= 2.04 F(o=-1.3,f=2) USER MOD Set 5.2: B 677 HIS : no HD1:sc=-0.00117 X(o=2,f=2) USER MOD Set 6.1: A 37 MET CE :methyl -132:sc= 0 (180deg=-0.00679) USER MOD Set 6.2: A 55 HIS :FLIP no HE2:sc= -0.139 F(o=-1.6,f=-0.14) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.0282 (180deg=-0.453) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0435 USER MOD Single : A 7 HIS : no HD1:sc= -0.0552 X(o=-0.055,f=-0.026) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot -120:sc= -0.0148 USER MOD Single : A 21 LYS NZ :NH3+ 151:sc= -0.164 (180deg=-1.35) USER MOD Single : A 25 MET CE :methyl -125:sc= -2.19! (180deg=-6.59!) USER MOD Single : A 27 HIS : no HD1:sc= -0.919 X(o=-0.92,f=-0.66) USER MOD Single : A 28 THR OG1 : rot 78:sc= -1.16 USER MOD Single : A 31 GLN : amide:sc= -0.24 K(o=-0.24,f=-0.8) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0064) USER MOD Single : A 44 GLN : amide:sc= -0.0545 X(o=-0.054,f=-0.31) USER MOD Single : A 47 SER OG : rot 65:sc= -0.0892 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -0.226 K(o=-0.23,f=-1.5!) USER MOD Single : A 73 GLN : amide:sc= -0.761 K(o=-0.76,f=-1.8!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 105:sc= 0.00872 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.411 USER MOD Single : B 601 SER OG : rot 180:sc= 0 USER MOD Single : B 602 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 603 SER OG : rot 180:sc= -0.334 USER MOD Single : B 604 GLN : amide:sc= 0.00721 X(o=0.0072,f=0) USER MOD Single : B 606 MET CE :methyl 150:sc= -0.119 (180deg=-0.921) USER MOD Single : B 607 TYR OH : rot 180:sc= -0.0394 USER MOD Single : B 608 ASN : amide:sc= -0.0604 X(o=-0.06,f=-0.37) USER MOD Single : B 609 TYR OH : rot 180:sc= 0 USER MOD Single : B 612 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 615 HIS : no HD1:sc= 0 X(o=0,f=-0.003) USER MOD Single : B 619 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 622 TYR OH : rot 180:sc= 0 USER MOD Single : B 625 THR OG1 : rot 87:sc= 0.234 USER MOD Single : B 627 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : B 628 SER OG : rot 180:sc= 0 USER MOD Single : B 642 SER OG : rot 180:sc= 0.0463 USER MOD Single : B 645 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 651 THR OG1 : rot 180:sc= 0 USER MOD Single : B 652 TYR OH : rot 180:sc= 0 USER MOD Single : B 653 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 656 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 660 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 661 GLN : amide:sc= -0.426 K(o=-0.43,f=-1.8) USER MOD Single : B 663 MET CE :methyl -160:sc= -1.67 (180deg=-3.27!) USER MOD Single : B 670 TYR OH : rot 180:sc= -1.2 USER MOD Single : B 671 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : B 673 MET CE :methyl -157:sc= -0.196 (180deg=-0.669) USER MOD Single : B 674 SER OG : rot 180:sc= 0 USER MOD Single : B 675 SER OG : rot 82:sc= 1.1 USER MOD Single : B 676 THR OG1 : rot 180:sc= 0.0554 USER MOD Single : B 680 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 681 THR OG1 : rot 180:sc= 0.033 USER MOD Single : B 682 MET CE :methyl 162:sc= -1.87 (180deg=-3.52!) USER MOD Single : B 684 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 685 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 689 THR OG1 : rot 180:sc= 0 USER MOD Single : B 694 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -19.277 -2.148 2.370 1.00 0.00 N ATOM 2 CA MET A 1 -20.304 -1.481 3.163 1.00 0.00 C ATOM 3 C MET A 1 -21.074 -0.473 2.317 1.00 0.00 C ATOM 4 O MET A 1 -20.483 0.288 1.550 1.00 0.00 O ATOM 5 CB MET A 1 -19.672 -0.778 4.366 1.00 0.00 C ATOM 6 CG MET A 1 -18.941 -1.722 5.307 1.00 0.00 C ATOM 7 SD MET A 1 -18.089 -0.854 6.639 1.00 0.00 S ATOM 8 CE MET A 1 -19.449 -0.536 7.759 1.00 0.00 C ATOM 0 H1 MET A 1 -18.978 -3.020 2.852 1.00 0.00 H new ATOM 0 H2 MET A 1 -19.661 -2.385 1.433 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.459 -1.516 2.259 1.00 0.00 H new ATOM 0 HA MET A 1 -21.002 -2.238 3.519 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.973 -0.022 4.009 1.00 0.00 H new ATOM 0 HB3 MET A 1 -20.451 -0.256 4.921 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.654 -2.426 5.735 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.218 -2.307 4.739 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.081 -0.003 8.636 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.201 0.070 7.255 1.00 0.00 H new ATOM 0 HE3 MET A 1 -19.894 -1.482 8.069 1.00 0.00 H new ATOM 16 N SER A 2 -22.395 -0.472 2.462 1.00 0.00 N ATOM 17 CA SER A 2 -23.246 0.441 1.707 1.00 0.00 C ATOM 18 C SER A 2 -24.496 0.801 2.504 1.00 0.00 C ATOM 19 O SER A 2 -24.650 1.934 2.962 1.00 0.00 O ATOM 20 CB SER A 2 -23.644 -0.187 0.370 1.00 0.00 C ATOM 21 OG SER A 2 -22.501 -0.602 -0.359 1.00 0.00 O ATOM 0 H SER A 2 -22.899 -1.093 3.095 1.00 0.00 H new ATOM 0 HA SER A 2 -22.680 1.353 1.518 1.00 0.00 H new ATOM 0 HB2 SER A 2 -24.297 -1.042 0.546 1.00 0.00 H new ATOM 0 HB3 SER A 2 -24.213 0.533 -0.218 1.00 0.00 H new ATOM 0 HG SER A 2 -22.782 -1.001 -1.209 1.00 0.00 H new ATOM 26 N LEU A 3 -25.388 -0.171 2.666 1.00 0.00 N ATOM 27 CA LEU A 3 -26.626 0.043 3.407 1.00 0.00 C ATOM 28 C LEU A 3 -26.491 -0.447 4.845 1.00 0.00 C ATOM 29 O LEU A 3 -26.611 0.332 5.792 1.00 0.00 O ATOM 30 CB LEU A 3 -27.786 -0.678 2.719 1.00 0.00 C ATOM 31 CG LEU A 3 -29.133 0.048 2.737 1.00 0.00 C ATOM 32 CD1 LEU A 3 -29.833 -0.091 1.394 1.00 0.00 C ATOM 33 CD2 LEU A 3 -30.012 -0.488 3.857 1.00 0.00 C ATOM 0 H LEU A 3 -25.277 -1.114 2.294 1.00 0.00 H new ATOM 0 HA LEU A 3 -26.830 1.114 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -27.509 -0.862 1.681 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -27.914 -1.652 3.192 1.00 0.00 H new ATOM 0 HG LEU A 3 -28.951 1.107 2.920 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -30.789 0.432 1.426 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -29.209 0.342 0.612 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -30.003 -1.146 1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -30.966 0.040 3.855 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -30.186 -1.553 3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -29.515 -0.335 4.815 1.00 0.00 H new ATOM 44 N LEU A 4 -26.237 -1.742 5.002 1.00 0.00 N ATOM 45 CA LEU A 4 -26.083 -2.336 6.326 1.00 0.00 C ATOM 46 C LEU A 4 -25.670 -3.801 6.221 1.00 0.00 C ATOM 47 O LEU A 4 -24.611 -4.195 6.710 1.00 0.00 O ATOM 48 CB LEU A 4 -27.387 -2.218 7.115 1.00 0.00 C ATOM 49 CG LEU A 4 -27.247 -2.135 8.636 1.00 0.00 C ATOM 50 CD1 LEU A 4 -28.369 -1.299 9.231 1.00 0.00 C ATOM 51 CD2 LEU A 4 -27.237 -3.530 9.246 1.00 0.00 C ATOM 0 H LEU A 4 -26.133 -2.400 4.230 1.00 0.00 H new ATOM 0 HA LEU A 4 -25.298 -1.793 6.851 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -27.918 -1.331 6.770 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -28.013 -3.077 6.874 1.00 0.00 H new ATOM 0 HG LEU A 4 -26.299 -1.650 8.869 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -28.252 -1.251 10.314 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -28.331 -0.291 8.817 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -29.329 -1.754 8.989 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -27.137 -3.453 10.329 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -28.169 -4.040 9.003 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -26.398 -4.097 8.843 1.00 0.00 H new ATOM 62 N ASP A 5 -26.511 -4.602 5.577 1.00 0.00 N ATOM 63 CA ASP A 5 -26.234 -6.023 5.403 1.00 0.00 C ATOM 64 C ASP A 5 -26.080 -6.371 3.926 1.00 0.00 C ATOM 65 O ASP A 5 -26.640 -7.357 3.449 1.00 0.00 O ATOM 66 CB ASP A 5 -27.351 -6.863 6.024 1.00 0.00 C ATOM 67 CG ASP A 5 -28.716 -6.522 5.457 1.00 0.00 C ATOM 68 OD1 ASP A 5 -29.182 -5.385 5.676 1.00 0.00 O ATOM 69 OD2 ASP A 5 -29.316 -7.392 4.793 1.00 0.00 O ATOM 0 H ASP A 5 -27.391 -4.291 5.166 1.00 0.00 H new ATOM 0 HA ASP A 5 -25.296 -6.249 5.910 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -27.144 -7.920 5.854 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -27.360 -6.709 7.103 1.00 0.00 H new ATOM 73 N ALA A 6 -25.319 -5.552 3.207 1.00 0.00 N ATOM 74 CA ALA A 6 -25.092 -5.774 1.784 1.00 0.00 C ATOM 75 C ALA A 6 -23.739 -6.436 1.541 1.00 0.00 C ATOM 76 O ALA A 6 -23.605 -7.296 0.670 1.00 0.00 O ATOM 77 CB ALA A 6 -25.181 -4.459 1.024 1.00 0.00 C ATOM 0 H ALA A 6 -24.850 -4.730 3.586 1.00 0.00 H new ATOM 0 HA ALA A 6 -25.868 -6.446 1.418 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -25.009 -4.640 -0.037 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -26.171 -4.025 1.163 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -24.426 -3.769 1.401 1.00 0.00 H new ATOM 83 N HIS A 7 -22.738 -6.030 2.317 1.00 0.00 N ATOM 84 CA HIS A 7 -21.396 -6.585 2.184 1.00 0.00 C ATOM 85 C HIS A 7 -20.740 -6.752 3.552 1.00 0.00 C ATOM 86 O HIS A 7 -19.711 -6.138 3.836 1.00 0.00 O ATOM 87 CB HIS A 7 -20.534 -5.683 1.299 1.00 0.00 C ATOM 88 CG HIS A 7 -20.939 -5.697 -0.143 1.00 0.00 C ATOM 89 ND1 HIS A 7 -20.371 -6.539 -1.076 1.00 0.00 N ATOM 90 CD2 HIS A 7 -21.862 -4.966 -0.811 1.00 0.00 C ATOM 91 CE1 HIS A 7 -20.926 -6.324 -2.255 1.00 0.00 C ATOM 92 NE2 HIS A 7 -21.834 -5.375 -2.121 1.00 0.00 N ATOM 0 H HIS A 7 -22.831 -5.320 3.043 1.00 0.00 H new ATOM 0 HA HIS A 7 -21.479 -7.567 1.718 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -20.589 -4.661 1.674 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -19.493 -5.997 1.379 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -22.501 -4.203 -0.391 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -20.679 -6.837 -3.173 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -22.420 -5.006 -2.870 1.00 0.00 H new ATOM 99 N ILE A 8 -21.343 -7.583 4.394 1.00 0.00 N ATOM 100 CA ILE A 8 -20.818 -7.830 5.731 1.00 0.00 C ATOM 101 C ILE A 8 -20.180 -9.212 5.824 1.00 0.00 C ATOM 102 O ILE A 8 -20.549 -10.143 5.108 1.00 0.00 O ATOM 103 CB ILE A 8 -21.921 -7.713 6.800 1.00 0.00 C ATOM 104 CG1 ILE A 8 -22.913 -8.870 6.669 1.00 0.00 C ATOM 105 CG2 ILE A 8 -22.637 -6.377 6.678 1.00 0.00 C ATOM 106 CD1 ILE A 8 -24.051 -8.806 7.664 1.00 0.00 C ATOM 0 H ILE A 8 -22.196 -8.097 4.174 1.00 0.00 H new ATOM 0 HA ILE A 8 -20.060 -7.069 5.918 1.00 0.00 H new ATOM 0 HB ILE A 8 -21.459 -7.766 7.786 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -23.324 -8.873 5.659 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -22.380 -9.812 6.799 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -23.413 -6.309 7.440 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -21.921 -5.567 6.816 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -23.090 -6.296 5.690 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -24.715 -9.657 7.513 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -23.650 -8.834 8.677 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -24.609 -7.881 7.520 1.00 0.00 H new ATOM 117 N PRO A 9 -19.201 -9.352 6.730 1.00 0.00 N ATOM 118 CA PRO A 9 -18.491 -10.617 6.941 1.00 0.00 C ATOM 119 C PRO A 9 -19.376 -11.676 7.589 1.00 0.00 C ATOM 120 O PRO A 9 -20.598 -11.537 7.629 1.00 0.00 O ATOM 121 CB PRO A 9 -17.345 -10.230 7.879 1.00 0.00 C ATOM 122 CG PRO A 9 -17.835 -9.020 8.596 1.00 0.00 C ATOM 123 CD PRO A 9 -18.710 -8.285 7.618 1.00 0.00 C ATOM 0 HA PRO A 9 -18.159 -11.060 6.002 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -17.114 -11.036 8.575 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -16.432 -10.018 7.322 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -18.395 -9.296 9.490 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -17.003 -8.395 8.921 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -19.530 -7.771 8.120 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -18.150 -7.530 7.067 1.00 0.00 H new ATOM 128 N GLN A 10 -18.750 -12.733 8.098 1.00 0.00 N ATOM 129 CA GLN A 10 -19.483 -13.816 8.745 1.00 0.00 C ATOM 130 C GLN A 10 -18.529 -14.898 9.241 1.00 0.00 C ATOM 131 O GLN A 10 -18.641 -15.367 10.375 1.00 0.00 O ATOM 132 CB GLN A 10 -20.502 -14.420 7.778 1.00 0.00 C ATOM 133 CG GLN A 10 -19.957 -14.632 6.375 1.00 0.00 C ATOM 134 CD GLN A 10 -20.993 -15.201 5.426 1.00 0.00 C ATOM 135 OE1 GLN A 10 -21.027 -16.406 5.175 1.00 0.00 O ATOM 136 NE2 GLN A 10 -21.846 -14.334 4.892 1.00 0.00 N ATOM 0 H GLN A 10 -17.739 -12.862 8.075 1.00 0.00 H new ATOM 0 HA GLN A 10 -20.011 -13.402 9.604 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -20.844 -15.376 8.174 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -21.373 -13.766 7.726 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.594 -13.682 5.983 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.102 -15.306 6.420 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -21.782 -13.344 5.128 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -22.566 -14.658 4.246 1.00 0.00 H new ATOM 143 N LEU A 11 -17.592 -15.290 8.385 1.00 0.00 N ATOM 144 CA LEU A 11 -16.618 -16.318 8.737 1.00 0.00 C ATOM 145 C LEU A 11 -15.200 -15.856 8.416 1.00 0.00 C ATOM 146 O LEU A 11 -14.297 -16.672 8.232 1.00 0.00 O ATOM 147 CB LEU A 11 -16.925 -17.616 7.988 1.00 0.00 C ATOM 148 CG LEU A 11 -17.967 -18.531 8.630 1.00 0.00 C ATOM 149 CD1 LEU A 11 -17.523 -18.951 10.023 1.00 0.00 C ATOM 150 CD2 LEU A 11 -19.322 -17.841 8.686 1.00 0.00 C ATOM 0 H LEU A 11 -17.486 -14.912 7.443 1.00 0.00 H new ATOM 0 HA LEU A 11 -16.688 -16.499 9.810 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -17.264 -17.361 6.984 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -15.997 -18.177 7.878 1.00 0.00 H new ATOM 0 HG LEU A 11 -18.063 -19.426 8.016 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -18.277 -19.602 10.464 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -16.576 -19.486 9.957 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -17.397 -18.066 10.647 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -20.051 -18.508 9.146 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -19.241 -16.928 9.277 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -19.645 -17.592 7.675 1.00 0.00 H new ATOM 161 N VAL A 12 -15.010 -14.542 8.353 1.00 0.00 N ATOM 162 CA VAL A 12 -13.702 -13.970 8.059 1.00 0.00 C ATOM 163 C VAL A 12 -12.673 -14.387 9.105 1.00 0.00 C ATOM 164 O VAL A 12 -13.028 -14.812 10.204 1.00 0.00 O ATOM 165 CB VAL A 12 -13.761 -12.433 7.997 1.00 0.00 C ATOM 166 CG1 VAL A 12 -14.779 -11.979 6.962 1.00 0.00 C ATOM 167 CG2 VAL A 12 -14.089 -11.857 9.366 1.00 0.00 C ATOM 0 H VAL A 12 -15.747 -13.853 8.502 1.00 0.00 H new ATOM 0 HA VAL A 12 -13.401 -14.353 7.084 1.00 0.00 H new ATOM 0 HB VAL A 12 -12.781 -12.061 7.696 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -14.807 -10.890 6.932 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -14.496 -12.362 5.981 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -15.765 -12.360 7.230 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -14.127 -10.769 9.304 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -15.056 -12.235 9.698 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -13.320 -12.153 10.079 1.00 0.00 H new ATOM 177 N ALA A 13 -11.398 -14.259 8.756 1.00 0.00 N ATOM 178 CA ALA A 13 -10.317 -14.618 9.666 1.00 0.00 C ATOM 179 C ALA A 13 -10.212 -16.131 9.822 1.00 0.00 C ATOM 180 O ALA A 13 -9.263 -16.751 9.342 1.00 0.00 O ATOM 181 CB ALA A 13 -10.526 -13.958 11.021 1.00 0.00 C ATOM 0 H ALA A 13 -11.088 -13.909 7.849 1.00 0.00 H new ATOM 0 HA ALA A 13 -9.381 -14.257 9.240 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -9.711 -14.235 11.690 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -10.543 -12.875 10.899 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -11.473 -14.291 11.446 1.00 0.00 H new ATOM 187 N SER A 14 -11.194 -16.721 10.497 1.00 0.00 N ATOM 188 CA SER A 14 -11.209 -18.162 10.721 1.00 0.00 C ATOM 189 C SER A 14 -11.036 -18.917 9.407 1.00 0.00 C ATOM 190 O SER A 14 -10.183 -19.796 9.293 1.00 0.00 O ATOM 191 CB SER A 14 -12.517 -18.580 11.396 1.00 0.00 C ATOM 192 OG SER A 14 -12.416 -19.885 11.939 1.00 0.00 O ATOM 0 H SER A 14 -11.989 -16.223 10.898 1.00 0.00 H new ATOM 0 HA SER A 14 -10.375 -18.413 11.376 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.764 -17.872 12.187 1.00 0.00 H new ATOM 0 HB3 SER A 14 -13.331 -18.546 10.672 1.00 0.00 H new ATOM 0 HG SER A 14 -13.264 -20.128 12.366 1.00 0.00 H new ATOM 197 N GLN A 15 -11.854 -18.568 8.419 1.00 0.00 N ATOM 198 CA GLN A 15 -11.792 -19.213 7.113 1.00 0.00 C ATOM 199 C GLN A 15 -10.432 -18.992 6.460 1.00 0.00 C ATOM 200 O GLN A 15 -9.918 -19.865 5.761 1.00 0.00 O ATOM 201 CB GLN A 15 -12.900 -18.680 6.204 1.00 0.00 C ATOM 202 CG GLN A 15 -13.376 -19.686 5.169 1.00 0.00 C ATOM 203 CD GLN A 15 -13.921 -19.024 3.919 1.00 0.00 C ATOM 204 OE1 GLN A 15 -13.163 -18.572 3.062 1.00 0.00 O ATOM 205 NE2 GLN A 15 -15.243 -18.966 3.808 1.00 0.00 N ATOM 0 H GLN A 15 -12.567 -17.843 8.498 1.00 0.00 H new ATOM 0 HA GLN A 15 -11.935 -20.284 7.258 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -13.747 -18.375 6.818 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -12.540 -17.787 5.692 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.548 -20.341 4.897 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -14.150 -20.316 5.609 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -15.834 -19.354 4.543 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -15.667 -18.534 2.987 1.00 0.00 H new ATOM 212 N SER A 16 -9.853 -17.818 6.693 1.00 0.00 N ATOM 213 CA SER A 16 -8.553 -17.480 6.123 1.00 0.00 C ATOM 214 C SER A 16 -8.012 -16.191 6.734 1.00 0.00 C ATOM 215 O SER A 16 -8.716 -15.186 6.814 1.00 0.00 O ATOM 216 CB SER A 16 -8.662 -17.331 4.604 1.00 0.00 C ATOM 217 OG SER A 16 -7.384 -17.157 4.016 1.00 0.00 O ATOM 0 H SER A 16 -10.263 -17.085 7.272 1.00 0.00 H new ATOM 0 HA SER A 16 -7.861 -18.290 6.353 1.00 0.00 H new ATOM 0 HB2 SER A 16 -9.143 -18.214 4.182 1.00 0.00 H new ATOM 0 HB3 SER A 16 -9.296 -16.477 4.364 1.00 0.00 H new ATOM 0 HG SER A 16 -7.355 -16.299 3.544 1.00 0.00 H new ATOM 222 N ALA A 17 -6.755 -16.230 7.163 1.00 0.00 N ATOM 223 CA ALA A 17 -6.116 -15.066 7.766 1.00 0.00 C ATOM 224 C ALA A 17 -5.808 -14.005 6.714 1.00 0.00 C ATOM 225 O ALA A 17 -5.792 -12.809 7.011 1.00 0.00 O ATOM 226 CB ALA A 17 -4.844 -15.478 8.492 1.00 0.00 C ATOM 0 H ALA A 17 -6.158 -17.055 7.104 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.809 -14.635 8.489 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.378 -14.599 8.937 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.088 -16.195 9.276 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.153 -15.936 7.784 1.00 0.00 H new ATOM 232 N PHE A 18 -5.561 -14.449 5.487 1.00 0.00 N ATOM 233 CA PHE A 18 -5.251 -13.537 4.392 1.00 0.00 C ATOM 234 C PHE A 18 -6.385 -12.539 4.177 1.00 0.00 C ATOM 235 O PHE A 18 -6.150 -11.345 3.997 1.00 0.00 O ATOM 236 CB PHE A 18 -4.995 -14.322 3.104 1.00 0.00 C ATOM 237 CG PHE A 18 -4.250 -13.537 2.063 1.00 0.00 C ATOM 238 CD1 PHE A 18 -4.932 -12.763 1.138 1.00 0.00 C ATOM 239 CD2 PHE A 18 -2.866 -13.573 2.008 1.00 0.00 C ATOM 240 CE1 PHE A 18 -4.248 -12.041 0.178 1.00 0.00 C ATOM 241 CE2 PHE A 18 -2.176 -12.852 1.051 1.00 0.00 C ATOM 242 CZ PHE A 18 -2.868 -12.084 0.135 1.00 0.00 C ATOM 0 H PHE A 18 -5.569 -15.435 5.225 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.350 -12.984 4.657 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.429 -15.222 3.343 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -5.950 -14.646 2.689 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -6.011 -12.723 1.167 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.319 -14.172 2.722 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.792 -11.443 -0.538 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.097 -12.889 1.020 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.332 -11.519 -0.613 1.00 0.00 H new ATOM 251 N ALA A 19 -7.616 -13.039 4.197 1.00 0.00 N ATOM 252 CA ALA A 19 -8.787 -12.193 4.006 1.00 0.00 C ATOM 253 C ALA A 19 -8.922 -11.179 5.137 1.00 0.00 C ATOM 254 O ALA A 19 -9.329 -10.039 4.915 1.00 0.00 O ATOM 255 CB ALA A 19 -10.043 -13.045 3.907 1.00 0.00 C ATOM 0 H ALA A 19 -7.828 -14.026 4.344 1.00 0.00 H new ATOM 0 HA ALA A 19 -8.659 -11.644 3.073 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -10.910 -12.400 3.764 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -9.955 -13.726 3.061 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -10.166 -13.620 4.825 1.00 0.00 H new ATOM 261 N ALA A 20 -8.578 -11.601 6.349 1.00 0.00 N ATOM 262 CA ALA A 20 -8.659 -10.729 7.514 1.00 0.00 C ATOM 263 C ALA A 20 -7.856 -9.451 7.301 1.00 0.00 C ATOM 264 O ALA A 20 -8.302 -8.358 7.651 1.00 0.00 O ATOM 265 CB ALA A 20 -8.171 -11.461 8.756 1.00 0.00 C ATOM 0 H ALA A 20 -8.240 -12.542 6.550 1.00 0.00 H new ATOM 0 HA ALA A 20 -9.703 -10.451 7.656 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.237 -10.798 9.619 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.791 -12.341 8.927 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -7.135 -11.769 8.613 1.00 0.00 H new ATOM 271 N LYS A 21 -6.667 -9.594 6.723 1.00 0.00 N ATOM 272 CA LYS A 21 -5.800 -8.452 6.461 1.00 0.00 C ATOM 273 C LYS A 21 -6.323 -7.630 5.287 1.00 0.00 C ATOM 274 O LYS A 21 -6.063 -6.431 5.192 1.00 0.00 O ATOM 275 CB LYS A 21 -4.374 -8.924 6.174 1.00 0.00 C ATOM 276 CG LYS A 21 -3.875 -9.980 7.142 1.00 0.00 C ATOM 277 CD LYS A 21 -2.436 -9.721 7.559 1.00 0.00 C ATOM 278 CE LYS A 21 -2.334 -8.527 8.495 1.00 0.00 C ATOM 279 NZ LYS A 21 -1.502 -8.830 9.692 1.00 0.00 N ATOM 0 H LYS A 21 -6.282 -10.491 6.427 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.794 -7.820 7.349 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -4.330 -9.323 5.161 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -3.703 -8.066 6.208 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -4.513 -9.995 8.025 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.949 -10.964 6.678 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -2.034 -10.606 8.052 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -1.826 -9.544 6.673 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.904 -7.681 7.959 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -3.333 -8.229 8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.051 -7.957 10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -2.104 -9.223 10.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.769 -9.522 9.439 1.00 0.00 H new ATOM 289 N ALA A 22 -7.062 -8.283 4.396 1.00 0.00 N ATOM 290 CA ALA A 22 -7.623 -7.612 3.230 1.00 0.00 C ATOM 291 C ALA A 22 -8.750 -6.666 3.631 1.00 0.00 C ATOM 292 O ALA A 22 -8.763 -5.499 3.241 1.00 0.00 O ATOM 293 CB ALA A 22 -8.125 -8.636 2.222 1.00 0.00 C ATOM 0 H ALA A 22 -7.286 -9.276 4.460 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.833 -7.020 2.767 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.541 -8.121 1.356 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.297 -9.269 1.904 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.897 -9.252 2.683 1.00 0.00 H new ATOM 299 N GLY A 23 -9.696 -7.177 4.414 1.00 0.00 N ATOM 300 CA GLY A 23 -10.815 -6.364 4.854 1.00 0.00 C ATOM 301 C GLY A 23 -10.382 -5.216 5.744 1.00 0.00 C ATOM 302 O GLY A 23 -11.033 -4.171 5.782 1.00 0.00 O ATOM 0 H GLY A 23 -9.707 -8.140 4.751 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -11.337 -5.968 3.983 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -11.525 -6.990 5.394 1.00 0.00 H new ATOM 306 N LEU A 24 -9.281 -5.409 6.462 1.00 0.00 N ATOM 307 CA LEU A 24 -8.763 -4.381 7.358 1.00 0.00 C ATOM 308 C LEU A 24 -7.897 -3.382 6.597 1.00 0.00 C ATOM 309 O LEU A 24 -7.766 -2.227 7.001 1.00 0.00 O ATOM 310 CB LEU A 24 -7.950 -5.022 8.485 1.00 0.00 C ATOM 311 CG LEU A 24 -8.307 -4.580 9.904 1.00 0.00 C ATOM 312 CD1 LEU A 24 -8.000 -5.687 10.902 1.00 0.00 C ATOM 313 CD2 LEU A 24 -7.558 -3.307 10.271 1.00 0.00 C ATOM 0 H LEU A 24 -8.730 -6.267 6.441 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.611 -3.847 7.787 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -8.069 -6.104 8.422 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.895 -4.807 8.313 1.00 0.00 H new ATOM 0 HG LEU A 24 -9.376 -4.372 9.940 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -8.261 -5.354 11.907 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -8.582 -6.574 10.652 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.937 -5.927 10.864 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.825 -3.007 11.285 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.485 -3.488 10.217 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -7.828 -2.513 9.575 1.00 0.00 H new ATOM 324 N MET A 25 -7.312 -3.833 5.493 1.00 0.00 N ATOM 325 CA MET A 25 -6.462 -2.977 4.674 1.00 0.00 C ATOM 326 C MET A 25 -7.212 -1.720 4.242 1.00 0.00 C ATOM 327 O MET A 25 -6.789 -0.602 4.536 1.00 0.00 O ATOM 328 CB MET A 25 -5.969 -3.739 3.443 1.00 0.00 C ATOM 329 CG MET A 25 -5.217 -2.868 2.449 1.00 0.00 C ATOM 330 SD MET A 25 -3.558 -3.482 2.104 1.00 0.00 S ATOM 331 CE MET A 25 -2.653 -2.817 3.499 1.00 0.00 C ATOM 0 H MET A 25 -7.411 -4.787 5.145 1.00 0.00 H new ATOM 0 HA MET A 25 -5.603 -2.678 5.275 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.319 -4.552 3.766 1.00 0.00 H new ATOM 0 HB3 MET A 25 -6.823 -4.194 2.941 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.782 -2.815 1.518 1.00 0.00 H new ATOM 0 HG3 MET A 25 -5.150 -1.852 2.839 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.808 -2.231 3.138 1.00 0.00 H new ATOM 0 HE2 MET A 25 -3.311 -2.179 4.089 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.289 -3.635 4.120 1.00 0.00 H new ATOM 339 N ARG A 26 -8.325 -1.912 3.543 1.00 0.00 N ATOM 340 CA ARG A 26 -9.132 -0.794 3.069 1.00 0.00 C ATOM 341 C ARG A 26 -9.573 0.090 4.233 1.00 0.00 C ATOM 342 O ARG A 26 -9.844 1.277 4.056 1.00 0.00 O ATOM 343 CB ARG A 26 -10.359 -1.307 2.312 1.00 0.00 C ATOM 344 CG ARG A 26 -10.015 -2.127 1.080 1.00 0.00 C ATOM 345 CD ARG A 26 -10.788 -3.437 1.047 1.00 0.00 C ATOM 346 NE ARG A 26 -10.402 -4.272 -0.085 1.00 0.00 N ATOM 347 CZ ARG A 26 -10.626 -5.581 -0.144 1.00 0.00 C ATOM 348 NH1 ARG A 26 -11.232 -6.198 0.861 1.00 0.00 N ATOM 349 NH2 ARG A 26 -10.245 -6.273 -1.209 1.00 0.00 N ATOM 0 H ARG A 26 -8.689 -2.831 3.292 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.519 -0.198 2.393 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.963 -1.915 2.986 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.972 -0.457 2.013 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.238 -1.549 0.183 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -8.945 -2.335 1.067 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -10.616 -3.983 1.975 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -11.856 -3.226 0.994 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.934 -3.827 -0.875 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -11.527 -5.668 1.681 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -11.403 -7.202 0.814 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -9.779 -5.801 -1.984 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -10.417 -7.277 -1.253 1.00 0.00 H new ATOM 360 N HIS A 27 -9.642 -0.499 5.422 1.00 0.00 N ATOM 361 CA HIS A 27 -10.050 0.236 6.616 1.00 0.00 C ATOM 362 C HIS A 27 -8.938 1.169 7.085 1.00 0.00 C ATOM 363 O HIS A 27 -9.197 2.181 7.737 1.00 0.00 O ATOM 364 CB HIS A 27 -10.423 -0.737 7.736 1.00 0.00 C ATOM 365 CG HIS A 27 -11.141 -0.087 8.877 1.00 0.00 C ATOM 366 ND1 HIS A 27 -11.746 1.148 8.782 1.00 0.00 N ATOM 367 CD2 HIS A 27 -11.350 -0.509 10.147 1.00 0.00 C ATOM 368 CE1 HIS A 27 -12.296 1.458 9.942 1.00 0.00 C ATOM 369 NE2 HIS A 27 -12.070 0.469 10.787 1.00 0.00 N ATOM 0 H HIS A 27 -9.421 -1.481 5.586 1.00 0.00 H new ATOM 0 HA HIS A 27 -10.922 0.838 6.363 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -11.051 -1.528 7.325 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -9.516 -1.212 8.111 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -11.013 -1.441 10.576 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -12.838 2.366 10.162 1.00 0.00 H new ATOM 0 HE2 HIS A 27 -12.380 0.437 11.758 1.00 0.00 H new ATOM 376 N THR A 28 -7.699 0.821 6.750 1.00 0.00 N ATOM 377 CA THR A 28 -6.548 1.627 7.139 1.00 0.00 C ATOM 378 C THR A 28 -6.478 2.914 6.324 1.00 0.00 C ATOM 379 O THR A 28 -6.271 3.997 6.874 1.00 0.00 O ATOM 380 CB THR A 28 -5.232 0.847 6.962 1.00 0.00 C ATOM 381 OG1 THR A 28 -5.409 -0.513 7.373 1.00 0.00 O ATOM 382 CG2 THR A 28 -4.112 1.485 7.770 1.00 0.00 C ATOM 0 H THR A 28 -7.467 -0.013 6.211 1.00 0.00 H new ATOM 0 HA THR A 28 -6.676 1.875 8.193 1.00 0.00 H new ATOM 0 HB THR A 28 -4.959 0.874 5.907 1.00 0.00 H new ATOM 0 HG1 THR A 28 -5.882 -1.008 6.672 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.193 0.917 7.629 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.960 2.511 7.434 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.380 1.485 8.827 1.00 0.00 H new ATOM 390 N ILE A 29 -6.649 2.788 5.012 1.00 0.00 N ATOM 391 CA ILE A 29 -6.607 3.943 4.124 1.00 0.00 C ATOM 392 C ILE A 29 -7.861 4.798 4.272 1.00 0.00 C ATOM 393 O ILE A 29 -7.780 6.019 4.399 1.00 0.00 O ATOM 394 CB ILE A 29 -6.462 3.515 2.651 1.00 0.00 C ATOM 395 CG1 ILE A 29 -5.131 2.792 2.435 1.00 0.00 C ATOM 396 CG2 ILE A 29 -6.572 4.724 1.734 1.00 0.00 C ATOM 397 CD1 ILE A 29 -5.182 1.318 2.766 1.00 0.00 C ATOM 0 H ILE A 29 -6.818 1.899 4.541 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.735 4.530 4.412 1.00 0.00 H new ATOM 0 HB ILE A 29 -7.270 2.826 2.407 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -4.827 2.912 1.395 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -4.365 3.267 3.048 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -6.467 4.405 0.697 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.544 5.198 1.872 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.783 5.437 1.975 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -4.204 0.871 2.589 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.455 1.190 3.813 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -5.924 0.829 2.135 1.00 0.00 H new ATOM 408 N GLY A 30 -9.019 4.148 4.256 1.00 0.00 N ATOM 409 CA GLY A 30 -10.274 4.864 4.392 1.00 0.00 C ATOM 410 C GLY A 30 -10.308 5.746 5.625 1.00 0.00 C ATOM 411 O GLY A 30 -10.698 6.911 5.551 1.00 0.00 O ATOM 0 H GLY A 30 -9.111 3.138 4.151 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.437 5.477 3.506 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.094 4.148 4.439 1.00 0.00 H new ATOM 415 N GLN A 31 -9.899 5.190 6.761 1.00 0.00 N ATOM 416 CA GLN A 31 -9.886 5.933 8.014 1.00 0.00 C ATOM 417 C GLN A 31 -8.758 6.958 8.028 1.00 0.00 C ATOM 418 O GLN A 31 -8.928 8.078 8.508 1.00 0.00 O ATOM 419 CB GLN A 31 -9.736 4.976 9.198 1.00 0.00 C ATOM 420 CG GLN A 31 -11.056 4.397 9.683 1.00 0.00 C ATOM 421 CD GLN A 31 -11.977 5.450 10.264 1.00 0.00 C ATOM 422 OE1 GLN A 31 -11.525 6.416 10.881 1.00 0.00 O ATOM 423 NE2 GLN A 31 -13.279 5.270 10.072 1.00 0.00 N ATOM 0 H GLN A 31 -9.572 4.227 6.839 1.00 0.00 H new ATOM 0 HA GLN A 31 -10.835 6.463 8.102 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -9.073 4.159 8.913 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.255 5.503 10.022 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -11.557 3.900 8.852 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.859 3.636 10.438 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -13.610 4.456 9.555 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -13.947 5.946 10.442 1.00 0.00 H new ATOM 430 N ALA A 32 -7.603 6.567 7.497 1.00 0.00 N ATOM 431 CA ALA A 32 -6.446 7.453 7.447 1.00 0.00 C ATOM 432 C ALA A 32 -6.722 8.666 6.565 1.00 0.00 C ATOM 433 O ALA A 32 -6.145 9.735 6.767 1.00 0.00 O ATOM 434 CB ALA A 32 -5.225 6.698 6.943 1.00 0.00 C ATOM 0 H ALA A 32 -7.444 5.643 7.096 1.00 0.00 H new ATOM 0 HA ALA A 32 -6.247 7.809 8.458 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -4.369 7.371 6.911 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -5.008 5.867 7.614 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -5.422 6.314 5.942 1.00 0.00 H new ATOM 440 N GLU A 33 -7.605 8.493 5.587 1.00 0.00 N ATOM 441 CA GLU A 33 -7.955 9.575 4.674 1.00 0.00 C ATOM 442 C GLU A 33 -8.803 10.629 5.379 1.00 0.00 C ATOM 443 O GLU A 33 -8.528 11.825 5.286 1.00 0.00 O ATOM 444 CB GLU A 33 -8.709 9.025 3.461 1.00 0.00 C ATOM 445 CG GLU A 33 -7.801 8.604 2.319 1.00 0.00 C ATOM 446 CD GLU A 33 -8.462 7.610 1.383 1.00 0.00 C ATOM 447 OE1 GLU A 33 -9.564 7.126 1.714 1.00 0.00 O ATOM 448 OE2 GLU A 33 -7.878 7.319 0.319 1.00 0.00 O ATOM 0 H GLU A 33 -8.091 7.615 5.406 1.00 0.00 H new ATOM 0 HA GLU A 33 -7.031 10.044 4.336 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -9.307 8.169 3.773 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -9.403 9.784 3.101 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -7.502 9.486 1.753 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.891 8.164 2.727 1.00 0.00 H new ATOM 453 N GLN A 34 -9.836 10.176 6.083 1.00 0.00 N ATOM 454 CA GLN A 34 -10.724 11.080 6.803 1.00 0.00 C ATOM 455 C GLN A 34 -9.998 11.744 7.968 1.00 0.00 C ATOM 456 O GLN A 34 -10.176 12.935 8.225 1.00 0.00 O ATOM 457 CB GLN A 34 -11.950 10.322 7.316 1.00 0.00 C ATOM 458 CG GLN A 34 -12.838 11.151 8.232 1.00 0.00 C ATOM 459 CD GLN A 34 -14.265 10.641 8.277 1.00 0.00 C ATOM 460 OE1 GLN A 34 -14.516 9.448 8.103 1.00 0.00 O ATOM 461 NE2 GLN A 34 -15.210 11.544 8.512 1.00 0.00 N ATOM 0 H GLN A 34 -10.078 9.189 6.170 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.049 11.857 6.111 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -12.539 9.981 6.464 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.619 9.432 7.852 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.422 11.144 9.239 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.837 12.187 7.893 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -14.957 12.522 8.650 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -16.188 11.259 8.554 1.00 0.00 H new ATOM 468 N ALA A 35 -9.181 10.967 8.671 1.00 0.00 N ATOM 469 CA ALA A 35 -8.426 11.481 9.807 1.00 0.00 C ATOM 470 C ALA A 35 -7.575 12.679 9.404 1.00 0.00 C ATOM 471 O ALA A 35 -7.308 13.565 10.217 1.00 0.00 O ATOM 472 CB ALA A 35 -7.553 10.385 10.399 1.00 0.00 C ATOM 0 H ALA A 35 -9.025 9.979 8.474 1.00 0.00 H new ATOM 0 HA ALA A 35 -9.137 11.813 10.564 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.995 10.783 11.247 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -8.182 9.560 10.734 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.856 10.026 9.642 1.00 0.00 H new ATOM 478 N ALA A 36 -7.150 12.701 8.145 1.00 0.00 N ATOM 479 CA ALA A 36 -6.330 13.793 7.635 1.00 0.00 C ATOM 480 C ALA A 36 -7.125 15.091 7.564 1.00 0.00 C ATOM 481 O ALA A 36 -6.855 16.037 8.303 1.00 0.00 O ATOM 482 CB ALA A 36 -5.773 13.437 6.264 1.00 0.00 C ATOM 0 H ALA A 36 -7.360 11.975 7.460 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.500 13.945 8.325 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.162 14.261 5.894 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.161 12.538 6.342 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.596 13.257 5.573 1.00 0.00 H new ATOM 488 N MET A 37 -8.107 15.130 6.668 1.00 0.00 N ATOM 489 CA MET A 37 -8.942 16.314 6.502 1.00 0.00 C ATOM 490 C MET A 37 -9.654 16.664 7.804 1.00 0.00 C ATOM 491 O MET A 37 -10.023 17.817 8.030 1.00 0.00 O ATOM 492 CB MET A 37 -9.969 16.087 5.390 1.00 0.00 C ATOM 493 CG MET A 37 -11.092 15.141 5.784 1.00 0.00 C ATOM 494 SD MET A 37 -12.336 14.962 4.492 1.00 0.00 S ATOM 495 CE MET A 37 -11.572 13.718 3.455 1.00 0.00 C ATOM 0 H MET A 37 -8.343 14.356 6.047 1.00 0.00 H new ATOM 0 HA MET A 37 -8.297 17.148 6.227 1.00 0.00 H new ATOM 0 HB2 MET A 37 -10.398 17.047 5.101 1.00 0.00 H new ATOM 0 HB3 MET A 37 -9.460 15.688 4.512 1.00 0.00 H new ATOM 0 HG2 MET A 37 -10.672 14.162 6.017 1.00 0.00 H new ATOM 0 HG3 MET A 37 -11.568 15.508 6.693 1.00 0.00 H new ATOM 0 HE1 MET A 37 -11.614 14.037 2.413 1.00 0.00 H new ATOM 0 HE2 MET A 37 -10.532 13.585 3.752 1.00 0.00 H new ATOM 0 HE3 MET A 37 -12.105 12.774 3.567 1.00 0.00 H new ATOM 503 N SER A 38 -9.844 15.663 8.658 1.00 0.00 N ATOM 504 CA SER A 38 -10.516 15.866 9.936 1.00 0.00 C ATOM 505 C SER A 38 -9.706 16.796 10.833 1.00 0.00 C ATOM 506 O SER A 38 -10.165 17.880 11.197 1.00 0.00 O ATOM 507 CB SER A 38 -10.736 14.525 10.639 1.00 0.00 C ATOM 508 OG SER A 38 -11.405 14.701 11.876 1.00 0.00 O ATOM 0 H SER A 38 -9.542 14.704 8.488 1.00 0.00 H new ATOM 0 HA SER A 38 -11.483 16.329 9.741 1.00 0.00 H new ATOM 0 HB2 SER A 38 -11.320 13.866 9.997 1.00 0.00 H new ATOM 0 HB3 SER A 38 -9.776 14.037 10.807 1.00 0.00 H new ATOM 0 HG SER A 38 -11.535 13.829 12.304 1.00 0.00 H new ATOM 513 N ALA A 39 -8.500 16.367 11.186 1.00 0.00 N ATOM 514 CA ALA A 39 -7.624 17.162 12.039 1.00 0.00 C ATOM 515 C ALA A 39 -7.053 18.355 11.280 1.00 0.00 C ATOM 516 O ALA A 39 -6.691 19.366 11.879 1.00 0.00 O ATOM 517 CB ALA A 39 -6.500 16.298 12.591 1.00 0.00 C ATOM 0 H ALA A 39 -8.106 15.472 10.895 1.00 0.00 H new ATOM 0 HA ALA A 39 -8.216 17.544 12.871 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.854 16.904 13.226 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -6.923 15.482 13.177 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.917 15.888 11.766 1.00 0.00 H new ATOM 523 N GLN A 40 -6.977 18.229 9.959 1.00 0.00 N ATOM 524 CA GLN A 40 -6.449 19.297 9.119 1.00 0.00 C ATOM 525 C GLN A 40 -7.537 20.308 8.776 1.00 0.00 C ATOM 526 O GLN A 40 -7.264 21.350 8.181 1.00 0.00 O ATOM 527 CB GLN A 40 -5.852 18.717 7.836 1.00 0.00 C ATOM 528 CG GLN A 40 -4.841 19.635 7.166 1.00 0.00 C ATOM 529 CD GLN A 40 -3.574 18.911 6.760 1.00 0.00 C ATOM 530 OE1 GLN A 40 -2.508 19.104 7.529 1.00 0.00 O flip ATOM 531 NE2 GLN A 40 -3.551 18.184 5.766 1.00 0.00 N flip ATOM 0 H GLN A 40 -7.274 17.398 9.448 1.00 0.00 H new ATOM 0 HA GLN A 40 -5.665 19.810 9.677 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -5.371 17.767 8.066 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -6.658 18.504 7.134 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -5.295 20.087 6.284 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -4.588 20.448 7.846 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -4.393 18.063 5.203 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -2.690 17.703 5.506 1.00 0.00 H new ATOM 538 N ALA A 41 -8.772 19.993 9.155 1.00 0.00 N ATOM 539 CA ALA A 41 -9.901 20.874 8.888 1.00 0.00 C ATOM 540 C ALA A 41 -9.666 22.261 9.478 1.00 0.00 C ATOM 541 O ALA A 41 -10.244 23.247 9.022 1.00 0.00 O ATOM 542 CB ALA A 41 -11.183 20.272 9.443 1.00 0.00 C ATOM 0 H ALA A 41 -9.015 19.134 9.648 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.001 20.980 7.808 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -12.018 20.941 9.236 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.366 19.307 8.971 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.085 20.136 10.520 1.00 0.00 H new ATOM 548 N PHE A 42 -8.815 22.329 10.496 1.00 0.00 N ATOM 549 CA PHE A 42 -8.504 23.595 11.150 1.00 0.00 C ATOM 550 C PHE A 42 -8.092 24.649 10.127 1.00 0.00 C ATOM 551 O PHE A 42 -7.312 24.373 9.214 1.00 0.00 O ATOM 552 CB PHE A 42 -7.388 23.402 12.178 1.00 0.00 C ATOM 553 CG PHE A 42 -6.024 23.270 11.565 1.00 0.00 C ATOM 554 CD1 PHE A 42 -5.677 22.133 10.853 1.00 0.00 C ATOM 555 CD2 PHE A 42 -5.088 24.284 11.700 1.00 0.00 C ATOM 556 CE1 PHE A 42 -4.422 22.009 10.287 1.00 0.00 C ATOM 557 CE2 PHE A 42 -3.832 24.164 11.136 1.00 0.00 C ATOM 558 CZ PHE A 42 -3.498 23.026 10.430 1.00 0.00 C ATOM 0 H PHE A 42 -8.328 21.522 10.886 1.00 0.00 H new ATOM 0 HA PHE A 42 -9.403 23.941 11.661 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.388 24.248 12.865 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -7.600 22.511 12.769 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -6.395 21.335 10.739 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -5.343 25.177 12.252 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -4.164 21.118 9.734 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -3.112 24.961 11.248 1.00 0.00 H new ATOM 0 HZ PHE A 42 -2.516 22.931 9.990 1.00 0.00 H new ATOM 567 N HIS A 43 -8.621 25.858 10.285 1.00 0.00 N ATOM 568 CA HIS A 43 -8.309 26.955 9.375 1.00 0.00 C ATOM 569 C HIS A 43 -8.531 26.537 7.924 1.00 0.00 C ATOM 570 O HIS A 43 -7.628 26.641 7.094 1.00 0.00 O ATOM 571 CB HIS A 43 -6.862 27.411 9.570 1.00 0.00 C ATOM 572 CG HIS A 43 -6.683 28.361 10.714 1.00 0.00 C ATOM 573 ND1 HIS A 43 -5.836 29.448 10.665 1.00 0.00 N ATOM 574 CD2 HIS A 43 -7.250 28.384 11.943 1.00 0.00 C ATOM 575 CE1 HIS A 43 -5.888 30.097 11.813 1.00 0.00 C ATOM 576 NE2 HIS A 43 -6.739 29.473 12.607 1.00 0.00 N ATOM 0 H HIS A 43 -9.268 26.103 11.035 1.00 0.00 H new ATOM 0 HA HIS A 43 -8.978 27.785 9.603 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -6.233 26.536 9.733 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -6.513 27.888 8.654 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -7.970 27.678 12.330 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -5.329 30.987 12.061 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.978 29.754 13.558 1.00 0.00 H new ATOM 583 N GLN A 44 -9.737 26.065 7.628 1.00 0.00 N ATOM 584 CA GLN A 44 -10.077 25.631 6.278 1.00 0.00 C ATOM 585 C GLN A 44 -11.156 26.523 5.675 1.00 0.00 C ATOM 586 O GLN A 44 -10.878 27.355 4.811 1.00 0.00 O ATOM 587 CB GLN A 44 -10.549 24.176 6.291 1.00 0.00 C ATOM 588 CG GLN A 44 -10.963 23.659 4.922 1.00 0.00 C ATOM 589 CD GLN A 44 -10.199 22.415 4.514 1.00 0.00 C ATOM 590 OE1 GLN A 44 -8.990 22.317 4.727 1.00 0.00 O ATOM 591 NE2 GLN A 44 -10.901 21.455 3.923 1.00 0.00 N ATOM 0 H GLN A 44 -10.495 25.973 8.304 1.00 0.00 H new ATOM 0 HA GLN A 44 -9.181 25.709 5.662 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -9.749 23.547 6.681 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -11.392 24.082 6.976 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -12.031 23.440 4.928 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -10.802 24.440 4.179 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -11.901 21.578 3.766 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -10.440 20.595 3.626 1.00 0.00 H new ATOM 598 N GLY A 45 -12.391 26.345 6.136 1.00 0.00 N ATOM 599 CA GLY A 45 -13.494 27.142 5.629 1.00 0.00 C ATOM 600 C GLY A 45 -14.011 26.634 4.298 1.00 0.00 C ATOM 601 O GLY A 45 -14.493 27.412 3.475 1.00 0.00 O ATOM 0 H GLY A 45 -12.647 25.664 6.851 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -14.306 27.138 6.356 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -13.170 28.177 5.519 1.00 0.00 H new ATOM 605 N GLU A 46 -13.911 25.326 4.085 1.00 0.00 N ATOM 606 CA GLU A 46 -14.372 24.718 2.842 1.00 0.00 C ATOM 607 C GLU A 46 -13.570 25.239 1.652 1.00 0.00 C ATOM 608 O GLU A 46 -14.115 25.893 0.762 1.00 0.00 O ATOM 609 CB GLU A 46 -15.860 24.999 2.632 1.00 0.00 C ATOM 610 CG GLU A 46 -16.493 24.145 1.546 1.00 0.00 C ATOM 611 CD GLU A 46 -17.996 24.013 1.709 1.00 0.00 C ATOM 612 OE1 GLU A 46 -18.502 24.328 2.807 1.00 0.00 O ATOM 613 OE2 GLU A 46 -18.664 23.599 0.739 1.00 0.00 O ATOM 0 H GLU A 46 -13.515 24.667 4.756 1.00 0.00 H new ATOM 0 HA GLU A 46 -14.221 23.641 2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -16.389 24.830 3.570 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -15.990 26.051 2.378 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -16.274 24.582 0.572 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -16.041 23.153 1.560 1.00 0.00 H new ATOM 618 N SER A 47 -12.274 24.945 1.644 1.00 0.00 N ATOM 619 CA SER A 47 -11.397 25.387 0.567 1.00 0.00 C ATOM 620 C SER A 47 -9.968 24.902 0.795 1.00 0.00 C ATOM 621 O SER A 47 -9.361 25.189 1.827 1.00 0.00 O ATOM 622 CB SER A 47 -11.418 26.913 0.457 1.00 0.00 C ATOM 623 OG SER A 47 -11.997 27.328 -0.768 1.00 0.00 O ATOM 0 H SER A 47 -11.808 24.403 2.371 1.00 0.00 H new ATOM 0 HA SER A 47 -11.763 24.957 -0.365 1.00 0.00 H new ATOM 0 HB2 SER A 47 -11.982 27.333 1.290 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.402 27.300 0.532 1.00 0.00 H new ATOM 0 HG SER A 47 -12.942 27.068 -0.788 1.00 0.00 H new ATOM 628 N SER A 48 -9.437 24.165 -0.175 1.00 0.00 N ATOM 629 CA SER A 48 -8.082 23.637 -0.079 1.00 0.00 C ATOM 630 C SER A 48 -7.717 22.847 -1.333 1.00 0.00 C ATOM 631 O SER A 48 -8.065 21.674 -1.464 1.00 0.00 O ATOM 632 CB SER A 48 -7.946 22.746 1.157 1.00 0.00 C ATOM 633 OG SER A 48 -6.939 23.232 2.028 1.00 0.00 O ATOM 0 H SER A 48 -9.925 23.920 -1.037 1.00 0.00 H new ATOM 0 HA SER A 48 -7.395 24.479 0.012 1.00 0.00 H new ATOM 0 HB2 SER A 48 -8.899 22.704 1.685 1.00 0.00 H new ATOM 0 HB3 SER A 48 -7.706 21.728 0.851 1.00 0.00 H new ATOM 0 HG SER A 48 -6.873 22.646 2.811 1.00 0.00 H new ATOM 638 N ALA A 49 -7.013 23.499 -2.252 1.00 0.00 N ATOM 639 CA ALA A 49 -6.598 22.859 -3.493 1.00 0.00 C ATOM 640 C ALA A 49 -5.322 22.049 -3.294 1.00 0.00 C ATOM 641 O ALA A 49 -5.199 20.933 -3.798 1.00 0.00 O ATOM 642 CB ALA A 49 -6.400 23.900 -4.585 1.00 0.00 C ATOM 0 H ALA A 49 -6.718 24.471 -2.160 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.388 22.173 -3.800 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -6.090 23.407 -5.506 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -7.336 24.431 -4.755 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -5.632 24.609 -4.277 1.00 0.00 H new ATOM 648 N ALA A 50 -4.374 22.619 -2.558 1.00 0.00 N ATOM 649 CA ALA A 50 -3.107 21.949 -2.291 1.00 0.00 C ATOM 650 C ALA A 50 -3.329 20.614 -1.588 1.00 0.00 C ATOM 651 O ALA A 50 -2.825 19.580 -2.025 1.00 0.00 O ATOM 652 CB ALA A 50 -2.203 22.844 -1.456 1.00 0.00 C ATOM 0 H ALA A 50 -4.459 23.544 -2.136 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.621 21.750 -3.246 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.260 22.331 -1.264 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -2.009 23.770 -1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -2.691 23.072 -0.509 1.00 0.00 H new ATOM 658 N PHE A 51 -4.087 20.645 -0.498 1.00 0.00 N ATOM 659 CA PHE A 51 -4.374 19.437 0.268 1.00 0.00 C ATOM 660 C PHE A 51 -5.151 18.430 -0.576 1.00 0.00 C ATOM 661 O PHE A 51 -4.971 17.220 -0.439 1.00 0.00 O ATOM 662 CB PHE A 51 -5.170 19.783 1.529 1.00 0.00 C ATOM 663 CG PHE A 51 -5.669 18.577 2.272 1.00 0.00 C ATOM 664 CD1 PHE A 51 -4.855 17.923 3.184 1.00 0.00 C ATOM 665 CD2 PHE A 51 -6.951 18.097 2.060 1.00 0.00 C ATOM 666 CE1 PHE A 51 -5.311 16.813 3.870 1.00 0.00 C ATOM 667 CE2 PHE A 51 -7.411 16.987 2.744 1.00 0.00 C ATOM 668 CZ PHE A 51 -6.590 16.345 3.649 1.00 0.00 C ATOM 0 H PHE A 51 -4.514 21.493 -0.125 1.00 0.00 H new ATOM 0 HA PHE A 51 -3.424 18.987 0.558 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -4.542 20.376 2.194 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -6.020 20.407 1.253 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -3.853 18.285 3.361 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.598 18.595 1.353 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -4.667 16.313 4.578 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -8.413 16.622 2.570 1.00 0.00 H new ATOM 0 HZ PHE A 51 -6.948 15.478 4.183 1.00 0.00 H new ATOM 677 N GLN A 52 -6.013 18.940 -1.450 1.00 0.00 N ATOM 678 CA GLN A 52 -6.818 18.086 -2.316 1.00 0.00 C ATOM 679 C GLN A 52 -5.931 17.204 -3.187 1.00 0.00 C ATOM 680 O GLN A 52 -6.076 15.982 -3.201 1.00 0.00 O ATOM 681 CB GLN A 52 -7.735 18.936 -3.197 1.00 0.00 C ATOM 682 CG GLN A 52 -8.417 18.149 -4.303 1.00 0.00 C ATOM 683 CD GLN A 52 -9.914 18.385 -4.351 1.00 0.00 C ATOM 684 OE1 GLN A 52 -10.410 19.396 -3.853 1.00 0.00 O ATOM 685 NE2 GLN A 52 -10.642 17.452 -4.953 1.00 0.00 N ATOM 0 H GLN A 52 -6.172 19.939 -1.577 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.429 17.443 -1.683 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -8.496 19.402 -2.571 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.152 19.742 -3.643 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -7.979 18.424 -5.262 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -8.225 17.086 -4.158 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.189 16.630 -5.352 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -11.655 17.557 -5.017 1.00 0.00 H new ATOM 692 N ALA A 53 -5.011 17.831 -3.913 1.00 0.00 N ATOM 693 CA ALA A 53 -4.099 17.103 -4.786 1.00 0.00 C ATOM 694 C ALA A 53 -3.407 15.971 -4.035 1.00 0.00 C ATOM 695 O ALA A 53 -3.388 14.830 -4.493 1.00 0.00 O ATOM 696 CB ALA A 53 -3.070 18.051 -5.383 1.00 0.00 C ATOM 0 H ALA A 53 -4.878 18.842 -3.914 1.00 0.00 H new ATOM 0 HA ALA A 53 -4.683 16.663 -5.595 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -2.395 17.493 -6.033 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.578 18.821 -5.963 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -2.498 18.518 -4.582 1.00 0.00 H new ATOM 702 N ALA A 54 -2.837 16.296 -2.879 1.00 0.00 N ATOM 703 CA ALA A 54 -2.145 15.306 -2.064 1.00 0.00 C ATOM 704 C ALA A 54 -3.107 14.231 -1.569 1.00 0.00 C ATOM 705 O ALA A 54 -2.759 13.052 -1.508 1.00 0.00 O ATOM 706 CB ALA A 54 -1.454 15.980 -0.888 1.00 0.00 C ATOM 0 H ALA A 54 -2.841 17.237 -2.486 1.00 0.00 H new ATOM 0 HA ALA A 54 -1.392 14.823 -2.686 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -0.941 15.228 -0.288 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.729 16.705 -1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -2.196 16.490 -0.274 1.00 0.00 H new ATOM 712 N HIS A 55 -4.320 14.647 -1.216 1.00 0.00 N ATOM 713 CA HIS A 55 -5.333 13.719 -0.726 1.00 0.00 C ATOM 714 C HIS A 55 -5.758 12.748 -1.824 1.00 0.00 C ATOM 715 O HIS A 55 -6.026 11.577 -1.560 1.00 0.00 O ATOM 716 CB HIS A 55 -6.550 14.487 -0.209 1.00 0.00 C ATOM 717 CG HIS A 55 -7.655 13.600 0.277 1.00 0.00 C ATOM 718 ND1 HIS A 55 -8.508 12.797 -0.400 1.00 0.00 N flip ATOM 719 CD2 HIS A 55 -7.986 13.472 1.609 1.00 0.00 C flip ATOM 720 CE1 HIS A 55 -9.330 12.203 0.526 1.00 0.00 C flip ATOM 721 NE2 HIS A 55 -8.994 12.627 1.731 1.00 0.00 N flip ATOM 0 H HIS A 55 -4.625 15.619 -1.260 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.899 13.145 0.093 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.237 15.143 0.604 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -6.932 15.126 -1.005 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -8.535 12.659 -1.410 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -7.497 13.983 2.426 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -10.122 11.503 0.305 1.00 0.00 H new ATOM 728 N ALA A 56 -5.816 13.245 -3.056 1.00 0.00 N ATOM 729 CA ALA A 56 -6.207 12.422 -4.193 1.00 0.00 C ATOM 730 C ALA A 56 -5.106 11.430 -4.557 1.00 0.00 C ATOM 731 O ALA A 56 -5.383 10.334 -5.043 1.00 0.00 O ATOM 732 CB ALA A 56 -6.545 13.300 -5.389 1.00 0.00 C ATOM 0 H ALA A 56 -5.597 14.213 -3.291 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.094 11.854 -3.911 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.835 12.672 -6.231 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.369 13.965 -5.131 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.673 13.893 -5.663 1.00 0.00 H new ATOM 738 N ARG A 57 -3.859 11.824 -4.318 1.00 0.00 N ATOM 739 CA ARG A 57 -2.718 10.970 -4.623 1.00 0.00 C ATOM 740 C ARG A 57 -2.752 9.697 -3.783 1.00 0.00 C ATOM 741 O ARG A 57 -2.475 8.605 -4.280 1.00 0.00 O ATOM 742 CB ARG A 57 -1.410 11.723 -4.374 1.00 0.00 C ATOM 743 CG ARG A 57 -1.036 12.680 -5.494 1.00 0.00 C ATOM 744 CD ARG A 57 0.167 13.532 -5.121 1.00 0.00 C ATOM 745 NE ARG A 57 1.140 13.612 -6.206 1.00 0.00 N ATOM 746 CZ ARG A 57 0.982 14.375 -7.282 1.00 0.00 C ATOM 747 NH1 ARG A 57 -0.106 15.121 -7.415 1.00 0.00 N ATOM 748 NH2 ARG A 57 1.913 14.394 -8.226 1.00 0.00 N ATOM 0 H ARG A 57 -3.614 12.728 -3.915 1.00 0.00 H new ATOM 0 HA ARG A 57 -2.775 10.692 -5.675 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -1.494 12.283 -3.442 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.605 11.001 -4.240 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.816 12.114 -6.399 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.884 13.326 -5.721 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.167 14.536 -4.860 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.646 13.115 -4.235 1.00 0.00 H new ATOM 0 HE ARG A 57 1.989 13.051 -6.134 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.824 15.110 -6.690 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.225 15.706 -8.242 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.752 13.822 -8.127 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.790 14.980 -9.052 1.00 0.00 H new ATOM 759 N PHE A 58 -3.093 9.845 -2.507 1.00 0.00 N ATOM 760 CA PHE A 58 -3.162 8.707 -1.597 1.00 0.00 C ATOM 761 C PHE A 58 -4.227 7.712 -2.049 1.00 0.00 C ATOM 762 O PHE A 58 -3.948 6.528 -2.234 1.00 0.00 O ATOM 763 CB PHE A 58 -3.463 9.183 -0.174 1.00 0.00 C ATOM 764 CG PHE A 58 -3.120 8.171 0.882 1.00 0.00 C ATOM 765 CD1 PHE A 58 -3.791 6.960 0.942 1.00 0.00 C ATOM 766 CD2 PHE A 58 -2.128 8.430 1.812 1.00 0.00 C ATOM 767 CE1 PHE A 58 -3.479 6.027 1.912 1.00 0.00 C ATOM 768 CE2 PHE A 58 -1.810 7.500 2.785 1.00 0.00 C ATOM 769 CZ PHE A 58 -2.486 6.297 2.834 1.00 0.00 C ATOM 0 H PHE A 58 -3.326 10.741 -2.080 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.194 8.205 -1.608 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.907 10.100 0.019 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -4.522 9.430 -0.099 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.567 6.743 0.222 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.596 9.369 1.777 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -4.011 5.088 1.950 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.034 7.714 3.505 1.00 0.00 H new ATOM 0 HZ PHE A 58 -2.239 5.568 3.592 1.00 0.00 H new ATOM 778 N VAL A 59 -5.449 8.204 -2.225 1.00 0.00 N ATOM 779 CA VAL A 59 -6.558 7.360 -2.655 1.00 0.00 C ATOM 780 C VAL A 59 -6.276 6.736 -4.018 1.00 0.00 C ATOM 781 O VAL A 59 -6.705 5.618 -4.300 1.00 0.00 O ATOM 782 CB VAL A 59 -7.874 8.156 -2.730 1.00 0.00 C ATOM 783 CG1 VAL A 59 -7.686 9.422 -3.552 1.00 0.00 C ATOM 784 CG2 VAL A 59 -8.986 7.294 -3.308 1.00 0.00 C ATOM 0 H VAL A 59 -5.696 9.182 -2.077 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.662 6.571 -1.911 1.00 0.00 H new ATOM 0 HB VAL A 59 -8.161 8.447 -1.720 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -8.626 9.972 -3.594 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.921 10.046 -3.089 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.375 9.157 -4.563 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -9.909 7.873 -3.354 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -8.711 6.970 -4.312 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.137 6.421 -2.673 1.00 0.00 H new ATOM 794 N ALA A 60 -5.552 7.467 -4.859 1.00 0.00 N ATOM 795 CA ALA A 60 -5.210 6.984 -6.192 1.00 0.00 C ATOM 796 C ALA A 60 -4.314 5.754 -6.116 1.00 0.00 C ATOM 797 O ALA A 60 -4.425 4.842 -6.935 1.00 0.00 O ATOM 798 CB ALA A 60 -4.533 8.086 -6.994 1.00 0.00 C ATOM 0 H ALA A 60 -5.191 8.396 -4.641 1.00 0.00 H new ATOM 0 HA ALA A 60 -6.133 6.697 -6.697 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -4.283 7.712 -7.987 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -5.208 8.937 -7.086 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.622 8.400 -6.484 1.00 0.00 H new ATOM 804 N ALA A 61 -3.424 5.734 -5.130 1.00 0.00 N ATOM 805 CA ALA A 61 -2.509 4.614 -4.947 1.00 0.00 C ATOM 806 C ALA A 61 -3.203 3.445 -4.258 1.00 0.00 C ATOM 807 O ALA A 61 -2.921 2.283 -4.551 1.00 0.00 O ATOM 808 CB ALA A 61 -1.291 5.053 -4.148 1.00 0.00 C ATOM 0 H ALA A 61 -3.317 6.482 -4.445 1.00 0.00 H new ATOM 0 HA ALA A 61 -2.183 4.279 -5.932 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.616 4.207 -4.019 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.774 5.851 -4.681 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.609 5.416 -3.171 1.00 0.00 H new ATOM 814 N ALA A 62 -4.112 3.759 -3.341 1.00 0.00 N ATOM 815 CA ALA A 62 -4.848 2.734 -2.612 1.00 0.00 C ATOM 816 C ALA A 62 -5.511 1.748 -3.568 1.00 0.00 C ATOM 817 O ALA A 62 -5.668 0.570 -3.249 1.00 0.00 O ATOM 818 CB ALA A 62 -5.889 3.374 -1.705 1.00 0.00 C ATOM 0 H ALA A 62 -4.356 4.716 -3.085 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.138 2.181 -1.997 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.431 2.596 -1.167 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -5.394 4.032 -0.990 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.589 3.953 -2.307 1.00 0.00 H new ATOM 824 N ALA A 63 -5.898 2.238 -4.741 1.00 0.00 N ATOM 825 CA ALA A 63 -6.543 1.400 -5.744 1.00 0.00 C ATOM 826 C ALA A 63 -5.616 0.279 -6.200 1.00 0.00 C ATOM 827 O ALA A 63 -6.070 -0.799 -6.584 1.00 0.00 O ATOM 828 CB ALA A 63 -6.981 2.242 -6.933 1.00 0.00 C ATOM 0 H ALA A 63 -5.776 3.211 -5.020 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.424 0.946 -5.291 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.461 1.603 -7.674 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.686 3.004 -6.600 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.110 2.723 -7.378 1.00 0.00 H new ATOM 834 N LYS A 64 -4.313 0.538 -6.156 1.00 0.00 N ATOM 835 CA LYS A 64 -3.321 -0.450 -6.564 1.00 0.00 C ATOM 836 C LYS A 64 -3.177 -1.544 -5.510 1.00 0.00 C ATOM 837 O LYS A 64 -3.275 -2.731 -5.818 1.00 0.00 O ATOM 838 CB LYS A 64 -1.968 0.225 -6.801 1.00 0.00 C ATOM 839 CG LYS A 64 -1.180 -0.380 -7.949 1.00 0.00 C ATOM 840 CD LYS A 64 -0.970 -1.872 -7.756 1.00 0.00 C ATOM 841 CE LYS A 64 -0.230 -2.488 -8.934 1.00 0.00 C ATOM 842 NZ LYS A 64 1.197 -2.065 -8.973 1.00 0.00 N ATOM 0 H LYS A 64 -3.919 1.425 -5.841 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.661 -0.908 -7.493 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -2.130 1.284 -7.001 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.374 0.160 -5.889 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.708 -0.204 -8.886 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.213 0.117 -8.030 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.406 -2.046 -6.840 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -1.935 -2.364 -7.634 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -0.285 -3.575 -8.870 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.721 -2.198 -9.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 1.654 -2.464 -9.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.251 -1.027 -9.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.684 -2.408 -8.121 1.00 0.00 H new ATOM 852 N VAL A 65 -2.947 -1.135 -4.266 1.00 0.00 N ATOM 853 CA VAL A 65 -2.793 -2.081 -3.167 1.00 0.00 C ATOM 854 C VAL A 65 -4.098 -2.818 -2.890 1.00 0.00 C ATOM 855 O VAL A 65 -4.092 -3.975 -2.473 1.00 0.00 O ATOM 856 CB VAL A 65 -2.332 -1.373 -1.879 1.00 0.00 C ATOM 857 CG1 VAL A 65 -3.346 -0.322 -1.455 1.00 0.00 C ATOM 858 CG2 VAL A 65 -2.106 -2.387 -0.767 1.00 0.00 C ATOM 0 H VAL A 65 -2.863 -0.155 -3.994 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.031 -2.799 -3.471 1.00 0.00 H new ATOM 0 HB VAL A 65 -1.386 -0.870 -2.080 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -3.003 0.167 -0.543 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.454 0.420 -2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -4.309 -0.799 -1.271 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -1.781 -1.870 0.136 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.036 -2.919 -0.566 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.340 -3.099 -1.074 1.00 0.00 H new ATOM 868 N ASN A 66 -5.216 -2.140 -3.126 1.00 0.00 N ATOM 869 CA ASN A 66 -6.531 -2.732 -2.901 1.00 0.00 C ATOM 870 C ASN A 66 -6.824 -3.813 -3.936 1.00 0.00 C ATOM 871 O ASN A 66 -7.156 -4.947 -3.588 1.00 0.00 O ATOM 872 CB ASN A 66 -7.614 -1.652 -2.954 1.00 0.00 C ATOM 873 CG ASN A 66 -8.981 -2.220 -3.287 1.00 0.00 C ATOM 874 OD1 ASN A 66 -9.754 -2.569 -2.394 1.00 0.00 O ATOM 875 ND2 ASN A 66 -9.283 -2.318 -4.576 1.00 0.00 N ATOM 0 H ASN A 66 -5.239 -1.181 -3.473 1.00 0.00 H new ATOM 0 HA ASN A 66 -6.532 -3.191 -1.912 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -7.660 -1.140 -1.993 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.342 -0.905 -3.700 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -10.187 -2.695 -4.861 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -8.611 -2.016 -5.282 1.00 0.00 H new ATOM 881 N THR A 67 -6.699 -3.456 -5.210 1.00 0.00 N ATOM 882 CA THR A 67 -6.951 -4.396 -6.296 1.00 0.00 C ATOM 883 C THR A 67 -6.099 -5.650 -6.145 1.00 0.00 C ATOM 884 O THR A 67 -6.605 -6.771 -6.228 1.00 0.00 O ATOM 885 CB THR A 67 -6.666 -3.757 -7.668 1.00 0.00 C ATOM 886 OG1 THR A 67 -7.532 -2.636 -7.876 1.00 0.00 O ATOM 887 CG2 THR A 67 -6.862 -4.770 -8.786 1.00 0.00 C ATOM 0 H THR A 67 -6.425 -2.522 -5.516 1.00 0.00 H new ATOM 0 HA THR A 67 -8.005 -4.668 -6.242 1.00 0.00 H new ATOM 0 HB THR A 67 -5.629 -3.421 -7.680 1.00 0.00 H new ATOM 0 HG1 THR A 67 -7.250 -1.894 -7.301 1.00 0.00 H new ATOM 0 HG21 THR A 67 -6.655 -4.297 -9.746 1.00 0.00 H new ATOM 0 HG22 THR A 67 -6.181 -5.609 -8.641 1.00 0.00 H new ATOM 0 HG23 THR A 67 -7.890 -5.131 -8.773 1.00 0.00 H new ATOM 895 N LEU A 68 -4.803 -5.457 -5.924 1.00 0.00 N ATOM 896 CA LEU A 68 -3.879 -6.575 -5.761 1.00 0.00 C ATOM 897 C LEU A 68 -4.388 -7.553 -4.705 1.00 0.00 C ATOM 898 O LEU A 68 -4.288 -8.769 -4.870 1.00 0.00 O ATOM 899 CB LEU A 68 -2.491 -6.064 -5.371 1.00 0.00 C ATOM 900 CG LEU A 68 -1.741 -5.277 -6.446 1.00 0.00 C ATOM 901 CD1 LEU A 68 -0.672 -4.398 -5.815 1.00 0.00 C ATOM 902 CD2 LEU A 68 -1.122 -6.223 -7.465 1.00 0.00 C ATOM 0 H LEU A 68 -4.368 -4.537 -5.854 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.812 -7.099 -6.714 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.593 -5.431 -4.490 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.879 -6.918 -5.081 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.454 -4.634 -6.962 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -0.148 -3.845 -6.595 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.139 -3.696 -5.124 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.039 -5.022 -5.273 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.592 -5.646 -8.223 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.422 -6.891 -6.963 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.908 -6.811 -7.940 1.00 0.00 H new ATOM 913 N LEU A 69 -4.938 -7.013 -3.624 1.00 0.00 N ATOM 914 CA LEU A 69 -5.465 -7.837 -2.541 1.00 0.00 C ATOM 915 C LEU A 69 -6.566 -8.762 -3.049 1.00 0.00 C ATOM 916 O LEU A 69 -6.679 -9.907 -2.611 1.00 0.00 O ATOM 917 CB LEU A 69 -6.006 -6.952 -1.417 1.00 0.00 C ATOM 918 CG LEU A 69 -5.160 -6.895 -0.143 1.00 0.00 C ATOM 919 CD1 LEU A 69 -5.673 -5.808 0.789 1.00 0.00 C ATOM 920 CD2 LEU A 69 -5.159 -8.244 0.558 1.00 0.00 C ATOM 0 H LEU A 69 -5.031 -6.008 -3.473 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.651 -8.449 -2.153 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.117 -5.938 -1.801 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.003 -7.304 -1.152 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.134 -6.653 -0.421 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.060 -5.782 1.690 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.620 -4.843 0.286 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.707 -6.020 1.060 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.552 -8.184 1.462 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.180 -8.517 0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.744 -9.000 -0.108 1.00 0.00 H new ATOM 931 N ASP A 70 -7.373 -8.260 -3.975 1.00 0.00 N ATOM 932 CA ASP A 70 -8.464 -9.043 -4.546 1.00 0.00 C ATOM 933 C ASP A 70 -7.931 -10.084 -5.525 1.00 0.00 C ATOM 934 O ASP A 70 -8.494 -11.172 -5.657 1.00 0.00 O ATOM 935 CB ASP A 70 -9.463 -8.126 -5.253 1.00 0.00 C ATOM 936 CG ASP A 70 -10.902 -8.518 -4.980 1.00 0.00 C ATOM 937 OD1 ASP A 70 -11.371 -9.509 -5.578 1.00 0.00 O ATOM 938 OD2 ASP A 70 -11.559 -7.834 -4.169 1.00 0.00 O ATOM 0 H ASP A 70 -7.293 -7.314 -4.348 1.00 0.00 H new ATOM 0 HA ASP A 70 -8.971 -9.561 -3.732 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -9.301 -7.098 -4.928 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -9.280 -8.153 -6.327 1.00 0.00 H new ATOM 942 N VAL A 71 -6.842 -9.746 -6.207 1.00 0.00 N ATOM 943 CA VAL A 71 -6.233 -10.652 -7.173 1.00 0.00 C ATOM 944 C VAL A 71 -5.477 -11.776 -6.473 1.00 0.00 C ATOM 945 O VAL A 71 -5.424 -12.903 -6.965 1.00 0.00 O ATOM 946 CB VAL A 71 -5.266 -9.905 -8.111 1.00 0.00 C ATOM 947 CG1 VAL A 71 -4.727 -10.844 -9.180 1.00 0.00 C ATOM 948 CG2 VAL A 71 -5.956 -8.706 -8.741 1.00 0.00 C ATOM 0 H VAL A 71 -6.363 -8.851 -6.108 1.00 0.00 H new ATOM 0 HA VAL A 71 -7.045 -11.077 -7.763 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.423 -9.542 -7.522 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.046 -10.299 -9.833 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.193 -11.668 -8.705 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.555 -11.239 -9.768 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -5.258 -8.190 -9.401 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.818 -9.043 -9.317 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -6.287 -8.024 -7.958 1.00 0.00 H new ATOM 958 N ALA A 72 -4.896 -11.461 -5.320 1.00 0.00 N ATOM 959 CA ALA A 72 -4.145 -12.444 -4.549 1.00 0.00 C ATOM 960 C ALA A 72 -5.049 -13.581 -4.081 1.00 0.00 C ATOM 961 O ALA A 72 -4.693 -14.754 -4.191 1.00 0.00 O ATOM 962 CB ALA A 72 -3.470 -11.779 -3.359 1.00 0.00 C ATOM 0 H ALA A 72 -4.931 -10.532 -4.899 1.00 0.00 H new ATOM 0 HA ALA A 72 -3.377 -12.868 -5.197 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.913 -12.525 -2.793 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.786 -11.007 -3.713 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -4.226 -11.327 -2.717 1.00 0.00 H new ATOM 968 N GLN A 73 -6.218 -13.223 -3.557 1.00 0.00 N ATOM 969 CA GLN A 73 -7.171 -14.214 -3.071 1.00 0.00 C ATOM 970 C GLN A 73 -7.761 -15.015 -4.227 1.00 0.00 C ATOM 971 O GLN A 73 -8.044 -16.204 -4.090 1.00 0.00 O ATOM 972 CB GLN A 73 -8.291 -13.531 -2.284 1.00 0.00 C ATOM 973 CG GLN A 73 -7.789 -12.662 -1.142 1.00 0.00 C ATOM 974 CD GLN A 73 -8.818 -11.646 -0.687 1.00 0.00 C ATOM 975 OE1 GLN A 73 -9.731 -11.292 -1.434 1.00 0.00 O ATOM 976 NE2 GLN A 73 -8.676 -11.171 0.545 1.00 0.00 N ATOM 0 H GLN A 73 -6.527 -12.256 -3.459 1.00 0.00 H new ATOM 0 HA GLN A 73 -6.639 -14.900 -2.412 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.880 -12.917 -2.965 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.959 -14.293 -1.883 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.514 -13.298 -0.300 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.884 -12.142 -1.457 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.904 -11.492 1.130 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -9.339 -10.485 0.907 1.00 0.00 H new ATOM 983 N ALA A 74 -7.944 -14.354 -5.365 1.00 0.00 N ATOM 984 CA ALA A 74 -8.498 -15.005 -6.546 1.00 0.00 C ATOM 985 C ALA A 74 -7.488 -15.960 -7.172 1.00 0.00 C ATOM 986 O ALA A 74 -7.854 -17.011 -7.695 1.00 0.00 O ATOM 987 CB ALA A 74 -8.945 -13.964 -7.562 1.00 0.00 C ATOM 0 H ALA A 74 -7.717 -13.368 -5.494 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.365 -15.589 -6.236 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.356 -14.464 -8.439 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.708 -13.325 -7.117 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.091 -13.355 -7.859 1.00 0.00 H new ATOM 993 N ASN A 75 -6.214 -15.585 -7.116 1.00 0.00 N ATOM 994 CA ASN A 75 -5.150 -16.409 -7.680 1.00 0.00 C ATOM 995 C ASN A 75 -4.832 -17.588 -6.766 1.00 0.00 C ATOM 996 O ASN A 75 -4.537 -18.688 -7.234 1.00 0.00 O ATOM 997 CB ASN A 75 -3.891 -15.568 -7.904 1.00 0.00 C ATOM 998 CG ASN A 75 -3.907 -14.846 -9.237 1.00 0.00 C ATOM 999 OD1 ASN A 75 -4.978 -14.105 -9.495 1.00 0.00 O flip ATOM 1000 ND2 ASN A 75 -2.967 -14.953 -10.025 1.00 0.00 N flip ATOM 0 H ASN A 75 -5.893 -14.717 -6.687 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.495 -16.798 -8.638 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -3.797 -14.838 -7.100 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.013 -16.212 -7.854 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -2.164 -15.534 -9.785 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.992 -14.461 -10.918 1.00 0.00 H new ATOM 1006 N LEU A 76 -4.896 -17.351 -5.461 1.00 0.00 N ATOM 1007 CA LEU A 76 -4.616 -18.394 -4.480 1.00 0.00 C ATOM 1008 C LEU A 76 -5.821 -19.312 -4.302 1.00 0.00 C ATOM 1009 O LEU A 76 -5.672 -20.499 -4.015 1.00 0.00 O ATOM 1010 CB LEU A 76 -4.235 -17.769 -3.137 1.00 0.00 C ATOM 1011 CG LEU A 76 -2.919 -16.990 -3.108 1.00 0.00 C ATOM 1012 CD1 LEU A 76 -2.751 -16.275 -1.776 1.00 0.00 C ATOM 1013 CD2 LEU A 76 -1.743 -17.920 -3.369 1.00 0.00 C ATOM 0 H LEU A 76 -5.139 -16.446 -5.057 1.00 0.00 H new ATOM 0 HA LEU A 76 -3.780 -18.989 -4.848 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -5.038 -17.098 -2.830 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.181 -18.563 -2.392 1.00 0.00 H new ATOM 0 HG LEU A 76 -2.945 -16.240 -3.898 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.809 -15.726 -1.774 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -3.577 -15.579 -1.630 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.746 -17.007 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.815 -17.349 -3.345 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.713 -18.693 -2.601 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -1.857 -18.385 -4.348 1.00 0.00 H new ATOM 1024 N GLY A 77 -7.015 -18.754 -4.477 1.00 0.00 N ATOM 1025 CA GLY A 77 -8.228 -19.537 -4.334 1.00 0.00 C ATOM 1026 C GLY A 77 -8.621 -19.739 -2.883 1.00 0.00 C ATOM 1027 O GLY A 77 -9.671 -19.268 -2.447 1.00 0.00 O ATOM 0 H GLY A 77 -7.164 -17.773 -4.715 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -9.042 -19.040 -4.862 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -8.087 -20.509 -4.808 1.00 0.00 H new ATOM 1031 N GLU A 78 -7.777 -20.441 -2.135 1.00 0.00 N ATOM 1032 CA GLU A 78 -8.043 -20.705 -0.726 1.00 0.00 C ATOM 1033 C GLU A 78 -8.340 -19.409 0.024 1.00 0.00 C ATOM 1034 O GLU A 78 -9.279 -19.340 0.817 1.00 0.00 O ATOM 1035 CB GLU A 78 -6.852 -21.417 -0.083 1.00 0.00 C ATOM 1036 CG GLU A 78 -7.094 -22.893 0.180 1.00 0.00 C ATOM 1037 CD GLU A 78 -7.540 -23.167 1.604 1.00 0.00 C ATOM 1038 OE1 GLU A 78 -8.761 -23.127 1.860 1.00 0.00 O ATOM 1039 OE2 GLU A 78 -6.668 -23.420 2.461 1.00 0.00 O ATOM 0 H GLU A 78 -6.903 -20.837 -2.481 1.00 0.00 H new ATOM 0 HA GLU A 78 -8.919 -21.350 -0.664 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -5.982 -21.310 -0.732 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.610 -20.924 0.858 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -7.852 -23.262 -0.511 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.179 -23.449 -0.024 1.00 0.00 H new ATOM 1044 N ALA A 79 -7.533 -18.385 -0.234 1.00 0.00 N ATOM 1045 CA ALA A 79 -7.709 -17.091 0.415 1.00 0.00 C ATOM 1046 C ALA A 79 -9.104 -16.531 0.153 1.00 0.00 C ATOM 1047 O ALA A 79 -9.784 -16.081 1.073 1.00 0.00 O ATOM 1048 CB ALA A 79 -6.647 -16.113 -0.062 1.00 0.00 C ATOM 0 H ALA A 79 -6.751 -18.426 -0.888 1.00 0.00 H new ATOM 0 HA ALA A 79 -7.599 -17.233 1.490 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -6.790 -15.151 0.431 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -5.658 -16.502 0.182 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -6.730 -15.984 -1.141 1.00 0.00 H new ATOM 1054 N ALA A 80 -9.521 -16.564 -1.108 1.00 0.00 N ATOM 1055 CA ALA A 80 -10.834 -16.061 -1.492 1.00 0.00 C ATOM 1056 C ALA A 80 -11.937 -17.024 -1.066 1.00 0.00 C ATOM 1057 O ALA A 80 -11.664 -18.102 -0.539 1.00 0.00 O ATOM 1058 CB ALA A 80 -10.891 -15.821 -2.993 1.00 0.00 C ATOM 0 H ALA A 80 -8.968 -16.934 -1.881 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.996 -15.113 -0.978 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -11.878 -15.446 -3.264 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -10.134 -15.088 -3.273 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -10.702 -16.757 -3.519 1.00 0.00 H new ATOM 1064 N GLY A 81 -13.185 -16.628 -1.297 1.00 0.00 N ATOM 1065 CA GLY A 81 -14.310 -17.469 -0.931 1.00 0.00 C ATOM 1066 C GLY A 81 -15.617 -16.702 -0.886 1.00 0.00 C ATOM 1067 O GLY A 81 -15.628 -15.473 -0.966 1.00 0.00 O ATOM 0 H GLY A 81 -13.437 -15.740 -1.731 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -14.397 -18.286 -1.647 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -14.122 -17.918 0.044 1.00 0.00 H new ATOM 1071 N THR A 82 -16.723 -17.427 -0.758 1.00 0.00 N ATOM 1072 CA THR A 82 -18.041 -16.808 -0.706 1.00 0.00 C ATOM 1073 C THR A 82 -18.360 -16.081 -2.007 1.00 0.00 C ATOM 1074 O THR A 82 -17.813 -15.013 -2.283 1.00 0.00 O ATOM 1075 CB THR A 82 -18.147 -15.811 0.464 1.00 0.00 C ATOM 1076 OG1 THR A 82 -17.741 -16.442 1.683 1.00 0.00 O ATOM 1077 CG2 THR A 82 -19.571 -15.293 0.606 1.00 0.00 C ATOM 0 H THR A 82 -16.732 -18.445 -0.688 1.00 0.00 H new ATOM 0 HA THR A 82 -18.761 -17.612 -0.557 1.00 0.00 H new ATOM 0 HB THR A 82 -17.489 -14.968 0.255 1.00 0.00 H new ATOM 0 HG1 THR A 82 -17.810 -15.801 2.422 1.00 0.00 H new ATOM 0 HG21 THR A 82 -19.621 -14.591 1.438 1.00 0.00 H new ATOM 0 HG22 THR A 82 -19.868 -14.788 -0.313 1.00 0.00 H new ATOM 0 HG23 THR A 82 -20.245 -16.129 0.795 1.00 0.00 H new ATOM 1085 N TYR A 83 -19.248 -16.665 -2.804 1.00 0.00 N ATOM 1086 CA TYR A 83 -19.638 -16.074 -4.078 1.00 0.00 C ATOM 1087 C TYR A 83 -21.131 -16.263 -4.333 1.00 0.00 C ATOM 1088 O TYR A 83 -21.784 -17.081 -3.685 1.00 0.00 O ATOM 1089 CB TYR A 83 -18.831 -16.695 -5.220 1.00 0.00 C ATOM 1090 CG TYR A 83 -19.438 -17.968 -5.767 1.00 0.00 C ATOM 1091 CD1 TYR A 83 -20.379 -17.930 -6.788 1.00 0.00 C ATOM 1092 CD2 TYR A 83 -19.068 -19.209 -5.261 1.00 0.00 C ATOM 1093 CE1 TYR A 83 -20.935 -19.091 -7.289 1.00 0.00 C ATOM 1094 CE2 TYR A 83 -19.619 -20.374 -5.758 1.00 0.00 C ATOM 1095 CZ TYR A 83 -20.552 -20.310 -6.772 1.00 0.00 C ATOM 1096 OH TYR A 83 -21.104 -21.469 -7.268 1.00 0.00 O ATOM 0 H TYR A 83 -19.712 -17.548 -2.590 1.00 0.00 H new ATOM 0 HA TYR A 83 -19.429 -15.005 -4.033 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -18.742 -15.969 -6.028 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -17.821 -16.906 -4.868 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -20.681 -16.977 -7.197 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -18.338 -19.263 -4.467 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -21.666 -19.044 -8.082 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -19.321 -21.330 -5.355 1.00 0.00 H new ATOM 0 HH TYR A 83 -20.726 -22.240 -6.796 1.00 0.00 H new ATOM 1105 N VAL A 84 -21.663 -15.500 -5.282 1.00 0.00 N ATOM 1106 CA VAL A 84 -23.078 -15.583 -5.624 1.00 0.00 C ATOM 1107 C VAL A 84 -23.291 -15.405 -7.123 1.00 0.00 C ATOM 1108 O VAL A 84 -23.680 -14.331 -7.582 1.00 0.00 O ATOM 1109 CB VAL A 84 -23.902 -14.521 -4.870 1.00 0.00 C ATOM 1110 CG1 VAL A 84 -25.387 -14.709 -5.138 1.00 0.00 C ATOM 1111 CG2 VAL A 84 -23.609 -14.582 -3.379 1.00 0.00 C ATOM 0 H VAL A 84 -21.136 -14.818 -5.827 1.00 0.00 H new ATOM 0 HA VAL A 84 -23.418 -16.575 -5.326 1.00 0.00 H new ATOM 0 HB VAL A 84 -23.614 -13.535 -5.234 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -25.953 -13.950 -4.598 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -25.579 -14.612 -6.207 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -25.695 -15.699 -4.802 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -24.199 -13.826 -2.861 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -23.869 -15.569 -2.997 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -22.549 -14.395 -3.209 1.00 0.00 H new ATOM 1121 N ALA A 85 -23.036 -16.466 -7.881 1.00 0.00 N ATOM 1122 CA ALA A 85 -23.203 -16.428 -9.329 1.00 0.00 C ATOM 1123 C ALA A 85 -24.677 -16.479 -9.713 1.00 0.00 C ATOM 1124 O ALA A 85 -25.148 -17.466 -10.277 1.00 0.00 O ATOM 1125 CB ALA A 85 -22.448 -17.579 -9.977 1.00 0.00 C ATOM 0 H ALA A 85 -22.713 -17.362 -7.517 1.00 0.00 H new ATOM 0 HA ALA A 85 -22.792 -15.486 -9.693 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -22.581 -17.539 -11.058 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -21.387 -17.498 -9.739 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -22.834 -18.526 -9.599 1.00 0.00 H new ATOM 1131 N ALA A 86 -25.401 -15.408 -9.404 1.00 0.00 N ATOM 1132 CA ALA A 86 -26.823 -15.330 -9.718 1.00 0.00 C ATOM 1133 C ALA A 86 -27.085 -14.309 -10.821 1.00 0.00 C ATOM 1134 O ALA A 86 -27.992 -14.482 -11.636 1.00 0.00 O ATOM 1135 CB ALA A 86 -27.621 -14.980 -8.471 1.00 0.00 C ATOM 0 H ALA A 86 -25.026 -14.582 -8.937 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.145 -16.307 -10.078 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -28.681 -14.925 -8.721 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -27.466 -15.747 -7.713 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.289 -14.016 -8.085 1.00 0.00 H new ATOM 1141 N ASP A 87 -26.290 -13.247 -10.838 1.00 0.00 N ATOM 1142 CA ASP A 87 -26.437 -12.198 -11.841 1.00 0.00 C ATOM 1143 C ASP A 87 -27.821 -11.562 -11.763 1.00 0.00 C ATOM 1144 O ASP A 87 -28.626 -11.907 -10.899 1.00 0.00 O ATOM 1145 CB ASP A 87 -26.200 -12.765 -13.241 1.00 0.00 C ATOM 1146 CG ASP A 87 -25.027 -12.107 -13.942 1.00 0.00 C ATOM 1147 OD1 ASP A 87 -24.917 -10.865 -13.876 1.00 0.00 O ATOM 1148 OD2 ASP A 87 -24.219 -12.835 -14.556 1.00 0.00 O ATOM 0 H ASP A 87 -25.537 -13.088 -10.169 1.00 0.00 H new ATOM 0 HA ASP A 87 -25.692 -11.429 -11.639 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -26.021 -13.838 -13.170 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -27.100 -12.631 -13.841 1.00 0.00 H new ATOM 1152 N ALA A 88 -28.091 -10.631 -12.673 1.00 0.00 N ATOM 1153 CA ALA A 88 -29.377 -9.947 -12.708 1.00 0.00 C ATOM 1154 C ALA A 88 -30.382 -10.711 -13.564 1.00 0.00 C ATOM 1155 O ALA A 88 -30.004 -11.548 -14.384 1.00 0.00 O ATOM 1156 CB ALA A 88 -29.207 -8.528 -13.230 1.00 0.00 C ATOM 0 H ALA A 88 -27.435 -10.334 -13.396 1.00 0.00 H new ATOM 0 HA ALA A 88 -29.765 -9.903 -11.690 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -30.176 -8.029 -13.251 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -28.530 -7.978 -12.576 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -28.793 -8.558 -14.238 1.00 0.00 H new ATOM 1162 N ALA A 89 -31.664 -10.418 -13.369 1.00 0.00 N ATOM 1163 CA ALA A 89 -32.721 -11.076 -14.125 1.00 0.00 C ATOM 1164 C ALA A 89 -32.862 -10.470 -15.517 1.00 0.00 C ATOM 1165 O ALA A 89 -33.096 -11.180 -16.494 1.00 0.00 O ATOM 1166 CB ALA A 89 -34.041 -10.987 -13.373 1.00 0.00 C ATOM 0 H ALA A 89 -31.995 -9.729 -12.694 1.00 0.00 H new ATOM 0 HA ALA A 89 -32.450 -12.125 -14.241 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -34.822 -11.483 -13.949 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -33.941 -11.474 -12.403 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -34.307 -9.940 -13.227 1.00 0.00 H new ATOM 1172 N ALA A 90 -32.717 -9.151 -15.600 1.00 0.00 N ATOM 1173 CA ALA A 90 -32.826 -8.448 -16.872 1.00 0.00 C ATOM 1174 C ALA A 90 -31.465 -8.318 -17.546 1.00 0.00 C ATOM 1175 O ALA A 90 -31.295 -7.532 -18.477 1.00 0.00 O ATOM 1176 CB ALA A 90 -33.449 -7.075 -16.666 1.00 0.00 C ATOM 0 H ALA A 90 -32.524 -8.548 -14.800 1.00 0.00 H new ATOM 0 HA ALA A 90 -33.472 -9.033 -17.527 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -33.524 -6.562 -17.625 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -34.444 -7.188 -16.236 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -32.826 -6.490 -15.989 1.00 0.00 H new ATOM 1182 N ALA A 91 -30.496 -9.094 -17.069 1.00 0.00 N ATOM 1183 CA ALA A 91 -29.150 -9.067 -17.626 1.00 0.00 C ATOM 1184 C ALA A 91 -29.161 -9.433 -19.107 1.00 0.00 C ATOM 1185 O ALA A 91 -28.725 -8.652 -19.952 1.00 0.00 O ATOM 1186 CB ALA A 91 -28.239 -10.009 -16.853 1.00 0.00 C ATOM 0 H ALA A 91 -30.619 -9.749 -16.297 1.00 0.00 H new ATOM 0 HA ALA A 91 -28.765 -8.051 -17.533 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -27.237 -9.978 -17.281 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -28.198 -9.700 -15.809 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -28.629 -11.025 -16.915 1.00 0.00 H new ATOM 1192 N SER A 92 -29.662 -10.626 -19.412 1.00 0.00 N ATOM 1193 CA SER A 92 -29.725 -11.097 -20.790 1.00 0.00 C ATOM 1194 C SER A 92 -31.163 -11.405 -21.193 1.00 0.00 C ATOM 1195 O SER A 92 -31.930 -11.978 -20.418 1.00 0.00 O ATOM 1196 CB SER A 92 -28.857 -12.346 -20.965 1.00 0.00 C ATOM 1197 OG SER A 92 -29.537 -13.506 -20.520 1.00 0.00 O ATOM 0 H SER A 92 -30.030 -11.283 -18.724 1.00 0.00 H new ATOM 0 HA SER A 92 -29.346 -10.305 -21.436 1.00 0.00 H new ATOM 0 HB2 SER A 92 -28.586 -12.460 -22.015 1.00 0.00 H new ATOM 0 HB3 SER A 92 -27.928 -12.228 -20.407 1.00 0.00 H new ATOM 0 HG SER A 92 -28.962 -14.290 -20.644 1.00 0.00 H new ATOM 1202 N THR A 93 -31.524 -11.020 -22.414 1.00 0.00 N ATOM 1203 CA THR A 93 -32.870 -11.253 -22.923 1.00 0.00 C ATOM 1204 C THR A 93 -32.892 -11.247 -24.446 1.00 0.00 C ATOM 1205 O THR A 93 -33.189 -12.261 -25.077 1.00 0.00 O ATOM 1206 CB THR A 93 -33.858 -10.191 -22.401 1.00 0.00 C ATOM 1207 OG1 THR A 93 -33.140 -9.058 -21.902 1.00 0.00 O ATOM 1208 CG2 THR A 93 -34.739 -10.764 -21.302 1.00 0.00 C ATOM 0 H THR A 93 -30.902 -10.545 -23.069 1.00 0.00 H new ATOM 0 HA THR A 93 -33.179 -12.235 -22.564 1.00 0.00 H new ATOM 0 HB THR A 93 -34.495 -9.881 -23.230 1.00 0.00 H new ATOM 0 HG1 THR A 93 -33.209 -8.319 -22.542 1.00 0.00 H new ATOM 0 HG21 THR A 93 -35.427 -9.996 -20.950 1.00 0.00 H new ATOM 0 HG22 THR A 93 -35.307 -11.608 -21.694 1.00 0.00 H new ATOM 0 HG23 THR A 93 -34.115 -11.099 -20.473 1.00 0.00 H new ATOM 1216 N TYR A 94 -32.574 -10.097 -25.033 1.00 0.00 N ATOM 1217 CA TYR A 94 -32.559 -9.959 -26.484 1.00 0.00 C ATOM 1218 C TYR A 94 -31.173 -9.557 -26.978 1.00 0.00 C ATOM 1219 O TYR A 94 -30.731 -9.985 -28.045 1.00 0.00 O ATOM 1220 CB TYR A 94 -33.592 -8.923 -26.930 1.00 0.00 C ATOM 1221 CG TYR A 94 -33.514 -7.622 -26.163 1.00 0.00 C ATOM 1222 CD1 TYR A 94 -34.144 -7.479 -24.933 1.00 0.00 C ATOM 1223 CD2 TYR A 94 -32.810 -6.536 -26.670 1.00 0.00 C ATOM 1224 CE1 TYR A 94 -34.076 -6.292 -24.229 1.00 0.00 C ATOM 1225 CE2 TYR A 94 -32.737 -5.345 -25.971 1.00 0.00 C ATOM 1226 CZ TYR A 94 -33.371 -5.229 -24.753 1.00 0.00 C ATOM 1227 OH TYR A 94 -33.300 -4.045 -24.055 1.00 0.00 O ATOM 0 H TYR A 94 -32.324 -9.248 -24.526 1.00 0.00 H new ATOM 0 HA TYR A 94 -32.814 -10.926 -26.918 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -33.454 -8.718 -27.992 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -34.591 -9.344 -26.814 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -34.696 -8.310 -24.520 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -32.312 -6.624 -27.625 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -34.572 -6.197 -23.274 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -32.186 -4.510 -26.378 1.00 0.00 H new ATOM 0 HH TYR A 94 -32.765 -3.398 -24.561 1.00 0.00 H new ATOM 1236 N THR A 95 -30.488 -8.730 -26.193 1.00 0.00 N ATOM 1237 CA THR A 95 -29.153 -8.268 -26.549 1.00 0.00 C ATOM 1238 C THR A 95 -29.154 -7.577 -27.908 1.00 0.00 C ATOM 1239 O THR A 95 -30.197 -7.444 -28.547 1.00 0.00 O ATOM 1240 CB THR A 95 -28.145 -9.432 -26.580 1.00 0.00 C ATOM 1241 OG1 THR A 95 -28.742 -10.611 -26.029 1.00 0.00 O ATOM 1242 CG2 THR A 95 -26.888 -9.081 -25.797 1.00 0.00 C ATOM 0 H THR A 95 -30.837 -8.367 -25.306 1.00 0.00 H new ATOM 0 HA THR A 95 -28.851 -7.555 -25.782 1.00 0.00 H new ATOM 0 HB THR A 95 -27.868 -9.616 -27.618 1.00 0.00 H new ATOM 0 HG1 THR A 95 -28.096 -11.347 -26.054 1.00 0.00 H new ATOM 0 HG21 THR A 95 -26.191 -9.918 -25.833 1.00 0.00 H new ATOM 0 HG22 THR A 95 -26.420 -8.200 -26.236 1.00 0.00 H new ATOM 0 HG23 THR A 95 -27.152 -8.873 -24.760 1.00 0.00 H new ATOM 1250 N GLY A 96 -27.978 -7.137 -28.344 1.00 0.00 N ATOM 1251 CA GLY A 96 -27.866 -6.463 -29.626 1.00 0.00 C ATOM 1252 C GLY A 96 -28.348 -7.325 -30.776 1.00 0.00 C ATOM 1253 O GLY A 96 -27.626 -8.203 -31.249 1.00 0.00 O ATOM 0 H GLY A 96 -27.101 -7.235 -27.833 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -28.445 -5.540 -29.600 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -26.827 -6.183 -29.796 1.00 0.00 H new ATOM 1257 N PHE A 97 -29.572 -7.075 -31.228 1.00 0.00 N ATOM 1258 CA PHE A 97 -30.151 -7.836 -32.328 1.00 0.00 C ATOM 1259 C PHE A 97 -29.333 -7.656 -33.603 1.00 0.00 C ATOM 1260 O PHE A 97 -28.590 -6.682 -33.711 1.00 0.00 O ATOM 1261 CB PHE A 97 -31.598 -7.400 -32.572 1.00 0.00 C ATOM 1262 CG PHE A 97 -31.726 -5.973 -33.020 1.00 0.00 C ATOM 1263 CD1 PHE A 97 -31.852 -4.950 -32.094 1.00 0.00 C ATOM 1264 CD2 PHE A 97 -31.722 -5.653 -34.369 1.00 0.00 C ATOM 1265 CE1 PHE A 97 -31.969 -3.635 -32.502 1.00 0.00 C ATOM 1266 CE2 PHE A 97 -31.839 -4.340 -34.783 1.00 0.00 C ATOM 1267 CZ PHE A 97 -31.965 -3.329 -33.849 1.00 0.00 C ATOM 0 H PHE A 97 -30.182 -6.351 -30.849 1.00 0.00 H new ATOM 0 HA PHE A 97 -30.138 -8.891 -32.054 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -32.043 -8.050 -33.325 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -32.170 -7.537 -31.654 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -31.859 -5.183 -31.040 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -31.626 -6.438 -35.104 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -32.063 -2.848 -31.769 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -31.832 -4.104 -35.837 1.00 0.00 H new ATOM 0 HZ PHE A 97 -32.060 -2.303 -34.171 1.00 0.00 H new TER 1276 PHE A 97 ATOM 1277 N SER B 601 5.898 14.536 -14.224 1.00 0.00 N ATOM 1278 CA SER B 601 6.738 15.729 -14.262 1.00 0.00 C ATOM 1279 C SER B 601 6.694 16.467 -12.927 1.00 0.00 C ATOM 1280 O SER B 601 5.620 16.777 -12.411 1.00 0.00 O ATOM 1281 CB SER B 601 6.285 16.661 -15.387 1.00 0.00 C ATOM 1282 OG SER B 601 7.297 17.597 -15.713 1.00 0.00 O ATOM 0 HA SER B 601 7.765 15.415 -14.450 1.00 0.00 H new ATOM 0 HB2 SER B 601 6.031 16.074 -16.269 1.00 0.00 H new ATOM 0 HB3 SER B 601 5.381 17.189 -15.084 1.00 0.00 H new ATOM 0 HG SER B 601 6.983 18.180 -16.436 1.00 0.00 H new ATOM 1287 N MET B 602 7.870 16.744 -12.373 1.00 0.00 N ATOM 1288 CA MET B 602 7.967 17.447 -11.099 1.00 0.00 C ATOM 1289 C MET B 602 9.162 18.394 -11.090 1.00 0.00 C ATOM 1290 O MET B 602 9.837 18.566 -12.105 1.00 0.00 O ATOM 1291 CB MET B 602 8.087 16.445 -9.948 1.00 0.00 C ATOM 1292 CG MET B 602 6.905 15.494 -9.845 1.00 0.00 C ATOM 1293 SD MET B 602 6.982 14.447 -8.378 1.00 0.00 S ATOM 1294 CE MET B 602 6.290 15.545 -7.143 1.00 0.00 C ATOM 0 H MET B 602 8.768 16.493 -12.786 1.00 0.00 H new ATOM 0 HA MET B 602 7.059 18.035 -10.967 1.00 0.00 H new ATOM 0 HB2 MET B 602 9.000 15.864 -10.076 1.00 0.00 H new ATOM 0 HB3 MET B 602 8.186 16.991 -9.010 1.00 0.00 H new ATOM 0 HG2 MET B 602 5.980 16.071 -9.827 1.00 0.00 H new ATOM 0 HG3 MET B 602 6.871 14.865 -10.734 1.00 0.00 H new ATOM 0 HE1 MET B 602 6.270 15.040 -6.177 1.00 0.00 H new ATOM 0 HE2 MET B 602 6.903 16.443 -7.070 1.00 0.00 H new ATOM 0 HE3 MET B 602 5.275 15.821 -7.429 1.00 0.00 H new ATOM 1302 N SER B 603 9.418 19.006 -9.938 1.00 0.00 N ATOM 1303 CA SER B 603 10.530 19.940 -9.799 1.00 0.00 C ATOM 1304 C SER B 603 10.205 21.274 -10.464 1.00 0.00 C ATOM 1305 O SER B 603 10.297 22.330 -9.839 1.00 0.00 O ATOM 1306 CB SER B 603 11.800 19.348 -10.412 1.00 0.00 C ATOM 1307 OG SER B 603 12.212 20.089 -11.547 1.00 0.00 O ATOM 0 H SER B 603 8.871 18.872 -9.088 1.00 0.00 H new ATOM 0 HA SER B 603 10.695 20.114 -8.736 1.00 0.00 H new ATOM 0 HB2 SER B 603 12.597 19.342 -9.669 1.00 0.00 H new ATOM 0 HB3 SER B 603 11.621 18.311 -10.696 1.00 0.00 H new ATOM 0 HG SER B 603 13.027 19.691 -11.919 1.00 0.00 H new ATOM 1312 N GLN B 604 9.824 21.218 -11.737 1.00 0.00 N ATOM 1313 CA GLN B 604 9.486 22.421 -12.487 1.00 0.00 C ATOM 1314 C GLN B 604 8.207 23.054 -11.953 1.00 0.00 C ATOM 1315 O GLN B 604 7.854 24.173 -12.326 1.00 0.00 O ATOM 1316 CB GLN B 604 9.326 22.092 -13.973 1.00 0.00 C ATOM 1317 CG GLN B 604 8.133 21.198 -14.273 1.00 0.00 C ATOM 1318 CD GLN B 604 7.237 21.766 -15.355 1.00 0.00 C ATOM 1319 OE1 GLN B 604 7.065 21.162 -16.415 1.00 0.00 O ATOM 1320 NE2 GLN B 604 6.658 22.932 -15.094 1.00 0.00 N ATOM 0 H GLN B 604 9.742 20.352 -12.270 1.00 0.00 H new ATOM 0 HA GLN B 604 10.300 23.136 -12.366 1.00 0.00 H new ATOM 0 HB2 GLN B 604 9.223 23.021 -14.533 1.00 0.00 H new ATOM 0 HB3 GLN B 604 10.234 21.604 -14.328 1.00 0.00 H new ATOM 0 HG2 GLN B 604 8.489 20.215 -14.580 1.00 0.00 H new ATOM 0 HG3 GLN B 604 7.551 21.056 -13.362 1.00 0.00 H new ATOM 0 HE21 GLN B 604 6.828 23.398 -14.203 1.00 0.00 H new ATOM 0 HE22 GLN B 604 6.043 23.362 -15.785 1.00 0.00 H new ATOM 1327 N ILE B 605 7.514 22.331 -11.078 1.00 0.00 N ATOM 1328 CA ILE B 605 6.274 22.822 -10.493 1.00 0.00 C ATOM 1329 C ILE B 605 6.468 24.202 -9.872 1.00 0.00 C ATOM 1330 O ILE B 605 5.999 25.206 -10.405 1.00 0.00 O ATOM 1331 CB ILE B 605 5.737 21.858 -9.419 1.00 0.00 C ATOM 1332 CG1 ILE B 605 5.709 20.426 -9.955 1.00 0.00 C ATOM 1333 CG2 ILE B 605 4.349 22.288 -8.967 1.00 0.00 C ATOM 1334 CD1 ILE B 605 5.052 20.303 -11.313 1.00 0.00 C ATOM 0 H ILE B 605 7.792 21.403 -10.759 1.00 0.00 H new ATOM 0 HA ILE B 605 5.548 22.890 -11.303 1.00 0.00 H new ATOM 0 HB ILE B 605 6.404 21.890 -8.558 1.00 0.00 H new ATOM 0 HG12 ILE B 605 6.730 20.050 -10.019 1.00 0.00 H new ATOM 0 HG13 ILE B 605 5.179 19.791 -9.245 1.00 0.00 H new ATOM 0 HG21 ILE B 605 3.983 21.597 -8.208 1.00 0.00 H new ATOM 0 HG22 ILE B 605 4.398 23.293 -8.549 1.00 0.00 H new ATOM 0 HG23 ILE B 605 3.671 22.282 -9.820 1.00 0.00 H new ATOM 0 HD11 ILE B 605 5.067 19.261 -11.632 1.00 0.00 H new ATOM 0 HD12 ILE B 605 4.020 20.648 -11.251 1.00 0.00 H new ATOM 0 HD13 ILE B 605 5.595 20.911 -12.036 1.00 0.00 H new ATOM 1345 N MET B 606 7.165 24.242 -8.740 1.00 0.00 N ATOM 1346 CA MET B 606 7.425 25.498 -8.048 1.00 0.00 C ATOM 1347 C MET B 606 8.213 25.259 -6.763 1.00 0.00 C ATOM 1348 O MET B 606 7.864 25.778 -5.704 1.00 0.00 O ATOM 1349 CB MET B 606 6.110 26.210 -7.727 1.00 0.00 C ATOM 1350 CG MET B 606 5.047 25.290 -7.148 1.00 0.00 C ATOM 1351 SD MET B 606 4.238 25.989 -5.695 1.00 0.00 S ATOM 1352 CE MET B 606 3.797 27.615 -6.304 1.00 0.00 C ATOM 0 H MET B 606 7.559 23.419 -8.284 1.00 0.00 H new ATOM 0 HA MET B 606 8.021 26.129 -8.707 1.00 0.00 H new ATOM 0 HB2 MET B 606 6.306 27.016 -7.020 1.00 0.00 H new ATOM 0 HB3 MET B 606 5.724 26.671 -8.636 1.00 0.00 H new ATOM 0 HG2 MET B 606 4.297 25.082 -7.911 1.00 0.00 H new ATOM 0 HG3 MET B 606 5.503 24.337 -6.881 1.00 0.00 H new ATOM 0 HE1 MET B 606 2.892 27.958 -5.803 1.00 0.00 H new ATOM 0 HE2 MET B 606 4.610 28.312 -6.102 1.00 0.00 H new ATOM 0 HE3 MET B 606 3.620 27.566 -7.378 1.00 0.00 H new ATOM 1360 N TYR B 607 9.277 24.469 -6.867 1.00 0.00 N ATOM 1361 CA TYR B 607 10.113 24.158 -5.713 1.00 0.00 C ATOM 1362 C TYR B 607 11.543 24.643 -5.931 1.00 0.00 C ATOM 1363 O TYR B 607 12.060 24.605 -7.047 1.00 0.00 O ATOM 1364 CB TYR B 607 10.107 22.652 -5.444 1.00 0.00 C ATOM 1365 CG TYR B 607 8.775 21.993 -5.719 1.00 0.00 C ATOM 1366 CD1 TYR B 607 7.592 22.546 -5.243 1.00 0.00 C ATOM 1367 CD2 TYR B 607 8.698 20.818 -6.456 1.00 0.00 C ATOM 1368 CE1 TYR B 607 6.373 21.946 -5.490 1.00 0.00 C ATOM 1369 CE2 TYR B 607 7.483 20.212 -6.710 1.00 0.00 C ATOM 1370 CZ TYR B 607 6.323 20.780 -6.225 1.00 0.00 C ATOM 1371 OH TYR B 607 5.110 20.180 -6.476 1.00 0.00 O ATOM 0 H TYR B 607 9.580 24.033 -7.738 1.00 0.00 H new ATOM 0 HA TYR B 607 9.701 24.676 -4.847 1.00 0.00 H new ATOM 0 HB2 TYR B 607 10.871 22.178 -6.060 1.00 0.00 H new ATOM 0 HB3 TYR B 607 10.382 22.476 -4.404 1.00 0.00 H new ATOM 0 HD1 TYR B 607 7.627 23.461 -4.670 1.00 0.00 H new ATOM 0 HD2 TYR B 607 9.604 20.370 -6.837 1.00 0.00 H new ATOM 0 HE1 TYR B 607 5.464 22.387 -5.110 1.00 0.00 H new ATOM 0 HE2 TYR B 607 7.441 19.299 -7.285 1.00 0.00 H new ATOM 0 HH TYR B 607 5.250 19.369 -7.008 1.00 0.00 H new ATOM 1380 N ASN B 608 12.178 25.096 -4.855 1.00 0.00 N ATOM 1381 CA ASN B 608 13.549 25.587 -4.926 1.00 0.00 C ATOM 1382 C ASN B 608 14.457 24.806 -3.981 1.00 0.00 C ATOM 1383 O ASN B 608 15.616 24.535 -4.298 1.00 0.00 O ATOM 1384 CB ASN B 608 13.597 27.077 -4.582 1.00 0.00 C ATOM 1385 CG ASN B 608 14.261 27.900 -5.670 1.00 0.00 C ATOM 1386 OD1 ASN B 608 14.023 27.687 -6.859 1.00 0.00 O ATOM 1387 ND2 ASN B 608 15.103 28.845 -5.266 1.00 0.00 N ATOM 0 H ASN B 608 11.765 25.133 -3.923 1.00 0.00 H new ATOM 0 HA ASN B 608 13.907 25.444 -5.945 1.00 0.00 H new ATOM 0 HB2 ASN B 608 12.583 27.443 -4.421 1.00 0.00 H new ATOM 0 HB3 ASN B 608 14.138 27.214 -3.645 1.00 0.00 H new ATOM 0 HD21 ASN B 608 15.582 29.429 -5.952 1.00 0.00 H new ATOM 0 HD22 ASN B 608 15.271 28.987 -4.270 1.00 0.00 H new ATOM 1393 N TYR B 609 13.922 24.446 -2.819 1.00 0.00 N ATOM 1394 CA TYR B 609 14.685 23.698 -1.826 1.00 0.00 C ATOM 1395 C TYR B 609 13.940 22.433 -1.408 1.00 0.00 C ATOM 1396 O TYR B 609 13.100 22.445 -0.508 1.00 0.00 O ATOM 1397 CB TYR B 609 14.959 24.570 -0.600 1.00 0.00 C ATOM 1398 CG TYR B 609 16.225 25.389 -0.710 1.00 0.00 C ATOM 1399 CD1 TYR B 609 16.312 26.453 -1.599 1.00 0.00 C ATOM 1400 CD2 TYR B 609 17.335 25.098 0.073 1.00 0.00 C ATOM 1401 CE1 TYR B 609 17.467 27.204 -1.705 1.00 0.00 C ATOM 1402 CE2 TYR B 609 18.494 25.844 -0.024 1.00 0.00 C ATOM 1403 CZ TYR B 609 18.554 26.895 -0.915 1.00 0.00 C ATOM 1404 OH TYR B 609 19.707 27.641 -1.016 1.00 0.00 O ATOM 0 H TYR B 609 12.964 24.660 -2.542 1.00 0.00 H new ATOM 0 HA TYR B 609 15.634 23.408 -2.276 1.00 0.00 H new ATOM 0 HB2 TYR B 609 14.114 25.241 -0.446 1.00 0.00 H new ATOM 0 HB3 TYR B 609 15.024 23.932 0.282 1.00 0.00 H new ATOM 0 HD1 TYR B 609 15.462 26.698 -2.218 1.00 0.00 H new ATOM 0 HD2 TYR B 609 17.291 24.274 0.770 1.00 0.00 H new ATOM 0 HE1 TYR B 609 17.518 28.027 -2.402 1.00 0.00 H new ATOM 0 HE2 TYR B 609 19.347 25.606 0.594 1.00 0.00 H new ATOM 0 HH TYR B 609 20.377 27.294 -0.391 1.00 0.00 H new ATOM 1413 N PRO B 610 14.256 21.314 -2.078 1.00 0.00 N ATOM 1414 CA PRO B 610 13.631 20.019 -1.794 1.00 0.00 C ATOM 1415 C PRO B 610 14.060 19.451 -0.445 1.00 0.00 C ATOM 1416 O PRO B 610 13.415 18.553 0.095 1.00 0.00 O ATOM 1417 CB PRO B 610 14.129 19.127 -2.933 1.00 0.00 C ATOM 1418 CG PRO B 610 15.414 19.746 -3.365 1.00 0.00 C ATOM 1419 CD PRO B 610 15.248 21.227 -3.162 1.00 0.00 C ATOM 0 HA PRO B 610 12.545 20.095 -1.737 1.00 0.00 H new ATOM 0 HB2 PRO B 610 14.277 18.101 -2.596 1.00 0.00 H new ATOM 0 HB3 PRO B 610 13.411 19.093 -3.752 1.00 0.00 H new ATOM 0 HG2 PRO B 610 16.249 19.363 -2.778 1.00 0.00 H new ATOM 0 HG3 PRO B 610 15.626 19.516 -4.409 1.00 0.00 H new ATOM 0 HD2 PRO B 610 16.189 21.702 -2.885 1.00 0.00 H new ATOM 0 HD3 PRO B 610 14.897 21.720 -4.069 1.00 0.00 H new ATOM 1424 N ALA B 611 15.154 19.981 0.094 1.00 0.00 N ATOM 1425 CA ALA B 611 15.667 19.529 1.381 1.00 0.00 C ATOM 1426 C ALA B 611 14.812 20.055 2.529 1.00 0.00 C ATOM 1427 O ALA B 611 14.755 19.451 3.600 1.00 0.00 O ATOM 1428 CB ALA B 611 17.114 19.966 1.555 1.00 0.00 C ATOM 0 H ALA B 611 15.701 20.724 -0.341 1.00 0.00 H new ATOM 0 HA ALA B 611 15.623 18.440 1.399 1.00 0.00 H new ATOM 0 HB1 ALA B 611 17.484 19.622 2.521 1.00 0.00 H new ATOM 0 HB2 ALA B 611 17.722 19.536 0.759 1.00 0.00 H new ATOM 0 HB3 ALA B 611 17.174 21.053 1.510 1.00 0.00 H new ATOM 1434 N MET B 612 14.151 21.184 2.299 1.00 0.00 N ATOM 1435 CA MET B 612 13.299 21.791 3.315 1.00 0.00 C ATOM 1436 C MET B 612 11.920 21.139 3.329 1.00 0.00 C ATOM 1437 O MET B 612 11.328 20.937 4.391 1.00 0.00 O ATOM 1438 CB MET B 612 13.162 23.294 3.065 1.00 0.00 C ATOM 1439 CG MET B 612 13.668 24.150 4.216 1.00 0.00 C ATOM 1440 SD MET B 612 13.257 25.895 4.016 1.00 0.00 S ATOM 1441 CE MET B 612 14.543 26.660 4.999 1.00 0.00 C ATOM 0 H MET B 612 14.189 21.697 1.418 1.00 0.00 H new ATOM 0 HA MET B 612 13.766 21.632 4.287 1.00 0.00 H new ATOM 0 HB2 MET B 612 13.711 23.555 2.160 1.00 0.00 H new ATOM 0 HB3 MET B 612 12.114 23.529 2.881 1.00 0.00 H new ATOM 0 HG2 MET B 612 13.241 23.785 5.150 1.00 0.00 H new ATOM 0 HG3 MET B 612 14.750 24.042 4.296 1.00 0.00 H new ATOM 0 HE1 MET B 612 14.424 27.743 4.974 1.00 0.00 H new ATOM 0 HE2 MET B 612 14.470 26.310 6.029 1.00 0.00 H new ATOM 0 HE3 MET B 612 15.519 26.393 4.593 1.00 0.00 H new ATOM 1449 N LEU B 613 11.414 20.811 2.146 1.00 0.00 N ATOM 1450 CA LEU B 613 10.104 20.181 2.023 1.00 0.00 C ATOM 1451 C LEU B 613 10.012 18.937 2.902 1.00 0.00 C ATOM 1452 O LEU B 613 10.548 17.884 2.563 1.00 0.00 O ATOM 1453 CB LEU B 613 9.831 19.808 0.564 1.00 0.00 C ATOM 1454 CG LEU B 613 8.663 20.533 -0.106 1.00 0.00 C ATOM 1455 CD1 LEU B 613 8.956 20.767 -1.580 1.00 0.00 C ATOM 1456 CD2 LEU B 613 7.375 19.741 0.065 1.00 0.00 C ATOM 0 H LEU B 613 11.890 20.971 1.258 1.00 0.00 H new ATOM 0 HA LEU B 613 9.352 20.896 2.357 1.00 0.00 H new ATOM 0 HB2 LEU B 613 10.734 20.003 -0.015 1.00 0.00 H new ATOM 0 HB3 LEU B 613 9.644 18.735 0.513 1.00 0.00 H new ATOM 0 HG LEU B 613 8.536 21.502 0.377 1.00 0.00 H new ATOM 0 HD11 LEU B 613 8.114 21.284 -2.041 1.00 0.00 H new ATOM 0 HD12 LEU B 613 9.855 21.376 -1.680 1.00 0.00 H new ATOM 0 HD13 LEU B 613 9.110 19.809 -2.077 1.00 0.00 H new ATOM 0 HD21 LEU B 613 6.555 20.272 -0.418 1.00 0.00 H new ATOM 0 HD22 LEU B 613 7.489 18.758 -0.391 1.00 0.00 H new ATOM 0 HD23 LEU B 613 7.157 19.625 1.127 1.00 0.00 H new ATOM 1467 N GLY B 614 9.327 19.070 4.034 1.00 0.00 N ATOM 1468 CA GLY B 614 9.175 17.949 4.944 1.00 0.00 C ATOM 1469 C GLY B 614 10.244 17.925 6.018 1.00 0.00 C ATOM 1470 O GLY B 614 11.430 18.089 5.727 1.00 0.00 O ATOM 0 H GLY B 614 8.875 19.933 4.337 1.00 0.00 H new ATOM 0 HA2 GLY B 614 8.193 17.997 5.414 1.00 0.00 H new ATOM 0 HA3 GLY B 614 9.212 17.018 4.378 1.00 0.00 H new ATOM 1474 N HIS B 615 9.826 17.724 7.263 1.00 0.00 N ATOM 1475 CA HIS B 615 10.757 17.681 8.385 1.00 0.00 C ATOM 1476 C HIS B 615 10.022 17.385 9.689 1.00 0.00 C ATOM 1477 O HIS B 615 9.101 18.106 10.071 1.00 0.00 O ATOM 1478 CB HIS B 615 11.511 19.006 8.500 1.00 0.00 C ATOM 1479 CG HIS B 615 12.974 18.841 8.774 1.00 0.00 C ATOM 1480 ND1 HIS B 615 13.933 18.863 7.783 1.00 0.00 N ATOM 1481 CD2 HIS B 615 13.641 18.652 9.937 1.00 0.00 C ATOM 1482 CE1 HIS B 615 15.126 18.693 8.324 1.00 0.00 C ATOM 1483 NE2 HIS B 615 14.977 18.562 9.630 1.00 0.00 N ATOM 0 H HIS B 615 8.849 17.588 7.521 1.00 0.00 H new ATOM 0 HA HIS B 615 11.473 16.879 8.202 1.00 0.00 H new ATOM 0 HB2 HIS B 615 11.384 19.568 7.575 1.00 0.00 H new ATOM 0 HB3 HIS B 615 11.065 19.600 9.298 1.00 0.00 H new ATOM 0 HD2 HIS B 615 13.204 18.585 10.922 1.00 0.00 H new ATOM 0 HE1 HIS B 615 16.064 18.666 7.789 1.00 0.00 H new ATOM 0 HE2 HIS B 615 15.731 18.418 10.301 1.00 0.00 H new ATOM 1490 N ALA B 616 10.438 16.320 10.368 1.00 0.00 N ATOM 1491 CA ALA B 616 9.820 15.930 11.629 1.00 0.00 C ATOM 1492 C ALA B 616 8.329 15.663 11.451 1.00 0.00 C ATOM 1493 O ALA B 616 7.809 15.708 10.337 1.00 0.00 O ATOM 1494 CB ALA B 616 10.044 17.006 12.681 1.00 0.00 C ATOM 0 H ALA B 616 11.200 15.713 10.066 1.00 0.00 H new ATOM 0 HA ALA B 616 10.290 15.005 11.965 1.00 0.00 H new ATOM 0 HB1 ALA B 616 9.577 16.702 13.618 1.00 0.00 H new ATOM 0 HB2 ALA B 616 11.114 17.145 12.837 1.00 0.00 H new ATOM 0 HB3 ALA B 616 9.602 17.943 12.343 1.00 0.00 H new ATOM 1500 N GLY B 617 7.646 15.387 12.558 1.00 0.00 N ATOM 1501 CA GLY B 617 6.221 15.116 12.503 1.00 0.00 C ATOM 1502 C GLY B 617 5.825 13.919 13.344 1.00 0.00 C ATOM 1503 O GLY B 617 6.666 13.091 13.692 1.00 0.00 O ATOM 0 H GLY B 617 8.054 15.346 13.492 1.00 0.00 H new ATOM 0 HA2 GLY B 617 5.674 15.994 12.846 1.00 0.00 H new ATOM 0 HA3 GLY B 617 5.927 14.942 11.468 1.00 0.00 H new ATOM 1507 N ASP B 618 4.540 13.828 13.671 1.00 0.00 N ATOM 1508 CA ASP B 618 4.035 12.723 14.478 1.00 0.00 C ATOM 1509 C ASP B 618 2.915 11.987 13.749 1.00 0.00 C ATOM 1510 O ASP B 618 2.799 10.766 13.843 1.00 0.00 O ATOM 1511 CB ASP B 618 3.528 13.239 15.826 1.00 0.00 C ATOM 1512 CG ASP B 618 3.507 12.157 16.888 1.00 0.00 C ATOM 1513 OD1 ASP B 618 2.552 11.352 16.896 1.00 0.00 O ATOM 1514 OD2 ASP B 618 4.444 12.114 17.712 1.00 0.00 O ATOM 0 H ASP B 618 3.830 14.505 13.390 1.00 0.00 H new ATOM 0 HA ASP B 618 4.855 12.025 14.649 1.00 0.00 H new ATOM 0 HB2 ASP B 618 4.163 14.060 16.160 1.00 0.00 H new ATOM 0 HB3 ASP B 618 2.523 13.643 15.703 1.00 0.00 H new ATOM 1518 N MET B 619 2.094 12.738 13.023 1.00 0.00 N ATOM 1519 CA MET B 619 0.984 12.155 12.276 1.00 0.00 C ATOM 1520 C MET B 619 1.485 11.111 11.284 1.00 0.00 C ATOM 1521 O MET B 619 0.756 10.190 10.918 1.00 0.00 O ATOM 1522 CB MET B 619 0.209 13.248 11.538 1.00 0.00 C ATOM 1523 CG MET B 619 -1.279 13.256 11.853 1.00 0.00 C ATOM 1524 SD MET B 619 -1.714 14.472 13.111 1.00 0.00 S ATOM 1525 CE MET B 619 -3.025 13.609 13.976 1.00 0.00 C ATOM 0 H MET B 619 2.176 13.751 12.936 1.00 0.00 H new ATOM 0 HA MET B 619 0.318 11.664 12.986 1.00 0.00 H new ATOM 0 HB2 MET B 619 0.632 14.219 11.796 1.00 0.00 H new ATOM 0 HB3 MET B 619 0.344 13.116 10.464 1.00 0.00 H new ATOM 0 HG2 MET B 619 -1.839 13.466 10.941 1.00 0.00 H new ATOM 0 HG3 MET B 619 -1.580 12.265 12.191 1.00 0.00 H new ATOM 0 HE1 MET B 619 -3.399 14.234 14.786 1.00 0.00 H new ATOM 0 HE2 MET B 619 -3.836 13.390 13.282 1.00 0.00 H new ATOM 0 HE3 MET B 619 -2.638 12.677 14.387 1.00 0.00 H new ATOM 1533 N ALA B 620 2.733 11.261 10.852 1.00 0.00 N ATOM 1534 CA ALA B 620 3.330 10.330 9.903 1.00 0.00 C ATOM 1535 C ALA B 620 3.254 8.897 10.419 1.00 0.00 C ATOM 1536 O ALA B 620 3.156 7.951 9.639 1.00 0.00 O ATOM 1537 CB ALA B 620 4.775 10.716 9.624 1.00 0.00 C ATOM 0 H ALA B 620 3.350 12.019 11.144 1.00 0.00 H new ATOM 0 HA ALA B 620 2.764 10.384 8.973 1.00 0.00 H new ATOM 0 HB1 ALA B 620 5.209 10.012 8.914 1.00 0.00 H new ATOM 0 HB2 ALA B 620 4.809 11.722 9.205 1.00 0.00 H new ATOM 0 HB3 ALA B 620 5.344 10.691 10.553 1.00 0.00 H new ATOM 1543 N GLY B 621 3.301 8.744 11.739 1.00 0.00 N ATOM 1544 CA GLY B 621 3.238 7.423 12.336 1.00 0.00 C ATOM 1545 C GLY B 621 2.041 6.627 11.855 1.00 0.00 C ATOM 1546 O GLY B 621 2.112 5.405 11.722 1.00 0.00 O ATOM 0 H GLY B 621 3.382 9.512 12.406 1.00 0.00 H new ATOM 0 HA2 GLY B 621 4.152 6.877 12.101 1.00 0.00 H new ATOM 0 HA3 GLY B 621 3.194 7.519 13.421 1.00 0.00 H new ATOM 1550 N TYR B 622 0.937 7.320 11.595 1.00 0.00 N ATOM 1551 CA TYR B 622 -0.282 6.669 11.131 1.00 0.00 C ATOM 1552 C TYR B 622 -0.060 5.998 9.779 1.00 0.00 C ATOM 1553 O TYR B 622 -0.414 4.836 9.585 1.00 0.00 O ATOM 1554 CB TYR B 622 -1.421 7.686 11.028 1.00 0.00 C ATOM 1555 CG TYR B 622 -2.091 7.979 12.351 1.00 0.00 C ATOM 1556 CD1 TYR B 622 -2.954 7.059 12.935 1.00 0.00 C ATOM 1557 CD2 TYR B 622 -1.864 9.176 13.017 1.00 0.00 C ATOM 1558 CE1 TYR B 622 -3.569 7.323 14.142 1.00 0.00 C ATOM 1559 CE2 TYR B 622 -2.473 9.449 14.226 1.00 0.00 C ATOM 1560 CZ TYR B 622 -3.326 8.519 14.785 1.00 0.00 C ATOM 1561 OH TYR B 622 -3.937 8.786 15.989 1.00 0.00 O ATOM 0 H TYR B 622 0.862 8.332 11.698 1.00 0.00 H new ATOM 0 HA TYR B 622 -0.553 5.902 11.857 1.00 0.00 H new ATOM 0 HB2 TYR B 622 -1.031 8.616 10.614 1.00 0.00 H new ATOM 0 HB3 TYR B 622 -2.168 7.313 10.327 1.00 0.00 H new ATOM 0 HD1 TYR B 622 -3.147 6.121 12.435 1.00 0.00 H new ATOM 0 HD2 TYR B 622 -1.199 9.907 12.582 1.00 0.00 H new ATOM 0 HE1 TYR B 622 -4.237 6.597 14.581 1.00 0.00 H new ATOM 0 HE2 TYR B 622 -2.283 10.385 14.731 1.00 0.00 H new ATOM 0 HH TYR B 622 -3.658 9.670 16.308 1.00 0.00 H new ATOM 1570 N ALA B 623 0.528 6.741 8.847 1.00 0.00 N ATOM 1571 CA ALA B 623 0.800 6.219 7.514 1.00 0.00 C ATOM 1572 C ALA B 623 1.615 4.932 7.584 1.00 0.00 C ATOM 1573 O ALA B 623 1.438 4.027 6.770 1.00 0.00 O ATOM 1574 CB ALA B 623 1.527 7.261 6.677 1.00 0.00 C ATOM 0 H ALA B 623 0.825 7.706 8.991 1.00 0.00 H new ATOM 0 HA ALA B 623 -0.154 5.989 7.040 1.00 0.00 H new ATOM 0 HB1 ALA B 623 1.724 6.857 5.684 1.00 0.00 H new ATOM 0 HB2 ALA B 623 0.908 8.154 6.590 1.00 0.00 H new ATOM 0 HB3 ALA B 623 2.471 7.519 7.157 1.00 0.00 H new ATOM 1580 N GLY B 624 2.512 4.856 8.563 1.00 0.00 N ATOM 1581 CA GLY B 624 3.341 3.676 8.720 1.00 0.00 C ATOM 1582 C GLY B 624 2.525 2.405 8.836 1.00 0.00 C ATOM 1583 O GLY B 624 3.012 1.315 8.534 1.00 0.00 O ATOM 0 H GLY B 624 2.679 5.591 9.250 1.00 0.00 H new ATOM 0 HA2 GLY B 624 4.016 3.594 7.868 1.00 0.00 H new ATOM 0 HA3 GLY B 624 3.962 3.788 9.609 1.00 0.00 H new ATOM 1587 N THR B 625 1.279 2.541 9.278 1.00 0.00 N ATOM 1588 CA THR B 625 0.394 1.396 9.436 1.00 0.00 C ATOM 1589 C THR B 625 0.210 0.655 8.115 1.00 0.00 C ATOM 1590 O THR B 625 0.089 -0.570 8.091 1.00 0.00 O ATOM 1591 CB THR B 625 -0.987 1.821 9.969 1.00 0.00 C ATOM 1592 OG1 THR B 625 -0.848 2.438 11.253 1.00 0.00 O ATOM 1593 CG2 THR B 625 -1.920 0.623 10.076 1.00 0.00 C ATOM 0 H THR B 625 0.860 3.435 9.533 1.00 0.00 H new ATOM 0 HA THR B 625 0.866 0.731 10.160 1.00 0.00 H new ATOM 0 HB THR B 625 -1.417 2.535 9.267 1.00 0.00 H new ATOM 0 HG1 THR B 625 -0.664 3.394 11.138 1.00 0.00 H new ATOM 0 HG21 THR B 625 -2.889 0.949 10.455 1.00 0.00 H new ATOM 0 HG22 THR B 625 -2.048 0.172 9.092 1.00 0.00 H new ATOM 0 HG23 THR B 625 -1.492 -0.112 10.758 1.00 0.00 H new ATOM 1601 N LEU B 626 0.191 1.406 7.021 1.00 0.00 N ATOM 1602 CA LEU B 626 0.023 0.822 5.695 1.00 0.00 C ATOM 1603 C LEU B 626 1.243 -0.008 5.307 1.00 0.00 C ATOM 1604 O LEU B 626 1.117 -1.053 4.670 1.00 0.00 O ATOM 1605 CB LEU B 626 -0.211 1.920 4.657 1.00 0.00 C ATOM 1606 CG LEU B 626 -1.566 2.627 4.721 1.00 0.00 C ATOM 1607 CD1 LEU B 626 -2.697 1.611 4.755 1.00 0.00 C ATOM 1608 CD2 LEU B 626 -1.632 3.541 5.936 1.00 0.00 C ATOM 0 H LEU B 626 0.290 2.421 7.025 1.00 0.00 H new ATOM 0 HA LEU B 626 -0.847 0.166 5.723 1.00 0.00 H new ATOM 0 HB2 LEU B 626 0.573 2.669 4.767 1.00 0.00 H new ATOM 0 HB3 LEU B 626 -0.098 1.484 3.664 1.00 0.00 H new ATOM 0 HG LEU B 626 -1.680 3.237 3.825 1.00 0.00 H new ATOM 0 HD11 LEU B 626 -3.653 2.132 4.800 1.00 0.00 H new ATOM 0 HD12 LEU B 626 -2.661 0.996 3.855 1.00 0.00 H new ATOM 0 HD13 LEU B 626 -2.588 0.975 5.634 1.00 0.00 H new ATOM 0 HD21 LEU B 626 -2.603 4.036 5.966 1.00 0.00 H new ATOM 0 HD22 LEU B 626 -1.497 2.951 6.843 1.00 0.00 H new ATOM 0 HD23 LEU B 626 -0.844 4.291 5.870 1.00 0.00 H new ATOM 1619 N GLN B 627 2.422 0.465 5.698 1.00 0.00 N ATOM 1620 CA GLN B 627 3.665 -0.235 5.393 1.00 0.00 C ATOM 1621 C GLN B 627 3.769 -1.532 6.188 1.00 0.00 C ATOM 1622 O GLN B 627 4.232 -2.550 5.674 1.00 0.00 O ATOM 1623 CB GLN B 627 4.867 0.661 5.696 1.00 0.00 C ATOM 1624 CG GLN B 627 6.157 0.190 5.042 1.00 0.00 C ATOM 1625 CD GLN B 627 7.392 0.669 5.779 1.00 0.00 C ATOM 1626 OE1 GLN B 627 7.609 0.323 6.942 1.00 0.00 O ATOM 1627 NE2 GLN B 627 8.211 1.468 5.106 1.00 0.00 N ATOM 0 H GLN B 627 2.543 1.329 6.226 1.00 0.00 H new ATOM 0 HA GLN B 627 3.663 -0.481 4.331 1.00 0.00 H new ATOM 0 HB2 GLN B 627 4.648 1.675 5.360 1.00 0.00 H new ATOM 0 HB3 GLN B 627 5.012 0.707 6.775 1.00 0.00 H new ATOM 0 HG2 GLN B 627 6.163 -0.899 5.001 1.00 0.00 H new ATOM 0 HG3 GLN B 627 6.190 0.548 4.013 1.00 0.00 H new ATOM 0 HE21 GLN B 627 7.993 1.729 4.145 1.00 0.00 H new ATOM 0 HE22 GLN B 627 9.059 1.821 5.550 1.00 0.00 H new ATOM 1634 N SER B 628 3.336 -1.487 7.443 1.00 0.00 N ATOM 1635 CA SER B 628 3.384 -2.658 8.311 1.00 0.00 C ATOM 1636 C SER B 628 2.275 -3.644 7.956 1.00 0.00 C ATOM 1637 O SER B 628 2.529 -4.826 7.720 1.00 0.00 O ATOM 1638 CB SER B 628 3.259 -2.238 9.777 1.00 0.00 C ATOM 1639 OG SER B 628 4.535 -2.071 10.370 1.00 0.00 O ATOM 0 H SER B 628 2.948 -0.652 7.882 1.00 0.00 H new ATOM 0 HA SER B 628 4.345 -3.150 8.162 1.00 0.00 H new ATOM 0 HB2 SER B 628 2.698 -1.306 9.845 1.00 0.00 H new ATOM 0 HB3 SER B 628 2.694 -2.991 10.327 1.00 0.00 H new ATOM 0 HG SER B 628 4.428 -1.801 11.306 1.00 0.00 H new ATOM 1644 N LEU B 629 1.042 -3.149 7.919 1.00 0.00 N ATOM 1645 CA LEU B 629 -0.108 -3.985 7.592 1.00 0.00 C ATOM 1646 C LEU B 629 0.019 -4.561 6.186 1.00 0.00 C ATOM 1647 O LEU B 629 -0.090 -5.770 5.988 1.00 0.00 O ATOM 1648 CB LEU B 629 -1.401 -3.176 7.710 1.00 0.00 C ATOM 1649 CG LEU B 629 -2.649 -3.812 7.096 1.00 0.00 C ATOM 1650 CD1 LEU B 629 -2.820 -5.238 7.595 1.00 0.00 C ATOM 1651 CD2 LEU B 629 -3.883 -2.981 7.418 1.00 0.00 C ATOM 0 H LEU B 629 0.813 -2.174 8.111 1.00 0.00 H new ATOM 0 HA LEU B 629 -0.138 -4.812 8.301 1.00 0.00 H new ATOM 0 HB2 LEU B 629 -1.595 -2.990 8.766 1.00 0.00 H new ATOM 0 HB3 LEU B 629 -1.243 -2.206 7.239 1.00 0.00 H new ATOM 0 HG LEU B 629 -2.526 -3.839 6.013 1.00 0.00 H new ATOM 0 HD11 LEU B 629 -3.713 -5.675 7.148 1.00 0.00 H new ATOM 0 HD12 LEU B 629 -1.948 -5.829 7.315 1.00 0.00 H new ATOM 0 HD13 LEU B 629 -2.922 -5.234 8.680 1.00 0.00 H new ATOM 0 HD21 LEU B 629 -4.762 -3.448 6.974 1.00 0.00 H new ATOM 0 HD22 LEU B 629 -4.010 -2.923 8.499 1.00 0.00 H new ATOM 0 HD23 LEU B 629 -3.761 -1.977 7.012 1.00 0.00 H new ATOM 1662 N GLY B 630 0.252 -3.686 5.212 1.00 0.00 N ATOM 1663 CA GLY B 630 0.393 -4.127 3.836 1.00 0.00 C ATOM 1664 C GLY B 630 1.515 -5.130 3.662 1.00 0.00 C ATOM 1665 O GLY B 630 1.399 -6.072 2.877 1.00 0.00 O ATOM 0 H GLY B 630 0.346 -2.680 5.351 1.00 0.00 H new ATOM 0 HA2 GLY B 630 -0.544 -4.573 3.503 1.00 0.00 H new ATOM 0 HA3 GLY B 630 0.580 -3.263 3.198 1.00 0.00 H new ATOM 1669 N ALA B 631 2.606 -4.929 4.393 1.00 0.00 N ATOM 1670 CA ALA B 631 3.755 -5.824 4.315 1.00 0.00 C ATOM 1671 C ALA B 631 3.357 -7.257 4.652 1.00 0.00 C ATOM 1672 O ALA B 631 3.809 -8.203 4.007 1.00 0.00 O ATOM 1673 CB ALA B 631 4.859 -5.347 5.245 1.00 0.00 C ATOM 0 H ALA B 631 2.719 -4.154 5.046 1.00 0.00 H new ATOM 0 HA ALA B 631 4.128 -5.810 3.291 1.00 0.00 H new ATOM 0 HB1 ALA B 631 5.710 -6.024 5.177 1.00 0.00 H new ATOM 0 HB2 ALA B 631 5.170 -4.343 4.956 1.00 0.00 H new ATOM 0 HB3 ALA B 631 4.489 -5.331 6.270 1.00 0.00 H new ATOM 1679 N GLU B 632 2.512 -7.409 5.666 1.00 0.00 N ATOM 1680 CA GLU B 632 2.057 -8.728 6.089 1.00 0.00 C ATOM 1681 C GLU B 632 1.421 -9.483 4.925 1.00 0.00 C ATOM 1682 O GLU B 632 1.498 -10.710 4.852 1.00 0.00 O ATOM 1683 CB GLU B 632 1.053 -8.602 7.237 1.00 0.00 C ATOM 1684 CG GLU B 632 1.705 -8.457 8.602 1.00 0.00 C ATOM 1685 CD GLU B 632 2.340 -9.745 9.085 1.00 0.00 C ATOM 1686 OE1 GLU B 632 2.457 -10.689 8.274 1.00 0.00 O ATOM 1687 OE2 GLU B 632 2.721 -9.812 10.273 1.00 0.00 O ATOM 0 H GLU B 632 2.129 -6.636 6.210 1.00 0.00 H new ATOM 0 HA GLU B 632 2.925 -9.290 6.434 1.00 0.00 H new ATOM 0 HB2 GLU B 632 0.413 -7.739 7.056 1.00 0.00 H new ATOM 0 HB3 GLU B 632 0.408 -9.481 7.243 1.00 0.00 H new ATOM 0 HG2 GLU B 632 2.465 -7.677 8.556 1.00 0.00 H new ATOM 0 HG3 GLU B 632 0.957 -8.132 9.325 1.00 0.00 H new ATOM 1692 N ILE B 633 0.794 -8.742 4.018 1.00 0.00 N ATOM 1693 CA ILE B 633 0.146 -9.340 2.857 1.00 0.00 C ATOM 1694 C ILE B 633 1.175 -9.824 1.842 1.00 0.00 C ATOM 1695 O ILE B 633 0.977 -10.841 1.178 1.00 0.00 O ATOM 1696 CB ILE B 633 -0.809 -8.347 2.171 1.00 0.00 C ATOM 1697 CG1 ILE B 633 -1.881 -7.873 3.155 1.00 0.00 C ATOM 1698 CG2 ILE B 633 -1.450 -8.987 0.949 1.00 0.00 C ATOM 1699 CD1 ILE B 633 -2.731 -6.741 2.623 1.00 0.00 C ATOM 0 H ILE B 633 0.721 -7.726 4.065 1.00 0.00 H new ATOM 0 HA ILE B 633 -0.430 -10.191 3.221 1.00 0.00 H new ATOM 0 HB ILE B 633 -0.234 -7.480 1.844 1.00 0.00 H new ATOM 0 HG12 ILE B 633 -2.527 -8.713 3.409 1.00 0.00 H new ATOM 0 HG13 ILE B 633 -1.399 -7.552 4.078 1.00 0.00 H new ATOM 0 HG21 ILE B 633 -2.123 -8.272 0.475 1.00 0.00 H new ATOM 0 HG22 ILE B 633 -0.674 -9.279 0.242 1.00 0.00 H new ATOM 0 HG23 ILE B 633 -2.014 -9.869 1.254 1.00 0.00 H new ATOM 0 HD11 ILE B 633 -3.469 -6.457 3.373 1.00 0.00 H new ATOM 0 HD12 ILE B 633 -2.096 -5.885 2.396 1.00 0.00 H new ATOM 0 HD13 ILE B 633 -3.242 -7.065 1.716 1.00 0.00 H new ATOM 1710 N ALA B 634 2.277 -9.088 1.728 1.00 0.00 N ATOM 1711 CA ALA B 634 3.340 -9.444 0.796 1.00 0.00 C ATOM 1712 C ALA B 634 4.063 -10.709 1.245 1.00 0.00 C ATOM 1713 O ALA B 634 4.426 -11.553 0.426 1.00 0.00 O ATOM 1714 CB ALA B 634 4.324 -8.292 0.654 1.00 0.00 C ATOM 0 H ALA B 634 2.456 -8.242 2.269 1.00 0.00 H new ATOM 0 HA ALA B 634 2.887 -9.642 -0.175 1.00 0.00 H new ATOM 0 HB1 ALA B 634 5.113 -8.571 -0.045 1.00 0.00 H new ATOM 0 HB2 ALA B 634 3.802 -7.412 0.279 1.00 0.00 H new ATOM 0 HB3 ALA B 634 4.763 -8.067 1.626 1.00 0.00 H new ATOM 1720 N VAL B 635 4.271 -10.834 2.553 1.00 0.00 N ATOM 1721 CA VAL B 635 4.952 -11.995 3.111 1.00 0.00 C ATOM 1722 C VAL B 635 4.022 -13.203 3.168 1.00 0.00 C ATOM 1723 O VAL B 635 4.460 -14.343 3.025 1.00 0.00 O ATOM 1724 CB VAL B 635 5.488 -11.707 4.526 1.00 0.00 C ATOM 1725 CG1 VAL B 635 4.344 -11.369 5.471 1.00 0.00 C ATOM 1726 CG2 VAL B 635 6.287 -12.892 5.045 1.00 0.00 C ATOM 0 H VAL B 635 3.977 -10.145 3.245 1.00 0.00 H new ATOM 0 HA VAL B 635 5.791 -12.216 2.451 1.00 0.00 H new ATOM 0 HB VAL B 635 6.153 -10.845 4.475 1.00 0.00 H new ATOM 0 HG11 VAL B 635 4.741 -11.168 6.466 1.00 0.00 H new ATOM 0 HG12 VAL B 635 3.819 -10.487 5.105 1.00 0.00 H new ATOM 0 HG13 VAL B 635 3.652 -12.209 5.519 1.00 0.00 H new ATOM 0 HG21 VAL B 635 6.658 -12.671 6.046 1.00 0.00 H new ATOM 0 HG22 VAL B 635 5.647 -13.774 5.082 1.00 0.00 H new ATOM 0 HG23 VAL B 635 7.129 -13.082 4.380 1.00 0.00 H new ATOM 1736 N GLU B 636 2.735 -12.941 3.377 1.00 0.00 N ATOM 1737 CA GLU B 636 1.743 -14.007 3.453 1.00 0.00 C ATOM 1738 C GLU B 636 1.629 -14.740 2.120 1.00 0.00 C ATOM 1739 O GLU B 636 1.699 -15.968 2.068 1.00 0.00 O ATOM 1740 CB GLU B 636 0.380 -13.437 3.852 1.00 0.00 C ATOM 1741 CG GLU B 636 0.087 -13.545 5.339 1.00 0.00 C ATOM 1742 CD GLU B 636 -1.352 -13.929 5.624 1.00 0.00 C ATOM 1743 OE1 GLU B 636 -2.202 -13.019 5.713 1.00 0.00 O ATOM 1744 OE2 GLU B 636 -1.629 -15.139 5.759 1.00 0.00 O ATOM 0 H GLU B 636 2.356 -12.002 3.496 1.00 0.00 H new ATOM 0 HA GLU B 636 2.068 -14.718 4.212 1.00 0.00 H new ATOM 0 HB2 GLU B 636 0.333 -12.389 3.556 1.00 0.00 H new ATOM 0 HB3 GLU B 636 -0.399 -13.960 3.298 1.00 0.00 H new ATOM 0 HG2 GLU B 636 0.752 -14.286 5.784 1.00 0.00 H new ATOM 0 HG3 GLU B 636 0.306 -12.591 5.819 1.00 0.00 H new ATOM 1749 N GLN B 637 1.452 -13.979 1.045 1.00 0.00 N ATOM 1750 CA GLN B 637 1.327 -14.557 -0.287 1.00 0.00 C ATOM 1751 C GLN B 637 2.635 -15.209 -0.723 1.00 0.00 C ATOM 1752 O GLN B 637 2.634 -16.173 -1.489 1.00 0.00 O ATOM 1753 CB GLN B 637 0.920 -13.481 -1.296 1.00 0.00 C ATOM 1754 CG GLN B 637 2.046 -12.525 -1.654 1.00 0.00 C ATOM 1755 CD GLN B 637 2.790 -12.945 -2.907 1.00 0.00 C ATOM 1756 OE1 GLN B 637 2.180 -13.262 -3.929 1.00 0.00 O ATOM 1757 NE2 GLN B 637 4.116 -12.948 -2.835 1.00 0.00 N ATOM 0 H GLN B 637 1.392 -12.961 1.071 1.00 0.00 H new ATOM 0 HA GLN B 637 0.554 -15.324 -0.251 1.00 0.00 H new ATOM 0 HB2 GLN B 637 0.562 -13.964 -2.205 1.00 0.00 H new ATOM 0 HB3 GLN B 637 0.086 -12.910 -0.889 1.00 0.00 H new ATOM 0 HG2 GLN B 637 1.637 -11.525 -1.797 1.00 0.00 H new ATOM 0 HG3 GLN B 637 2.747 -12.467 -0.822 1.00 0.00 H new ATOM 0 HE21 GLN B 637 4.580 -12.678 -1.968 1.00 0.00 H new ATOM 0 HE22 GLN B 637 4.670 -13.220 -3.647 1.00 0.00 H new ATOM 1764 N ALA B 638 3.749 -14.677 -0.231 1.00 0.00 N ATOM 1765 CA ALA B 638 5.063 -15.209 -0.567 1.00 0.00 C ATOM 1766 C ALA B 638 5.205 -16.656 -0.106 1.00 0.00 C ATOM 1767 O ALA B 638 5.996 -17.419 -0.659 1.00 0.00 O ATOM 1768 CB ALA B 638 6.155 -14.347 0.050 1.00 0.00 C ATOM 0 H ALA B 638 3.767 -13.877 0.402 1.00 0.00 H new ATOM 0 HA ALA B 638 5.169 -15.189 -1.652 1.00 0.00 H new ATOM 0 HB1 ALA B 638 7.131 -14.756 -0.209 1.00 0.00 H new ATOM 0 HB2 ALA B 638 6.075 -13.329 -0.332 1.00 0.00 H new ATOM 0 HB3 ALA B 638 6.042 -14.337 1.134 1.00 0.00 H new ATOM 1774 N ALA B 639 4.434 -17.025 0.911 1.00 0.00 N ATOM 1775 CA ALA B 639 4.472 -18.381 1.445 1.00 0.00 C ATOM 1776 C ALA B 639 3.604 -19.323 0.618 1.00 0.00 C ATOM 1777 O ALA B 639 3.835 -20.532 0.588 1.00 0.00 O ATOM 1778 CB ALA B 639 4.025 -18.389 2.900 1.00 0.00 C ATOM 0 H ALA B 639 3.776 -16.404 1.382 1.00 0.00 H new ATOM 0 HA ALA B 639 5.501 -18.736 1.390 1.00 0.00 H new ATOM 0 HB1 ALA B 639 4.058 -19.408 3.285 1.00 0.00 H new ATOM 0 HB2 ALA B 639 4.690 -17.757 3.488 1.00 0.00 H new ATOM 0 HB3 ALA B 639 3.006 -18.008 2.970 1.00 0.00 H new ATOM 1784 N LEU B 640 2.604 -18.761 -0.052 1.00 0.00 N ATOM 1785 CA LEU B 640 1.698 -19.552 -0.880 1.00 0.00 C ATOM 1786 C LEU B 640 2.038 -19.395 -2.358 1.00 0.00 C ATOM 1787 O LEU B 640 1.175 -19.551 -3.222 1.00 0.00 O ATOM 1788 CB LEU B 640 0.249 -19.131 -0.630 1.00 0.00 C ATOM 1789 CG LEU B 640 -0.137 -18.890 0.830 1.00 0.00 C ATOM 1790 CD1 LEU B 640 -1.464 -18.150 0.915 1.00 0.00 C ATOM 1791 CD2 LEU B 640 -0.209 -20.207 1.588 1.00 0.00 C ATOM 0 H LEU B 640 2.399 -17.762 -0.039 1.00 0.00 H new ATOM 0 HA LEU B 640 1.816 -20.601 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU B 640 0.055 -18.217 -1.192 1.00 0.00 H new ATOM 0 HB3 LEU B 640 -0.407 -19.901 -1.036 1.00 0.00 H new ATOM 0 HG LEU B 640 0.632 -18.271 1.292 1.00 0.00 H new ATOM 0 HD11 LEU B 640 -1.723 -17.987 1.961 1.00 0.00 H new ATOM 0 HD12 LEU B 640 -1.378 -17.189 0.408 1.00 0.00 H new ATOM 0 HD13 LEU B 640 -2.243 -18.744 0.436 1.00 0.00 H new ATOM 0 HD21 LEU B 640 -0.485 -20.015 2.625 1.00 0.00 H new ATOM 0 HD22 LEU B 640 -0.957 -20.852 1.127 1.00 0.00 H new ATOM 0 HD23 LEU B 640 0.763 -20.699 1.556 1.00 0.00 H new ATOM 1802 N GLN B 641 3.299 -19.088 -2.642 1.00 0.00 N ATOM 1803 CA GLN B 641 3.752 -18.912 -4.017 1.00 0.00 C ATOM 1804 C GLN B 641 3.426 -20.142 -4.859 1.00 0.00 C ATOM 1805 O GLN B 641 2.955 -20.025 -5.990 1.00 0.00 O ATOM 1806 CB GLN B 641 5.257 -18.641 -4.050 1.00 0.00 C ATOM 1807 CG GLN B 641 5.639 -17.263 -3.533 1.00 0.00 C ATOM 1808 CD GLN B 641 5.516 -16.188 -4.595 1.00 0.00 C ATOM 1809 OE1 GLN B 641 6.451 -15.944 -5.358 1.00 0.00 O ATOM 1810 NE2 GLN B 641 4.359 -15.538 -4.648 1.00 0.00 N ATOM 0 H GLN B 641 4.026 -18.956 -1.938 1.00 0.00 H new ATOM 0 HA GLN B 641 3.227 -18.055 -4.439 1.00 0.00 H new ATOM 0 HB2 GLN B 641 5.767 -19.398 -3.454 1.00 0.00 H new ATOM 0 HB3 GLN B 641 5.615 -18.748 -5.074 1.00 0.00 H new ATOM 0 HG2 GLN B 641 5.002 -17.007 -2.686 1.00 0.00 H new ATOM 0 HG3 GLN B 641 6.664 -17.289 -3.164 1.00 0.00 H new ATOM 0 HE21 GLN B 641 3.611 -15.774 -3.995 1.00 0.00 H new ATOM 0 HE22 GLN B 641 4.218 -14.803 -5.341 1.00 0.00 H new ATOM 1817 N SER B 642 3.679 -21.320 -4.299 1.00 0.00 N ATOM 1818 CA SER B 642 3.418 -22.572 -5.000 1.00 0.00 C ATOM 1819 C SER B 642 1.930 -22.721 -5.307 1.00 0.00 C ATOM 1820 O SER B 642 1.547 -23.394 -6.263 1.00 0.00 O ATOM 1821 CB SER B 642 3.898 -23.760 -4.164 1.00 0.00 C ATOM 1822 OG SER B 642 3.737 -23.507 -2.779 1.00 0.00 O ATOM 0 H SER B 642 4.065 -21.434 -3.362 1.00 0.00 H new ATOM 0 HA SER B 642 3.967 -22.554 -5.941 1.00 0.00 H new ATOM 0 HB2 SER B 642 3.338 -24.653 -4.441 1.00 0.00 H new ATOM 0 HB3 SER B 642 4.947 -23.961 -4.381 1.00 0.00 H new ATOM 0 HG SER B 642 4.049 -24.282 -2.266 1.00 0.00 H new ATOM 1827 N ALA B 643 1.097 -22.088 -4.488 1.00 0.00 N ATOM 1828 CA ALA B 643 -0.348 -22.147 -4.672 1.00 0.00 C ATOM 1829 C ALA B 643 -0.796 -21.225 -5.801 1.00 0.00 C ATOM 1830 O ALA B 643 -1.773 -21.507 -6.495 1.00 0.00 O ATOM 1831 CB ALA B 643 -1.060 -21.786 -3.378 1.00 0.00 C ATOM 0 H ALA B 643 1.398 -21.528 -3.690 1.00 0.00 H new ATOM 0 HA ALA B 643 -0.613 -23.168 -4.946 1.00 0.00 H new ATOM 0 HB1 ALA B 643 -2.138 -21.834 -3.530 1.00 0.00 H new ATOM 0 HB2 ALA B 643 -0.772 -22.489 -2.596 1.00 0.00 H new ATOM 0 HB3 ALA B 643 -0.781 -20.776 -3.079 1.00 0.00 H new ATOM 1837 N TRP B 644 -0.077 -20.122 -5.978 1.00 0.00 N ATOM 1838 CA TRP B 644 -0.401 -19.158 -7.023 1.00 0.00 C ATOM 1839 C TRP B 644 -0.521 -19.845 -8.379 1.00 0.00 C ATOM 1840 O TRP B 644 0.153 -20.840 -8.642 1.00 0.00 O ATOM 1841 CB TRP B 644 0.665 -18.063 -7.083 1.00 0.00 C ATOM 1842 CG TRP B 644 0.225 -16.848 -7.844 1.00 0.00 C ATOM 1843 CD1 TRP B 644 0.248 -16.676 -9.198 1.00 0.00 C ATOM 1844 CD2 TRP B 644 -0.300 -15.636 -7.291 1.00 0.00 C ATOM 1845 NE1 TRP B 644 -0.233 -15.430 -9.521 1.00 0.00 N ATOM 1846 CE2 TRP B 644 -0.575 -14.772 -8.369 1.00 0.00 C ATOM 1847 CE3 TRP B 644 -0.566 -15.196 -5.991 1.00 0.00 C ATOM 1848 CZ2 TRP B 644 -1.102 -13.497 -8.186 1.00 0.00 C ATOM 1849 CZ3 TRP B 644 -1.088 -13.930 -5.810 1.00 0.00 C ATOM 1850 CH2 TRP B 644 -1.353 -13.092 -6.903 1.00 0.00 C ATOM 0 H TRP B 644 0.734 -19.873 -5.411 1.00 0.00 H new ATOM 0 HA TRP B 644 -1.363 -18.705 -6.781 1.00 0.00 H new ATOM 0 HB2 TRP B 644 0.933 -17.770 -6.068 1.00 0.00 H new ATOM 0 HB3 TRP B 644 1.565 -18.467 -7.546 1.00 0.00 H new ATOM 0 HD1 TRP B 644 0.593 -17.411 -9.910 1.00 0.00 H new ATOM 0 HE1 TRP B 644 -0.321 -15.056 -10.466 1.00 0.00 H new ATOM 0 HE3 TRP B 644 -0.367 -15.835 -5.143 1.00 0.00 H new ATOM 0 HZ2 TRP B 644 -1.306 -12.850 -9.027 1.00 0.00 H new ATOM 0 HZ3 TRP B 644 -1.296 -13.579 -4.810 1.00 0.00 H new ATOM 0 HH2 TRP B 644 -1.763 -12.108 -6.729 1.00 0.00 H new ATOM 1860 N GLN B 645 -1.382 -19.306 -9.236 1.00 0.00 N ATOM 1861 CA GLN B 645 -1.588 -19.868 -10.566 1.00 0.00 C ATOM 1862 C GLN B 645 -0.676 -19.199 -11.588 1.00 0.00 C ATOM 1863 O GLN B 645 0.201 -19.841 -12.166 1.00 0.00 O ATOM 1864 CB GLN B 645 -3.051 -19.708 -10.989 1.00 0.00 C ATOM 1865 CG GLN B 645 -4.039 -20.299 -9.997 1.00 0.00 C ATOM 1866 CD GLN B 645 -4.208 -21.797 -10.163 1.00 0.00 C ATOM 1867 OE1 GLN B 645 -4.984 -22.257 -11.000 1.00 0.00 O ATOM 1868 NE2 GLN B 645 -3.478 -22.567 -9.364 1.00 0.00 N ATOM 0 H GLN B 645 -1.948 -18.482 -9.034 1.00 0.00 H new ATOM 0 HA GLN B 645 -1.341 -20.929 -10.526 1.00 0.00 H new ATOM 0 HB2 GLN B 645 -3.269 -18.648 -11.119 1.00 0.00 H new ATOM 0 HB3 GLN B 645 -3.194 -20.184 -11.959 1.00 0.00 H new ATOM 0 HG2 GLN B 645 -3.701 -20.086 -8.983 1.00 0.00 H new ATOM 0 HG3 GLN B 645 -5.007 -19.812 -10.120 1.00 0.00 H new ATOM 0 HE21 GLN B 645 -2.847 -22.143 -8.684 1.00 0.00 H new ATOM 0 HE22 GLN B 645 -3.548 -23.582 -9.430 1.00 0.00 H new ATOM 1875 N GLY B 646 -0.887 -17.905 -11.806 1.00 0.00 N ATOM 1876 CA GLY B 646 -0.075 -17.171 -12.759 1.00 0.00 C ATOM 1877 C GLY B 646 -0.777 -16.975 -14.088 1.00 0.00 C ATOM 1878 O GLY B 646 -0.528 -15.995 -14.791 1.00 0.00 O ATOM 0 H GLY B 646 -1.606 -17.352 -11.340 1.00 0.00 H new ATOM 0 HA2 GLY B 646 0.181 -16.198 -12.340 1.00 0.00 H new ATOM 0 HA3 GLY B 646 0.861 -17.705 -12.921 1.00 0.00 H new ATOM 1882 N ASP B 647 -1.656 -17.908 -14.435 1.00 0.00 N ATOM 1883 CA ASP B 647 -2.396 -17.833 -15.690 1.00 0.00 C ATOM 1884 C ASP B 647 -3.802 -17.288 -15.460 1.00 0.00 C ATOM 1885 O ASP B 647 -4.722 -17.569 -16.228 1.00 0.00 O ATOM 1886 CB ASP B 647 -2.471 -19.213 -16.345 1.00 0.00 C ATOM 1887 CG ASP B 647 -2.395 -19.141 -17.857 1.00 0.00 C ATOM 1888 OD1 ASP B 647 -2.714 -18.071 -18.417 1.00 0.00 O ATOM 1889 OD2 ASP B 647 -2.017 -20.154 -18.481 1.00 0.00 O ATOM 0 H ASP B 647 -1.874 -18.725 -13.865 1.00 0.00 H new ATOM 0 HA ASP B 647 -1.866 -17.152 -16.356 1.00 0.00 H new ATOM 0 HB2 ASP B 647 -1.656 -19.834 -15.972 1.00 0.00 H new ATOM 0 HB3 ASP B 647 -3.402 -19.700 -16.054 1.00 0.00 H new ATOM 1893 N THR B 648 -3.963 -16.508 -14.395 1.00 0.00 N ATOM 1894 CA THR B 648 -5.256 -15.926 -14.063 1.00 0.00 C ATOM 1895 C THR B 648 -5.150 -14.416 -13.885 1.00 0.00 C ATOM 1896 O THR B 648 -5.963 -13.803 -13.195 1.00 0.00 O ATOM 1897 CB THR B 648 -5.835 -16.542 -12.775 1.00 0.00 C ATOM 1898 OG1 THR B 648 -4.974 -16.261 -11.666 1.00 0.00 O ATOM 1899 CG2 THR B 648 -6.003 -18.047 -12.923 1.00 0.00 C ATOM 0 H THR B 648 -3.213 -16.265 -13.748 1.00 0.00 H new ATOM 0 HA THR B 648 -5.924 -16.146 -14.896 1.00 0.00 H new ATOM 0 HB THR B 648 -6.814 -16.098 -12.596 1.00 0.00 H new ATOM 0 HG1 THR B 648 -5.351 -16.655 -10.851 1.00 0.00 H new ATOM 0 HG21 THR B 648 -6.413 -18.460 -12.001 1.00 0.00 H new ATOM 0 HG22 THR B 648 -6.682 -18.258 -13.749 1.00 0.00 H new ATOM 0 HG23 THR B 648 -5.034 -18.503 -13.125 1.00 0.00 H new ATOM 1907 N GLY B 649 -4.142 -13.820 -14.516 1.00 0.00 N ATOM 1908 CA GLY B 649 -3.949 -12.385 -14.416 1.00 0.00 C ATOM 1909 C GLY B 649 -2.558 -12.019 -13.940 1.00 0.00 C ATOM 1910 O GLY B 649 -1.585 -12.151 -14.684 1.00 0.00 O ATOM 0 H GLY B 649 -3.456 -14.305 -15.094 1.00 0.00 H new ATOM 0 HA2 GLY B 649 -4.128 -11.929 -15.390 1.00 0.00 H new ATOM 0 HA3 GLY B 649 -4.686 -11.969 -13.729 1.00 0.00 H new ATOM 1914 N ILE B 650 -2.461 -11.556 -12.698 1.00 0.00 N ATOM 1915 CA ILE B 650 -1.178 -11.170 -12.124 1.00 0.00 C ATOM 1916 C ILE B 650 -0.377 -12.394 -11.696 1.00 0.00 C ATOM 1917 O ILE B 650 -0.936 -13.382 -11.218 1.00 0.00 O ATOM 1918 CB ILE B 650 -1.362 -10.241 -10.910 1.00 0.00 C ATOM 1919 CG1 ILE B 650 -2.138 -8.985 -11.314 1.00 0.00 C ATOM 1920 CG2 ILE B 650 -0.010 -9.867 -10.320 1.00 0.00 C ATOM 1921 CD1 ILE B 650 -2.372 -8.025 -10.169 1.00 0.00 C ATOM 0 H ILE B 650 -3.256 -11.439 -12.070 1.00 0.00 H new ATOM 0 HA ILE B 650 -0.632 -10.635 -12.901 1.00 0.00 H new ATOM 0 HB ILE B 650 -1.935 -10.771 -10.149 1.00 0.00 H new ATOM 0 HG12 ILE B 650 -1.592 -8.469 -12.104 1.00 0.00 H new ATOM 0 HG13 ILE B 650 -3.100 -9.281 -11.732 1.00 0.00 H new ATOM 0 HG21 ILE B 650 -0.156 -9.210 -9.463 1.00 0.00 H new ATOM 0 HG22 ILE B 650 0.510 -10.770 -10.001 1.00 0.00 H new ATOM 0 HG23 ILE B 650 0.586 -9.353 -11.074 1.00 0.00 H new ATOM 0 HD11 ILE B 650 -2.927 -7.159 -10.528 1.00 0.00 H new ATOM 0 HD12 ILE B 650 -2.944 -8.524 -9.387 1.00 0.00 H new ATOM 0 HD13 ILE B 650 -1.413 -7.700 -9.765 1.00 0.00 H new ATOM 1932 N THR B 651 0.940 -12.323 -11.868 1.00 0.00 N ATOM 1933 CA THR B 651 1.820 -13.424 -11.500 1.00 0.00 C ATOM 1934 C THR B 651 2.507 -13.156 -10.165 1.00 0.00 C ATOM 1935 O THR B 651 2.353 -12.083 -9.581 1.00 0.00 O ATOM 1936 CB THR B 651 2.894 -13.669 -12.575 1.00 0.00 C ATOM 1937 OG1 THR B 651 2.529 -13.007 -13.792 1.00 0.00 O ATOM 1938 CG2 THR B 651 3.069 -15.158 -12.837 1.00 0.00 C ATOM 0 H THR B 651 1.420 -11.513 -12.260 1.00 0.00 H new ATOM 0 HA THR B 651 1.194 -14.312 -11.413 1.00 0.00 H new ATOM 0 HB THR B 651 3.839 -13.266 -12.210 1.00 0.00 H new ATOM 0 HG1 THR B 651 3.218 -13.166 -14.470 1.00 0.00 H new ATOM 0 HG21 THR B 651 3.833 -15.306 -13.600 1.00 0.00 H new ATOM 0 HG22 THR B 651 3.374 -15.656 -11.917 1.00 0.00 H new ATOM 0 HG23 THR B 651 2.125 -15.580 -13.182 1.00 0.00 H new ATOM 1946 N TYR B 652 3.263 -14.138 -9.687 1.00 0.00 N ATOM 1947 CA TYR B 652 3.973 -14.008 -8.419 1.00 0.00 C ATOM 1948 C TYR B 652 5.064 -12.946 -8.511 1.00 0.00 C ATOM 1949 O TYR B 652 5.291 -12.192 -7.566 1.00 0.00 O ATOM 1950 CB TYR B 652 4.585 -15.350 -8.014 1.00 0.00 C ATOM 1951 CG TYR B 652 5.621 -15.862 -8.989 1.00 0.00 C ATOM 1952 CD1 TYR B 652 5.255 -16.654 -10.071 1.00 0.00 C ATOM 1953 CD2 TYR B 652 6.967 -15.555 -8.829 1.00 0.00 C ATOM 1954 CE1 TYR B 652 6.197 -17.124 -10.964 1.00 0.00 C ATOM 1955 CE2 TYR B 652 7.916 -16.020 -9.718 1.00 0.00 C ATOM 1956 CZ TYR B 652 7.527 -16.805 -10.783 1.00 0.00 C ATOM 1957 OH TYR B 652 8.470 -17.271 -11.670 1.00 0.00 O ATOM 0 H TYR B 652 3.400 -15.032 -10.158 1.00 0.00 H new ATOM 0 HA TYR B 652 3.255 -13.699 -7.660 1.00 0.00 H new ATOM 0 HB2 TYR B 652 5.043 -15.249 -7.030 1.00 0.00 H new ATOM 0 HB3 TYR B 652 3.789 -16.089 -7.921 1.00 0.00 H new ATOM 0 HD1 TYR B 652 4.215 -16.906 -10.216 1.00 0.00 H new ATOM 0 HD2 TYR B 652 7.276 -14.942 -7.995 1.00 0.00 H new ATOM 0 HE1 TYR B 652 5.895 -17.738 -11.800 1.00 0.00 H new ATOM 0 HE2 TYR B 652 8.958 -15.770 -9.580 1.00 0.00 H new ATOM 0 HH TYR B 652 9.357 -16.955 -11.400 1.00 0.00 H new ATOM 1966 N GLN B 653 5.734 -12.892 -9.658 1.00 0.00 N ATOM 1967 CA GLN B 653 6.801 -11.923 -9.875 1.00 0.00 C ATOM 1968 C GLN B 653 6.232 -10.523 -10.072 1.00 0.00 C ATOM 1969 O GLN B 653 6.770 -9.544 -9.555 1.00 0.00 O ATOM 1970 CB GLN B 653 7.641 -12.321 -11.089 1.00 0.00 C ATOM 1971 CG GLN B 653 6.838 -12.436 -12.374 1.00 0.00 C ATOM 1972 CD GLN B 653 7.668 -12.938 -13.539 1.00 0.00 C ATOM 1973 OE1 GLN B 653 7.364 -13.974 -14.131 1.00 0.00 O ATOM 1974 NE2 GLN B 653 8.723 -12.205 -13.874 1.00 0.00 N ATOM 0 H GLN B 653 5.556 -13.508 -10.451 1.00 0.00 H new ATOM 0 HA GLN B 653 7.437 -11.916 -8.990 1.00 0.00 H new ATOM 0 HB2 GLN B 653 8.432 -11.585 -11.230 1.00 0.00 H new ATOM 0 HB3 GLN B 653 8.126 -13.276 -10.887 1.00 0.00 H new ATOM 0 HG2 GLN B 653 5.998 -13.112 -12.214 1.00 0.00 H new ATOM 0 HG3 GLN B 653 6.419 -11.461 -12.625 1.00 0.00 H new ATOM 0 HE21 GLN B 653 8.938 -11.353 -13.356 1.00 0.00 H new ATOM 0 HE22 GLN B 653 9.319 -12.494 -14.650 1.00 0.00 H new ATOM 1981 N ALA B 654 5.140 -10.433 -10.825 1.00 0.00 N ATOM 1982 CA ALA B 654 4.496 -9.152 -11.089 1.00 0.00 C ATOM 1983 C ALA B 654 3.818 -8.609 -9.836 1.00 0.00 C ATOM 1984 O ALA B 654 3.922 -7.423 -9.527 1.00 0.00 O ATOM 1985 CB ALA B 654 3.488 -9.291 -12.220 1.00 0.00 C ATOM 0 H ALA B 654 4.683 -11.233 -11.263 1.00 0.00 H new ATOM 0 HA ALA B 654 5.266 -8.442 -11.389 1.00 0.00 H new ATOM 0 HB1 ALA B 654 3.015 -8.327 -12.406 1.00 0.00 H new ATOM 0 HB2 ALA B 654 3.998 -9.625 -13.123 1.00 0.00 H new ATOM 0 HB3 ALA B 654 2.727 -10.021 -11.942 1.00 0.00 H new ATOM 1991 N TRP B 655 3.124 -9.485 -9.119 1.00 0.00 N ATOM 1992 CA TRP B 655 2.426 -9.092 -7.900 1.00 0.00 C ATOM 1993 C TRP B 655 3.407 -8.556 -6.861 1.00 0.00 C ATOM 1994 O TRP B 655 3.146 -7.540 -6.217 1.00 0.00 O ATOM 1995 CB TRP B 655 1.654 -10.281 -7.324 1.00 0.00 C ATOM 1996 CG TRP B 655 0.696 -9.896 -6.237 1.00 0.00 C ATOM 1997 CD1 TRP B 655 -0.661 -9.785 -6.341 1.00 0.00 C ATOM 1998 CD2 TRP B 655 1.024 -9.570 -4.882 1.00 0.00 C ATOM 1999 NE1 TRP B 655 -1.196 -9.409 -5.133 1.00 0.00 N ATOM 2000 CE2 TRP B 655 -0.184 -9.272 -4.221 1.00 0.00 C ATOM 2001 CE3 TRP B 655 2.219 -9.502 -4.162 1.00 0.00 C ATOM 2002 CZ2 TRP B 655 -0.227 -8.912 -2.877 1.00 0.00 C ATOM 2003 CZ3 TRP B 655 2.175 -9.145 -2.827 1.00 0.00 C ATOM 2004 CH2 TRP B 655 0.958 -8.853 -2.196 1.00 0.00 C ATOM 0 H TRP B 655 3.029 -10.472 -9.360 1.00 0.00 H new ATOM 0 HA TRP B 655 1.722 -8.299 -8.153 1.00 0.00 H new ATOM 0 HB2 TRP B 655 1.104 -10.771 -8.127 1.00 0.00 H new ATOM 0 HB3 TRP B 655 2.363 -11.010 -6.932 1.00 0.00 H new ATOM 0 HD1 TRP B 655 -1.230 -9.966 -7.241 1.00 0.00 H new ATOM 0 HE1 TRP B 655 -2.187 -9.257 -4.946 1.00 0.00 H new ATOM 0 HE3 TRP B 655 3.162 -9.725 -4.640 1.00 0.00 H new ATOM 0 HZ2 TRP B 655 -1.164 -8.687 -2.389 1.00 0.00 H new ATOM 0 HZ3 TRP B 655 3.093 -9.090 -2.261 1.00 0.00 H new ATOM 0 HH2 TRP B 655 0.956 -8.576 -1.152 1.00 0.00 H new ATOM 2014 N GLN B 656 4.532 -9.246 -6.705 1.00 0.00 N ATOM 2015 CA GLN B 656 5.550 -8.838 -5.744 1.00 0.00 C ATOM 2016 C GLN B 656 6.025 -7.416 -6.026 1.00 0.00 C ATOM 2017 O GLN B 656 5.971 -6.549 -5.155 1.00 0.00 O ATOM 2018 CB GLN B 656 6.736 -9.802 -5.785 1.00 0.00 C ATOM 2019 CG GLN B 656 6.529 -11.057 -4.953 1.00 0.00 C ATOM 2020 CD GLN B 656 7.412 -11.093 -3.722 1.00 0.00 C ATOM 2021 OE1 GLN B 656 7.038 -10.594 -2.660 1.00 0.00 O ATOM 2022 NE2 GLN B 656 8.593 -11.686 -3.857 1.00 0.00 N ATOM 0 H GLN B 656 4.762 -10.089 -7.231 1.00 0.00 H new ATOM 0 HA GLN B 656 5.106 -8.863 -4.749 1.00 0.00 H new ATOM 0 HB2 GLN B 656 6.925 -10.089 -6.819 1.00 0.00 H new ATOM 0 HB3 GLN B 656 7.627 -9.284 -5.430 1.00 0.00 H new ATOM 0 HG2 GLN B 656 5.484 -11.118 -4.648 1.00 0.00 H new ATOM 0 HG3 GLN B 656 6.733 -11.934 -5.568 1.00 0.00 H new ATOM 0 HE21 GLN B 656 8.863 -12.086 -4.755 1.00 0.00 H new ATOM 0 HE22 GLN B 656 9.230 -11.741 -3.062 1.00 0.00 H new ATOM 2029 N ALA B 657 6.492 -7.184 -7.249 1.00 0.00 N ATOM 2030 CA ALA B 657 6.976 -5.868 -7.646 1.00 0.00 C ATOM 2031 C ALA B 657 5.859 -4.832 -7.586 1.00 0.00 C ATOM 2032 O ALA B 657 6.045 -3.735 -7.059 1.00 0.00 O ATOM 2033 CB ALA B 657 7.573 -5.925 -9.044 1.00 0.00 C ATOM 0 H ALA B 657 6.545 -7.891 -7.982 1.00 0.00 H new ATOM 0 HA ALA B 657 7.753 -5.566 -6.944 1.00 0.00 H new ATOM 0 HB1 ALA B 657 7.930 -4.935 -9.328 1.00 0.00 H new ATOM 0 HB2 ALA B 657 8.405 -6.629 -9.056 1.00 0.00 H new ATOM 0 HB3 ALA B 657 6.811 -6.252 -9.752 1.00 0.00 H new ATOM 2039 N GLN B 658 4.700 -5.187 -8.132 1.00 0.00 N ATOM 2040 CA GLN B 658 3.553 -4.285 -8.142 1.00 0.00 C ATOM 2041 C GLN B 658 3.199 -3.840 -6.727 1.00 0.00 C ATOM 2042 O GLN B 658 3.091 -2.646 -6.450 1.00 0.00 O ATOM 2043 CB GLN B 658 2.348 -4.967 -8.792 1.00 0.00 C ATOM 2044 CG GLN B 658 2.352 -4.889 -10.311 1.00 0.00 C ATOM 2045 CD GLN B 658 1.012 -5.257 -10.917 1.00 0.00 C ATOM 2046 OE1 GLN B 658 0.140 -4.405 -11.088 1.00 0.00 O ATOM 2047 NE2 GLN B 658 0.841 -6.532 -11.246 1.00 0.00 N ATOM 0 H GLN B 658 4.530 -6.091 -8.573 1.00 0.00 H new ATOM 0 HA GLN B 658 3.820 -3.403 -8.724 1.00 0.00 H new ATOM 0 HB2 GLN B 658 2.327 -6.014 -8.490 1.00 0.00 H new ATOM 0 HB3 GLN B 658 1.434 -4.508 -8.415 1.00 0.00 H new ATOM 0 HG2 GLN B 658 2.620 -3.878 -10.619 1.00 0.00 H new ATOM 0 HG3 GLN B 658 3.120 -5.556 -10.703 1.00 0.00 H new ATOM 0 HE21 GLN B 658 1.591 -7.205 -11.087 1.00 0.00 H new ATOM 0 HE22 GLN B 658 -0.040 -6.839 -11.658 1.00 0.00 H new ATOM 2054 N TRP B 659 3.018 -4.808 -5.835 1.00 0.00 N ATOM 2055 CA TRP B 659 2.675 -4.516 -4.448 1.00 0.00 C ATOM 2056 C TRP B 659 3.650 -3.510 -3.847 1.00 0.00 C ATOM 2057 O TRP B 659 3.241 -2.498 -3.281 1.00 0.00 O ATOM 2058 CB TRP B 659 2.674 -5.802 -3.620 1.00 0.00 C ATOM 2059 CG TRP B 659 2.221 -5.597 -2.206 1.00 0.00 C ATOM 2060 CD1 TRP B 659 3.013 -5.379 -1.116 1.00 0.00 C ATOM 2061 CD2 TRP B 659 0.870 -5.591 -1.731 1.00 0.00 C ATOM 2062 NE1 TRP B 659 2.237 -5.240 0.009 1.00 0.00 N ATOM 2063 CE2 TRP B 659 0.918 -5.365 -0.342 1.00 0.00 C ATOM 2064 CE3 TRP B 659 -0.375 -5.754 -2.344 1.00 0.00 C ATOM 2065 CZ2 TRP B 659 -0.231 -5.299 0.442 1.00 0.00 C ATOM 2066 CZ3 TRP B 659 -1.515 -5.690 -1.565 1.00 0.00 C ATOM 2067 CH2 TRP B 659 -1.436 -5.462 -0.185 1.00 0.00 C ATOM 0 H TRP B 659 3.103 -5.802 -6.048 1.00 0.00 H new ATOM 0 HA TRP B 659 1.676 -4.080 -4.430 1.00 0.00 H new ATOM 0 HB2 TRP B 659 2.024 -6.534 -4.100 1.00 0.00 H new ATOM 0 HB3 TRP B 659 3.679 -6.223 -3.615 1.00 0.00 H new ATOM 0 HD1 TRP B 659 4.091 -5.324 -1.135 1.00 0.00 H new ATOM 0 HE1 TRP B 659 2.586 -5.071 0.953 1.00 0.00 H new ATOM 0 HE3 TRP B 659 -0.445 -5.927 -3.408 1.00 0.00 H new ATOM 0 HZ2 TRP B 659 -0.173 -5.125 1.506 1.00 0.00 H new ATOM 0 HZ3 TRP B 659 -2.482 -5.818 -2.028 1.00 0.00 H new ATOM 0 HH2 TRP B 659 -2.345 -5.414 0.396 1.00 0.00 H new ATOM 2077 N ASN B 660 4.942 -3.796 -3.973 1.00 0.00 N ATOM 2078 CA ASN B 660 5.976 -2.916 -3.442 1.00 0.00 C ATOM 2079 C ASN B 660 5.770 -1.483 -3.922 1.00 0.00 C ATOM 2080 O ASN B 660 5.713 -0.551 -3.121 1.00 0.00 O ATOM 2081 CB ASN B 660 7.361 -3.412 -3.858 1.00 0.00 C ATOM 2082 CG ASN B 660 8.373 -3.315 -2.732 1.00 0.00 C ATOM 2083 OD1 ASN B 660 8.643 -2.230 -2.217 1.00 0.00 O ATOM 2084 ND2 ASN B 660 8.938 -4.452 -2.346 1.00 0.00 N ATOM 0 H ASN B 660 5.298 -4.631 -4.439 1.00 0.00 H new ATOM 0 HA ASN B 660 5.906 -2.929 -2.354 1.00 0.00 H new ATOM 0 HB2 ASN B 660 7.288 -4.448 -4.189 1.00 0.00 H new ATOM 0 HB3 ASN B 660 7.712 -2.829 -4.709 1.00 0.00 H new ATOM 0 HD21 ASN B 660 9.627 -4.450 -1.594 1.00 0.00 H new ATOM 0 HD22 ASN B 660 8.684 -5.328 -2.802 1.00 0.00 H new ATOM 2090 N GLN B 661 5.659 -1.316 -5.236 1.00 0.00 N ATOM 2091 CA GLN B 661 5.458 0.004 -5.824 1.00 0.00 C ATOM 2092 C GLN B 661 4.262 0.706 -5.192 1.00 0.00 C ATOM 2093 O GLN B 661 4.339 1.878 -4.823 1.00 0.00 O ATOM 2094 CB GLN B 661 5.257 -0.113 -7.335 1.00 0.00 C ATOM 2095 CG GLN B 661 6.539 -0.402 -8.100 1.00 0.00 C ATOM 2096 CD GLN B 661 7.597 0.664 -7.891 1.00 0.00 C ATOM 2097 OE1 GLN B 661 7.294 1.778 -7.461 1.00 0.00 O ATOM 2098 NE2 GLN B 661 8.844 0.328 -8.195 1.00 0.00 N ATOM 0 H GLN B 661 5.705 -2.077 -5.913 1.00 0.00 H new ATOM 0 HA GLN B 661 6.349 0.600 -5.629 1.00 0.00 H new ATOM 0 HB2 GLN B 661 4.537 -0.906 -7.537 1.00 0.00 H new ATOM 0 HB3 GLN B 661 4.823 0.814 -7.708 1.00 0.00 H new ATOM 0 HG2 GLN B 661 6.935 -1.368 -7.786 1.00 0.00 H new ATOM 0 HG3 GLN B 661 6.313 -0.481 -9.163 1.00 0.00 H new ATOM 0 HE21 GLN B 661 9.049 -0.607 -8.548 1.00 0.00 H new ATOM 0 HE22 GLN B 661 9.598 1.004 -8.075 1.00 0.00 H new ATOM 2105 N ALA B 662 3.154 -0.019 -5.070 1.00 0.00 N ATOM 2106 CA ALA B 662 1.940 0.534 -4.481 1.00 0.00 C ATOM 2107 C ALA B 662 2.174 0.954 -3.034 1.00 0.00 C ATOM 2108 O ALA B 662 1.822 2.064 -2.635 1.00 0.00 O ATOM 2109 CB ALA B 662 0.807 -0.477 -4.563 1.00 0.00 C ATOM 0 H ALA B 662 3.072 -0.990 -5.371 1.00 0.00 H new ATOM 0 HA ALA B 662 1.662 1.422 -5.048 1.00 0.00 H new ATOM 0 HB1 ALA B 662 -0.093 -0.051 -4.120 1.00 0.00 H new ATOM 0 HB2 ALA B 662 0.615 -0.725 -5.607 1.00 0.00 H new ATOM 0 HB3 ALA B 662 1.086 -1.381 -4.021 1.00 0.00 H new ATOM 2115 N MET B 663 2.771 0.060 -2.252 1.00 0.00 N ATOM 2116 CA MET B 663 3.052 0.340 -0.849 1.00 0.00 C ATOM 2117 C MET B 663 3.818 1.650 -0.698 1.00 0.00 C ATOM 2118 O MET B 663 3.370 2.566 -0.011 1.00 0.00 O ATOM 2119 CB MET B 663 3.852 -0.807 -0.229 1.00 0.00 C ATOM 2120 CG MET B 663 3.920 -0.750 1.288 1.00 0.00 C ATOM 2121 SD MET B 663 2.685 -1.800 2.078 1.00 0.00 S ATOM 2122 CE MET B 663 1.194 -0.854 1.779 1.00 0.00 C ATOM 0 H MET B 663 3.069 -0.864 -2.566 1.00 0.00 H new ATOM 0 HA MET B 663 2.101 0.435 -0.326 1.00 0.00 H new ATOM 0 HB2 MET B 663 3.405 -1.755 -0.529 1.00 0.00 H new ATOM 0 HB3 MET B 663 4.865 -0.791 -0.631 1.00 0.00 H new ATOM 0 HG2 MET B 663 4.914 -1.055 1.615 1.00 0.00 H new ATOM 0 HG3 MET B 663 3.779 0.280 1.616 1.00 0.00 H new ATOM 0 HE1 MET B 663 0.421 -1.161 2.483 1.00 0.00 H new ATOM 0 HE2 MET B 663 1.404 0.207 1.911 1.00 0.00 H new ATOM 0 HE3 MET B 663 0.849 -1.032 0.761 1.00 0.00 H new ATOM 2130 N GLU B 664 4.977 1.730 -1.346 1.00 0.00 N ATOM 2131 CA GLU B 664 5.805 2.929 -1.282 1.00 0.00 C ATOM 2132 C GLU B 664 4.994 4.170 -1.638 1.00 0.00 C ATOM 2133 O GLU B 664 5.204 5.245 -1.075 1.00 0.00 O ATOM 2134 CB GLU B 664 7.002 2.800 -2.226 1.00 0.00 C ATOM 2135 CG GLU B 664 7.906 4.021 -2.235 1.00 0.00 C ATOM 2136 CD GLU B 664 9.275 3.729 -2.815 1.00 0.00 C ATOM 2137 OE1 GLU B 664 9.602 2.538 -2.997 1.00 0.00 O ATOM 2138 OE2 GLU B 664 10.021 4.693 -3.088 1.00 0.00 O ATOM 0 H GLU B 664 5.363 0.980 -1.920 1.00 0.00 H new ATOM 0 HA GLU B 664 6.168 3.035 -0.260 1.00 0.00 H new ATOM 0 HB2 GLU B 664 7.588 1.927 -1.939 1.00 0.00 H new ATOM 0 HB3 GLU B 664 6.638 2.621 -3.238 1.00 0.00 H new ATOM 0 HG2 GLU B 664 7.433 4.815 -2.813 1.00 0.00 H new ATOM 0 HG3 GLU B 664 8.019 4.392 -1.216 1.00 0.00 H new ATOM 2143 N ASP B 665 4.067 4.015 -2.576 1.00 0.00 N ATOM 2144 CA ASP B 665 3.222 5.123 -3.008 1.00 0.00 C ATOM 2145 C ASP B 665 2.320 5.594 -1.872 1.00 0.00 C ATOM 2146 O ASP B 665 2.234 6.790 -1.588 1.00 0.00 O ATOM 2147 CB ASP B 665 2.373 4.707 -4.211 1.00 0.00 C ATOM 2148 CG ASP B 665 1.830 5.897 -4.976 1.00 0.00 C ATOM 2149 OD1 ASP B 665 1.945 7.032 -4.467 1.00 0.00 O ATOM 2150 OD2 ASP B 665 1.287 5.694 -6.082 1.00 0.00 O ATOM 0 H ASP B 665 3.881 3.133 -3.053 1.00 0.00 H new ATOM 0 HA ASP B 665 3.871 5.949 -3.299 1.00 0.00 H new ATOM 0 HB2 ASP B 665 2.974 4.092 -4.881 1.00 0.00 H new ATOM 0 HB3 ASP B 665 1.543 4.089 -3.870 1.00 0.00 H new ATOM 2154 N LEU B 666 1.649 4.648 -1.225 1.00 0.00 N ATOM 2155 CA LEU B 666 0.752 4.966 -0.119 1.00 0.00 C ATOM 2156 C LEU B 666 1.506 5.659 1.011 1.00 0.00 C ATOM 2157 O LEU B 666 1.019 6.627 1.595 1.00 0.00 O ATOM 2158 CB LEU B 666 0.084 3.693 0.403 1.00 0.00 C ATOM 2159 CG LEU B 666 -0.563 2.793 -0.651 1.00 0.00 C ATOM 2160 CD1 LEU B 666 -0.457 1.332 -0.243 1.00 0.00 C ATOM 2161 CD2 LEU B 666 -2.018 3.185 -0.868 1.00 0.00 C ATOM 0 H LEU B 666 1.709 3.654 -1.447 1.00 0.00 H new ATOM 0 HA LEU B 666 -0.015 5.646 -0.489 1.00 0.00 H new ATOM 0 HB2 LEU B 666 0.831 3.109 0.941 1.00 0.00 H new ATOM 0 HB3 LEU B 666 -0.680 3.978 1.127 1.00 0.00 H new ATOM 0 HG LEU B 666 -0.029 2.926 -1.592 1.00 0.00 H new ATOM 0 HD11 LEU B 666 -0.923 0.707 -1.005 1.00 0.00 H new ATOM 0 HD12 LEU B 666 0.593 1.058 -0.141 1.00 0.00 H new ATOM 0 HD13 LEU B 666 -0.965 1.182 0.710 1.00 0.00 H new ATOM 0 HD21 LEU B 666 -2.462 2.534 -1.621 1.00 0.00 H new ATOM 0 HD22 LEU B 666 -2.566 3.083 0.069 1.00 0.00 H new ATOM 0 HD23 LEU B 666 -2.069 4.220 -1.207 1.00 0.00 H new ATOM 2172 N VAL B 667 2.699 5.158 1.314 1.00 0.00 N ATOM 2173 CA VAL B 667 3.523 5.731 2.372 1.00 0.00 C ATOM 2174 C VAL B 667 3.898 7.174 2.057 1.00 0.00 C ATOM 2175 O VAL B 667 3.712 8.070 2.881 1.00 0.00 O ATOM 2176 CB VAL B 667 4.810 4.913 2.587 1.00 0.00 C ATOM 2177 CG1 VAL B 667 5.540 5.383 3.836 1.00 0.00 C ATOM 2178 CG2 VAL B 667 4.489 3.428 2.674 1.00 0.00 C ATOM 0 H VAL B 667 3.117 4.356 0.842 1.00 0.00 H new ATOM 0 HA VAL B 667 2.928 5.705 3.285 1.00 0.00 H new ATOM 0 HB VAL B 667 5.467 5.070 1.731 1.00 0.00 H new ATOM 0 HG11 VAL B 667 6.447 4.793 3.971 1.00 0.00 H new ATOM 0 HG12 VAL B 667 5.804 6.435 3.729 1.00 0.00 H new ATOM 0 HG13 VAL B 667 4.893 5.258 4.704 1.00 0.00 H new ATOM 0 HG21 VAL B 667 5.410 2.865 2.826 1.00 0.00 H new ATOM 0 HG22 VAL B 667 3.813 3.250 3.510 1.00 0.00 H new ATOM 0 HG23 VAL B 667 4.014 3.104 1.748 1.00 0.00 H new ATOM 2188 N ARG B 668 4.428 7.393 0.857 1.00 0.00 N ATOM 2189 CA ARG B 668 4.830 8.728 0.432 1.00 0.00 C ATOM 2190 C ARG B 668 3.617 9.643 0.293 1.00 0.00 C ATOM 2191 O ARG B 668 3.714 10.853 0.498 1.00 0.00 O ATOM 2192 CB ARG B 668 5.585 8.658 -0.897 1.00 0.00 C ATOM 2193 CG ARG B 668 6.753 7.686 -0.883 1.00 0.00 C ATOM 2194 CD ARG B 668 8.086 8.416 -0.930 1.00 0.00 C ATOM 2195 NE ARG B 668 8.851 8.084 -2.128 1.00 0.00 N ATOM 2196 CZ ARG B 668 8.641 8.648 -3.314 1.00 0.00 C ATOM 2197 NH1 ARG B 668 7.696 9.566 -3.456 1.00 0.00 N ATOM 2198 NH2 ARG B 668 9.378 8.294 -4.358 1.00 0.00 N ATOM 0 H ARG B 668 4.589 6.663 0.163 1.00 0.00 H new ATOM 0 HA ARG B 668 5.489 9.141 1.195 1.00 0.00 H new ATOM 0 HB2 ARG B 668 4.890 8.367 -1.685 1.00 0.00 H new ATOM 0 HB3 ARG B 668 5.954 9.652 -1.149 1.00 0.00 H new ATOM 0 HG2 ARG B 668 6.705 7.071 0.016 1.00 0.00 H new ATOM 0 HG3 ARG B 668 6.676 7.011 -1.735 1.00 0.00 H new ATOM 0 HD2 ARG B 668 7.911 9.491 -0.898 1.00 0.00 H new ATOM 0 HD3 ARG B 668 8.670 8.162 -0.045 1.00 0.00 H new ATOM 0 HE ARG B 668 9.586 7.381 -2.051 1.00 0.00 H new ATOM 0 HH11 ARG B 668 7.128 9.841 -2.655 1.00 0.00 H new ATOM 0 HH12 ARG B 668 7.537 9.997 -4.366 1.00 0.00 H new ATOM 0 HH21 ARG B 668 10.107 7.588 -4.252 1.00 0.00 H new ATOM 0 HH22 ARG B 668 9.216 8.727 -5.267 1.00 0.00 H new ATOM 2209 N ALA B 669 2.477 9.057 -0.057 1.00 0.00 N ATOM 2210 CA ALA B 669 1.246 9.819 -0.221 1.00 0.00 C ATOM 2211 C ALA B 669 0.909 10.599 1.045 1.00 0.00 C ATOM 2212 O ALA B 669 0.256 11.642 0.988 1.00 0.00 O ATOM 2213 CB ALA B 669 0.097 8.892 -0.593 1.00 0.00 C ATOM 0 H ALA B 669 2.381 8.057 -0.232 1.00 0.00 H new ATOM 0 HA ALA B 669 1.397 10.536 -1.028 1.00 0.00 H new ATOM 0 HB1 ALA B 669 -0.816 9.475 -0.712 1.00 0.00 H new ATOM 0 HB2 ALA B 669 0.328 8.384 -1.529 1.00 0.00 H new ATOM 0 HB3 ALA B 669 -0.044 8.153 0.196 1.00 0.00 H new ATOM 2219 N TYR B 670 1.357 10.088 2.186 1.00 0.00 N ATOM 2220 CA TYR B 670 1.100 10.735 3.466 1.00 0.00 C ATOM 2221 C TYR B 670 2.150 11.804 3.757 1.00 0.00 C ATOM 2222 O TYR B 670 1.825 12.976 3.947 1.00 0.00 O ATOM 2223 CB TYR B 670 1.087 9.700 4.592 1.00 0.00 C ATOM 2224 CG TYR B 670 0.499 10.218 5.885 1.00 0.00 C ATOM 2225 CD1 TYR B 670 1.154 11.193 6.627 1.00 0.00 C ATOM 2226 CD2 TYR B 670 -0.712 9.734 6.364 1.00 0.00 C ATOM 2227 CE1 TYR B 670 0.621 11.669 7.810 1.00 0.00 C ATOM 2228 CE2 TYR B 670 -1.253 10.205 7.544 1.00 0.00 C ATOM 2229 CZ TYR B 670 -0.583 11.173 8.264 1.00 0.00 C ATOM 2230 OH TYR B 670 -1.118 11.644 9.441 1.00 0.00 O ATOM 0 H TYR B 670 1.900 9.227 2.250 1.00 0.00 H new ATOM 0 HA TYR B 670 0.123 11.215 3.411 1.00 0.00 H new ATOM 0 HB2 TYR B 670 0.517 8.829 4.267 1.00 0.00 H new ATOM 0 HB3 TYR B 670 2.107 9.363 4.776 1.00 0.00 H new ATOM 0 HD1 TYR B 670 2.096 11.586 6.273 1.00 0.00 H new ATOM 0 HD2 TYR B 670 -1.239 8.976 5.804 1.00 0.00 H new ATOM 0 HE1 TYR B 670 1.145 12.425 8.376 1.00 0.00 H new ATOM 0 HE2 TYR B 670 -2.196 9.818 7.902 1.00 0.00 H new ATOM 0 HH TYR B 670 -1.969 11.192 9.617 1.00 0.00 H new ATOM 2239 N HIS B 671 3.414 11.390 3.790 1.00 0.00 N ATOM 2240 CA HIS B 671 4.513 12.310 4.055 1.00 0.00 C ATOM 2241 C HIS B 671 4.503 13.470 3.064 1.00 0.00 C ATOM 2242 O HIS B 671 4.973 14.565 3.371 1.00 0.00 O ATOM 2243 CB HIS B 671 5.851 11.573 3.982 1.00 0.00 C ATOM 2244 CG HIS B 671 7.026 12.428 4.346 1.00 0.00 C ATOM 2245 ND1 HIS B 671 7.130 13.092 5.550 1.00 0.00 N ATOM 2246 CD2 HIS B 671 8.152 12.726 3.656 1.00 0.00 C ATOM 2247 CE1 HIS B 671 8.269 13.762 5.585 1.00 0.00 C ATOM 2248 NE2 HIS B 671 8.908 13.555 4.447 1.00 0.00 N ATOM 0 H HIS B 671 3.701 10.423 3.636 1.00 0.00 H new ATOM 0 HA HIS B 671 4.382 12.713 5.059 1.00 0.00 H new ATOM 0 HB2 HIS B 671 5.819 10.711 4.649 1.00 0.00 H new ATOM 0 HB3 HIS B 671 5.990 11.189 2.971 1.00 0.00 H new ATOM 0 HD2 HIS B 671 8.408 12.376 2.667 1.00 0.00 H new ATOM 0 HE1 HIS B 671 8.618 14.374 6.404 1.00 0.00 H new ATOM 0 HE2 HIS B 671 9.816 13.947 4.197 1.00 0.00 H new ATOM 2255 N ALA B 672 3.964 13.221 1.875 1.00 0.00 N ATOM 2256 CA ALA B 672 3.891 14.244 0.840 1.00 0.00 C ATOM 2257 C ALA B 672 2.869 15.318 1.199 1.00 0.00 C ATOM 2258 O ALA B 672 3.167 16.510 1.155 1.00 0.00 O ATOM 2259 CB ALA B 672 3.548 13.614 -0.502 1.00 0.00 C ATOM 0 H ALA B 672 3.571 12.319 1.605 1.00 0.00 H new ATOM 0 HA ALA B 672 4.869 14.720 0.766 1.00 0.00 H new ATOM 0 HB1 ALA B 672 3.497 14.390 -1.266 1.00 0.00 H new ATOM 0 HB2 ALA B 672 4.317 12.890 -0.771 1.00 0.00 H new ATOM 0 HB3 ALA B 672 2.584 13.110 -0.432 1.00 0.00 H new ATOM 2265 N MET B 673 1.664 14.884 1.555 1.00 0.00 N ATOM 2266 CA MET B 673 0.598 15.809 1.923 1.00 0.00 C ATOM 2267 C MET B 673 1.056 16.754 3.030 1.00 0.00 C ATOM 2268 O MET B 673 0.741 17.944 3.012 1.00 0.00 O ATOM 2269 CB MET B 673 -0.642 15.037 2.375 1.00 0.00 C ATOM 2270 CG MET B 673 -1.736 15.926 2.947 1.00 0.00 C ATOM 2271 SD MET B 673 -1.890 15.774 4.737 1.00 0.00 S ATOM 2272 CE MET B 673 -2.393 14.061 4.890 1.00 0.00 C ATOM 0 H MET B 673 1.402 13.899 1.596 1.00 0.00 H new ATOM 0 HA MET B 673 0.347 16.403 1.044 1.00 0.00 H new ATOM 0 HB2 MET B 673 -1.043 14.481 1.528 1.00 0.00 H new ATOM 0 HB3 MET B 673 -0.350 14.304 3.127 1.00 0.00 H new ATOM 0 HG2 MET B 673 -1.526 16.964 2.691 1.00 0.00 H new ATOM 0 HG3 MET B 673 -2.688 15.670 2.481 1.00 0.00 H new ATOM 0 HE1 MET B 673 -2.911 13.917 5.838 1.00 0.00 H new ATOM 0 HE2 MET B 673 -3.061 13.803 4.068 1.00 0.00 H new ATOM 0 HE3 MET B 673 -1.513 13.419 4.857 1.00 0.00 H new ATOM 2280 N SER B 674 1.801 16.216 3.990 1.00 0.00 N ATOM 2281 CA SER B 674 2.299 17.011 5.106 1.00 0.00 C ATOM 2282 C SER B 674 3.570 17.759 4.717 1.00 0.00 C ATOM 2283 O SER B 674 3.879 18.813 5.273 1.00 0.00 O ATOM 2284 CB SER B 674 2.570 16.115 6.316 1.00 0.00 C ATOM 2285 OG SER B 674 2.787 16.887 7.484 1.00 0.00 O ATOM 0 H SER B 674 2.073 15.233 4.017 1.00 0.00 H new ATOM 0 HA SER B 674 1.535 17.743 5.368 1.00 0.00 H new ATOM 0 HB2 SER B 674 1.725 15.444 6.472 1.00 0.00 H new ATOM 0 HB3 SER B 674 3.442 15.490 6.122 1.00 0.00 H new ATOM 0 HG SER B 674 2.956 16.291 8.243 1.00 0.00 H new ATOM 2290 N SER B 675 4.305 17.206 3.758 1.00 0.00 N ATOM 2291 CA SER B 675 5.544 17.817 3.295 1.00 0.00 C ATOM 2292 C SER B 675 5.285 19.205 2.718 1.00 0.00 C ATOM 2293 O SER B 675 5.818 20.203 3.203 1.00 0.00 O ATOM 2294 CB SER B 675 6.213 16.931 2.242 1.00 0.00 C ATOM 2295 OG SER B 675 7.130 16.030 2.840 1.00 0.00 O ATOM 0 H SER B 675 4.063 16.335 3.286 1.00 0.00 H new ATOM 0 HA SER B 675 6.211 17.918 4.151 1.00 0.00 H new ATOM 0 HB2 SER B 675 5.453 16.372 1.697 1.00 0.00 H new ATOM 0 HB3 SER B 675 6.733 17.555 1.515 1.00 0.00 H new ATOM 0 HG SER B 675 6.645 15.252 3.186 1.00 0.00 H new ATOM 2300 N THR B 676 4.459 19.260 1.677 1.00 0.00 N ATOM 2301 CA THR B 676 4.127 20.525 1.032 1.00 0.00 C ATOM 2302 C THR B 676 3.294 21.410 1.952 1.00 0.00 C ATOM 2303 O THR B 676 3.110 22.598 1.686 1.00 0.00 O ATOM 2304 CB THR B 676 3.355 20.299 -0.281 1.00 0.00 C ATOM 2305 OG1 THR B 676 3.547 18.955 -0.738 1.00 0.00 O ATOM 2306 CG2 THR B 676 3.815 21.275 -1.354 1.00 0.00 C ATOM 0 H THR B 676 4.008 18.444 1.263 1.00 0.00 H new ATOM 0 HA THR B 676 5.070 21.024 0.810 1.00 0.00 H new ATOM 0 HB THR B 676 2.296 20.468 -0.087 1.00 0.00 H new ATOM 0 HG1 THR B 676 3.051 18.819 -1.572 1.00 0.00 H new ATOM 0 HG21 THR B 676 3.256 21.096 -2.272 1.00 0.00 H new ATOM 0 HG22 THR B 676 3.640 22.296 -1.016 1.00 0.00 H new ATOM 0 HG23 THR B 676 4.879 21.132 -1.544 1.00 0.00 H new ATOM 2314 N HIS B 677 2.794 20.824 3.036 1.00 0.00 N ATOM 2315 CA HIS B 677 1.981 21.561 3.997 1.00 0.00 C ATOM 2316 C HIS B 677 2.701 22.824 4.461 1.00 0.00 C ATOM 2317 O HIS B 677 2.101 23.896 4.545 1.00 0.00 O ATOM 2318 CB HIS B 677 1.648 20.678 5.199 1.00 0.00 C ATOM 2319 CG HIS B 677 0.489 21.176 6.006 1.00 0.00 C ATOM 2320 ND1 HIS B 677 -0.760 21.401 5.469 1.00 0.00 N ATOM 2321 CD2 HIS B 677 0.395 21.491 7.319 1.00 0.00 C ATOM 2322 CE1 HIS B 677 -1.572 21.834 6.416 1.00 0.00 C ATOM 2323 NE2 HIS B 677 -0.896 21.898 7.548 1.00 0.00 N ATOM 0 H HIS B 677 2.938 19.842 3.270 1.00 0.00 H new ATOM 0 HA HIS B 677 1.054 21.853 3.504 1.00 0.00 H new ATOM 0 HB2 HIS B 677 1.429 19.669 4.849 1.00 0.00 H new ATOM 0 HB3 HIS B 677 2.525 20.609 5.843 1.00 0.00 H new ATOM 0 HD2 HIS B 677 1.188 21.433 8.050 1.00 0.00 H new ATOM 0 HE1 HIS B 677 -2.613 22.092 6.286 1.00 0.00 H new ATOM 0 HE2 HIS B 677 -1.272 22.201 8.447 1.00 0.00 H new ATOM 2330 N GLU B 678 3.989 22.689 4.761 1.00 0.00 N ATOM 2331 CA GLU B 678 4.788 23.819 5.220 1.00 0.00 C ATOM 2332 C GLU B 678 5.275 24.655 4.039 1.00 0.00 C ATOM 2333 O GLU B 678 5.690 25.801 4.206 1.00 0.00 O ATOM 2334 CB GLU B 678 5.985 23.328 6.038 1.00 0.00 C ATOM 2335 CG GLU B 678 7.072 22.679 5.198 1.00 0.00 C ATOM 2336 CD GLU B 678 8.061 21.890 6.033 1.00 0.00 C ATOM 2337 OE1 GLU B 678 7.768 20.719 6.353 1.00 0.00 O ATOM 2338 OE2 GLU B 678 9.129 22.444 6.367 1.00 0.00 O ATOM 0 H GLU B 678 4.501 21.809 4.694 1.00 0.00 H new ATOM 0 HA GLU B 678 4.157 24.444 5.852 1.00 0.00 H new ATOM 0 HB2 GLU B 678 6.412 24.170 6.582 1.00 0.00 H new ATOM 0 HB3 GLU B 678 5.636 22.612 6.782 1.00 0.00 H new ATOM 0 HG2 GLU B 678 6.612 22.017 4.464 1.00 0.00 H new ATOM 0 HG3 GLU B 678 7.605 23.450 4.642 1.00 0.00 H new ATOM 2343 N ALA B 679 5.221 24.071 2.846 1.00 0.00 N ATOM 2344 CA ALA B 679 5.654 24.762 1.638 1.00 0.00 C ATOM 2345 C ALA B 679 4.993 26.131 1.521 1.00 0.00 C ATOM 2346 O ALA B 679 5.558 27.055 0.938 1.00 0.00 O ATOM 2347 CB ALA B 679 5.346 23.918 0.409 1.00 0.00 C ATOM 0 H ALA B 679 4.882 23.122 2.691 1.00 0.00 H new ATOM 0 HA ALA B 679 6.732 24.913 1.702 1.00 0.00 H new ATOM 0 HB1 ALA B 679 5.674 24.446 -0.486 1.00 0.00 H new ATOM 0 HB2 ALA B 679 5.870 22.965 0.481 1.00 0.00 H new ATOM 0 HB3 ALA B 679 4.273 23.738 0.351 1.00 0.00 H new ATOM 2353 N ASN B 680 3.793 26.253 2.078 1.00 0.00 N ATOM 2354 CA ASN B 680 3.055 27.509 2.035 1.00 0.00 C ATOM 2355 C ASN B 680 3.742 28.575 2.884 1.00 0.00 C ATOM 2356 O ASN B 680 3.803 29.744 2.505 1.00 0.00 O ATOM 2357 CB ASN B 680 1.620 27.300 2.524 1.00 0.00 C ATOM 2358 CG ASN B 680 0.596 27.939 1.606 1.00 0.00 C ATOM 2359 OD1 ASN B 680 0.448 29.161 1.578 1.00 0.00 O ATOM 2360 ND2 ASN B 680 -0.116 27.113 0.847 1.00 0.00 N ATOM 0 H ASN B 680 3.311 25.497 2.564 1.00 0.00 H new ATOM 0 HA ASN B 680 3.033 27.852 1.000 1.00 0.00 H new ATOM 0 HB2 ASN B 680 1.418 26.232 2.601 1.00 0.00 H new ATOM 0 HB3 ASN B 680 1.516 27.717 3.526 1.00 0.00 H new ATOM 0 HD21 ASN B 680 -0.819 27.485 0.208 1.00 0.00 H new ATOM 0 HD22 ASN B 680 0.040 26.107 0.903 1.00 0.00 H new ATOM 2366 N THR B 681 4.260 28.161 4.037 1.00 0.00 N ATOM 2367 CA THR B 681 4.942 29.078 4.941 1.00 0.00 C ATOM 2368 C THR B 681 6.144 29.726 4.262 1.00 0.00 C ATOM 2369 O THR B 681 6.584 30.805 4.657 1.00 0.00 O ATOM 2370 CB THR B 681 5.416 28.359 6.219 1.00 0.00 C ATOM 2371 OG1 THR B 681 4.481 27.336 6.580 1.00 0.00 O ATOM 2372 CG2 THR B 681 5.568 29.344 7.368 1.00 0.00 C ATOM 0 H THR B 681 4.220 27.196 4.366 1.00 0.00 H new ATOM 0 HA THR B 681 4.221 29.849 5.213 1.00 0.00 H new ATOM 0 HB THR B 681 6.388 27.908 6.018 1.00 0.00 H new ATOM 0 HG1 THR B 681 4.790 26.882 7.392 1.00 0.00 H new ATOM 0 HG21 THR B 681 5.903 28.814 8.260 1.00 0.00 H new ATOM 0 HG22 THR B 681 6.301 30.105 7.101 1.00 0.00 H new ATOM 0 HG23 THR B 681 4.608 29.820 7.568 1.00 0.00 H new ATOM 2380 N MET B 682 6.669 29.061 3.239 1.00 0.00 N ATOM 2381 CA MET B 682 7.820 29.575 2.503 1.00 0.00 C ATOM 2382 C MET B 682 7.584 31.016 2.063 1.00 0.00 C ATOM 2383 O MET B 682 8.339 31.917 2.427 1.00 0.00 O ATOM 2384 CB MET B 682 8.106 28.697 1.283 1.00 0.00 C ATOM 2385 CG MET B 682 8.576 27.297 1.639 1.00 0.00 C ATOM 2386 SD MET B 682 9.471 26.501 0.290 1.00 0.00 S ATOM 2387 CE MET B 682 8.204 25.416 -0.362 1.00 0.00 C ATOM 0 H MET B 682 6.317 28.166 2.900 1.00 0.00 H new ATOM 0 HA MET B 682 8.684 29.553 3.167 1.00 0.00 H new ATOM 0 HB2 MET B 682 7.202 28.625 0.678 1.00 0.00 H new ATOM 0 HB3 MET B 682 8.865 29.181 0.667 1.00 0.00 H new ATOM 0 HG2 MET B 682 9.219 27.346 2.518 1.00 0.00 H new ATOM 0 HG3 MET B 682 7.714 26.686 1.909 1.00 0.00 H new ATOM 0 HE1 MET B 682 8.478 25.100 -1.368 1.00 0.00 H new ATOM 0 HE2 MET B 682 8.109 24.541 0.280 1.00 0.00 H new ATOM 0 HE3 MET B 682 7.252 25.947 -0.395 1.00 0.00 H new ATOM 2395 N ALA B 683 6.532 31.227 1.279 1.00 0.00 N ATOM 2396 CA ALA B 683 6.196 32.558 0.792 1.00 0.00 C ATOM 2397 C ALA B 683 5.677 33.442 1.922 1.00 0.00 C ATOM 2398 O ALA B 683 5.813 34.664 1.879 1.00 0.00 O ATOM 2399 CB ALA B 683 5.168 32.469 -0.325 1.00 0.00 C ATOM 0 H ALA B 683 5.897 30.492 0.968 1.00 0.00 H new ATOM 0 HA ALA B 683 7.105 33.013 0.398 1.00 0.00 H new ATOM 0 HB1 ALA B 683 4.927 33.472 -0.678 1.00 0.00 H new ATOM 0 HB2 ALA B 683 5.575 31.882 -1.148 1.00 0.00 H new ATOM 0 HB3 ALA B 683 4.264 31.989 0.050 1.00 0.00 H new ATOM 2405 N MET B 684 5.080 32.815 2.930 1.00 0.00 N ATOM 2406 CA MET B 684 4.541 33.545 4.072 1.00 0.00 C ATOM 2407 C MET B 684 3.592 34.648 3.612 1.00 0.00 C ATOM 2408 O MET B 684 3.232 34.720 2.438 1.00 0.00 O ATOM 2409 CB MET B 684 5.676 34.145 4.903 1.00 0.00 C ATOM 2410 CG MET B 684 5.634 33.744 6.368 1.00 0.00 C ATOM 2411 SD MET B 684 7.242 33.213 6.989 1.00 0.00 S ATOM 2412 CE MET B 684 7.083 33.614 8.727 1.00 0.00 C ATOM 0 H MET B 684 4.957 31.804 2.980 1.00 0.00 H new ATOM 0 HA MET B 684 3.981 32.843 4.690 1.00 0.00 H new ATOM 0 HB2 MET B 684 6.630 33.835 4.477 1.00 0.00 H new ATOM 0 HB3 MET B 684 5.633 35.232 4.831 1.00 0.00 H new ATOM 0 HG2 MET B 684 5.280 34.587 6.961 1.00 0.00 H new ATOM 0 HG3 MET B 684 4.913 32.937 6.499 1.00 0.00 H new ATOM 0 HE1 MET B 684 8.001 33.343 9.248 1.00 0.00 H new ATOM 0 HE2 MET B 684 6.904 34.683 8.839 1.00 0.00 H new ATOM 0 HE3 MET B 684 6.247 33.060 9.153 1.00 0.00 H new ATOM 2420 N MET B 685 3.192 35.504 4.546 1.00 0.00 N ATOM 2421 CA MET B 685 2.286 36.605 4.236 1.00 0.00 C ATOM 2422 C MET B 685 3.035 37.755 3.571 1.00 0.00 C ATOM 2423 O MET B 685 2.453 38.536 2.820 1.00 0.00 O ATOM 2424 CB MET B 685 1.594 37.098 5.508 1.00 0.00 C ATOM 2425 CG MET B 685 0.413 36.239 5.930 1.00 0.00 C ATOM 2426 SD MET B 685 -1.097 36.649 5.035 1.00 0.00 S ATOM 2427 CE MET B 685 -2.272 36.754 6.383 1.00 0.00 C ATOM 0 H MET B 685 3.480 35.457 5.523 1.00 0.00 H new ATOM 0 HA MET B 685 1.532 36.237 3.541 1.00 0.00 H new ATOM 0 HB2 MET B 685 2.321 37.126 6.320 1.00 0.00 H new ATOM 0 HB3 MET B 685 1.251 38.121 5.352 1.00 0.00 H new ATOM 0 HG2 MET B 685 0.655 35.189 5.765 1.00 0.00 H new ATOM 0 HG3 MET B 685 0.242 36.363 6.999 1.00 0.00 H new ATOM 0 HE1 MET B 685 -3.257 37.002 5.988 1.00 0.00 H new ATOM 0 HE2 MET B 685 -2.319 35.796 6.900 1.00 0.00 H new ATOM 0 HE3 MET B 685 -1.956 37.529 7.082 1.00 0.00 H new ATOM 2435 N ALA B 686 4.331 37.854 3.853 1.00 0.00 N ATOM 2436 CA ALA B 686 5.159 38.907 3.281 1.00 0.00 C ATOM 2437 C ALA B 686 5.093 38.891 1.757 1.00 0.00 C ATOM 2438 O ALA B 686 4.722 39.885 1.132 1.00 0.00 O ATOM 2439 CB ALA B 686 6.599 38.760 3.750 1.00 0.00 C ATOM 0 H ALA B 686 4.829 37.217 4.475 1.00 0.00 H new ATOM 0 HA ALA B 686 4.772 39.866 3.625 1.00 0.00 H new ATOM 0 HB1 ALA B 686 7.206 39.554 3.315 1.00 0.00 H new ATOM 0 HB2 ALA B 686 6.636 38.829 4.837 1.00 0.00 H new ATOM 0 HB3 ALA B 686 6.987 37.792 3.435 1.00 0.00 H new ATOM 2445 N ARG B 687 5.456 37.758 1.166 1.00 0.00 N ATOM 2446 CA ARG B 687 5.439 37.614 -0.285 1.00 0.00 C ATOM 2447 C ARG B 687 4.019 37.377 -0.791 1.00 0.00 C ATOM 2448 O ARG B 687 3.502 38.146 -1.602 1.00 0.00 O ATOM 2449 CB ARG B 687 6.345 36.458 -0.714 1.00 0.00 C ATOM 2450 CG ARG B 687 7.527 36.895 -1.564 1.00 0.00 C ATOM 2451 CD ARG B 687 8.540 37.680 -0.746 1.00 0.00 C ATOM 2452 NE ARG B 687 9.826 37.795 -1.431 1.00 0.00 N ATOM 2453 CZ ARG B 687 10.071 38.681 -2.389 1.00 0.00 C ATOM 2454 NH1 ARG B 687 9.124 39.527 -2.773 1.00 0.00 N ATOM 2455 NH2 ARG B 687 11.266 38.725 -2.964 1.00 0.00 N ATOM 0 H ARG B 687 5.765 36.926 1.669 1.00 0.00 H new ATOM 0 HA ARG B 687 5.812 38.540 -0.722 1.00 0.00 H new ATOM 0 HB2 ARG B 687 6.716 35.949 0.175 1.00 0.00 H new ATOM 0 HB3 ARG B 687 5.754 35.733 -1.273 1.00 0.00 H new ATOM 0 HG2 ARG B 687 8.009 36.019 -1.998 1.00 0.00 H new ATOM 0 HG3 ARG B 687 7.174 37.508 -2.393 1.00 0.00 H new ATOM 0 HD2 ARG B 687 8.147 38.676 -0.542 1.00 0.00 H new ATOM 0 HD3 ARG B 687 8.685 37.191 0.217 1.00 0.00 H new ATOM 0 HE ARG B 687 10.576 37.160 -1.158 1.00 0.00 H new ATOM 0 HH11 ARG B 687 8.205 39.498 -2.332 1.00 0.00 H new ATOM 0 HH12 ARG B 687 9.315 40.207 -3.509 1.00 0.00 H new ATOM 0 HH21 ARG B 687 11.997 38.078 -2.670 1.00 0.00 H new ATOM 0 HH22 ARG B 687 11.453 39.406 -3.700 1.00 0.00 H new ATOM 2466 N ASP B 688 3.395 36.308 -0.310 1.00 0.00 N ATOM 2467 CA ASP B 688 2.035 35.970 -0.713 1.00 0.00 C ATOM 2468 C ASP B 688 1.014 36.683 0.167 1.00 0.00 C ATOM 2469 O ASP B 688 0.666 36.204 1.248 1.00 0.00 O ATOM 2470 CB ASP B 688 1.821 34.457 -0.641 1.00 0.00 C ATOM 2471 CG ASP B 688 2.538 33.718 -1.754 1.00 0.00 C ATOM 2472 OD1 ASP B 688 3.234 34.378 -2.554 1.00 0.00 O ATOM 2473 OD2 ASP B 688 2.403 32.478 -1.825 1.00 0.00 O ATOM 0 H ASP B 688 3.809 35.660 0.360 1.00 0.00 H new ATOM 0 HA ASP B 688 1.894 36.301 -1.742 1.00 0.00 H new ATOM 0 HB2 ASP B 688 2.174 34.088 0.322 1.00 0.00 H new ATOM 0 HB3 ASP B 688 0.754 34.241 -0.694 1.00 0.00 H new ATOM 2477 N THR B 689 0.536 37.832 -0.300 1.00 0.00 N ATOM 2478 CA THR B 689 -0.443 38.612 0.445 1.00 0.00 C ATOM 2479 C THR B 689 -1.788 38.638 -0.273 1.00 0.00 C ATOM 2480 O THR B 689 -2.841 38.553 0.357 1.00 0.00 O ATOM 2481 CB THR B 689 0.038 40.059 0.661 1.00 0.00 C ATOM 2482 OG1 THR B 689 -1.030 40.859 1.180 1.00 0.00 O ATOM 2483 CG2 THR B 689 0.542 40.662 -0.642 1.00 0.00 C ATOM 0 H THR B 689 0.812 38.243 -1.192 1.00 0.00 H new ATOM 0 HA THR B 689 -0.561 38.127 1.414 1.00 0.00 H new ATOM 0 HB THR B 689 0.859 40.042 1.377 1.00 0.00 H new ATOM 0 HG1 THR B 689 -0.715 41.777 1.316 1.00 0.00 H new ATOM 0 HG21 THR B 689 0.876 41.684 -0.465 1.00 0.00 H new ATOM 0 HG22 THR B 689 1.374 40.068 -1.020 1.00 0.00 H new ATOM 0 HG23 THR B 689 -0.263 40.666 -1.377 1.00 0.00 H new ATOM 2491 N ALA B 690 -1.744 38.756 -1.596 1.00 0.00 N ATOM 2492 CA ALA B 690 -2.960 38.791 -2.401 1.00 0.00 C ATOM 2493 C ALA B 690 -3.357 37.390 -2.855 1.00 0.00 C ATOM 2494 O ALA B 690 -4.518 37.138 -3.174 1.00 0.00 O ATOM 2495 CB ALA B 690 -2.770 39.704 -3.603 1.00 0.00 C ATOM 0 H ALA B 690 -0.880 38.829 -2.133 1.00 0.00 H new ATOM 0 HA ALA B 690 -3.766 39.186 -1.782 1.00 0.00 H new ATOM 0 HB1 ALA B 690 -3.685 39.721 -4.195 1.00 0.00 H new ATOM 0 HB2 ALA B 690 -2.540 40.713 -3.261 1.00 0.00 H new ATOM 0 HB3 ALA B 690 -1.948 39.333 -4.215 1.00 0.00 H new ATOM 2501 N GLU B 691 -2.384 36.483 -2.883 1.00 0.00 N ATOM 2502 CA GLU B 691 -2.634 35.109 -3.300 1.00 0.00 C ATOM 2503 C GLU B 691 -3.383 34.339 -2.216 1.00 0.00 C ATOM 2504 O GLU B 691 -4.494 33.858 -2.436 1.00 0.00 O ATOM 2505 CB GLU B 691 -1.316 34.403 -3.624 1.00 0.00 C ATOM 2506 CG GLU B 691 -0.314 35.287 -4.347 1.00 0.00 C ATOM 2507 CD GLU B 691 0.379 34.570 -5.489 1.00 0.00 C ATOM 2508 OE1 GLU B 691 -0.303 34.232 -6.479 1.00 0.00 O ATOM 2509 OE2 GLU B 691 1.604 34.346 -5.394 1.00 0.00 O ATOM 0 H GLU B 691 -1.417 36.676 -2.622 1.00 0.00 H new ATOM 0 HA GLU B 691 -3.254 35.136 -4.196 1.00 0.00 H new ATOM 0 HB2 GLU B 691 -0.869 34.044 -2.697 1.00 0.00 H new ATOM 0 HB3 GLU B 691 -1.524 33.527 -4.238 1.00 0.00 H new ATOM 0 HG2 GLU B 691 -0.825 36.169 -4.733 1.00 0.00 H new ATOM 0 HG3 GLU B 691 0.434 35.638 -3.636 1.00 0.00 H new ATOM 2514 N ALA B 692 -2.765 34.226 -1.045 1.00 0.00 N ATOM 2515 CA ALA B 692 -3.373 33.516 0.074 1.00 0.00 C ATOM 2516 C ALA B 692 -4.659 34.200 0.524 1.00 0.00 C ATOM 2517 O ALA B 692 -5.538 33.567 1.109 1.00 0.00 O ATOM 2518 CB ALA B 692 -2.392 33.418 1.232 1.00 0.00 C ATOM 0 H ALA B 692 -1.844 34.617 -0.846 1.00 0.00 H new ATOM 0 HA ALA B 692 -3.625 32.510 -0.260 1.00 0.00 H new ATOM 0 HB1 ALA B 692 -2.859 32.886 2.061 1.00 0.00 H new ATOM 0 HB2 ALA B 692 -1.502 32.878 0.910 1.00 0.00 H new ATOM 0 HB3 ALA B 692 -2.111 34.420 1.557 1.00 0.00 H new ATOM 2524 N ALA B 693 -4.763 35.496 0.249 1.00 0.00 N ATOM 2525 CA ALA B 693 -5.942 36.265 0.624 1.00 0.00 C ATOM 2526 C ALA B 693 -7.019 36.179 -0.451 1.00 0.00 C ATOM 2527 O ALA B 693 -8.207 36.341 -0.169 1.00 0.00 O ATOM 2528 CB ALA B 693 -5.567 37.717 0.882 1.00 0.00 C ATOM 0 H ALA B 693 -4.044 36.035 -0.233 1.00 0.00 H new ATOM 0 HA ALA B 693 -6.346 35.837 1.542 1.00 0.00 H new ATOM 0 HB1 ALA B 693 -6.458 38.279 1.161 1.00 0.00 H new ATOM 0 HB2 ALA B 693 -4.839 37.766 1.691 1.00 0.00 H new ATOM 0 HB3 ALA B 693 -5.135 38.147 -0.022 1.00 0.00 H new ATOM 2534 N LYS B 694 -6.599 35.922 -1.685 1.00 0.00 N ATOM 2535 CA LYS B 694 -7.527 35.814 -2.804 1.00 0.00 C ATOM 2536 C LYS B 694 -8.565 34.725 -2.546 1.00 0.00 C ATOM 2537 O LYS B 694 -8.439 33.948 -1.600 1.00 0.00 O ATOM 2538 CB LYS B 694 -6.765 35.511 -4.097 1.00 0.00 C ATOM 2539 CG LYS B 694 -6.784 36.657 -5.095 1.00 0.00 C ATOM 2540 CD LYS B 694 -5.609 36.577 -6.055 1.00 0.00 C ATOM 2541 CE LYS B 694 -5.115 37.962 -6.446 1.00 0.00 C ATOM 2542 NZ LYS B 694 -5.341 38.244 -7.890 1.00 0.00 N ATOM 0 H LYS B 694 -5.620 35.784 -1.936 1.00 0.00 H new ATOM 0 HA LYS B 694 -8.044 36.768 -2.909 1.00 0.00 H new ATOM 0 HB2 LYS B 694 -5.731 35.270 -3.852 1.00 0.00 H new ATOM 0 HB3 LYS B 694 -7.196 34.626 -4.564 1.00 0.00 H new ATOM 0 HG2 LYS B 694 -7.717 36.636 -5.658 1.00 0.00 H new ATOM 0 HG3 LYS B 694 -6.755 37.607 -4.561 1.00 0.00 H new ATOM 0 HD2 LYS B 694 -4.797 36.017 -5.592 1.00 0.00 H new ATOM 0 HD3 LYS B 694 -5.905 36.029 -6.949 1.00 0.00 H new ATOM 0 HE2 LYS B 694 -5.627 38.713 -5.845 1.00 0.00 H new ATOM 0 HE3 LYS B 694 -4.052 38.045 -6.222 1.00 0.00 H new ATOM 0 HZ1 LYS B 694 -4.991 39.197 -8.117 1.00 0.00 H new ATOM 0 HZ2 LYS B 694 -4.832 37.542 -8.465 1.00 0.00 H new ATOM 0 HZ3 LYS B 694 -6.358 38.190 -8.099 1.00 0.00 H new ATOM 2552 N TRP B 695 -9.586 34.676 -3.393 1.00 0.00 N ATOM 2553 CA TRP B 695 -10.644 33.682 -3.258 1.00 0.00 C ATOM 2554 C TRP B 695 -10.071 32.270 -3.285 1.00 0.00 C ATOM 2555 O TRP B 695 -8.910 32.068 -3.638 1.00 0.00 O ATOM 2556 CB TRP B 695 -11.675 33.848 -4.374 1.00 0.00 C ATOM 2557 CG TRP B 695 -12.495 35.097 -4.245 1.00 0.00 C ATOM 2558 CD1 TRP B 695 -12.579 36.120 -5.147 1.00 0.00 C ATOM 2559 CD2 TRP B 695 -13.345 35.454 -3.150 1.00 0.00 C ATOM 2560 NE1 TRP B 695 -13.429 37.092 -4.677 1.00 0.00 N ATOM 2561 CE2 TRP B 695 -13.913 36.707 -3.455 1.00 0.00 C ATOM 2562 CE3 TRP B 695 -13.683 34.837 -1.943 1.00 0.00 C ATOM 2563 CZ2 TRP B 695 -14.798 37.351 -2.596 1.00 0.00 C ATOM 2564 CZ3 TRP B 695 -14.562 35.479 -1.090 1.00 0.00 C ATOM 2565 CH2 TRP B 695 -15.112 36.725 -1.420 1.00 0.00 C ATOM 0 H TRP B 695 -9.704 35.313 -4.181 1.00 0.00 H new ATOM 0 HA TRP B 695 -11.133 33.838 -2.296 1.00 0.00 H new ATOM 0 HB2 TRP B 695 -11.161 33.857 -5.335 1.00 0.00 H new ATOM 0 HB3 TRP B 695 -12.340 32.984 -4.376 1.00 0.00 H new ATOM 0 HD1 TRP B 695 -12.055 36.159 -6.090 1.00 0.00 H new ATOM 0 HE1 TRP B 695 -13.662 37.960 -5.160 1.00 0.00 H new ATOM 0 HE3 TRP B 695 -13.265 33.876 -1.681 1.00 0.00 H new ATOM 0 HZ2 TRP B 695 -15.222 38.311 -2.848 1.00 0.00 H new ATOM 0 HZ3 TRP B 695 -14.829 35.012 -0.153 1.00 0.00 H new ATOM 0 HH2 TRP B 695 -15.797 37.200 -0.733 1.00 0.00 H new ATOM 2575 N GLY B 696 -10.893 31.294 -2.910 1.00 0.00 N ATOM 2576 CA GLY B 696 -10.449 29.913 -2.899 1.00 0.00 C ATOM 2577 C GLY B 696 -11.434 28.981 -3.576 1.00 0.00 C ATOM 2578 O GLY B 696 -12.509 29.405 -4.000 1.00 0.00 O ATOM 0 H GLY B 696 -11.859 31.436 -2.614 1.00 0.00 H new ATOM 0 HA2 GLY B 696 -9.483 29.841 -3.399 1.00 0.00 H new ATOM 0 HA3 GLY B 696 -10.299 29.591 -1.868 1.00 0.00 H new ATOM 2582 N GLY B 697 -11.066 27.708 -3.682 1.00 0.00 N ATOM 2583 CA GLY B 697 -11.936 26.735 -4.316 1.00 0.00 C ATOM 2584 C GLY B 697 -12.870 26.062 -3.329 1.00 0.00 C ATOM 2585 O GLY B 697 -13.701 25.239 -3.713 1.00 0.00 O ATOM 0 H GLY B 697 -10.181 27.333 -3.340 1.00 0.00 H new ATOM 0 HA2 GLY B 697 -12.524 27.228 -5.090 1.00 0.00 H new ATOM 0 HA3 GLY B 697 -11.329 25.977 -4.811 1.00 0.00 H new TER 2589 GLY B 697