USER MOD reduce.3.24.130724 H: found=0, std=0, add=1327, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1332 hydrogens (8 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 NoAdj-H: P 829 PTR HN2 : P 829 PTR N : P 828 ILE C :(H bumps) USER MOD NoAdj-H: P 829 PTR H : P 829 PTR N : P 828 ILE C :(H bumps) USER MOD Set 1.1: A 627 LYS NZ :NH3+ -158:sc= -1.38 (180deg=-2.3) USER MOD Set 1.2: A 700 THR OG1 : rot 101:sc= 0.037 USER MOD Set 2.1: A 654 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 666 GLN : amide:sc= 0.774 K(o=0.77,f=-1) USER MOD Set 3.1: A 623 CYS SG : rot 170:sc= -4.23! USER MOD Set 3.2: A 649 TYR OH : rot 162:sc= -0.604 USER MOD Set 3.3: A 651 HIS : no HD1:sc= -6.29! C(o=-9.9!,f=-16!) USER MOD Set 3.4: A 657 SER OG : rot -139:sc= 1.21! USER MOD Single : A 574 ASN : amide:sc= -0.203 K(o=-0.2,f=-2.3!) USER MOD Single : A 579 THR OG1 : rot 82:sc= 0.0124 USER MOD Single : A 581 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 586 SER OG : rot -144:sc= -1.97! USER MOD Single : A 589 GLN : amide:sc= -2.74! C(o=-2.7!,f=-4.7!) USER MOD Single : A 591 SER OG : rot 180:sc= 0 USER MOD Single : A 595 GLN :FLIP amide:sc= -0.191 F(o=-2.3,f=-0.19) USER MOD Single : A 596 GLN : amide:sc= -2.17 K(o=-2.2,f=-4.2!) USER MOD Single : A 599 ASN : amide:sc= 0.971 K(o=0.97,f=-8.2!) USER MOD Single : A 606 SER OG : rot 180:sc=0.000426 USER MOD Single : A 609 CYS SG : rot 135:sc= 0.156 USER MOD Single : A 610 ASN : amide:sc= -2.62 K(o=-2.6,f=-10!) USER MOD Single : A 611 CYS SG : rot -38:sc= -14.2! USER MOD Single : A 612 LYS NZ :NH3+ -96:sc=-0.00167 (180deg=-0.169) USER MOD Single : A 616 ASN : amide:sc= -0.106 X(o=-0.11,f=-0.14) USER MOD Single : A 619 SER OG : rot 180:sc= 0 USER MOD Single : A 622 HIS :FLIP no HD1:sc= -8.75! C(o=-11!,f=-8.8!) USER MOD Single : A 628 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 630 HIS : no HE2:sc= -1.68 K(o=-1.7,f=-4!) USER MOD Single : A 634 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.2) USER MOD Single : A 635 SER OG : rot 180:sc= 0.021 USER MOD Single : A 636 MET CE :methyl -164:sc= 0 (180deg=-0.575) USER MOD Single : A 637 TYR OH : rot 180:sc= 0 USER MOD Single : A 639 SER OG : rot 44:sc= 1.17 USER MOD Single : A 642 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 650 CYS SG : rot 148:sc= -0.594 USER MOD Single : A 652 THR OG1 : rot 59:sc= -0.344! USER MOD Single : A 655 ASN : amide:sc= -0.966 K(o=-0.97,f=-6.1!) USER MOD Single : A 658 TYR OH : rot 180:sc= -0.319 USER MOD Single : A 660 ASN : amide:sc= -0.0675 X(o=-0.068,f=-0.068) USER MOD Single : A 661 ASN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 662 ASN : amide:sc= -5.19! C(o=-5.2!,f=-12!) USER MOD Single : A 664 MET CE :methyl 171:sc= -2.37! (180deg=-2.69!) USER MOD Single : A 668 THR OG1 : rot -99:sc= -1.24! USER MOD Single : A 669 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 673 GLN :FLIP amide:sc= -2.76 F(o=-5.1!,f=-2.8) USER MOD Single : A 679 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00139) USER MOD Single : A 684 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 685 ASN : amide:sc= -0.0975 X(o=-0.097,f=-0.0011) USER MOD Single : A 686 ASN : amide:sc= -0.246 K(o=-0.25,f=-2.1!) USER MOD Single : A 687 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 693 LYS NZ :NH3+ 145:sc= 0.409 (180deg=0.00379) USER MOD Single : A 697 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 699 THR OG1 : rot -26:sc= 0.921 USER MOD Single : A 704 ASN :FLIP amide:sc= -10.7! C(o=-14!,f=-11!) USER MOD Single : A 709 MET CE :methyl 155:sc= -0.48 (180deg=-1.93!) USER MOD Single : A 711 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 713 GLN : amide:sc= -1.21 K(o=-1.2,f=-4.1!) USER MOD Single : A 718 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 719 GLN : amide:sc= -0.445 K(o=-0.44,f=-1.5) USER MOD Single : A 720 THR OG1 : rot 180:sc= 0 USER MOD Single : A 724 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 728 LYS NZ :NH3+ -157:sc= -0.0262 (180deg=-0.265) USER MOD Single : A 729 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 830 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 573 -16.837 11.681 -10.637 1.00 0.00 N ATOM 2 CA GLY A 573 -16.651 10.414 -11.320 1.00 0.00 C ATOM 3 C GLY A 573 -17.908 9.568 -11.326 1.00 0.00 C ATOM 4 O GLY A 573 -18.598 9.462 -10.311 1.00 0.00 O ATOM 0 HA2 GLY A 573 -16.338 10.601 -12.347 1.00 0.00 H new ATOM 0 HA3 GLY A 573 -15.846 9.860 -10.838 1.00 0.00 H new ATOM 8 N ASN A 574 -18.206 8.963 -12.471 1.00 0.00 N ATOM 9 CA ASN A 574 -19.389 8.120 -12.607 1.00 0.00 C ATOM 10 C ASN A 574 -19.184 6.773 -11.920 1.00 0.00 C ATOM 11 O ASN A 574 -20.149 6.095 -11.567 1.00 0.00 O ATOM 12 CB ASN A 574 -19.717 7.905 -14.085 1.00 0.00 C ATOM 13 CG ASN A 574 -20.706 8.925 -14.614 1.00 0.00 C ATOM 14 OD1 ASN A 574 -21.179 9.789 -13.876 1.00 0.00 O ATOM 15 ND2 ASN A 574 -21.023 8.831 -15.900 1.00 0.00 N ATOM 0 H ASN A 574 -17.644 9.041 -13.319 1.00 0.00 H new ATOM 0 HA ASN A 574 -20.223 8.629 -12.124 1.00 0.00 H new ATOM 0 HB2 ASN A 574 -18.798 7.957 -14.669 1.00 0.00 H new ATOM 0 HB3 ASN A 574 -20.125 6.903 -14.222 1.00 0.00 H new ATOM 0 HD21 ASN A 574 -21.682 9.491 -16.312 1.00 0.00 H new ATOM 0 HD22 ASN A 574 -20.607 8.099 -16.476 1.00 0.00 H new ATOM 22 N GLY A 575 -17.925 6.387 -11.735 1.00 0.00 N ATOM 23 CA GLY A 575 -17.624 5.123 -11.095 1.00 0.00 C ATOM 24 C GLY A 575 -16.369 4.473 -11.647 1.00 0.00 C ATOM 25 O GLY A 575 -15.806 3.576 -11.022 1.00 0.00 O ATOM 0 H GLY A 575 -17.109 6.929 -12.018 1.00 0.00 H new ATOM 0 HA2 GLY A 575 -17.505 5.282 -10.023 1.00 0.00 H new ATOM 0 HA3 GLY A 575 -18.467 4.445 -11.225 1.00 0.00 H new ATOM 29 N ARG A 576 -15.931 4.924 -12.820 1.00 0.00 N ATOM 30 CA ARG A 576 -14.741 4.376 -13.453 1.00 0.00 C ATOM 31 C ARG A 576 -13.574 5.348 -13.361 1.00 0.00 C ATOM 32 O ARG A 576 -13.754 6.561 -13.458 1.00 0.00 O ATOM 33 CB ARG A 576 -15.032 4.046 -14.918 1.00 0.00 C ATOM 34 CG ARG A 576 -14.235 2.864 -15.444 1.00 0.00 C ATOM 35 CD ARG A 576 -13.061 3.311 -16.301 1.00 0.00 C ATOM 36 NE ARG A 576 -13.490 3.770 -17.622 1.00 0.00 N ATOM 37 CZ ARG A 576 -13.677 5.049 -17.947 1.00 0.00 C ATOM 38 NH1 ARG A 576 -13.467 6.012 -17.058 1.00 0.00 N ATOM 39 NH2 ARG A 576 -14.074 5.366 -19.172 1.00 0.00 N ATOM 0 H ARG A 576 -16.385 5.668 -13.349 1.00 0.00 H new ATOM 0 HA ARG A 576 -14.466 3.463 -12.925 1.00 0.00 H new ATOM 0 HB2 ARG A 576 -16.096 3.835 -15.030 1.00 0.00 H new ATOM 0 HB3 ARG A 576 -14.814 4.922 -15.529 1.00 0.00 H new ATOM 0 HG2 ARG A 576 -13.868 2.271 -14.606 1.00 0.00 H new ATOM 0 HG3 ARG A 576 -14.888 2.218 -16.030 1.00 0.00 H new ATOM 0 HD2 ARG A 576 -12.527 4.115 -15.794 1.00 0.00 H new ATOM 0 HD3 ARG A 576 -12.360 2.484 -16.415 1.00 0.00 H new ATOM 0 HE ARG A 576 -13.657 3.066 -18.341 1.00 0.00 H new ATOM 0 HH11 ARG A 576 -13.159 5.777 -16.114 1.00 0.00 H new ATOM 0 HH12 ARG A 576 -13.613 6.987 -17.318 1.00 0.00 H new ATOM 0 HH21 ARG A 576 -14.235 4.632 -19.862 1.00 0.00 H new ATOM 0 HH22 ARG A 576 -14.218 6.344 -19.424 1.00 0.00 H new ATOM 53 N PHE A 577 -12.376 4.807 -13.174 1.00 0.00 N ATOM 54 CA PHE A 577 -11.180 5.632 -13.068 1.00 0.00 C ATOM 55 C PHE A 577 -10.056 5.081 -13.945 1.00 0.00 C ATOM 56 O PHE A 577 -9.469 5.810 -14.744 1.00 0.00 O ATOM 57 CB PHE A 577 -10.725 5.718 -11.606 1.00 0.00 C ATOM 58 CG PHE A 577 -9.258 5.996 -11.431 1.00 0.00 C ATOM 59 CD1 PHE A 577 -8.336 4.968 -11.498 1.00 0.00 C ATOM 60 CD2 PHE A 577 -8.806 7.283 -11.205 1.00 0.00 C ATOM 61 CE1 PHE A 577 -6.986 5.219 -11.343 1.00 0.00 C ATOM 62 CE2 PHE A 577 -7.459 7.542 -11.048 1.00 0.00 C ATOM 63 CZ PHE A 577 -6.547 6.508 -11.118 1.00 0.00 C ATOM 0 H PHE A 577 -12.208 3.804 -13.093 1.00 0.00 H new ATOM 0 HA PHE A 577 -11.423 6.634 -13.421 1.00 0.00 H new ATOM 0 HB2 PHE A 577 -11.294 6.502 -11.106 1.00 0.00 H new ATOM 0 HB3 PHE A 577 -10.967 4.780 -11.106 1.00 0.00 H new ATOM 0 HD1 PHE A 577 -8.675 3.958 -11.673 1.00 0.00 H new ATOM 0 HD2 PHE A 577 -9.515 8.096 -11.151 1.00 0.00 H new ATOM 0 HE1 PHE A 577 -6.275 4.408 -11.398 1.00 0.00 H new ATOM 0 HE2 PHE A 577 -7.119 8.552 -10.871 1.00 0.00 H new ATOM 0 HZ PHE A 577 -5.492 6.707 -10.997 1.00 0.00 H new ATOM 73 N LEU A 578 -9.760 3.794 -13.789 1.00 0.00 N ATOM 74 CA LEU A 578 -8.704 3.158 -14.567 1.00 0.00 C ATOM 75 C LEU A 578 -9.279 2.103 -15.496 1.00 0.00 C ATOM 76 O LEU A 578 -10.218 1.394 -15.141 1.00 0.00 O ATOM 77 CB LEU A 578 -7.662 2.523 -13.644 1.00 0.00 C ATOM 78 CG LEU A 578 -6.394 2.035 -14.344 1.00 0.00 C ATOM 79 CD1 LEU A 578 -5.781 3.150 -15.176 1.00 0.00 C ATOM 80 CD2 LEU A 578 -5.392 1.516 -13.324 1.00 0.00 C ATOM 0 H LEU A 578 -10.235 3.174 -13.133 1.00 0.00 H new ATOM 0 HA LEU A 578 -8.221 3.928 -15.168 1.00 0.00 H new ATOM 0 HB2 LEU A 578 -7.382 3.250 -12.882 1.00 0.00 H new ATOM 0 HB3 LEU A 578 -8.121 1.680 -13.127 1.00 0.00 H new ATOM 0 HG LEU A 578 -6.661 1.217 -15.013 1.00 0.00 H new ATOM 0 HD11 LEU A 578 -4.879 2.784 -15.667 1.00 0.00 H new ATOM 0 HD12 LEU A 578 -6.497 3.477 -15.930 1.00 0.00 H new ATOM 0 HD13 LEU A 578 -5.527 3.989 -14.529 1.00 0.00 H new ATOM 0 HD21 LEU A 578 -4.494 1.172 -13.838 1.00 0.00 H new ATOM 0 HD22 LEU A 578 -5.130 2.316 -12.632 1.00 0.00 H new ATOM 0 HD23 LEU A 578 -5.833 0.687 -12.770 1.00 0.00 H new ATOM 92 N THR A 579 -8.712 2.005 -16.689 1.00 0.00 N ATOM 93 CA THR A 579 -9.172 1.035 -17.668 1.00 0.00 C ATOM 94 C THR A 579 -8.042 0.109 -18.099 1.00 0.00 C ATOM 95 O THR A 579 -7.073 0.545 -18.716 1.00 0.00 O ATOM 96 CB THR A 579 -9.753 1.731 -18.913 1.00 0.00 C ATOM 97 OG1 THR A 579 -10.629 2.793 -18.516 1.00 0.00 O ATOM 98 CG2 THR A 579 -10.514 0.739 -19.781 1.00 0.00 C ATOM 0 H THR A 579 -7.933 2.585 -17.001 1.00 0.00 H new ATOM 0 HA THR A 579 -9.955 0.447 -17.188 1.00 0.00 H new ATOM 0 HB THR A 579 -8.926 2.139 -19.493 1.00 0.00 H new ATOM 0 HG1 THR A 579 -10.100 3.589 -18.297 1.00 0.00 H new ATOM 0 HG21 THR A 579 -10.915 1.253 -20.654 1.00 0.00 H new ATOM 0 HG22 THR A 579 -9.839 -0.054 -20.105 1.00 0.00 H new ATOM 0 HG23 THR A 579 -11.333 0.306 -19.206 1.00 0.00 H new ATOM 106 N LEU A 580 -8.194 -1.177 -17.806 1.00 0.00 N ATOM 107 CA LEU A 580 -7.209 -2.168 -18.198 1.00 0.00 C ATOM 108 C LEU A 580 -7.772 -2.903 -19.387 1.00 0.00 C ATOM 109 O LEU A 580 -8.750 -3.634 -19.256 1.00 0.00 O ATOM 110 CB LEU A 580 -6.927 -3.145 -17.051 1.00 0.00 C ATOM 111 CG LEU A 580 -5.631 -2.892 -16.279 1.00 0.00 C ATOM 112 CD1 LEU A 580 -5.359 -4.032 -15.309 1.00 0.00 C ATOM 113 CD2 LEU A 580 -4.462 -2.716 -17.237 1.00 0.00 C ATOM 0 H LEU A 580 -8.993 -1.555 -17.297 1.00 0.00 H new ATOM 0 HA LEU A 580 -6.264 -1.687 -18.448 1.00 0.00 H new ATOM 0 HB2 LEU A 580 -7.761 -3.107 -16.350 1.00 0.00 H new ATOM 0 HB3 LEU A 580 -6.897 -4.156 -17.456 1.00 0.00 H new ATOM 0 HG LEU A 580 -5.746 -1.971 -15.707 1.00 0.00 H new ATOM 0 HD11 LEU A 580 -4.433 -3.836 -14.768 1.00 0.00 H new ATOM 0 HD12 LEU A 580 -6.184 -4.112 -14.601 1.00 0.00 H new ATOM 0 HD13 LEU A 580 -5.265 -4.966 -15.863 1.00 0.00 H new ATOM 0 HD21 LEU A 580 -3.549 -2.537 -16.668 1.00 0.00 H new ATOM 0 HD22 LEU A 580 -4.345 -3.618 -17.837 1.00 0.00 H new ATOM 0 HD23 LEU A 580 -4.654 -1.866 -17.893 1.00 0.00 H new ATOM 125 N LYS A 581 -7.209 -2.669 -20.559 1.00 0.00 N ATOM 126 CA LYS A 581 -7.758 -3.288 -21.752 1.00 0.00 C ATOM 127 C LYS A 581 -6.876 -4.363 -22.372 1.00 0.00 C ATOM 128 O LYS A 581 -5.979 -4.060 -23.158 1.00 0.00 O ATOM 129 CB LYS A 581 -8.049 -2.215 -22.801 1.00 0.00 C ATOM 130 CG LYS A 581 -8.704 -0.965 -22.233 1.00 0.00 C ATOM 131 CD LYS A 581 -8.839 0.122 -23.287 1.00 0.00 C ATOM 132 CE LYS A 581 -9.006 1.493 -22.654 1.00 0.00 C ATOM 133 NZ LYS A 581 -8.988 2.581 -23.672 1.00 0.00 N ATOM 0 H LYS A 581 -6.395 -2.073 -20.710 1.00 0.00 H new ATOM 0 HA LYS A 581 -8.670 -3.790 -21.429 1.00 0.00 H new ATOM 0 HB2 LYS A 581 -7.116 -1.935 -23.290 1.00 0.00 H new ATOM 0 HB3 LYS A 581 -8.697 -2.637 -23.569 1.00 0.00 H new ATOM 0 HG2 LYS A 581 -9.689 -1.216 -21.840 1.00 0.00 H new ATOM 0 HG3 LYS A 581 -8.113 -0.591 -21.397 1.00 0.00 H new ATOM 0 HD2 LYS A 581 -7.957 0.121 -23.928 1.00 0.00 H new ATOM 0 HD3 LYS A 581 -9.697 -0.092 -23.925 1.00 0.00 H new ATOM 0 HE2 LYS A 581 -9.946 1.527 -22.103 1.00 0.00 H new ATOM 0 HE3 LYS A 581 -8.207 1.659 -21.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 581 -9.105 3.500 -23.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 581 -8.081 2.566 -24.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 581 -9.766 2.438 -24.347 1.00 0.00 H new ATOM 147 N PRO A 582 -7.164 -5.648 -22.081 1.00 0.00 N ATOM 148 CA PRO A 582 -6.429 -6.757 -22.684 1.00 0.00 C ATOM 149 C PRO A 582 -6.371 -6.558 -24.199 1.00 0.00 C ATOM 150 O PRO A 582 -7.386 -6.675 -24.887 1.00 0.00 O ATOM 151 CB PRO A 582 -7.262 -7.992 -22.320 1.00 0.00 C ATOM 152 CG PRO A 582 -8.066 -7.597 -21.120 1.00 0.00 C ATOM 153 CD PRO A 582 -8.245 -6.104 -21.184 1.00 0.00 C ATOM 0 HA PRO A 582 -5.400 -6.843 -22.336 1.00 0.00 H new ATOM 0 HB2 PRO A 582 -7.910 -8.285 -23.146 1.00 0.00 H new ATOM 0 HB3 PRO A 582 -6.621 -8.846 -22.099 1.00 0.00 H new ATOM 0 HG2 PRO A 582 -9.032 -8.102 -21.120 1.00 0.00 H new ATOM 0 HG3 PRO A 582 -7.555 -7.885 -20.201 1.00 0.00 H new ATOM 0 HD2 PRO A 582 -9.227 -5.837 -21.575 1.00 0.00 H new ATOM 0 HD3 PRO A 582 -8.161 -5.650 -20.197 1.00 0.00 H new ATOM 161 N LEU A 583 -5.194 -6.192 -24.695 1.00 0.00 N ATOM 162 CA LEU A 583 -5.012 -5.893 -26.117 1.00 0.00 C ATOM 163 C LEU A 583 -5.004 -7.133 -27.012 1.00 0.00 C ATOM 164 O LEU A 583 -4.738 -8.248 -26.564 1.00 0.00 O ATOM 165 CB LEU A 583 -3.731 -5.083 -26.342 1.00 0.00 C ATOM 166 CG LEU A 583 -2.600 -5.324 -25.338 1.00 0.00 C ATOM 167 CD1 LEU A 583 -1.245 -5.189 -26.014 1.00 0.00 C ATOM 168 CD2 LEU A 583 -2.710 -4.354 -24.170 1.00 0.00 C ATOM 0 H LEU A 583 -4.348 -6.094 -24.134 1.00 0.00 H new ATOM 0 HA LEU A 583 -5.882 -5.303 -26.407 1.00 0.00 H new ATOM 0 HB2 LEU A 583 -3.356 -5.303 -27.341 1.00 0.00 H new ATOM 0 HB3 LEU A 583 -3.987 -4.024 -26.324 1.00 0.00 H new ATOM 0 HG LEU A 583 -2.693 -6.340 -24.955 1.00 0.00 H new ATOM 0 HD11 LEU A 583 -0.455 -5.364 -25.284 1.00 0.00 H new ATOM 0 HD12 LEU A 583 -1.165 -5.921 -26.818 1.00 0.00 H new ATOM 0 HD13 LEU A 583 -1.142 -4.185 -26.426 1.00 0.00 H new ATOM 0 HD21 LEU A 583 -1.899 -4.539 -23.466 1.00 0.00 H new ATOM 0 HD22 LEU A 583 -2.644 -3.331 -24.539 1.00 0.00 H new ATOM 0 HD23 LEU A 583 -3.666 -4.497 -23.667 1.00 0.00 H new ATOM 180 N PRO A 584 -5.315 -6.922 -28.310 1.00 0.00 N ATOM 181 CA PRO A 584 -5.373 -7.983 -29.326 1.00 0.00 C ATOM 182 C PRO A 584 -4.090 -8.800 -29.424 1.00 0.00 C ATOM 183 O PRO A 584 -4.113 -9.951 -29.857 1.00 0.00 O ATOM 184 CB PRO A 584 -5.626 -7.229 -30.641 1.00 0.00 C ATOM 185 CG PRO A 584 -5.323 -5.801 -30.342 1.00 0.00 C ATOM 186 CD PRO A 584 -5.647 -5.611 -28.891 1.00 0.00 C ATOM 0 HA PRO A 584 -6.145 -8.712 -29.079 1.00 0.00 H new ATOM 0 HB2 PRO A 584 -4.988 -7.607 -31.440 1.00 0.00 H new ATOM 0 HB3 PRO A 584 -6.657 -7.351 -30.972 1.00 0.00 H new ATOM 0 HG2 PRO A 584 -4.276 -5.573 -30.542 1.00 0.00 H new ATOM 0 HG3 PRO A 584 -5.919 -5.136 -30.966 1.00 0.00 H new ATOM 0 HD2 PRO A 584 -5.057 -4.810 -28.446 1.00 0.00 H new ATOM 0 HD3 PRO A 584 -6.696 -5.355 -28.741 1.00 0.00 H new ATOM 194 N ASP A 585 -2.969 -8.216 -29.027 1.00 0.00 N ATOM 195 CA ASP A 585 -1.700 -8.931 -29.085 1.00 0.00 C ATOM 196 C ASP A 585 -1.755 -10.157 -28.178 1.00 0.00 C ATOM 197 O ASP A 585 -1.012 -11.120 -28.366 1.00 0.00 O ATOM 198 CB ASP A 585 -0.550 -8.014 -28.662 1.00 0.00 C ATOM 199 CG ASP A 585 0.015 -7.222 -29.825 1.00 0.00 C ATOM 200 OD1 ASP A 585 -0.770 -6.830 -30.714 1.00 0.00 O ATOM 201 OD2 ASP A 585 1.243 -6.995 -29.847 1.00 0.00 O ATOM 0 H ASP A 585 -2.910 -7.264 -28.666 1.00 0.00 H new ATOM 0 HA ASP A 585 -1.525 -9.254 -30.111 1.00 0.00 H new ATOM 0 HB2 ASP A 585 -0.902 -7.325 -27.894 1.00 0.00 H new ATOM 0 HB3 ASP A 585 0.243 -8.613 -28.214 1.00 0.00 H new ATOM 206 N SER A 586 -2.660 -10.112 -27.205 1.00 0.00 N ATOM 207 CA SER A 586 -2.851 -11.207 -26.267 1.00 0.00 C ATOM 208 C SER A 586 -4.014 -12.084 -26.696 1.00 0.00 C ATOM 209 O SER A 586 -4.941 -11.614 -27.351 1.00 0.00 O ATOM 210 CB SER A 586 -3.114 -10.652 -24.869 1.00 0.00 C ATOM 211 OG SER A 586 -3.855 -11.569 -24.083 1.00 0.00 O ATOM 0 H SER A 586 -3.279 -9.317 -27.047 1.00 0.00 H new ATOM 0 HA SER A 586 -1.945 -11.812 -26.254 1.00 0.00 H new ATOM 0 HB2 SER A 586 -2.166 -10.432 -24.378 1.00 0.00 H new ATOM 0 HB3 SER A 586 -3.659 -9.711 -24.945 1.00 0.00 H new ATOM 0 HG SER A 586 -4.474 -11.078 -23.503 1.00 0.00 H new ATOM 217 N ILE A 587 -3.989 -13.350 -26.295 1.00 0.00 N ATOM 218 CA ILE A 587 -5.080 -14.260 -26.619 1.00 0.00 C ATOM 219 C ILE A 587 -6.418 -13.634 -26.225 1.00 0.00 C ATOM 220 O ILE A 587 -7.470 -14.001 -26.746 1.00 0.00 O ATOM 221 CB ILE A 587 -4.922 -15.614 -25.902 1.00 0.00 C ATOM 222 CG1 ILE A 587 -4.637 -15.398 -24.415 1.00 0.00 C ATOM 223 CG2 ILE A 587 -3.812 -16.430 -26.547 1.00 0.00 C ATOM 224 CD1 ILE A 587 -5.020 -16.576 -23.549 1.00 0.00 C ATOM 0 H ILE A 587 -3.233 -13.766 -25.751 1.00 0.00 H new ATOM 0 HA ILE A 587 -5.053 -14.436 -27.694 1.00 0.00 H new ATOM 0 HB ILE A 587 -5.855 -16.169 -25.997 1.00 0.00 H new ATOM 0 HG12 ILE A 587 -3.575 -15.191 -24.283 1.00 0.00 H new ATOM 0 HG13 ILE A 587 -5.179 -14.516 -24.074 1.00 0.00 H new ATOM 0 HG21 ILE A 587 -3.713 -17.384 -26.029 1.00 0.00 H new ATOM 0 HG22 ILE A 587 -4.054 -16.610 -27.594 1.00 0.00 H new ATOM 0 HG23 ILE A 587 -2.872 -15.882 -26.481 1.00 0.00 H new ATOM 0 HD11 ILE A 587 -4.790 -16.352 -22.507 1.00 0.00 H new ATOM 0 HD12 ILE A 587 -6.088 -16.771 -23.651 1.00 0.00 H new ATOM 0 HD13 ILE A 587 -4.459 -17.456 -23.863 1.00 0.00 H new ATOM 236 N ILE A 588 -6.356 -12.668 -25.304 1.00 0.00 N ATOM 237 CA ILE A 588 -7.543 -11.962 -24.836 1.00 0.00 C ATOM 238 C ILE A 588 -7.596 -10.555 -25.436 1.00 0.00 C ATOM 239 O ILE A 588 -6.698 -9.742 -25.220 1.00 0.00 O ATOM 240 CB ILE A 588 -7.558 -11.870 -23.293 1.00 0.00 C ATOM 241 CG1 ILE A 588 -7.597 -13.273 -22.682 1.00 0.00 C ATOM 242 CG2 ILE A 588 -8.740 -11.041 -22.807 1.00 0.00 C ATOM 243 CD1 ILE A 588 -7.735 -13.278 -21.174 1.00 0.00 C ATOM 0 H ILE A 588 -5.488 -12.358 -24.868 1.00 0.00 H new ATOM 0 HA ILE A 588 -8.418 -12.525 -25.160 1.00 0.00 H new ATOM 0 HB ILE A 588 -6.644 -11.372 -22.970 1.00 0.00 H new ATOM 0 HG12 ILE A 588 -8.431 -13.825 -23.116 1.00 0.00 H new ATOM 0 HG13 ILE A 588 -6.686 -13.804 -22.956 1.00 0.00 H new ATOM 0 HG21 ILE A 588 -8.727 -10.992 -21.718 1.00 0.00 H new ATOM 0 HG22 ILE A 588 -8.670 -10.033 -23.216 1.00 0.00 H new ATOM 0 HG23 ILE A 588 -9.670 -11.504 -23.138 1.00 0.00 H new ATOM 0 HD11 ILE A 588 -7.756 -14.307 -20.814 1.00 0.00 H new ATOM 0 HD12 ILE A 588 -6.888 -12.755 -20.729 1.00 0.00 H new ATOM 0 HD13 ILE A 588 -8.661 -12.776 -20.892 1.00 0.00 H new ATOM 255 N GLN A 589 -8.649 -10.282 -26.201 1.00 0.00 N ATOM 256 CA GLN A 589 -8.818 -8.980 -26.849 1.00 0.00 C ATOM 257 C GLN A 589 -10.068 -8.282 -26.316 1.00 0.00 C ATOM 258 O GLN A 589 -10.998 -7.972 -27.061 1.00 0.00 O ATOM 259 CB GLN A 589 -8.903 -9.145 -28.377 1.00 0.00 C ATOM 260 CG GLN A 589 -8.565 -10.548 -28.876 1.00 0.00 C ATOM 261 CD GLN A 589 -7.410 -10.566 -29.852 1.00 0.00 C ATOM 262 OE1 GLN A 589 -7.561 -10.208 -31.021 1.00 0.00 O ATOM 263 NE2 GLN A 589 -6.246 -10.984 -29.373 1.00 0.00 N ATOM 0 H GLN A 589 -9.401 -10.945 -26.389 1.00 0.00 H new ATOM 0 HA GLN A 589 -7.950 -8.362 -26.619 1.00 0.00 H new ATOM 0 HB2 GLN A 589 -9.911 -8.889 -28.703 1.00 0.00 H new ATOM 0 HB3 GLN A 589 -8.225 -8.432 -28.846 1.00 0.00 H new ATOM 0 HG2 GLN A 589 -8.323 -11.182 -28.023 1.00 0.00 H new ATOM 0 HG3 GLN A 589 -9.444 -10.979 -29.354 1.00 0.00 H new ATOM 0 HE21 GLN A 589 -6.169 -11.271 -28.397 1.00 0.00 H new ATOM 0 HE22 GLN A 589 -5.427 -11.019 -29.981 1.00 0.00 H new ATOM 272 N GLU A 590 -10.074 -8.052 -25.010 1.00 0.00 N ATOM 273 CA GLU A 590 -11.195 -7.405 -24.328 1.00 0.00 C ATOM 274 C GLU A 590 -10.721 -6.184 -23.551 1.00 0.00 C ATOM 275 O GLU A 590 -9.521 -5.947 -23.443 1.00 0.00 O ATOM 276 CB GLU A 590 -11.883 -8.391 -23.383 1.00 0.00 C ATOM 277 CG GLU A 590 -12.610 -9.515 -24.102 1.00 0.00 C ATOM 278 CD GLU A 590 -14.032 -9.702 -23.606 1.00 0.00 C ATOM 279 OE1 GLU A 590 -14.668 -8.693 -23.236 1.00 0.00 O ATOM 280 OE2 GLU A 590 -14.507 -10.857 -23.587 1.00 0.00 O ATOM 0 H GLU A 590 -9.305 -8.307 -24.391 1.00 0.00 H new ATOM 0 HA GLU A 590 -11.911 -7.080 -25.083 1.00 0.00 H new ATOM 0 HB2 GLU A 590 -11.137 -8.821 -22.714 1.00 0.00 H new ATOM 0 HB3 GLU A 590 -12.595 -7.849 -22.761 1.00 0.00 H new ATOM 0 HG2 GLU A 590 -12.627 -9.306 -25.172 1.00 0.00 H new ATOM 0 HG3 GLU A 590 -12.057 -10.445 -23.968 1.00 0.00 H new ATOM 287 N SER A 591 -11.664 -5.411 -23.006 1.00 0.00 N ATOM 288 CA SER A 591 -11.316 -4.228 -22.221 1.00 0.00 C ATOM 289 C SER A 591 -11.935 -4.291 -20.827 1.00 0.00 C ATOM 290 O SER A 591 -13.127 -4.559 -20.675 1.00 0.00 O ATOM 291 CB SER A 591 -11.754 -2.942 -22.919 1.00 0.00 C ATOM 292 OG SER A 591 -12.381 -3.216 -24.160 1.00 0.00 O ATOM 0 H SER A 591 -12.666 -5.582 -23.094 1.00 0.00 H new ATOM 0 HA SER A 591 -10.230 -4.218 -22.127 1.00 0.00 H new ATOM 0 HB2 SER A 591 -12.441 -2.393 -22.276 1.00 0.00 H new ATOM 0 HB3 SER A 591 -10.888 -2.301 -23.081 1.00 0.00 H new ATOM 0 HG SER A 591 -12.652 -2.374 -24.583 1.00 0.00 H new ATOM 298 N LEU A 592 -11.115 -4.032 -19.813 1.00 0.00 N ATOM 299 CA LEU A 592 -11.570 -4.047 -18.425 1.00 0.00 C ATOM 300 C LEU A 592 -11.527 -2.638 -17.841 1.00 0.00 C ATOM 301 O LEU A 592 -10.635 -1.854 -18.163 1.00 0.00 O ATOM 302 CB LEU A 592 -10.704 -4.988 -17.579 1.00 0.00 C ATOM 303 CG LEU A 592 -10.017 -6.122 -18.345 1.00 0.00 C ATOM 304 CD1 LEU A 592 -8.642 -6.405 -17.758 1.00 0.00 C ATOM 305 CD2 LEU A 592 -10.879 -7.375 -18.326 1.00 0.00 C ATOM 0 H LEU A 592 -10.126 -3.808 -19.927 1.00 0.00 H new ATOM 0 HA LEU A 592 -12.597 -4.411 -18.407 1.00 0.00 H new ATOM 0 HB2 LEU A 592 -9.938 -4.396 -17.078 1.00 0.00 H new ATOM 0 HB3 LEU A 592 -11.329 -5.426 -16.800 1.00 0.00 H new ATOM 0 HG LEU A 592 -9.888 -5.811 -19.382 1.00 0.00 H new ATOM 0 HD11 LEU A 592 -8.168 -7.214 -18.315 1.00 0.00 H new ATOM 0 HD12 LEU A 592 -8.026 -5.508 -17.826 1.00 0.00 H new ATOM 0 HD13 LEU A 592 -8.746 -6.696 -16.713 1.00 0.00 H new ATOM 0 HD21 LEU A 592 -10.376 -8.171 -18.875 1.00 0.00 H new ATOM 0 HD22 LEU A 592 -11.040 -7.690 -17.295 1.00 0.00 H new ATOM 0 HD23 LEU A 592 -11.840 -7.163 -18.794 1.00 0.00 H new ATOM 317 N GLU A 593 -12.495 -2.316 -16.990 1.00 0.00 N ATOM 318 CA GLU A 593 -12.555 -0.992 -16.379 1.00 0.00 C ATOM 319 C GLU A 593 -12.576 -1.074 -14.854 1.00 0.00 C ATOM 320 O GLU A 593 -13.518 -1.603 -14.266 1.00 0.00 O ATOM 321 CB GLU A 593 -13.790 -0.239 -16.875 1.00 0.00 C ATOM 322 CG GLU A 593 -14.015 -0.353 -18.375 1.00 0.00 C ATOM 323 CD GLU A 593 -15.453 -0.689 -18.726 1.00 0.00 C ATOM 324 OE1 GLU A 593 -16.084 -1.457 -17.970 1.00 0.00 O ATOM 325 OE2 GLU A 593 -15.945 -0.184 -19.756 1.00 0.00 O ATOM 0 H GLU A 593 -13.244 -2.948 -16.709 1.00 0.00 H new ATOM 0 HA GLU A 593 -11.655 -0.452 -16.674 1.00 0.00 H new ATOM 0 HB2 GLU A 593 -14.669 -0.619 -16.355 1.00 0.00 H new ATOM 0 HB3 GLU A 593 -13.693 0.814 -16.610 1.00 0.00 H new ATOM 0 HG2 GLU A 593 -13.739 0.587 -18.853 1.00 0.00 H new ATOM 0 HG3 GLU A 593 -13.357 -1.122 -18.780 1.00 0.00 H new ATOM 332 N ILE A 594 -11.539 -0.532 -14.215 1.00 0.00 N ATOM 333 CA ILE A 594 -11.450 -0.530 -12.766 1.00 0.00 C ATOM 334 C ILE A 594 -12.265 0.613 -12.186 1.00 0.00 C ATOM 335 O ILE A 594 -11.892 1.780 -12.307 1.00 0.00 O ATOM 336 CB ILE A 594 -9.988 -0.392 -12.302 1.00 0.00 C ATOM 337 CG1 ILE A 594 -9.184 -1.607 -12.750 1.00 0.00 C ATOM 338 CG2 ILE A 594 -9.907 -0.221 -10.790 1.00 0.00 C ATOM 339 CD1 ILE A 594 -7.724 -1.532 -12.373 1.00 0.00 C ATOM 0 H ILE A 594 -10.750 -0.089 -14.685 1.00 0.00 H new ATOM 0 HA ILE A 594 -11.847 -1.480 -12.410 1.00 0.00 H new ATOM 0 HB ILE A 594 -9.563 0.501 -12.760 1.00 0.00 H new ATOM 0 HG12 ILE A 594 -9.620 -2.504 -12.310 1.00 0.00 H new ATOM 0 HG13 ILE A 594 -9.267 -1.710 -13.832 1.00 0.00 H new ATOM 0 HG21 ILE A 594 -8.863 -0.126 -10.490 1.00 0.00 H new ATOM 0 HG22 ILE A 594 -10.452 0.676 -10.496 1.00 0.00 H new ATOM 0 HG23 ILE A 594 -10.347 -1.090 -10.301 1.00 0.00 H new ATOM 0 HD11 ILE A 594 -7.212 -2.428 -12.722 1.00 0.00 H new ATOM 0 HD12 ILE A 594 -7.274 -0.653 -12.835 1.00 0.00 H new ATOM 0 HD13 ILE A 594 -7.631 -1.460 -11.289 1.00 0.00 H new ATOM 351 N GLN A 595 -13.372 0.274 -11.546 1.00 0.00 N ATOM 352 CA GLN A 595 -14.227 1.278 -10.939 1.00 0.00 C ATOM 353 C GLN A 595 -13.486 1.971 -9.803 1.00 0.00 C ATOM 354 O GLN A 595 -13.137 1.340 -8.807 1.00 0.00 O ATOM 355 CB GLN A 595 -15.519 0.643 -10.420 1.00 0.00 C ATOM 356 CG GLN A 595 -16.689 0.762 -11.383 1.00 0.00 C ATOM 357 CD GLN A 595 -16.349 0.275 -12.775 1.00 0.00 C ATOM 358 OE1 GLN A 595 -15.921 1.192 -13.631 1.00 0.00 O flip ATOM 359 NE2 GLN A 595 -16.469 -0.913 -13.077 1.00 0.00 N flip ATOM 0 H GLN A 595 -13.698 -0.686 -11.434 1.00 0.00 H new ATOM 0 HA GLN A 595 -14.489 2.017 -11.696 1.00 0.00 H new ATOM 0 HB2 GLN A 595 -15.337 -0.411 -10.212 1.00 0.00 H new ATOM 0 HB3 GLN A 595 -15.789 1.112 -9.474 1.00 0.00 H new ATOM 0 HG2 GLN A 595 -17.532 0.189 -10.997 1.00 0.00 H new ATOM 0 HG3 GLN A 595 -17.008 1.803 -11.434 1.00 0.00 H new ATOM 0 HE21 GLN A 595 -16.802 -1.584 -12.385 1.00 0.00 H new ATOM 0 HE22 GLN A 595 -16.235 -1.226 -14.019 1.00 0.00 H new ATOM 368 N GLN A 596 -13.238 3.269 -9.959 1.00 0.00 N ATOM 369 CA GLN A 596 -12.530 4.040 -8.942 1.00 0.00 C ATOM 370 C GLN A 596 -13.089 3.743 -7.555 1.00 0.00 C ATOM 371 O GLN A 596 -12.376 3.801 -6.553 1.00 0.00 O ATOM 372 CB GLN A 596 -12.607 5.542 -9.267 1.00 0.00 C ATOM 373 CG GLN A 596 -13.731 6.309 -8.575 1.00 0.00 C ATOM 374 CD GLN A 596 -14.813 6.749 -9.540 1.00 0.00 C ATOM 375 OE1 GLN A 596 -16.002 6.664 -9.236 1.00 0.00 O ATOM 376 NE2 GLN A 596 -14.404 7.226 -10.710 1.00 0.00 N ATOM 0 H GLN A 596 -13.517 3.808 -10.779 1.00 0.00 H new ATOM 0 HA GLN A 596 -11.481 3.745 -8.944 1.00 0.00 H new ATOM 0 HB2 GLN A 596 -11.657 6.003 -8.997 1.00 0.00 H new ATOM 0 HB3 GLN A 596 -12.723 5.657 -10.345 1.00 0.00 H new ATOM 0 HG2 GLN A 596 -14.172 5.681 -7.801 1.00 0.00 H new ATOM 0 HG3 GLN A 596 -13.316 7.185 -8.076 1.00 0.00 H new ATOM 0 HE21 GLN A 596 -13.407 7.278 -10.919 1.00 0.00 H new ATOM 0 HE22 GLN A 596 -15.087 7.540 -11.399 1.00 0.00 H new ATOM 385 N GLY A 597 -14.377 3.426 -7.514 1.00 0.00 N ATOM 386 CA GLY A 597 -15.028 3.124 -6.257 1.00 0.00 C ATOM 387 C GLY A 597 -14.546 1.828 -5.629 1.00 0.00 C ATOM 388 O GLY A 597 -14.718 1.622 -4.429 1.00 0.00 O ATOM 0 H GLY A 597 -14.983 3.373 -8.333 1.00 0.00 H new ATOM 0 HA2 GLY A 597 -14.856 3.944 -5.560 1.00 0.00 H new ATOM 0 HA3 GLY A 597 -16.104 3.064 -6.418 1.00 0.00 H new ATOM 392 N VAL A 598 -13.947 0.944 -6.430 1.00 0.00 N ATOM 393 CA VAL A 598 -13.465 -0.323 -5.912 1.00 0.00 C ATOM 394 C VAL A 598 -11.957 -0.301 -5.685 1.00 0.00 C ATOM 395 O VAL A 598 -11.179 -0.140 -6.625 1.00 0.00 O ATOM 396 CB VAL A 598 -13.805 -1.470 -6.881 1.00 0.00 C ATOM 397 CG1 VAL A 598 -13.367 -2.809 -6.310 1.00 0.00 C ATOM 398 CG2 VAL A 598 -15.292 -1.476 -7.200 1.00 0.00 C ATOM 0 H VAL A 598 -13.789 1.086 -7.428 1.00 0.00 H new ATOM 0 HA VAL A 598 -13.962 -0.486 -4.956 1.00 0.00 H new ATOM 0 HB VAL A 598 -13.258 -1.307 -7.809 1.00 0.00 H new ATOM 0 HG11 VAL A 598 -13.618 -3.604 -7.013 1.00 0.00 H new ATOM 0 HG12 VAL A 598 -12.290 -2.799 -6.143 1.00 0.00 H new ATOM 0 HG13 VAL A 598 -13.879 -2.986 -5.364 1.00 0.00 H new ATOM 0 HG21 VAL A 598 -15.514 -2.293 -7.886 1.00 0.00 H new ATOM 0 HG22 VAL A 598 -15.861 -1.610 -6.280 1.00 0.00 H new ATOM 0 HG23 VAL A 598 -15.569 -0.529 -7.663 1.00 0.00 H new ATOM 408 N ASN A 599 -11.552 -0.497 -4.434 1.00 0.00 N ATOM 409 CA ASN A 599 -10.138 -0.536 -4.088 1.00 0.00 C ATOM 410 C ASN A 599 -9.885 -1.644 -3.069 1.00 0.00 C ATOM 411 O ASN A 599 -10.468 -1.631 -1.985 1.00 0.00 O ATOM 412 CB ASN A 599 -9.689 0.810 -3.507 1.00 0.00 C ATOM 413 CG ASN A 599 -8.288 1.190 -3.932 1.00 0.00 C ATOM 414 OD1 ASN A 599 -7.877 0.926 -5.062 1.00 0.00 O ATOM 415 ND2 ASN A 599 -7.541 1.814 -3.028 1.00 0.00 N ATOM 0 H ASN A 599 -12.184 -0.631 -3.644 1.00 0.00 H new ATOM 0 HA ASN A 599 -9.565 -0.736 -4.993 1.00 0.00 H new ATOM 0 HB2 ASN A 599 -10.384 1.588 -3.823 1.00 0.00 H new ATOM 0 HB3 ASN A 599 -9.735 0.765 -2.419 1.00 0.00 H new ATOM 0 HD21 ASN A 599 -6.588 2.094 -3.259 1.00 0.00 H new ATOM 0 HD22 ASN A 599 -7.921 2.014 -2.103 1.00 0.00 H new ATOM 422 N PRO A 600 -9.011 -2.620 -3.382 1.00 0.00 N ATOM 423 CA PRO A 600 -8.280 -2.705 -4.646 1.00 0.00 C ATOM 424 C PRO A 600 -9.055 -3.504 -5.692 1.00 0.00 C ATOM 425 O PRO A 600 -9.956 -4.270 -5.351 1.00 0.00 O ATOM 426 CB PRO A 600 -7.025 -3.455 -4.232 1.00 0.00 C ATOM 427 CG PRO A 600 -7.503 -4.416 -3.200 1.00 0.00 C ATOM 428 CD PRO A 600 -8.666 -3.750 -2.499 1.00 0.00 C ATOM 0 HA PRO A 600 -8.096 -1.733 -5.104 1.00 0.00 H new ATOM 0 HB2 PRO A 600 -6.571 -3.971 -5.078 1.00 0.00 H new ATOM 0 HB3 PRO A 600 -6.271 -2.779 -3.829 1.00 0.00 H new ATOM 0 HG2 PRO A 600 -7.813 -5.355 -3.658 1.00 0.00 H new ATOM 0 HG3 PRO A 600 -6.708 -4.653 -2.493 1.00 0.00 H new ATOM 0 HD2 PRO A 600 -9.506 -4.435 -2.379 1.00 0.00 H new ATOM 0 HD3 PRO A 600 -8.389 -3.408 -1.502 1.00 0.00 H new ATOM 436 N PHE A 601 -8.709 -3.322 -6.961 1.00 0.00 N ATOM 437 CA PHE A 601 -9.392 -4.035 -8.039 1.00 0.00 C ATOM 438 C PHE A 601 -8.658 -5.337 -8.332 1.00 0.00 C ATOM 439 O PHE A 601 -7.490 -5.333 -8.717 1.00 0.00 O ATOM 440 CB PHE A 601 -9.463 -3.163 -9.302 1.00 0.00 C ATOM 441 CG PHE A 601 -10.683 -3.406 -10.146 1.00 0.00 C ATOM 442 CD1 PHE A 601 -11.858 -2.708 -9.911 1.00 0.00 C ATOM 443 CD2 PHE A 601 -10.651 -4.325 -11.182 1.00 0.00 C ATOM 444 CE1 PHE A 601 -12.975 -2.924 -10.694 1.00 0.00 C ATOM 445 CE2 PHE A 601 -11.765 -4.543 -11.969 1.00 0.00 C ATOM 446 CZ PHE A 601 -12.929 -3.842 -11.724 1.00 0.00 C ATOM 0 H PHE A 601 -7.967 -2.694 -7.269 1.00 0.00 H new ATOM 0 HA PHE A 601 -10.411 -4.261 -7.726 1.00 0.00 H new ATOM 0 HB2 PHE A 601 -9.440 -2.114 -9.008 1.00 0.00 H new ATOM 0 HB3 PHE A 601 -8.574 -3.344 -9.906 1.00 0.00 H new ATOM 0 HD1 PHE A 601 -11.900 -1.988 -9.107 1.00 0.00 H new ATOM 0 HD2 PHE A 601 -9.744 -4.878 -11.377 1.00 0.00 H new ATOM 0 HE1 PHE A 601 -13.885 -2.375 -10.500 1.00 0.00 H new ATOM 0 HE2 PHE A 601 -11.726 -5.261 -12.775 1.00 0.00 H new ATOM 0 HZ PHE A 601 -13.802 -4.012 -12.337 1.00 0.00 H new ATOM 456 N PHE A 602 -9.349 -6.452 -8.105 1.00 0.00 N ATOM 457 CA PHE A 602 -8.768 -7.778 -8.299 1.00 0.00 C ATOM 458 C PHE A 602 -9.036 -8.328 -9.695 1.00 0.00 C ATOM 459 O PHE A 602 -10.136 -8.199 -10.229 1.00 0.00 O ATOM 460 CB PHE A 602 -9.316 -8.753 -7.256 1.00 0.00 C ATOM 461 CG PHE A 602 -9.314 -8.213 -5.854 1.00 0.00 C ATOM 462 CD1 PHE A 602 -8.202 -8.366 -5.041 1.00 0.00 C ATOM 463 CD2 PHE A 602 -10.425 -7.559 -5.349 1.00 0.00 C ATOM 464 CE1 PHE A 602 -8.200 -7.875 -3.748 1.00 0.00 C ATOM 465 CE2 PHE A 602 -10.430 -7.067 -4.058 1.00 0.00 C ATOM 466 CZ PHE A 602 -9.315 -7.226 -3.256 1.00 0.00 C ATOM 0 H PHE A 602 -10.317 -6.463 -7.785 1.00 0.00 H new ATOM 0 HA PHE A 602 -7.689 -7.673 -8.182 1.00 0.00 H new ATOM 0 HB2 PHE A 602 -10.336 -9.025 -7.528 1.00 0.00 H new ATOM 0 HB3 PHE A 602 -8.724 -9.668 -7.283 1.00 0.00 H new ATOM 0 HD1 PHE A 602 -7.328 -8.874 -5.421 1.00 0.00 H new ATOM 0 HD2 PHE A 602 -11.298 -7.432 -5.972 1.00 0.00 H new ATOM 0 HE1 PHE A 602 -7.327 -7.999 -3.124 1.00 0.00 H new ATOM 0 HE2 PHE A 602 -11.303 -6.559 -3.676 1.00 0.00 H new ATOM 0 HZ PHE A 602 -9.316 -6.843 -2.246 1.00 0.00 H new ATOM 476 N ILE A 603 -8.012 -8.949 -10.265 1.00 0.00 N ATOM 477 CA ILE A 603 -8.096 -9.545 -11.593 1.00 0.00 C ATOM 478 C ILE A 603 -7.600 -10.984 -11.567 1.00 0.00 C ATOM 479 O ILE A 603 -6.629 -11.299 -10.878 1.00 0.00 O ATOM 480 CB ILE A 603 -7.252 -8.765 -12.615 1.00 0.00 C ATOM 481 CG1 ILE A 603 -7.489 -7.258 -12.478 1.00 0.00 C ATOM 482 CG2 ILE A 603 -7.562 -9.237 -14.026 1.00 0.00 C ATOM 483 CD1 ILE A 603 -6.501 -6.568 -11.564 1.00 0.00 C ATOM 0 H ILE A 603 -7.100 -9.054 -9.821 1.00 0.00 H new ATOM 0 HA ILE A 603 -9.144 -9.512 -11.889 1.00 0.00 H new ATOM 0 HB ILE A 603 -6.198 -8.958 -12.413 1.00 0.00 H new ATOM 0 HG12 ILE A 603 -7.438 -6.800 -13.466 1.00 0.00 H new ATOM 0 HG13 ILE A 603 -8.498 -7.091 -12.101 1.00 0.00 H new ATOM 0 HG21 ILE A 603 -6.957 -8.676 -14.738 1.00 0.00 H new ATOM 0 HG22 ILE A 603 -7.333 -10.299 -14.113 1.00 0.00 H new ATOM 0 HG23 ILE A 603 -8.618 -9.075 -14.240 1.00 0.00 H new ATOM 0 HD11 ILE A 603 -6.731 -5.504 -11.516 1.00 0.00 H new ATOM 0 HD12 ILE A 603 -6.567 -6.999 -10.565 1.00 0.00 H new ATOM 0 HD13 ILE A 603 -5.491 -6.704 -11.951 1.00 0.00 H new ATOM 495 N GLY A 604 -8.258 -11.854 -12.324 1.00 0.00 N ATOM 496 CA GLY A 604 -7.839 -13.247 -12.362 1.00 0.00 C ATOM 497 C GLY A 604 -8.890 -14.191 -12.918 1.00 0.00 C ATOM 498 O GLY A 604 -9.909 -13.759 -13.456 1.00 0.00 O ATOM 0 H GLY A 604 -9.064 -11.627 -12.906 1.00 0.00 H new ATOM 0 HA2 GLY A 604 -6.936 -13.328 -12.967 1.00 0.00 H new ATOM 0 HA3 GLY A 604 -7.577 -13.565 -11.353 1.00 0.00 H new ATOM 502 N ARG A 605 -8.627 -15.491 -12.782 1.00 0.00 N ATOM 503 CA ARG A 605 -9.536 -16.528 -13.267 1.00 0.00 C ATOM 504 C ARG A 605 -10.691 -16.758 -12.290 1.00 0.00 C ATOM 505 O ARG A 605 -11.546 -17.613 -12.522 1.00 0.00 O ATOM 506 CB ARG A 605 -8.763 -17.837 -13.483 1.00 0.00 C ATOM 507 CG ARG A 605 -9.566 -18.926 -14.184 1.00 0.00 C ATOM 508 CD ARG A 605 -8.661 -19.886 -14.951 1.00 0.00 C ATOM 509 NE ARG A 605 -8.243 -21.020 -14.134 1.00 0.00 N ATOM 510 CZ ARG A 605 -9.081 -21.930 -13.642 1.00 0.00 C ATOM 511 NH1 ARG A 605 -10.382 -21.845 -13.884 1.00 0.00 N ATOM 512 NH2 ARG A 605 -8.614 -22.931 -12.908 1.00 0.00 N ATOM 0 H ARG A 605 -7.784 -15.852 -12.336 1.00 0.00 H new ATOM 0 HA ARG A 605 -9.959 -16.193 -14.214 1.00 0.00 H new ATOM 0 HB2 ARG A 605 -7.869 -17.626 -14.069 1.00 0.00 H new ATOM 0 HB3 ARG A 605 -8.429 -18.213 -12.516 1.00 0.00 H new ATOM 0 HG2 ARG A 605 -10.146 -19.482 -13.448 1.00 0.00 H new ATOM 0 HG3 ARG A 605 -10.278 -18.469 -14.871 1.00 0.00 H new ATOM 0 HD2 ARG A 605 -9.186 -20.250 -15.834 1.00 0.00 H new ATOM 0 HD3 ARG A 605 -7.780 -19.349 -15.303 1.00 0.00 H new ATOM 0 HE ARG A 605 -7.249 -21.122 -13.927 1.00 0.00 H new ATOM 0 HH11 ARG A 605 -10.746 -21.079 -14.450 1.00 0.00 H new ATOM 0 HH12 ARG A 605 -11.018 -22.546 -13.504 1.00 0.00 H new ATOM 0 HH21 ARG A 605 -7.614 -23.003 -12.721 1.00 0.00 H new ATOM 0 HH22 ARG A 605 -9.255 -23.629 -12.530 1.00 0.00 H new ATOM 526 N SER A 606 -10.718 -15.992 -11.200 1.00 0.00 N ATOM 527 CA SER A 606 -11.771 -16.120 -10.202 1.00 0.00 C ATOM 528 C SER A 606 -12.812 -15.018 -10.366 1.00 0.00 C ATOM 529 O SER A 606 -12.495 -13.833 -10.264 1.00 0.00 O ATOM 530 CB SER A 606 -11.177 -16.067 -8.794 1.00 0.00 C ATOM 531 OG SER A 606 -12.190 -15.911 -7.816 1.00 0.00 O ATOM 0 H SER A 606 -10.021 -15.277 -10.989 1.00 0.00 H new ATOM 0 HA SER A 606 -12.260 -17.083 -10.348 1.00 0.00 H new ATOM 0 HB2 SER A 606 -10.617 -16.981 -8.598 1.00 0.00 H new ATOM 0 HB3 SER A 606 -10.471 -15.239 -8.725 1.00 0.00 H new ATOM 0 HG SER A 606 -11.783 -15.882 -6.925 1.00 0.00 H new ATOM 537 N GLU A 607 -14.057 -15.414 -10.616 1.00 0.00 N ATOM 538 CA GLU A 607 -15.144 -14.458 -10.786 1.00 0.00 C ATOM 539 C GLU A 607 -15.195 -13.474 -9.620 1.00 0.00 C ATOM 540 O GLU A 607 -15.691 -12.357 -9.760 1.00 0.00 O ATOM 541 CB GLU A 607 -16.482 -15.190 -10.910 1.00 0.00 C ATOM 542 CG GLU A 607 -16.752 -16.161 -9.772 1.00 0.00 C ATOM 543 CD GLU A 607 -17.625 -17.326 -10.195 1.00 0.00 C ATOM 544 OE1 GLU A 607 -18.865 -17.176 -10.180 1.00 0.00 O ATOM 545 OE2 GLU A 607 -17.068 -18.389 -10.540 1.00 0.00 O ATOM 0 H GLU A 607 -14.337 -16.391 -10.705 1.00 0.00 H new ATOM 0 HA GLU A 607 -14.958 -13.897 -11.702 1.00 0.00 H new ATOM 0 HB2 GLU A 607 -17.286 -14.455 -10.948 1.00 0.00 H new ATOM 0 HB3 GLU A 607 -16.503 -15.735 -11.854 1.00 0.00 H new ATOM 0 HG2 GLU A 607 -15.804 -16.541 -9.391 1.00 0.00 H new ATOM 0 HG3 GLU A 607 -17.234 -15.629 -8.952 1.00 0.00 H new ATOM 552 N ASP A 608 -14.669 -13.893 -8.471 1.00 0.00 N ATOM 553 CA ASP A 608 -14.647 -13.041 -7.288 1.00 0.00 C ATOM 554 C ASP A 608 -13.832 -11.781 -7.556 1.00 0.00 C ATOM 555 O ASP A 608 -14.061 -10.736 -6.946 1.00 0.00 O ATOM 556 CB ASP A 608 -14.062 -13.801 -6.096 1.00 0.00 C ATOM 557 CG ASP A 608 -14.784 -13.488 -4.800 1.00 0.00 C ATOM 558 OD1 ASP A 608 -14.825 -12.301 -4.416 1.00 0.00 O ATOM 559 OD2 ASP A 608 -15.307 -14.431 -4.169 1.00 0.00 O ATOM 0 H ASP A 608 -14.254 -14.815 -8.336 1.00 0.00 H new ATOM 0 HA ASP A 608 -15.671 -12.752 -7.052 1.00 0.00 H new ATOM 0 HB2 ASP A 608 -14.117 -14.872 -6.289 1.00 0.00 H new ATOM 0 HB3 ASP A 608 -13.007 -13.549 -5.991 1.00 0.00 H new ATOM 564 N CYS A 609 -12.883 -11.890 -8.481 1.00 0.00 N ATOM 565 CA CYS A 609 -12.031 -10.767 -8.846 1.00 0.00 C ATOM 566 C CYS A 609 -12.813 -9.728 -9.634 1.00 0.00 C ATOM 567 O CYS A 609 -13.474 -10.054 -10.621 1.00 0.00 O ATOM 568 CB CYS A 609 -10.839 -11.260 -9.667 1.00 0.00 C ATOM 569 SG CYS A 609 -9.634 -12.211 -8.712 1.00 0.00 S ATOM 0 H CYS A 609 -12.685 -12.750 -8.993 1.00 0.00 H new ATOM 0 HA CYS A 609 -11.667 -10.300 -7.931 1.00 0.00 H new ATOM 0 HB2 CYS A 609 -11.206 -11.877 -10.487 1.00 0.00 H new ATOM 0 HB3 CYS A 609 -10.338 -10.401 -10.113 1.00 0.00 H new ATOM 0 HG CYS A 609 -9.296 -13.276 -9.377 1.00 0.00 H new ATOM 575 N ASN A 610 -12.728 -8.473 -9.197 1.00 0.00 N ATOM 576 CA ASN A 610 -13.421 -7.377 -9.867 1.00 0.00 C ATOM 577 C ASN A 610 -13.270 -7.502 -11.380 1.00 0.00 C ATOM 578 O ASN A 610 -14.186 -7.191 -12.142 1.00 0.00 O ATOM 579 CB ASN A 610 -12.866 -6.039 -9.390 1.00 0.00 C ATOM 580 CG ASN A 610 -13.024 -5.846 -7.894 1.00 0.00 C ATOM 581 OD1 ASN A 610 -12.043 -5.671 -7.172 1.00 0.00 O ATOM 582 ND2 ASN A 610 -14.265 -5.880 -7.421 1.00 0.00 N ATOM 0 H ASN A 610 -12.185 -8.191 -8.381 1.00 0.00 H new ATOM 0 HA ASN A 610 -14.481 -7.427 -9.618 1.00 0.00 H new ATOM 0 HB2 ASN A 610 -11.810 -5.973 -9.652 1.00 0.00 H new ATOM 0 HB3 ASN A 610 -13.376 -5.230 -9.913 1.00 0.00 H new ATOM 0 HD21 ASN A 610 -14.434 -5.758 -6.422 1.00 0.00 H new ATOM 0 HD22 ASN A 610 -15.049 -6.028 -8.056 1.00 0.00 H new ATOM 589 N CYS A 611 -12.110 -7.993 -11.792 1.00 0.00 N ATOM 590 CA CYS A 611 -11.817 -8.211 -13.204 1.00 0.00 C ATOM 591 C CYS A 611 -11.860 -9.705 -13.497 1.00 0.00 C ATOM 592 O CYS A 611 -11.436 -10.516 -12.669 1.00 0.00 O ATOM 593 CB CYS A 611 -10.455 -7.634 -13.573 1.00 0.00 C ATOM 594 SG CYS A 611 -10.036 -7.812 -15.320 1.00 0.00 S ATOM 0 H CYS A 611 -11.349 -8.250 -11.163 1.00 0.00 H new ATOM 0 HA CYS A 611 -12.567 -7.699 -13.807 1.00 0.00 H new ATOM 0 HB2 CYS A 611 -10.436 -6.576 -13.311 1.00 0.00 H new ATOM 0 HB3 CYS A 611 -9.688 -8.125 -12.973 1.00 0.00 H new ATOM 0 HG CYS A 611 -10.456 -8.964 -15.752 1.00 0.00 H new ATOM 600 N LYS A 612 -12.393 -10.080 -14.656 1.00 0.00 N ATOM 601 CA LYS A 612 -12.511 -11.495 -14.988 1.00 0.00 C ATOM 602 C LYS A 612 -11.671 -11.912 -16.188 1.00 0.00 C ATOM 603 O LYS A 612 -11.964 -11.563 -17.332 1.00 0.00 O ATOM 604 CB LYS A 612 -13.978 -11.862 -15.223 1.00 0.00 C ATOM 605 CG LYS A 612 -14.527 -12.838 -14.191 1.00 0.00 C ATOM 606 CD LYS A 612 -15.392 -13.911 -14.833 1.00 0.00 C ATOM 607 CE LYS A 612 -16.736 -13.353 -15.271 1.00 0.00 C ATOM 608 NZ LYS A 612 -16.734 -12.960 -16.707 1.00 0.00 N ATOM 0 H LYS A 612 -12.743 -9.439 -15.368 1.00 0.00 H new ATOM 0 HA LYS A 612 -12.120 -12.043 -14.131 1.00 0.00 H new ATOM 0 HB2 LYS A 612 -14.579 -10.953 -15.209 1.00 0.00 H new ATOM 0 HB3 LYS A 612 -14.082 -12.298 -16.217 1.00 0.00 H new ATOM 0 HG2 LYS A 612 -13.700 -13.308 -13.659 1.00 0.00 H new ATOM 0 HG3 LYS A 612 -15.113 -12.293 -13.451 1.00 0.00 H new ATOM 0 HD2 LYS A 612 -14.873 -14.331 -15.694 1.00 0.00 H new ATOM 0 HD3 LYS A 612 -15.548 -14.726 -14.126 1.00 0.00 H new ATOM 0 HE2 LYS A 612 -17.512 -14.099 -15.100 1.00 0.00 H new ATOM 0 HE3 LYS A 612 -16.986 -12.487 -14.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 612 -16.539 -11.942 -16.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 612 -15.999 -13.495 -17.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 612 -17.663 -13.169 -17.125 1.00 0.00 H new ATOM 622 N ILE A 613 -10.651 -12.710 -15.900 1.00 0.00 N ATOM 623 CA ILE A 613 -9.768 -13.259 -16.916 1.00 0.00 C ATOM 624 C ILE A 613 -9.503 -14.715 -16.575 1.00 0.00 C ATOM 625 O ILE A 613 -8.816 -15.006 -15.596 1.00 0.00 O ATOM 626 CB ILE A 613 -8.428 -12.499 -16.981 1.00 0.00 C ATOM 627 CG1 ILE A 613 -8.676 -11.012 -17.252 1.00 0.00 C ATOM 628 CG2 ILE A 613 -7.513 -13.108 -18.041 1.00 0.00 C ATOM 629 CD1 ILE A 613 -9.099 -10.712 -18.675 1.00 0.00 C ATOM 0 H ILE A 613 -10.413 -12.995 -14.950 1.00 0.00 H new ATOM 0 HA ILE A 613 -10.250 -13.162 -17.889 1.00 0.00 H new ATOM 0 HB ILE A 613 -7.926 -12.591 -16.018 1.00 0.00 H new ATOM 0 HG12 ILE A 613 -9.446 -10.652 -16.570 1.00 0.00 H new ATOM 0 HG13 ILE A 613 -7.766 -10.455 -17.028 1.00 0.00 H new ATOM 0 HG21 ILE A 613 -6.573 -12.557 -18.070 1.00 0.00 H new ATOM 0 HG22 ILE A 613 -7.315 -14.151 -17.795 1.00 0.00 H new ATOM 0 HG23 ILE A 613 -7.997 -13.051 -19.016 1.00 0.00 H new ATOM 0 HD11 ILE A 613 -9.256 -9.639 -18.790 1.00 0.00 H new ATOM 0 HD12 ILE A 613 -8.320 -11.040 -19.363 1.00 0.00 H new ATOM 0 HD13 ILE A 613 -10.026 -11.240 -18.898 1.00 0.00 H new ATOM 641 N GLU A 614 -10.066 -15.635 -17.351 1.00 0.00 N ATOM 642 CA GLU A 614 -9.887 -17.049 -17.057 1.00 0.00 C ATOM 643 C GLU A 614 -8.895 -17.717 -17.995 1.00 0.00 C ATOM 644 O GLU A 614 -9.200 -18.010 -19.150 1.00 0.00 O ATOM 645 CB GLU A 614 -11.232 -17.774 -17.130 1.00 0.00 C ATOM 646 CG GLU A 614 -12.282 -17.199 -16.194 1.00 0.00 C ATOM 647 CD GLU A 614 -13.164 -16.168 -16.870 1.00 0.00 C ATOM 648 OE1 GLU A 614 -14.089 -16.569 -17.607 1.00 0.00 O ATOM 649 OE2 GLU A 614 -12.929 -14.959 -16.662 1.00 0.00 O ATOM 0 H GLU A 614 -10.638 -15.432 -18.171 1.00 0.00 H new ATOM 0 HA GLU A 614 -9.480 -17.117 -16.048 1.00 0.00 H new ATOM 0 HB2 GLU A 614 -11.605 -17.729 -18.153 1.00 0.00 H new ATOM 0 HB3 GLU A 614 -11.082 -18.827 -16.892 1.00 0.00 H new ATOM 0 HG2 GLU A 614 -12.904 -18.008 -15.811 1.00 0.00 H new ATOM 0 HG3 GLU A 614 -11.788 -16.743 -15.336 1.00 0.00 H new ATOM 656 N ASP A 615 -7.721 -18.001 -17.452 1.00 0.00 N ATOM 657 CA ASP A 615 -6.672 -18.690 -18.181 1.00 0.00 C ATOM 658 C ASP A 615 -6.158 -19.840 -17.327 1.00 0.00 C ATOM 659 O ASP A 615 -5.782 -19.632 -16.173 1.00 0.00 O ATOM 660 CB ASP A 615 -5.537 -17.735 -18.547 1.00 0.00 C ATOM 661 CG ASP A 615 -4.743 -18.222 -19.742 1.00 0.00 C ATOM 662 OD1 ASP A 615 -3.829 -19.052 -19.549 1.00 0.00 O ATOM 663 OD2 ASP A 615 -5.033 -17.773 -20.871 1.00 0.00 O ATOM 0 H ASP A 615 -7.471 -17.759 -16.493 1.00 0.00 H new ATOM 0 HA ASP A 615 -7.078 -19.080 -19.115 1.00 0.00 H new ATOM 0 HB2 ASP A 615 -5.949 -16.750 -18.764 1.00 0.00 H new ATOM 0 HB3 ASP A 615 -4.871 -17.621 -17.692 1.00 0.00 H new ATOM 668 N ASN A 616 -6.155 -21.049 -17.873 1.00 0.00 N ATOM 669 CA ASN A 616 -5.698 -22.215 -17.121 1.00 0.00 C ATOM 670 C ASN A 616 -4.416 -21.906 -16.345 1.00 0.00 C ATOM 671 O ASN A 616 -4.210 -22.412 -15.241 1.00 0.00 O ATOM 672 CB ASN A 616 -5.473 -23.403 -18.057 1.00 0.00 C ATOM 673 CG ASN A 616 -6.684 -23.697 -18.921 1.00 0.00 C ATOM 674 OD1 ASN A 616 -7.812 -23.750 -18.431 1.00 0.00 O ATOM 675 ND2 ASN A 616 -6.456 -23.890 -20.214 1.00 0.00 N ATOM 0 H ASN A 616 -6.461 -21.249 -18.825 1.00 0.00 H new ATOM 0 HA ASN A 616 -6.476 -22.474 -16.403 1.00 0.00 H new ATOM 0 HB2 ASN A 616 -4.614 -23.200 -18.697 1.00 0.00 H new ATOM 0 HB3 ASN A 616 -5.229 -24.286 -17.466 1.00 0.00 H new ATOM 0 HD21 ASN A 616 -7.232 -24.092 -20.844 1.00 0.00 H new ATOM 0 HD22 ASN A 616 -5.504 -23.837 -20.578 1.00 0.00 H new ATOM 682 N ARG A 617 -3.569 -21.062 -16.923 1.00 0.00 N ATOM 683 CA ARG A 617 -2.317 -20.671 -16.282 1.00 0.00 C ATOM 684 C ARG A 617 -2.582 -19.639 -15.190 1.00 0.00 C ATOM 685 O ARG A 617 -1.968 -19.673 -14.124 1.00 0.00 O ATOM 686 CB ARG A 617 -1.348 -20.097 -17.317 1.00 0.00 C ATOM 687 CG ARG A 617 -1.084 -21.032 -18.485 1.00 0.00 C ATOM 688 CD ARG A 617 0.019 -22.028 -18.164 1.00 0.00 C ATOM 689 NE ARG A 617 0.114 -23.083 -19.170 1.00 0.00 N ATOM 690 CZ ARG A 617 0.745 -24.239 -18.975 1.00 0.00 C ATOM 691 NH1 ARG A 617 1.337 -24.493 -17.815 1.00 0.00 N ATOM 692 NH2 ARG A 617 0.785 -25.143 -19.944 1.00 0.00 N ATOM 0 H ARG A 617 -3.726 -20.634 -17.836 1.00 0.00 H new ATOM 0 HA ARG A 617 -1.868 -21.556 -15.831 1.00 0.00 H new ATOM 0 HB2 ARG A 617 -1.750 -19.158 -17.697 1.00 0.00 H new ATOM 0 HB3 ARG A 617 -0.402 -19.864 -16.828 1.00 0.00 H new ATOM 0 HG2 ARG A 617 -1.999 -21.569 -18.736 1.00 0.00 H new ATOM 0 HG3 ARG A 617 -0.805 -20.449 -19.363 1.00 0.00 H new ATOM 0 HD2 ARG A 617 0.972 -21.504 -18.097 1.00 0.00 H new ATOM 0 HD3 ARG A 617 -0.169 -22.474 -17.187 1.00 0.00 H new ATOM 0 HE ARG A 617 -0.329 -22.925 -20.075 1.00 0.00 H new ATOM 0 HH11 ARG A 617 1.310 -23.801 -17.066 1.00 0.00 H new ATOM 0 HH12 ARG A 617 1.819 -25.381 -17.672 1.00 0.00 H new ATOM 0 HH21 ARG A 617 0.333 -24.953 -20.838 1.00 0.00 H new ATOM 0 HH22 ARG A 617 1.268 -26.029 -19.795 1.00 0.00 H new ATOM 706 N LEU A 618 -3.505 -18.727 -15.467 1.00 0.00 N ATOM 707 CA LEU A 618 -3.864 -17.680 -14.518 1.00 0.00 C ATOM 708 C LEU A 618 -4.382 -18.277 -13.213 1.00 0.00 C ATOM 709 O LEU A 618 -4.841 -19.418 -13.178 1.00 0.00 O ATOM 710 CB LEU A 618 -4.930 -16.764 -15.126 1.00 0.00 C ATOM 711 CG LEU A 618 -4.419 -15.402 -15.595 1.00 0.00 C ATOM 712 CD1 LEU A 618 -4.109 -15.419 -17.082 1.00 0.00 C ATOM 713 CD2 LEU A 618 -5.430 -14.313 -15.274 1.00 0.00 C ATOM 0 H LEU A 618 -4.021 -18.691 -16.346 1.00 0.00 H new ATOM 0 HA LEU A 618 -2.968 -17.100 -14.299 1.00 0.00 H new ATOM 0 HB2 LEU A 618 -5.387 -17.275 -15.973 1.00 0.00 H new ATOM 0 HB3 LEU A 618 -5.716 -16.606 -14.388 1.00 0.00 H new ATOM 0 HG LEU A 618 -3.495 -15.186 -15.059 1.00 0.00 H new ATOM 0 HD11 LEU A 618 -3.747 -14.438 -17.390 1.00 0.00 H new ATOM 0 HD12 LEU A 618 -3.344 -16.168 -17.286 1.00 0.00 H new ATOM 0 HD13 LEU A 618 -5.013 -15.663 -17.639 1.00 0.00 H new ATOM 0 HD21 LEU A 618 -5.049 -13.351 -15.615 1.00 0.00 H new ATOM 0 HD22 LEU A 618 -6.371 -14.530 -15.779 1.00 0.00 H new ATOM 0 HD23 LEU A 618 -5.596 -14.276 -14.197 1.00 0.00 H new ATOM 725 N SER A 619 -4.314 -17.489 -12.147 1.00 0.00 N ATOM 726 CA SER A 619 -4.784 -17.926 -10.839 1.00 0.00 C ATOM 727 C SER A 619 -6.048 -17.170 -10.452 1.00 0.00 C ATOM 728 O SER A 619 -6.361 -16.137 -11.044 1.00 0.00 O ATOM 729 CB SER A 619 -3.698 -17.707 -9.784 1.00 0.00 C ATOM 730 OG SER A 619 -3.707 -18.745 -8.819 1.00 0.00 O ATOM 0 H SER A 619 -3.937 -16.541 -12.163 1.00 0.00 H new ATOM 0 HA SER A 619 -5.013 -18.990 -10.891 1.00 0.00 H new ATOM 0 HB2 SER A 619 -2.722 -17.663 -10.266 1.00 0.00 H new ATOM 0 HB3 SER A 619 -3.853 -16.747 -9.292 1.00 0.00 H new ATOM 0 HG SER A 619 -3.003 -18.583 -8.157 1.00 0.00 H new ATOM 736 N ARG A 620 -6.774 -17.679 -9.456 1.00 0.00 N ATOM 737 CA ARG A 620 -8.002 -17.027 -9.002 1.00 0.00 C ATOM 738 C ARG A 620 -7.770 -15.529 -8.842 1.00 0.00 C ATOM 739 O ARG A 620 -8.460 -14.714 -9.451 1.00 0.00 O ATOM 740 CB ARG A 620 -8.482 -17.633 -7.679 1.00 0.00 C ATOM 741 CG ARG A 620 -7.368 -17.883 -6.677 1.00 0.00 C ATOM 742 CD ARG A 620 -7.447 -19.283 -6.091 1.00 0.00 C ATOM 743 NE ARG A 620 -7.148 -20.312 -7.085 1.00 0.00 N ATOM 744 CZ ARG A 620 -6.786 -21.556 -6.780 1.00 0.00 C ATOM 745 NH1 ARG A 620 -6.680 -21.932 -5.511 1.00 0.00 N ATOM 746 NH2 ARG A 620 -6.531 -22.428 -7.746 1.00 0.00 N ATOM 0 H ARG A 620 -6.536 -18.533 -8.952 1.00 0.00 H new ATOM 0 HA ARG A 620 -8.776 -17.188 -9.752 1.00 0.00 H new ATOM 0 HB2 ARG A 620 -9.218 -16.965 -7.231 1.00 0.00 H new ATOM 0 HB3 ARG A 620 -8.990 -18.575 -7.885 1.00 0.00 H new ATOM 0 HG2 ARG A 620 -6.402 -17.746 -7.164 1.00 0.00 H new ATOM 0 HG3 ARG A 620 -7.428 -17.148 -5.874 1.00 0.00 H new ATOM 0 HD2 ARG A 620 -6.747 -19.368 -5.260 1.00 0.00 H new ATOM 0 HD3 ARG A 620 -8.445 -19.450 -5.685 1.00 0.00 H new ATOM 0 HE ARG A 620 -7.221 -20.062 -8.071 1.00 0.00 H new ATOM 0 HH11 ARG A 620 -6.876 -21.266 -4.764 1.00 0.00 H new ATOM 0 HH12 ARG A 620 -6.402 -22.887 -5.283 1.00 0.00 H new ATOM 0 HH21 ARG A 620 -6.612 -22.145 -8.723 1.00 0.00 H new ATOM 0 HH22 ARG A 620 -6.254 -23.381 -7.512 1.00 0.00 H new ATOM 760 N VAL A 621 -6.767 -15.182 -8.046 1.00 0.00 N ATOM 761 CA VAL A 621 -6.403 -13.791 -7.827 1.00 0.00 C ATOM 762 C VAL A 621 -5.064 -13.507 -8.494 1.00 0.00 C ATOM 763 O VAL A 621 -4.076 -13.192 -7.832 1.00 0.00 O ATOM 764 CB VAL A 621 -6.313 -13.455 -6.327 1.00 0.00 C ATOM 765 CG1 VAL A 621 -6.055 -11.969 -6.125 1.00 0.00 C ATOM 766 CG2 VAL A 621 -7.583 -13.887 -5.612 1.00 0.00 C ATOM 0 H VAL A 621 -6.188 -15.851 -7.539 1.00 0.00 H new ATOM 0 HA VAL A 621 -7.182 -13.166 -8.264 1.00 0.00 H new ATOM 0 HB VAL A 621 -5.475 -14.004 -5.898 1.00 0.00 H new ATOM 0 HG11 VAL A 621 -5.995 -11.752 -5.059 1.00 0.00 H new ATOM 0 HG12 VAL A 621 -5.116 -11.694 -6.605 1.00 0.00 H new ATOM 0 HG13 VAL A 621 -6.870 -11.395 -6.567 1.00 0.00 H new ATOM 0 HG21 VAL A 621 -7.505 -13.643 -4.552 1.00 0.00 H new ATOM 0 HG22 VAL A 621 -8.438 -13.366 -6.042 1.00 0.00 H new ATOM 0 HG23 VAL A 621 -7.718 -14.962 -5.728 1.00 0.00 H new ATOM 776 N HIS A 622 -5.044 -13.645 -9.815 1.00 0.00 N ATOM 777 CA HIS A 622 -3.835 -13.432 -10.601 1.00 0.00 C ATOM 778 C HIS A 622 -3.129 -12.139 -10.205 1.00 0.00 C ATOM 779 O HIS A 622 -1.918 -12.121 -9.989 1.00 0.00 O ATOM 780 CB HIS A 622 -4.179 -13.398 -12.089 1.00 0.00 C ATOM 781 CG HIS A 622 -3.057 -13.848 -12.966 1.00 0.00 C ATOM 782 ND1 HIS A 622 -2.603 -13.358 -14.142 1.00 0.00 N flip ATOM 783 CD2 HIS A 622 -2.253 -14.925 -12.665 1.00 0.00 C flip ATOM 784 CE1 HIS A 622 -1.543 -14.141 -14.527 1.00 0.00 C flip ATOM 785 NE2 HIS A 622 -1.353 -15.079 -13.618 1.00 0.00 N flip ATOM 0 H HIS A 622 -5.860 -13.906 -10.368 1.00 0.00 H new ATOM 0 HA HIS A 622 -3.157 -14.261 -10.400 1.00 0.00 H new ATOM 0 HB2 HIS A 622 -5.048 -14.032 -12.268 1.00 0.00 H new ATOM 0 HB3 HIS A 622 -4.463 -12.383 -12.366 1.00 0.00 H new ATOM 0 HD2 HIS A 622 -2.345 -15.546 -11.786 1.00 0.00 H new ATOM 0 HE1 HIS A 622 -0.960 -14.011 -15.427 1.00 0.00 H new ATOM 0 HE2 HIS A 622 -0.633 -15.801 -13.647 1.00 0.00 H new ATOM 794 N CYS A 623 -3.894 -11.060 -10.116 1.00 0.00 N ATOM 795 CA CYS A 623 -3.341 -9.761 -9.748 1.00 0.00 C ATOM 796 C CYS A 623 -4.440 -8.774 -9.403 1.00 0.00 C ATOM 797 O CYS A 623 -5.579 -8.916 -9.839 1.00 0.00 O ATOM 798 CB CYS A 623 -2.501 -9.192 -10.889 1.00 0.00 C ATOM 799 SG CYS A 623 -3.403 -9.027 -12.446 1.00 0.00 S ATOM 0 H CYS A 623 -4.899 -11.057 -10.293 1.00 0.00 H new ATOM 0 HA CYS A 623 -2.712 -9.912 -8.871 1.00 0.00 H new ATOM 0 HB2 CYS A 623 -2.120 -8.214 -10.595 1.00 0.00 H new ATOM 0 HB3 CYS A 623 -1.636 -9.836 -11.047 1.00 0.00 H new ATOM 0 HG CYS A 623 -2.688 -8.346 -13.291 1.00 0.00 H new ATOM 805 N PHE A 624 -4.082 -7.761 -8.628 1.00 0.00 N ATOM 806 CA PHE A 624 -5.030 -6.732 -8.231 1.00 0.00 C ATOM 807 C PHE A 624 -4.353 -5.367 -8.160 1.00 0.00 C ATOM 808 O PHE A 624 -3.199 -5.258 -7.751 1.00 0.00 O ATOM 809 CB PHE A 624 -5.670 -7.077 -6.883 1.00 0.00 C ATOM 810 CG PHE A 624 -4.707 -7.062 -5.732 1.00 0.00 C ATOM 811 CD1 PHE A 624 -4.399 -5.877 -5.081 1.00 0.00 C ATOM 812 CD2 PHE A 624 -4.111 -8.235 -5.298 1.00 0.00 C ATOM 813 CE1 PHE A 624 -3.515 -5.864 -4.019 1.00 0.00 C ATOM 814 CE2 PHE A 624 -3.227 -8.228 -4.238 1.00 0.00 C ATOM 815 CZ PHE A 624 -2.929 -7.042 -3.597 1.00 0.00 C ATOM 0 H PHE A 624 -3.139 -7.630 -8.261 1.00 0.00 H new ATOM 0 HA PHE A 624 -5.814 -6.688 -8.987 1.00 0.00 H new ATOM 0 HB2 PHE A 624 -6.473 -6.369 -6.681 1.00 0.00 H new ATOM 0 HB3 PHE A 624 -6.126 -8.065 -6.950 1.00 0.00 H new ATOM 0 HD1 PHE A 624 -4.855 -4.954 -5.408 1.00 0.00 H new ATOM 0 HD2 PHE A 624 -4.341 -9.166 -5.795 1.00 0.00 H new ATOM 0 HE1 PHE A 624 -3.283 -4.935 -3.520 1.00 0.00 H new ATOM 0 HE2 PHE A 624 -2.769 -9.149 -3.910 1.00 0.00 H new ATOM 0 HZ PHE A 624 -2.239 -7.035 -2.767 1.00 0.00 H new ATOM 825 N ILE A 625 -5.085 -4.331 -8.547 1.00 0.00 N ATOM 826 CA ILE A 625 -4.568 -2.968 -8.518 1.00 0.00 C ATOM 827 C ILE A 625 -5.116 -2.239 -7.296 1.00 0.00 C ATOM 828 O ILE A 625 -6.314 -2.282 -7.020 1.00 0.00 O ATOM 829 CB ILE A 625 -4.952 -2.201 -9.800 1.00 0.00 C ATOM 830 CG1 ILE A 625 -4.247 -2.814 -11.011 1.00 0.00 C ATOM 831 CG2 ILE A 625 -4.607 -0.723 -9.677 1.00 0.00 C ATOM 832 CD1 ILE A 625 -4.956 -2.547 -12.321 1.00 0.00 C ATOM 0 H ILE A 625 -6.044 -4.409 -8.887 1.00 0.00 H new ATOM 0 HA ILE A 625 -3.480 -3.014 -8.462 1.00 0.00 H new ATOM 0 HB ILE A 625 -6.030 -2.285 -9.938 1.00 0.00 H new ATOM 0 HG12 ILE A 625 -3.233 -2.420 -11.069 1.00 0.00 H new ATOM 0 HG13 ILE A 625 -4.162 -3.891 -10.866 1.00 0.00 H new ATOM 0 HG21 ILE A 625 -4.888 -0.206 -10.595 1.00 0.00 H new ATOM 0 HG22 ILE A 625 -5.150 -0.291 -8.836 1.00 0.00 H new ATOM 0 HG23 ILE A 625 -3.535 -0.612 -9.512 1.00 0.00 H new ATOM 0 HD11 ILE A 625 -4.401 -3.011 -13.136 1.00 0.00 H new ATOM 0 HD12 ILE A 625 -5.962 -2.966 -12.282 1.00 0.00 H new ATOM 0 HD13 ILE A 625 -5.017 -1.472 -12.489 1.00 0.00 H new ATOM 844 N PHE A 626 -4.226 -1.593 -6.558 1.00 0.00 N ATOM 845 CA PHE A 626 -4.610 -0.876 -5.354 1.00 0.00 C ATOM 846 C PHE A 626 -4.208 0.592 -5.444 1.00 0.00 C ATOM 847 O PHE A 626 -3.078 0.916 -5.806 1.00 0.00 O ATOM 848 CB PHE A 626 -3.957 -1.542 -4.136 1.00 0.00 C ATOM 849 CG PHE A 626 -3.763 -0.630 -2.958 1.00 0.00 C ATOM 850 CD1 PHE A 626 -4.849 -0.030 -2.343 1.00 0.00 C ATOM 851 CD2 PHE A 626 -2.493 -0.373 -2.472 1.00 0.00 C ATOM 852 CE1 PHE A 626 -4.670 0.809 -1.261 1.00 0.00 C ATOM 853 CE2 PHE A 626 -2.307 0.465 -1.392 1.00 0.00 C ATOM 854 CZ PHE A 626 -3.398 1.057 -0.785 1.00 0.00 C ATOM 0 H PHE A 626 -3.230 -1.551 -6.774 1.00 0.00 H new ATOM 0 HA PHE A 626 -5.694 -0.916 -5.247 1.00 0.00 H new ATOM 0 HB2 PHE A 626 -4.571 -2.388 -3.827 1.00 0.00 H new ATOM 0 HB3 PHE A 626 -2.988 -1.943 -4.433 1.00 0.00 H new ATOM 0 HD1 PHE A 626 -5.846 -0.220 -2.713 1.00 0.00 H new ATOM 0 HD2 PHE A 626 -1.638 -0.834 -2.944 1.00 0.00 H new ATOM 0 HE1 PHE A 626 -5.524 1.271 -0.788 1.00 0.00 H new ATOM 0 HE2 PHE A 626 -1.311 0.658 -1.022 1.00 0.00 H new ATOM 0 HZ PHE A 626 -3.256 1.713 0.061 1.00 0.00 H new ATOM 864 N LYS A 627 -5.139 1.472 -5.108 1.00 0.00 N ATOM 865 CA LYS A 627 -4.888 2.905 -5.148 1.00 0.00 C ATOM 866 C LYS A 627 -4.537 3.426 -3.758 1.00 0.00 C ATOM 867 O LYS A 627 -5.159 3.051 -2.765 1.00 0.00 O ATOM 868 CB LYS A 627 -6.106 3.641 -5.704 1.00 0.00 C ATOM 869 CG LYS A 627 -5.988 5.157 -5.643 1.00 0.00 C ATOM 870 CD LYS A 627 -7.277 5.834 -6.082 1.00 0.00 C ATOM 871 CE LYS A 627 -7.137 6.461 -7.460 1.00 0.00 C ATOM 872 NZ LYS A 627 -7.952 7.700 -7.591 1.00 0.00 N ATOM 0 H LYS A 627 -6.079 1.218 -4.803 1.00 0.00 H new ATOM 0 HA LYS A 627 -4.040 3.090 -5.807 1.00 0.00 H new ATOM 0 HB2 LYS A 627 -6.260 3.339 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 627 -6.991 3.332 -5.148 1.00 0.00 H new ATOM 0 HG2 LYS A 627 -5.743 5.463 -4.626 1.00 0.00 H new ATOM 0 HG3 LYS A 627 -5.168 5.485 -6.281 1.00 0.00 H new ATOM 0 HD2 LYS A 627 -8.086 5.104 -6.094 1.00 0.00 H new ATOM 0 HD3 LYS A 627 -7.551 6.602 -5.358 1.00 0.00 H new ATOM 0 HE2 LYS A 627 -6.089 6.694 -7.648 1.00 0.00 H new ATOM 0 HE3 LYS A 627 -7.445 5.742 -8.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 627 -8.136 7.890 -8.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 627 -8.855 7.576 -7.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 627 -7.434 8.501 -7.177 1.00 0.00 H new ATOM 886 N LYS A 628 -3.524 4.280 -3.701 1.00 0.00 N ATOM 887 CA LYS A 628 -3.064 4.847 -2.437 1.00 0.00 C ATOM 888 C LYS A 628 -2.805 6.341 -2.566 1.00 0.00 C ATOM 889 O LYS A 628 -2.606 6.851 -3.666 1.00 0.00 O ATOM 890 CB LYS A 628 -1.801 4.133 -1.956 1.00 0.00 C ATOM 891 CG LYS A 628 -1.903 3.640 -0.524 1.00 0.00 C ATOM 892 CD LYS A 628 -1.104 4.514 0.430 1.00 0.00 C ATOM 893 CE LYS A 628 -0.898 3.828 1.772 1.00 0.00 C ATOM 894 NZ LYS A 628 -1.940 4.220 2.762 1.00 0.00 N ATOM 0 H LYS A 628 -3.002 4.597 -4.518 1.00 0.00 H new ATOM 0 HA LYS A 628 -3.854 4.701 -1.700 1.00 0.00 H new ATOM 0 HB2 LYS A 628 -1.598 3.286 -2.612 1.00 0.00 H new ATOM 0 HB3 LYS A 628 -0.953 4.812 -2.040 1.00 0.00 H new ATOM 0 HG2 LYS A 628 -2.949 3.628 -0.217 1.00 0.00 H new ATOM 0 HG3 LYS A 628 -1.542 2.613 -0.466 1.00 0.00 H new ATOM 0 HD2 LYS A 628 -0.136 4.748 -0.013 1.00 0.00 H new ATOM 0 HD3 LYS A 628 -1.623 5.461 0.580 1.00 0.00 H new ATOM 0 HE2 LYS A 628 -0.917 2.747 1.634 1.00 0.00 H new ATOM 0 HE3 LYS A 628 0.087 4.082 2.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 628 -1.764 3.731 3.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 628 -1.906 5.248 2.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 628 -2.879 3.954 2.402 1.00 0.00 H new ATOM 908 N ARG A 629 -2.813 7.042 -1.437 1.00 0.00 N ATOM 909 CA ARG A 629 -2.584 8.479 -1.444 1.00 0.00 C ATOM 910 C ARG A 629 -1.093 8.781 -1.624 1.00 0.00 C ATOM 911 O ARG A 629 -0.264 8.466 -0.769 1.00 0.00 O ATOM 912 CB ARG A 629 -3.153 9.114 -0.160 1.00 0.00 C ATOM 913 CG ARG A 629 -2.116 9.625 0.832 1.00 0.00 C ATOM 914 CD ARG A 629 -1.474 10.917 0.353 1.00 0.00 C ATOM 915 NE ARG A 629 -1.276 11.872 1.442 1.00 0.00 N ATOM 916 CZ ARG A 629 -0.485 11.651 2.491 1.00 0.00 C ATOM 917 NH1 ARG A 629 0.196 10.516 2.591 1.00 0.00 N ATOM 918 NH2 ARG A 629 -0.372 12.571 3.440 1.00 0.00 N ATOM 0 H ARG A 629 -2.974 6.641 -0.513 1.00 0.00 H new ATOM 0 HA ARG A 629 -3.109 8.923 -2.290 1.00 0.00 H new ATOM 0 HB2 ARG A 629 -3.801 9.944 -0.442 1.00 0.00 H new ATOM 0 HB3 ARG A 629 -3.779 8.377 0.343 1.00 0.00 H new ATOM 0 HG2 ARG A 629 -2.588 9.790 1.801 1.00 0.00 H new ATOM 0 HG3 ARG A 629 -1.346 8.867 0.977 1.00 0.00 H new ATOM 0 HD2 ARG A 629 -0.513 10.693 -0.111 1.00 0.00 H new ATOM 0 HD3 ARG A 629 -2.101 11.369 -0.415 1.00 0.00 H new ATOM 0 HE ARG A 629 -1.774 12.761 1.396 1.00 0.00 H new ATOM 0 HH11 ARG A 629 0.115 9.807 1.862 1.00 0.00 H new ATOM 0 HH12 ARG A 629 0.800 10.353 3.397 1.00 0.00 H new ATOM 0 HH21 ARG A 629 -0.890 13.446 3.366 1.00 0.00 H new ATOM 0 HH22 ARG A 629 0.233 12.403 4.244 1.00 0.00 H new ATOM 932 N HIS A 630 -0.767 9.379 -2.767 1.00 0.00 N ATOM 933 CA HIS A 630 0.608 9.723 -3.110 1.00 0.00 C ATOM 934 C HIS A 630 1.128 10.861 -2.237 1.00 0.00 C ATOM 935 O HIS A 630 0.544 11.944 -2.197 1.00 0.00 O ATOM 936 CB HIS A 630 0.680 10.116 -4.588 1.00 0.00 C ATOM 937 CG HIS A 630 2.051 10.484 -5.062 1.00 0.00 C ATOM 938 ND1 HIS A 630 2.664 9.870 -6.134 1.00 0.00 N ATOM 939 CD2 HIS A 630 2.924 11.420 -4.619 1.00 0.00 C ATOM 940 CE1 HIS A 630 3.852 10.412 -6.330 1.00 0.00 C ATOM 941 NE2 HIS A 630 4.034 11.354 -5.424 1.00 0.00 N ATOM 0 H HIS A 630 -1.449 9.638 -3.480 1.00 0.00 H new ATOM 0 HA HIS A 630 1.238 8.852 -2.931 1.00 0.00 H new ATOM 0 HB2 HIS A 630 0.311 9.286 -5.191 1.00 0.00 H new ATOM 0 HB3 HIS A 630 0.010 10.959 -4.761 1.00 0.00 H new ATOM 0 HD1 HIS A 630 2.262 9.115 -6.689 1.00 0.00 H new ATOM 0 HD2 HIS A 630 2.775 12.093 -3.787 1.00 0.00 H new ATOM 0 HE1 HIS A 630 4.555 10.132 -7.101 1.00 0.00 H new ATOM 950 N ALA A 631 2.233 10.607 -1.541 1.00 0.00 N ATOM 951 CA ALA A 631 2.840 11.607 -0.669 1.00 0.00 C ATOM 952 C ALA A 631 4.040 11.028 0.073 1.00 0.00 C ATOM 953 O ALA A 631 3.936 9.990 0.728 1.00 0.00 O ATOM 954 CB ALA A 631 1.816 12.142 0.322 1.00 0.00 C ATOM 0 H ALA A 631 2.727 9.715 -1.565 1.00 0.00 H new ATOM 0 HA ALA A 631 3.188 12.431 -1.292 1.00 0.00 H new ATOM 0 HB1 ALA A 631 2.286 12.887 0.964 1.00 0.00 H new ATOM 0 HB2 ALA A 631 0.990 12.601 -0.221 1.00 0.00 H new ATOM 0 HB3 ALA A 631 1.438 11.322 0.933 1.00 0.00 H new ATOM 960 N VAL A 632 5.178 11.706 -0.032 1.00 0.00 N ATOM 961 CA VAL A 632 6.397 11.258 0.628 1.00 0.00 C ATOM 962 C VAL A 632 6.400 11.647 2.104 1.00 0.00 C ATOM 963 O VAL A 632 5.517 12.371 2.565 1.00 0.00 O ATOM 964 CB VAL A 632 7.651 11.845 -0.049 1.00 0.00 C ATOM 965 CG1 VAL A 632 7.731 11.399 -1.501 1.00 0.00 C ATOM 966 CG2 VAL A 632 7.655 13.363 0.049 1.00 0.00 C ATOM 0 H VAL A 632 5.281 12.568 -0.568 1.00 0.00 H new ATOM 0 HA VAL A 632 6.421 10.172 0.542 1.00 0.00 H new ATOM 0 HB VAL A 632 8.531 11.469 0.474 1.00 0.00 H new ATOM 0 HG11 VAL A 632 8.622 11.823 -1.963 1.00 0.00 H new ATOM 0 HG12 VAL A 632 7.782 10.311 -1.545 1.00 0.00 H new ATOM 0 HG13 VAL A 632 6.846 11.743 -2.037 1.00 0.00 H new ATOM 0 HG21 VAL A 632 8.549 13.757 -0.435 1.00 0.00 H new ATOM 0 HG22 VAL A 632 6.769 13.762 -0.445 1.00 0.00 H new ATOM 0 HG23 VAL A 632 7.650 13.660 1.098 1.00 0.00 H new ATOM 976 N GLY A 633 7.397 11.165 2.836 1.00 0.00 N ATOM 977 CA GLY A 633 7.494 11.474 4.251 1.00 0.00 C ATOM 978 C GLY A 633 7.780 12.941 4.503 1.00 0.00 C ATOM 979 O GLY A 633 8.929 13.377 4.435 1.00 0.00 O ATOM 0 H GLY A 633 8.140 10.566 2.476 1.00 0.00 H new ATOM 0 HA2 GLY A 633 6.563 11.198 4.745 1.00 0.00 H new ATOM 0 HA3 GLY A 633 8.283 10.870 4.699 1.00 0.00 H new ATOM 983 N LYS A 634 6.730 13.705 4.792 1.00 0.00 N ATOM 984 CA LYS A 634 6.873 15.133 5.054 1.00 0.00 C ATOM 985 C LYS A 634 7.428 15.856 3.832 1.00 0.00 C ATOM 986 O LYS A 634 8.146 15.268 3.022 1.00 0.00 O ATOM 987 CB LYS A 634 7.787 15.364 6.258 1.00 0.00 C ATOM 988 CG LYS A 634 7.774 16.797 6.766 1.00 0.00 C ATOM 989 CD LYS A 634 7.688 16.853 8.282 1.00 0.00 C ATOM 990 CE LYS A 634 8.258 18.155 8.825 1.00 0.00 C ATOM 991 NZ LYS A 634 7.767 19.336 8.064 1.00 0.00 N ATOM 0 H LYS A 634 5.772 13.359 4.850 1.00 0.00 H new ATOM 0 HA LYS A 634 5.885 15.537 5.276 1.00 0.00 H new ATOM 0 HB2 LYS A 634 7.485 14.698 7.066 1.00 0.00 H new ATOM 0 HB3 LYS A 634 8.807 15.093 5.986 1.00 0.00 H new ATOM 0 HG2 LYS A 634 8.676 17.310 6.433 1.00 0.00 H new ATOM 0 HG3 LYS A 634 6.927 17.329 6.333 1.00 0.00 H new ATOM 0 HD2 LYS A 634 6.648 16.752 8.592 1.00 0.00 H new ATOM 0 HD3 LYS A 634 8.231 16.010 8.710 1.00 0.00 H new ATOM 0 HE2 LYS A 634 7.985 18.261 9.875 1.00 0.00 H new ATOM 0 HE3 LYS A 634 9.347 18.121 8.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 634 7.963 20.203 8.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 634 8.252 19.383 7.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 634 6.742 19.248 7.910 1.00 0.00 H new ATOM 1005 N SER A 635 7.091 17.135 3.703 1.00 0.00 N ATOM 1006 CA SER A 635 7.557 17.939 2.579 1.00 0.00 C ATOM 1007 C SER A 635 8.811 18.723 2.953 1.00 0.00 C ATOM 1008 O SER A 635 8.930 19.908 2.643 1.00 0.00 O ATOM 1009 CB SER A 635 6.457 18.898 2.121 1.00 0.00 C ATOM 1010 OG SER A 635 5.830 19.523 3.227 1.00 0.00 O ATOM 0 H SER A 635 6.497 17.637 4.363 1.00 0.00 H new ATOM 0 HA SER A 635 7.805 17.264 1.759 1.00 0.00 H new ATOM 0 HB2 SER A 635 6.882 19.657 1.464 1.00 0.00 H new ATOM 0 HB3 SER A 635 5.714 18.352 1.539 1.00 0.00 H new ATOM 0 HG SER A 635 5.132 20.132 2.906 1.00 0.00 H new ATOM 1016 N MET A 636 9.744 18.052 3.620 1.00 0.00 N ATOM 1017 CA MET A 636 10.989 18.686 4.037 1.00 0.00 C ATOM 1018 C MET A 636 11.837 19.068 2.827 1.00 0.00 C ATOM 1019 O MET A 636 12.353 18.202 2.120 1.00 0.00 O ATOM 1020 CB MET A 636 11.782 17.750 4.952 1.00 0.00 C ATOM 1021 CG MET A 636 11.413 17.878 6.421 1.00 0.00 C ATOM 1022 SD MET A 636 12.843 17.748 7.510 1.00 0.00 S ATOM 1023 CE MET A 636 12.198 18.493 9.006 1.00 0.00 C ATOM 0 H MET A 636 9.662 17.070 3.883 1.00 0.00 H new ATOM 0 HA MET A 636 10.738 19.594 4.586 1.00 0.00 H new ATOM 0 HB2 MET A 636 11.619 16.720 4.634 1.00 0.00 H new ATOM 0 HB3 MET A 636 12.846 17.956 4.834 1.00 0.00 H new ATOM 0 HG2 MET A 636 10.922 18.837 6.586 1.00 0.00 H new ATOM 0 HG3 MET A 636 10.693 17.102 6.680 1.00 0.00 H new ATOM 0 HE1 MET A 636 13.023 18.747 9.671 1.00 0.00 H new ATOM 0 HE2 MET A 636 11.645 19.397 8.753 1.00 0.00 H new ATOM 0 HE3 MET A 636 11.533 17.789 9.506 1.00 0.00 H new ATOM 1033 N TYR A 637 11.976 20.370 2.595 1.00 0.00 N ATOM 1034 CA TYR A 637 12.762 20.873 1.470 1.00 0.00 C ATOM 1035 C TYR A 637 12.062 20.597 0.141 1.00 0.00 C ATOM 1036 O TYR A 637 11.699 21.525 -0.582 1.00 0.00 O ATOM 1037 CB TYR A 637 14.157 20.241 1.467 1.00 0.00 C ATOM 1038 CG TYR A 637 15.267 21.221 1.160 1.00 0.00 C ATOM 1039 CD1 TYR A 637 15.133 22.155 0.140 1.00 0.00 C ATOM 1040 CD2 TYR A 637 16.449 21.213 1.891 1.00 0.00 C ATOM 1041 CE1 TYR A 637 16.144 23.053 -0.144 1.00 0.00 C ATOM 1042 CE2 TYR A 637 17.465 22.109 1.613 1.00 0.00 C ATOM 1043 CZ TYR A 637 17.308 23.026 0.596 1.00 0.00 C ATOM 1044 OH TYR A 637 18.318 23.917 0.316 1.00 0.00 O ATOM 0 H TYR A 637 11.554 21.098 3.172 1.00 0.00 H new ATOM 0 HA TYR A 637 12.860 21.952 1.588 1.00 0.00 H new ATOM 0 HB2 TYR A 637 14.343 19.788 2.441 1.00 0.00 H new ATOM 0 HB3 TYR A 637 14.180 19.437 0.732 1.00 0.00 H new ATOM 0 HD1 TYR A 637 14.223 22.179 -0.441 1.00 0.00 H new ATOM 0 HD2 TYR A 637 16.576 20.496 2.689 1.00 0.00 H new ATOM 0 HE1 TYR A 637 16.024 23.772 -0.941 1.00 0.00 H new ATOM 0 HE2 TYR A 637 18.378 22.090 2.190 1.00 0.00 H new ATOM 0 HH TYR A 637 19.067 23.765 0.929 1.00 0.00 H new ATOM 1054 N GLU A 638 11.877 19.319 -0.177 1.00 0.00 N ATOM 1055 CA GLU A 638 11.223 18.929 -1.422 1.00 0.00 C ATOM 1056 C GLU A 638 9.715 19.138 -1.337 1.00 0.00 C ATOM 1057 O GLU A 638 9.105 18.920 -0.289 1.00 0.00 O ATOM 1058 CB GLU A 638 11.528 17.466 -1.746 1.00 0.00 C ATOM 1059 CG GLU A 638 12.834 17.268 -2.499 1.00 0.00 C ATOM 1060 CD GLU A 638 12.710 17.595 -3.974 1.00 0.00 C ATOM 1061 OE1 GLU A 638 11.891 16.948 -4.659 1.00 0.00 O ATOM 1062 OE2 GLU A 638 13.434 18.498 -4.445 1.00 0.00 O ATOM 0 H GLU A 638 12.170 18.537 0.409 1.00 0.00 H new ATOM 0 HA GLU A 638 11.614 19.561 -2.219 1.00 0.00 H new ATOM 0 HB2 GLU A 638 11.564 16.897 -0.817 1.00 0.00 H new ATOM 0 HB3 GLU A 638 10.711 17.056 -2.339 1.00 0.00 H new ATOM 0 HG2 GLU A 638 13.605 17.897 -2.054 1.00 0.00 H new ATOM 0 HG3 GLU A 638 13.162 16.235 -2.386 1.00 0.00 H new ATOM 1069 N SER A 639 9.118 19.561 -2.447 1.00 0.00 N ATOM 1070 CA SER A 639 7.681 19.799 -2.502 1.00 0.00 C ATOM 1071 C SER A 639 7.005 18.831 -3.472 1.00 0.00 C ATOM 1072 O SER A 639 6.926 19.097 -4.671 1.00 0.00 O ATOM 1073 CB SER A 639 7.398 21.242 -2.927 1.00 0.00 C ATOM 1074 OG SER A 639 7.863 21.486 -4.242 1.00 0.00 O ATOM 0 H SER A 639 9.609 19.746 -3.322 1.00 0.00 H new ATOM 0 HA SER A 639 7.272 19.633 -1.505 1.00 0.00 H new ATOM 0 HB2 SER A 639 6.327 21.436 -2.875 1.00 0.00 H new ATOM 0 HB3 SER A 639 7.881 21.930 -2.233 1.00 0.00 H new ATOM 0 HG SER A 639 7.618 20.734 -4.820 1.00 0.00 H new ATOM 1080 N PRO A 640 6.507 17.689 -2.964 1.00 0.00 N ATOM 1081 CA PRO A 640 5.836 16.680 -3.789 1.00 0.00 C ATOM 1082 C PRO A 640 4.513 17.193 -4.352 1.00 0.00 C ATOM 1083 O PRO A 640 4.353 18.391 -4.588 1.00 0.00 O ATOM 1084 CB PRO A 640 5.599 15.510 -2.819 1.00 0.00 C ATOM 1085 CG PRO A 640 6.458 15.796 -1.634 1.00 0.00 C ATOM 1086 CD PRO A 640 6.553 17.289 -1.552 1.00 0.00 C ATOM 0 HA PRO A 640 6.430 16.402 -4.659 1.00 0.00 H new ATOM 0 HB2 PRO A 640 4.549 15.442 -2.535 1.00 0.00 H new ATOM 0 HB3 PRO A 640 5.868 14.559 -3.278 1.00 0.00 H new ATOM 0 HG2 PRO A 640 6.022 15.381 -0.725 1.00 0.00 H new ATOM 0 HG3 PRO A 640 7.445 15.347 -1.748 1.00 0.00 H new ATOM 0 HD2 PRO A 640 5.729 17.717 -0.982 1.00 0.00 H new ATOM 0 HD3 PRO A 640 7.476 17.611 -1.069 1.00 0.00 H new ATOM 1094 N ALA A 641 3.567 16.283 -4.566 1.00 0.00 N ATOM 1095 CA ALA A 641 2.263 16.649 -5.100 1.00 0.00 C ATOM 1096 C ALA A 641 1.261 16.928 -3.984 1.00 0.00 C ATOM 1097 O ALA A 641 0.077 16.615 -4.110 1.00 0.00 O ATOM 1098 CB ALA A 641 1.747 15.548 -6.010 1.00 0.00 C ATOM 0 H ALA A 641 3.681 15.287 -4.377 1.00 0.00 H new ATOM 0 HA ALA A 641 2.380 17.566 -5.677 1.00 0.00 H new ATOM 0 HB1 ALA A 641 0.771 15.830 -6.405 1.00 0.00 H new ATOM 0 HB2 ALA A 641 2.444 15.401 -6.835 1.00 0.00 H new ATOM 0 HB3 ALA A 641 1.655 14.621 -5.444 1.00 0.00 H new ATOM 1104 N GLN A 642 1.739 17.520 -2.892 1.00 0.00 N ATOM 1105 CA GLN A 642 0.882 17.843 -1.755 1.00 0.00 C ATOM 1106 C GLN A 642 0.394 16.576 -1.057 1.00 0.00 C ATOM 1107 O GLN A 642 0.811 16.274 0.061 1.00 0.00 O ATOM 1108 CB GLN A 642 -0.313 18.687 -2.205 1.00 0.00 C ATOM 1109 CG GLN A 642 0.071 19.850 -3.107 1.00 0.00 C ATOM 1110 CD GLN A 642 -1.124 20.459 -3.813 1.00 0.00 C ATOM 1111 OE1 GLN A 642 -1.992 21.064 -3.183 1.00 0.00 O ATOM 1112 NE2 GLN A 642 -1.176 20.301 -5.131 1.00 0.00 N ATOM 0 H GLN A 642 2.716 17.786 -2.771 1.00 0.00 H new ATOM 0 HA GLN A 642 1.474 18.420 -1.045 1.00 0.00 H new ATOM 0 HB2 GLN A 642 -1.022 18.048 -2.732 1.00 0.00 H new ATOM 0 HB3 GLN A 642 -0.826 19.074 -1.325 1.00 0.00 H new ATOM 0 HG2 GLN A 642 0.567 20.617 -2.513 1.00 0.00 H new ATOM 0 HG3 GLN A 642 0.791 19.507 -3.850 1.00 0.00 H new ATOM 0 HE21 GLN A 642 -0.435 19.792 -5.613 1.00 0.00 H new ATOM 0 HE22 GLN A 642 -1.957 20.688 -5.661 1.00 0.00 H new ATOM 1121 N GLY A 643 -0.490 15.837 -1.722 1.00 0.00 N ATOM 1122 CA GLY A 643 -1.014 14.614 -1.143 1.00 0.00 C ATOM 1123 C GLY A 643 -2.226 14.085 -1.884 1.00 0.00 C ATOM 1124 O GLY A 643 -3.315 13.989 -1.316 1.00 0.00 O ATOM 0 H GLY A 643 -0.851 16.063 -2.649 1.00 0.00 H new ATOM 0 HA2 GLY A 643 -0.233 13.854 -1.144 1.00 0.00 H new ATOM 0 HA3 GLY A 643 -1.281 14.796 -0.102 1.00 0.00 H new ATOM 1128 N LEU A 644 -2.039 13.734 -3.152 1.00 0.00 N ATOM 1129 CA LEU A 644 -3.125 13.205 -3.967 1.00 0.00 C ATOM 1130 C LEU A 644 -3.120 11.674 -3.920 1.00 0.00 C ATOM 1131 O LEU A 644 -2.566 11.092 -2.991 1.00 0.00 O ATOM 1132 CB LEU A 644 -2.996 13.725 -5.401 1.00 0.00 C ATOM 1133 CG LEU A 644 -3.408 15.190 -5.582 1.00 0.00 C ATOM 1134 CD1 LEU A 644 -2.188 16.098 -5.559 1.00 0.00 C ATOM 1135 CD2 LEU A 644 -4.190 15.373 -6.875 1.00 0.00 C ATOM 0 H LEU A 644 -1.145 13.807 -3.637 1.00 0.00 H new ATOM 0 HA LEU A 644 -4.081 13.546 -3.569 1.00 0.00 H new ATOM 0 HB2 LEU A 644 -1.962 13.608 -5.725 1.00 0.00 H new ATOM 0 HB3 LEU A 644 -3.608 13.105 -6.056 1.00 0.00 H new ATOM 0 HG LEU A 644 -4.055 15.467 -4.750 1.00 0.00 H new ATOM 0 HD11 LEU A 644 -2.503 17.133 -5.689 1.00 0.00 H new ATOM 0 HD12 LEU A 644 -1.674 15.992 -4.604 1.00 0.00 H new ATOM 0 HD13 LEU A 644 -1.512 15.820 -6.368 1.00 0.00 H new ATOM 0 HD21 LEU A 644 -4.473 16.420 -6.984 1.00 0.00 H new ATOM 0 HD22 LEU A 644 -3.570 15.075 -7.720 1.00 0.00 H new ATOM 0 HD23 LEU A 644 -5.088 14.756 -6.848 1.00 0.00 H new ATOM 1147 N ASP A 645 -3.746 11.019 -4.898 1.00 0.00 N ATOM 1148 CA ASP A 645 -3.801 9.558 -4.908 1.00 0.00 C ATOM 1149 C ASP A 645 -3.143 8.964 -6.152 1.00 0.00 C ATOM 1150 O ASP A 645 -3.192 9.543 -7.236 1.00 0.00 O ATOM 1151 CB ASP A 645 -5.248 9.070 -4.812 1.00 0.00 C ATOM 1152 CG ASP A 645 -6.088 9.913 -3.871 1.00 0.00 C ATOM 1153 OD1 ASP A 645 -5.511 10.520 -2.944 1.00 0.00 O ATOM 1154 OD2 ASP A 645 -7.322 9.968 -4.062 1.00 0.00 O ATOM 0 H ASP A 645 -4.216 11.470 -5.683 1.00 0.00 H new ATOM 0 HA ASP A 645 -3.242 9.217 -4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 645 -5.698 9.083 -5.805 1.00 0.00 H new ATOM 0 HB3 ASP A 645 -5.256 8.035 -4.471 1.00 0.00 H new ATOM 1159 N ASP A 646 -2.540 7.791 -5.973 1.00 0.00 N ATOM 1160 CA ASP A 646 -1.876 7.076 -7.059 1.00 0.00 C ATOM 1161 C ASP A 646 -2.408 5.647 -7.138 1.00 0.00 C ATOM 1162 O ASP A 646 -2.976 5.138 -6.173 1.00 0.00 O ATOM 1163 CB ASP A 646 -0.362 7.058 -6.839 1.00 0.00 C ATOM 1164 CG ASP A 646 0.366 8.010 -7.767 1.00 0.00 C ATOM 1165 OD1 ASP A 646 0.510 9.197 -7.406 1.00 0.00 O ATOM 1166 OD2 ASP A 646 0.794 7.568 -8.854 1.00 0.00 O ATOM 0 H ASP A 646 -2.498 7.311 -5.074 1.00 0.00 H new ATOM 0 HA ASP A 646 -2.085 7.590 -7.997 1.00 0.00 H new ATOM 0 HB2 ASP A 646 -0.144 7.325 -5.805 1.00 0.00 H new ATOM 0 HB3 ASP A 646 0.013 6.046 -6.993 1.00 0.00 H new ATOM 1171 N ILE A 647 -2.226 4.999 -8.285 1.00 0.00 N ATOM 1172 CA ILE A 647 -2.701 3.630 -8.456 1.00 0.00 C ATOM 1173 C ILE A 647 -1.551 2.639 -8.560 1.00 0.00 C ATOM 1174 O ILE A 647 -0.701 2.735 -9.446 1.00 0.00 O ATOM 1175 CB ILE A 647 -3.616 3.485 -9.685 1.00 0.00 C ATOM 1176 CG1 ILE A 647 -3.052 4.257 -10.880 1.00 0.00 C ATOM 1177 CG2 ILE A 647 -5.015 3.968 -9.341 1.00 0.00 C ATOM 1178 CD1 ILE A 647 -3.425 3.654 -12.220 1.00 0.00 C ATOM 0 H ILE A 647 -1.759 5.394 -9.101 1.00 0.00 H new ATOM 0 HA ILE A 647 -3.281 3.400 -7.562 1.00 0.00 H new ATOM 0 HB ILE A 647 -3.665 2.433 -9.965 1.00 0.00 H new ATOM 0 HG12 ILE A 647 -3.411 5.285 -10.841 1.00 0.00 H new ATOM 0 HG13 ILE A 647 -1.966 4.296 -10.798 1.00 0.00 H new ATOM 0 HG21 ILE A 647 -5.660 3.864 -10.213 1.00 0.00 H new ATOM 0 HG22 ILE A 647 -5.414 3.372 -8.521 1.00 0.00 H new ATOM 0 HG23 ILE A 647 -4.975 5.015 -9.042 1.00 0.00 H new ATOM 0 HD11 ILE A 647 -2.992 4.252 -13.021 1.00 0.00 H new ATOM 0 HD12 ILE A 647 -3.042 2.635 -12.280 1.00 0.00 H new ATOM 0 HD13 ILE A 647 -4.510 3.640 -12.323 1.00 0.00 H new ATOM 1190 N TRP A 648 -1.545 1.688 -7.638 1.00 0.00 N ATOM 1191 CA TRP A 648 -0.518 0.657 -7.586 1.00 0.00 C ATOM 1192 C TRP A 648 -1.044 -0.665 -8.136 1.00 0.00 C ATOM 1193 O TRP A 648 -2.155 -1.081 -7.820 1.00 0.00 O ATOM 1194 CB TRP A 648 -0.053 0.454 -6.142 1.00 0.00 C ATOM 1195 CG TRP A 648 0.601 1.662 -5.548 1.00 0.00 C ATOM 1196 CD1 TRP A 648 0.027 2.591 -4.727 1.00 0.00 C ATOM 1197 CD2 TRP A 648 1.960 2.067 -5.727 1.00 0.00 C ATOM 1198 NE1 TRP A 648 0.948 3.557 -4.393 1.00 0.00 N ATOM 1199 CE2 TRP A 648 2.144 3.253 -4.992 1.00 0.00 C ATOM 1200 CE3 TRP A 648 3.040 1.540 -6.439 1.00 0.00 C ATOM 1201 CZ2 TRP A 648 3.365 3.920 -4.950 1.00 0.00 C ATOM 1202 CZ3 TRP A 648 4.251 2.201 -6.397 1.00 0.00 C ATOM 1203 CH2 TRP A 648 4.406 3.381 -5.657 1.00 0.00 C ATOM 0 H TRP A 648 -2.251 1.609 -6.906 1.00 0.00 H new ATOM 0 HA TRP A 648 0.320 0.984 -8.201 1.00 0.00 H new ATOM 0 HB2 TRP A 648 -0.910 0.177 -5.529 1.00 0.00 H new ATOM 0 HB3 TRP A 648 0.647 -0.381 -6.108 1.00 0.00 H new ATOM 0 HD1 TRP A 648 -0.999 2.570 -4.390 1.00 0.00 H new ATOM 0 HE1 TRP A 648 0.771 4.366 -3.798 1.00 0.00 H new ATOM 0 HE3 TRP A 648 2.929 0.631 -7.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 648 3.487 4.830 -4.380 1.00 0.00 H new ATOM 0 HZ3 TRP A 648 5.093 1.802 -6.943 1.00 0.00 H new ATOM 0 HH2 TRP A 648 5.366 3.875 -5.644 1.00 0.00 H new ATOM 1214 N TYR A 649 -0.231 -1.325 -8.948 1.00 0.00 N ATOM 1215 CA TYR A 649 -0.606 -2.608 -9.528 1.00 0.00 C ATOM 1216 C TYR A 649 0.028 -3.743 -8.729 1.00 0.00 C ATOM 1217 O TYR A 649 1.251 -3.832 -8.627 1.00 0.00 O ATOM 1218 CB TYR A 649 -0.164 -2.676 -10.993 1.00 0.00 C ATOM 1219 CG TYR A 649 -0.106 -4.080 -11.556 1.00 0.00 C ATOM 1220 CD1 TYR A 649 -1.224 -4.903 -11.534 1.00 0.00 C ATOM 1221 CD2 TYR A 649 1.068 -4.582 -12.103 1.00 0.00 C ATOM 1222 CE1 TYR A 649 -1.174 -6.186 -12.043 1.00 0.00 C ATOM 1223 CE2 TYR A 649 1.126 -5.864 -12.614 1.00 0.00 C ATOM 1224 CZ TYR A 649 0.002 -6.662 -12.582 1.00 0.00 C ATOM 1225 OH TYR A 649 0.054 -7.941 -13.090 1.00 0.00 O ATOM 0 H TYR A 649 0.694 -0.993 -9.221 1.00 0.00 H new ATOM 0 HA TYR A 649 -1.690 -2.712 -9.489 1.00 0.00 H new ATOM 0 HB2 TYR A 649 -0.850 -2.082 -11.596 1.00 0.00 H new ATOM 0 HB3 TYR A 649 0.821 -2.218 -11.086 1.00 0.00 H new ATOM 0 HD1 TYR A 649 -2.147 -4.534 -11.112 1.00 0.00 H new ATOM 0 HD2 TYR A 649 1.950 -3.960 -12.129 1.00 0.00 H new ATOM 0 HE1 TYR A 649 -2.053 -6.814 -12.019 1.00 0.00 H new ATOM 0 HE2 TYR A 649 2.047 -6.239 -13.036 1.00 0.00 H new ATOM 0 HH TYR A 649 0.834 -8.028 -13.677 1.00 0.00 H new ATOM 1235 N CYS A 650 -0.807 -4.605 -8.163 1.00 0.00 N ATOM 1236 CA CYS A 650 -0.317 -5.729 -7.370 1.00 0.00 C ATOM 1237 C CYS A 650 -0.553 -7.050 -8.090 1.00 0.00 C ATOM 1238 O CYS A 650 -1.582 -7.239 -8.737 1.00 0.00 O ATOM 1239 CB CYS A 650 -0.999 -5.752 -6.000 1.00 0.00 C ATOM 1240 SG CYS A 650 -1.139 -4.128 -5.215 1.00 0.00 S ATOM 0 H CYS A 650 -1.823 -4.549 -8.237 1.00 0.00 H new ATOM 0 HA CYS A 650 0.756 -5.600 -7.232 1.00 0.00 H new ATOM 0 HB2 CYS A 650 -1.997 -6.177 -6.110 1.00 0.00 H new ATOM 0 HB3 CYS A 650 -0.441 -6.416 -5.340 1.00 0.00 H new ATOM 0 HG CYS A 650 -2.223 -4.084 -4.499 1.00 0.00 H new ATOM 1246 N HIS A 651 0.407 -7.960 -7.975 1.00 0.00 N ATOM 1247 CA HIS A 651 0.306 -9.266 -8.616 1.00 0.00 C ATOM 1248 C HIS A 651 0.398 -10.387 -7.585 1.00 0.00 C ATOM 1249 O HIS A 651 1.377 -10.481 -6.840 1.00 0.00 O ATOM 1250 CB HIS A 651 1.406 -9.422 -9.667 1.00 0.00 C ATOM 1251 CG HIS A 651 1.398 -10.743 -10.373 1.00 0.00 C ATOM 1252 ND1 HIS A 651 0.823 -10.933 -11.613 1.00 0.00 N ATOM 1253 CD2 HIS A 651 1.924 -11.939 -10.019 1.00 0.00 C ATOM 1254 CE1 HIS A 651 0.999 -12.187 -11.992 1.00 0.00 C ATOM 1255 NE2 HIS A 651 1.663 -12.818 -11.042 1.00 0.00 N ATOM 0 H HIS A 651 1.266 -7.817 -7.443 1.00 0.00 H new ATOM 0 HA HIS A 651 -0.665 -9.333 -9.106 1.00 0.00 H new ATOM 0 HB2 HIS A 651 1.302 -8.627 -10.406 1.00 0.00 H new ATOM 0 HB3 HIS A 651 2.375 -9.286 -9.186 1.00 0.00 H new ATOM 0 HD2 HIS A 651 2.451 -12.161 -9.103 1.00 0.00 H new ATOM 0 HE1 HIS A 651 0.658 -12.621 -12.920 1.00 0.00 H new ATOM 0 HE2 HIS A 651 1.938 -13.800 -11.064 1.00 0.00 H new ATOM 1264 N THR A 652 -0.632 -11.231 -7.553 1.00 0.00 N ATOM 1265 CA THR A 652 -0.689 -12.353 -6.622 1.00 0.00 C ATOM 1266 C THR A 652 -0.686 -13.688 -7.361 1.00 0.00 C ATOM 1267 O THR A 652 -0.930 -14.734 -6.763 1.00 0.00 O ATOM 1268 CB THR A 652 -1.941 -12.271 -5.727 1.00 0.00 C ATOM 1269 OG1 THR A 652 -2.974 -11.538 -6.396 1.00 0.00 O ATOM 1270 CG2 THR A 652 -1.615 -11.596 -4.403 1.00 0.00 C ATOM 0 H THR A 652 -1.443 -11.156 -8.167 1.00 0.00 H new ATOM 0 HA THR A 652 0.202 -12.292 -5.997 1.00 0.00 H new ATOM 0 HB THR A 652 -2.285 -13.286 -5.527 1.00 0.00 H new ATOM 0 HG1 THR A 652 -3.192 -11.979 -7.243 1.00 0.00 H new ATOM 0 HG21 THR A 652 -2.513 -11.549 -3.788 1.00 0.00 H new ATOM 0 HG22 THR A 652 -0.848 -12.169 -3.882 1.00 0.00 H new ATOM 0 HG23 THR A 652 -1.250 -10.586 -4.590 1.00 0.00 H new ATOM 1278 N GLY A 653 -0.401 -13.648 -8.659 1.00 0.00 N ATOM 1279 CA GLY A 653 -0.359 -14.867 -9.445 1.00 0.00 C ATOM 1280 C GLY A 653 1.018 -15.505 -9.423 1.00 0.00 C ATOM 1281 O GLY A 653 2.030 -14.808 -9.485 1.00 0.00 O ATOM 0 H GLY A 653 -0.199 -12.794 -9.180 1.00 0.00 H new ATOM 0 HA2 GLY A 653 -1.093 -15.574 -9.059 1.00 0.00 H new ATOM 0 HA3 GLY A 653 -0.641 -14.646 -10.474 1.00 0.00 H new ATOM 1285 N THR A 654 1.060 -16.828 -9.328 1.00 0.00 N ATOM 1286 CA THR A 654 2.327 -17.550 -9.291 1.00 0.00 C ATOM 1287 C THR A 654 3.017 -17.559 -10.657 1.00 0.00 C ATOM 1288 O THR A 654 4.162 -17.996 -10.776 1.00 0.00 O ATOM 1289 CB THR A 654 2.130 -19.002 -8.822 1.00 0.00 C ATOM 1290 OG1 THR A 654 1.390 -19.027 -7.595 1.00 0.00 O ATOM 1291 CG2 THR A 654 3.470 -19.695 -8.624 1.00 0.00 C ATOM 0 H THR A 654 0.233 -17.423 -9.275 1.00 0.00 H new ATOM 0 HA THR A 654 2.961 -17.022 -8.579 1.00 0.00 H new ATOM 0 HB THR A 654 1.573 -19.535 -9.593 1.00 0.00 H new ATOM 0 HG1 THR A 654 1.268 -19.955 -7.305 1.00 0.00 H new ATOM 0 HG21 THR A 654 3.304 -20.720 -8.292 1.00 0.00 H new ATOM 0 HG22 THR A 654 4.018 -19.703 -9.566 1.00 0.00 H new ATOM 0 HG23 THR A 654 4.049 -19.159 -7.872 1.00 0.00 H new ATOM 1299 N ASN A 655 2.318 -17.081 -11.684 1.00 0.00 N ATOM 1300 CA ASN A 655 2.871 -17.046 -13.037 1.00 0.00 C ATOM 1301 C ASN A 655 3.704 -15.783 -13.275 1.00 0.00 C ATOM 1302 O ASN A 655 4.207 -15.564 -14.377 1.00 0.00 O ATOM 1303 CB ASN A 655 1.745 -17.126 -14.070 1.00 0.00 C ATOM 1304 CG ASN A 655 0.670 -18.124 -13.682 1.00 0.00 C ATOM 1305 OD1 ASN A 655 0.019 -17.978 -12.647 1.00 0.00 O ATOM 1306 ND2 ASN A 655 0.475 -19.148 -14.508 1.00 0.00 N ATOM 0 H ASN A 655 1.370 -16.713 -11.606 1.00 0.00 H new ATOM 0 HA ASN A 655 3.528 -17.909 -13.146 1.00 0.00 H new ATOM 0 HB2 ASN A 655 1.295 -16.140 -14.189 1.00 0.00 H new ATOM 0 HB3 ASN A 655 2.163 -17.405 -15.037 1.00 0.00 H new ATOM 0 HD21 ASN A 655 -0.235 -19.848 -14.294 1.00 0.00 H new ATOM 0 HD22 ASN A 655 1.035 -19.233 -15.356 1.00 0.00 H new ATOM 1313 N VAL A 656 3.848 -14.960 -12.237 1.00 0.00 N ATOM 1314 CA VAL A 656 4.619 -13.718 -12.328 1.00 0.00 C ATOM 1315 C VAL A 656 4.036 -12.781 -13.379 1.00 0.00 C ATOM 1316 O VAL A 656 3.523 -13.220 -14.409 1.00 0.00 O ATOM 1317 CB VAL A 656 6.129 -13.966 -12.628 1.00 0.00 C ATOM 1318 CG1 VAL A 656 6.475 -15.446 -12.598 1.00 0.00 C ATOM 1319 CG2 VAL A 656 6.544 -13.357 -13.961 1.00 0.00 C ATOM 0 H VAL A 656 3.439 -15.131 -11.318 1.00 0.00 H new ATOM 0 HA VAL A 656 4.548 -13.249 -11.347 1.00 0.00 H new ATOM 0 HB VAL A 656 6.689 -13.470 -11.835 1.00 0.00 H new ATOM 0 HG11 VAL A 656 7.536 -15.576 -12.812 1.00 0.00 H new ATOM 0 HG12 VAL A 656 6.251 -15.852 -11.612 1.00 0.00 H new ATOM 0 HG13 VAL A 656 5.886 -15.973 -13.349 1.00 0.00 H new ATOM 0 HG21 VAL A 656 7.602 -13.550 -14.135 1.00 0.00 H new ATOM 0 HG22 VAL A 656 5.957 -13.803 -14.763 1.00 0.00 H new ATOM 0 HG23 VAL A 656 6.370 -12.281 -13.939 1.00 0.00 H new ATOM 1329 N SER A 657 4.133 -11.485 -13.112 1.00 0.00 N ATOM 1330 CA SER A 657 3.635 -10.477 -14.033 1.00 0.00 C ATOM 1331 C SER A 657 4.789 -9.625 -14.551 1.00 0.00 C ATOM 1332 O SER A 657 5.872 -9.612 -13.965 1.00 0.00 O ATOM 1333 CB SER A 657 2.590 -9.592 -13.345 1.00 0.00 C ATOM 1334 OG SER A 657 2.695 -8.242 -13.765 1.00 0.00 O ATOM 0 H SER A 657 4.553 -11.109 -12.262 1.00 0.00 H new ATOM 0 HA SER A 657 3.161 -10.979 -14.876 1.00 0.00 H new ATOM 0 HB2 SER A 657 1.591 -9.967 -13.568 1.00 0.00 H new ATOM 0 HB3 SER A 657 2.718 -9.649 -12.264 1.00 0.00 H new ATOM 0 HG SER A 657 2.578 -7.649 -12.993 1.00 0.00 H new ATOM 1340 N TYR A 658 4.553 -8.916 -15.645 1.00 0.00 N ATOM 1341 CA TYR A 658 5.576 -8.061 -16.231 1.00 0.00 C ATOM 1342 C TYR A 658 4.972 -6.729 -16.660 1.00 0.00 C ATOM 1343 O TYR A 658 4.060 -6.690 -17.485 1.00 0.00 O ATOM 1344 CB TYR A 658 6.228 -8.757 -17.430 1.00 0.00 C ATOM 1345 CG TYR A 658 6.453 -10.244 -17.236 1.00 0.00 C ATOM 1346 CD1 TYR A 658 5.383 -11.132 -17.203 1.00 0.00 C ATOM 1347 CD2 TYR A 658 7.736 -10.761 -17.094 1.00 0.00 C ATOM 1348 CE1 TYR A 658 5.585 -12.488 -17.032 1.00 0.00 C ATOM 1349 CE2 TYR A 658 7.945 -12.117 -16.925 1.00 0.00 C ATOM 1350 CZ TYR A 658 6.867 -12.975 -16.895 1.00 0.00 C ATOM 1351 OH TYR A 658 7.073 -14.325 -16.728 1.00 0.00 O ATOM 0 H TYR A 658 3.664 -8.915 -16.145 1.00 0.00 H new ATOM 0 HA TYR A 658 6.341 -7.871 -15.479 1.00 0.00 H new ATOM 0 HB2 TYR A 658 5.601 -8.607 -18.309 1.00 0.00 H new ATOM 0 HB3 TYR A 658 7.186 -8.280 -17.637 1.00 0.00 H new ATOM 0 HD1 TYR A 658 4.377 -10.755 -17.313 1.00 0.00 H new ATOM 0 HD2 TYR A 658 8.583 -10.092 -17.116 1.00 0.00 H new ATOM 0 HE1 TYR A 658 4.742 -13.163 -17.006 1.00 0.00 H new ATOM 0 HE2 TYR A 658 8.948 -12.502 -16.817 1.00 0.00 H new ATOM 0 HH TYR A 658 8.034 -14.502 -16.648 1.00 0.00 H new ATOM 1361 N LEU A 659 5.481 -5.641 -16.095 1.00 0.00 N ATOM 1362 CA LEU A 659 4.980 -4.311 -16.422 1.00 0.00 C ATOM 1363 C LEU A 659 5.993 -3.531 -17.254 1.00 0.00 C ATOM 1364 O LEU A 659 7.095 -3.237 -16.793 1.00 0.00 O ATOM 1365 CB LEU A 659 4.645 -3.536 -15.143 1.00 0.00 C ATOM 1366 CG LEU A 659 3.307 -2.791 -15.172 1.00 0.00 C ATOM 1367 CD1 LEU A 659 3.212 -1.802 -14.022 1.00 0.00 C ATOM 1368 CD2 LEU A 659 3.126 -2.069 -16.495 1.00 0.00 C ATOM 0 H LEU A 659 6.237 -5.653 -15.411 1.00 0.00 H new ATOM 0 HA LEU A 659 4.072 -4.432 -17.013 1.00 0.00 H new ATOM 0 HB2 LEU A 659 4.638 -4.233 -14.305 1.00 0.00 H new ATOM 0 HB3 LEU A 659 5.441 -2.816 -14.953 1.00 0.00 H new ATOM 0 HG LEU A 659 2.511 -3.527 -15.062 1.00 0.00 H new ATOM 0 HD11 LEU A 659 2.253 -1.286 -14.064 1.00 0.00 H new ATOM 0 HD12 LEU A 659 3.295 -2.336 -13.075 1.00 0.00 H new ATOM 0 HD13 LEU A 659 4.020 -1.074 -14.100 1.00 0.00 H new ATOM 0 HD21 LEU A 659 2.170 -1.546 -16.496 1.00 0.00 H new ATOM 0 HD22 LEU A 659 3.933 -1.349 -16.630 1.00 0.00 H new ATOM 0 HD23 LEU A 659 3.145 -2.793 -17.310 1.00 0.00 H new ATOM 1380 N ASN A 660 5.608 -3.199 -18.482 1.00 0.00 N ATOM 1381 CA ASN A 660 6.477 -2.452 -19.384 1.00 0.00 C ATOM 1382 C ASN A 660 7.770 -3.220 -19.656 1.00 0.00 C ATOM 1383 O ASN A 660 7.880 -3.928 -20.658 1.00 0.00 O ATOM 1384 CB ASN A 660 6.784 -1.069 -18.801 1.00 0.00 C ATOM 1385 CG ASN A 660 7.761 -0.279 -19.650 1.00 0.00 C ATOM 1386 OD1 ASN A 660 8.823 0.129 -19.179 1.00 0.00 O ATOM 1387 ND2 ASN A 660 7.406 -0.059 -20.911 1.00 0.00 N ATOM 0 H ASN A 660 4.698 -3.436 -18.876 1.00 0.00 H new ATOM 0 HA ASN A 660 5.956 -2.323 -20.333 1.00 0.00 H new ATOM 0 HB2 ASN A 660 5.856 -0.506 -18.704 1.00 0.00 H new ATOM 0 HB3 ASN A 660 7.193 -1.185 -17.797 1.00 0.00 H new ATOM 0 HD21 ASN A 660 8.023 0.466 -21.530 1.00 0.00 H new ATOM 0 HD22 ASN A 660 6.516 -0.416 -21.260 1.00 0.00 H new ATOM 1394 N ASN A 661 8.750 -3.076 -18.767 1.00 0.00 N ATOM 1395 CA ASN A 661 10.029 -3.759 -18.929 1.00 0.00 C ATOM 1396 C ASN A 661 10.528 -4.356 -17.611 1.00 0.00 C ATOM 1397 O ASN A 661 11.614 -4.934 -17.562 1.00 0.00 O ATOM 1398 CB ASN A 661 11.074 -2.793 -19.489 1.00 0.00 C ATOM 1399 CG ASN A 661 12.103 -3.492 -20.356 1.00 0.00 C ATOM 1400 OD1 ASN A 661 13.012 -4.152 -19.852 1.00 0.00 O ATOM 1401 ND2 ASN A 661 11.963 -3.352 -21.670 1.00 0.00 N ATOM 0 H ASN A 661 8.683 -2.495 -17.931 1.00 0.00 H new ATOM 0 HA ASN A 661 9.876 -4.580 -19.630 1.00 0.00 H new ATOM 0 HB2 ASN A 661 10.574 -2.021 -20.074 1.00 0.00 H new ATOM 0 HB3 ASN A 661 11.579 -2.291 -18.664 1.00 0.00 H new ATOM 0 HD21 ASN A 661 12.624 -3.801 -22.304 1.00 0.00 H new ATOM 0 HD22 ASN A 661 11.195 -2.796 -22.045 1.00 0.00 H new ATOM 1408 N ASN A 662 9.742 -4.219 -16.545 1.00 0.00 N ATOM 1409 CA ASN A 662 10.130 -4.753 -15.245 1.00 0.00 C ATOM 1410 C ASN A 662 9.393 -6.055 -14.942 1.00 0.00 C ATOM 1411 O ASN A 662 8.208 -6.196 -15.248 1.00 0.00 O ATOM 1412 CB ASN A 662 9.857 -3.725 -14.144 1.00 0.00 C ATOM 1413 CG ASN A 662 11.074 -3.470 -13.277 1.00 0.00 C ATOM 1414 OD1 ASN A 662 10.991 -3.488 -12.049 1.00 0.00 O ATOM 1415 ND2 ASN A 662 12.214 -3.228 -13.913 1.00 0.00 N ATOM 0 H ASN A 662 8.839 -3.746 -16.557 1.00 0.00 H new ATOM 0 HA ASN A 662 11.199 -4.966 -15.275 1.00 0.00 H new ATOM 0 HB2 ASN A 662 9.535 -2.788 -14.598 1.00 0.00 H new ATOM 0 HB3 ASN A 662 9.036 -4.076 -13.519 1.00 0.00 H new ATOM 0 HD21 ASN A 662 13.066 -3.048 -13.382 1.00 0.00 H new ATOM 0 HD22 ASN A 662 12.238 -3.223 -14.933 1.00 0.00 H new ATOM 1422 N ARG A 663 10.101 -7.000 -14.331 1.00 0.00 N ATOM 1423 CA ARG A 663 9.520 -8.291 -13.977 1.00 0.00 C ATOM 1424 C ARG A 663 9.005 -8.267 -12.543 1.00 0.00 C ATOM 1425 O ARG A 663 9.626 -7.668 -11.664 1.00 0.00 O ATOM 1426 CB ARG A 663 10.554 -9.407 -14.146 1.00 0.00 C ATOM 1427 CG ARG A 663 10.060 -10.772 -13.689 1.00 0.00 C ATOM 1428 CD ARG A 663 10.575 -11.885 -14.589 1.00 0.00 C ATOM 1429 NE ARG A 663 11.428 -12.824 -13.865 1.00 0.00 N ATOM 1430 CZ ARG A 663 12.191 -13.740 -14.457 1.00 0.00 C ATOM 1431 NH1 ARG A 663 12.211 -13.842 -15.779 1.00 0.00 N ATOM 1432 NH2 ARG A 663 12.938 -14.554 -13.724 1.00 0.00 N ATOM 0 H ARG A 663 11.081 -6.895 -14.070 1.00 0.00 H new ATOM 0 HA ARG A 663 8.682 -8.486 -14.647 1.00 0.00 H new ATOM 0 HB2 ARG A 663 10.842 -9.467 -15.195 1.00 0.00 H new ATOM 0 HB3 ARG A 663 11.451 -9.148 -13.583 1.00 0.00 H new ATOM 0 HG2 ARG A 663 10.385 -10.953 -12.664 1.00 0.00 H new ATOM 0 HG3 ARG A 663 8.970 -10.782 -13.684 1.00 0.00 H new ATOM 0 HD2 ARG A 663 9.730 -12.422 -15.021 1.00 0.00 H new ATOM 0 HD3 ARG A 663 11.135 -11.451 -15.418 1.00 0.00 H new ATOM 0 HE ARG A 663 11.440 -12.775 -12.846 1.00 0.00 H new ATOM 0 HH11 ARG A 663 11.640 -13.217 -16.347 1.00 0.00 H new ATOM 0 HH12 ARG A 663 12.798 -14.546 -16.227 1.00 0.00 H new ATOM 0 HH21 ARG A 663 12.928 -14.478 -12.707 1.00 0.00 H new ATOM 0 HH22 ARG A 663 13.523 -15.256 -14.177 1.00 0.00 H new ATOM 1446 N MET A 664 7.868 -8.913 -12.306 1.00 0.00 N ATOM 1447 CA MET A 664 7.286 -8.948 -10.974 1.00 0.00 C ATOM 1448 C MET A 664 6.754 -10.340 -10.642 1.00 0.00 C ATOM 1449 O MET A 664 6.221 -11.037 -11.506 1.00 0.00 O ATOM 1450 CB MET A 664 6.173 -7.905 -10.861 1.00 0.00 C ATOM 1451 CG MET A 664 4.939 -8.226 -11.688 1.00 0.00 C ATOM 1452 SD MET A 664 3.465 -7.381 -11.085 1.00 0.00 S ATOM 1453 CE MET A 664 4.125 -5.758 -10.724 1.00 0.00 C ATOM 0 H MET A 664 7.336 -9.416 -13.016 1.00 0.00 H new ATOM 0 HA MET A 664 8.067 -8.710 -10.252 1.00 0.00 H new ATOM 0 HB2 MET A 664 5.882 -7.811 -9.815 1.00 0.00 H new ATOM 0 HB3 MET A 664 6.564 -6.936 -11.172 1.00 0.00 H new ATOM 0 HG2 MET A 664 5.117 -7.943 -12.725 1.00 0.00 H new ATOM 0 HG3 MET A 664 4.767 -9.302 -11.676 1.00 0.00 H new ATOM 0 HE1 MET A 664 3.307 -5.075 -10.494 1.00 0.00 H new ATOM 0 HE2 MET A 664 4.797 -5.821 -9.868 1.00 0.00 H new ATOM 0 HE3 MET A 664 4.674 -5.388 -11.590 1.00 0.00 H new ATOM 1463 N ILE A 665 6.916 -10.740 -9.386 1.00 0.00 N ATOM 1464 CA ILE A 665 6.469 -12.051 -8.929 1.00 0.00 C ATOM 1465 C ILE A 665 5.306 -11.932 -7.950 1.00 0.00 C ATOM 1466 O ILE A 665 5.034 -10.856 -7.423 1.00 0.00 O ATOM 1467 CB ILE A 665 7.618 -12.814 -8.241 1.00 0.00 C ATOM 1468 CG1 ILE A 665 7.985 -12.134 -6.917 1.00 0.00 C ATOM 1469 CG2 ILE A 665 8.827 -12.889 -9.164 1.00 0.00 C ATOM 1470 CD1 ILE A 665 9.150 -12.784 -6.202 1.00 0.00 C ATOM 0 H ILE A 665 7.356 -10.172 -8.662 1.00 0.00 H new ATOM 0 HA ILE A 665 6.140 -12.600 -9.811 1.00 0.00 H new ATOM 0 HB ILE A 665 7.289 -13.831 -8.025 1.00 0.00 H new ATOM 0 HG12 ILE A 665 8.226 -11.089 -7.110 1.00 0.00 H new ATOM 0 HG13 ILE A 665 7.115 -12.144 -6.260 1.00 0.00 H new ATOM 0 HG21 ILE A 665 9.632 -13.430 -8.666 1.00 0.00 H new ATOM 0 HG22 ILE A 665 8.553 -13.410 -10.081 1.00 0.00 H new ATOM 0 HG23 ILE A 665 9.163 -11.881 -9.406 1.00 0.00 H new ATOM 0 HD11 ILE A 665 9.352 -12.249 -5.274 1.00 0.00 H new ATOM 0 HD12 ILE A 665 8.905 -13.822 -5.977 1.00 0.00 H new ATOM 0 HD13 ILE A 665 10.033 -12.750 -6.840 1.00 0.00 H new ATOM 1482 N GLN A 666 4.630 -13.048 -7.699 1.00 0.00 N ATOM 1483 CA GLN A 666 3.506 -13.064 -6.768 1.00 0.00 C ATOM 1484 C GLN A 666 3.867 -12.340 -5.473 1.00 0.00 C ATOM 1485 O GLN A 666 4.781 -12.744 -4.756 1.00 0.00 O ATOM 1486 CB GLN A 666 3.089 -14.504 -6.463 1.00 0.00 C ATOM 1487 CG GLN A 666 2.013 -14.606 -5.398 1.00 0.00 C ATOM 1488 CD GLN A 666 1.587 -16.033 -5.130 1.00 0.00 C ATOM 1489 OE1 GLN A 666 2.170 -16.724 -4.295 1.00 0.00 O ATOM 1490 NE2 GLN A 666 0.561 -16.481 -5.841 1.00 0.00 N ATOM 0 H GLN A 666 4.839 -13.951 -8.125 1.00 0.00 H new ATOM 0 HA GLN A 666 2.669 -12.544 -7.235 1.00 0.00 H new ATOM 0 HB2 GLN A 666 2.729 -14.972 -7.379 1.00 0.00 H new ATOM 0 HB3 GLN A 666 3.964 -15.067 -6.140 1.00 0.00 H new ATOM 0 HG2 GLN A 666 2.380 -14.161 -4.473 1.00 0.00 H new ATOM 0 HG3 GLN A 666 1.145 -14.025 -5.708 1.00 0.00 H new ATOM 0 HE21 GLN A 666 0.108 -15.872 -6.523 1.00 0.00 H new ATOM 0 HE22 GLN A 666 0.225 -17.435 -5.706 1.00 0.00 H new ATOM 1499 N GLY A 667 3.147 -11.260 -5.190 1.00 0.00 N ATOM 1500 CA GLY A 667 3.409 -10.486 -3.994 1.00 0.00 C ATOM 1501 C GLY A 667 4.197 -9.225 -4.291 1.00 0.00 C ATOM 1502 O GLY A 667 4.867 -8.680 -3.413 1.00 0.00 O ATOM 0 H GLY A 667 2.385 -10.907 -5.770 1.00 0.00 H new ATOM 0 HA2 GLY A 667 2.464 -10.219 -3.521 1.00 0.00 H new ATOM 0 HA3 GLY A 667 3.961 -11.098 -3.280 1.00 0.00 H new ATOM 1506 N THR A 668 4.120 -8.764 -5.537 1.00 0.00 N ATOM 1507 CA THR A 668 4.836 -7.562 -5.954 1.00 0.00 C ATOM 1508 C THR A 668 3.874 -6.422 -6.274 1.00 0.00 C ATOM 1509 O THR A 668 2.681 -6.643 -6.486 1.00 0.00 O ATOM 1510 CB THR A 668 5.706 -7.834 -7.193 1.00 0.00 C ATOM 1511 OG1 THR A 668 4.962 -8.597 -8.149 1.00 0.00 O ATOM 1512 CG2 THR A 668 6.976 -8.579 -6.811 1.00 0.00 C ATOM 0 H THR A 668 3.570 -9.204 -6.274 1.00 0.00 H new ATOM 0 HA THR A 668 5.472 -7.272 -5.118 1.00 0.00 H new ATOM 0 HB THR A 668 5.989 -6.878 -7.633 1.00 0.00 H new ATOM 0 HG1 THR A 668 5.207 -9.543 -8.075 1.00 0.00 H new ATOM 0 HG21 THR A 668 7.574 -8.760 -7.704 1.00 0.00 H new ATOM 0 HG22 THR A 668 7.550 -7.980 -6.104 1.00 0.00 H new ATOM 0 HG23 THR A 668 6.714 -9.532 -6.351 1.00 0.00 H new ATOM 1520 N LYS A 669 4.403 -5.202 -6.308 1.00 0.00 N ATOM 1521 CA LYS A 669 3.595 -4.023 -6.602 1.00 0.00 C ATOM 1522 C LYS A 669 4.305 -3.112 -7.601 1.00 0.00 C ATOM 1523 O LYS A 669 5.531 -2.993 -7.583 1.00 0.00 O ATOM 1524 CB LYS A 669 3.295 -3.255 -5.314 1.00 0.00 C ATOM 1525 CG LYS A 669 2.403 -2.041 -5.519 1.00 0.00 C ATOM 1526 CD LYS A 669 2.088 -1.354 -4.199 1.00 0.00 C ATOM 1527 CE LYS A 669 3.126 -0.296 -3.858 1.00 0.00 C ATOM 1528 NZ LYS A 669 3.955 -0.688 -2.686 1.00 0.00 N ATOM 0 H LYS A 669 5.389 -5.004 -6.135 1.00 0.00 H new ATOM 0 HA LYS A 669 2.657 -4.355 -7.046 1.00 0.00 H new ATOM 0 HB2 LYS A 669 2.818 -3.929 -4.602 1.00 0.00 H new ATOM 0 HB3 LYS A 669 4.235 -2.932 -4.867 1.00 0.00 H new ATOM 0 HG2 LYS A 669 2.894 -1.336 -6.190 1.00 0.00 H new ATOM 0 HG3 LYS A 669 1.475 -2.347 -6.002 1.00 0.00 H new ATOM 0 HD2 LYS A 669 1.102 -0.893 -4.254 1.00 0.00 H new ATOM 0 HD3 LYS A 669 2.049 -2.096 -3.402 1.00 0.00 H new ATOM 0 HE2 LYS A 669 3.772 -0.130 -4.720 1.00 0.00 H new ATOM 0 HE3 LYS A 669 2.625 0.649 -3.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 669 4.650 0.060 -2.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 669 3.342 -0.821 -1.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 669 4.453 -1.577 -2.895 1.00 0.00 H new ATOM 1542 N PHE A 670 3.529 -2.470 -8.471 1.00 0.00 N ATOM 1543 CA PHE A 670 4.087 -1.570 -9.477 1.00 0.00 C ATOM 1544 C PHE A 670 3.141 -0.401 -9.749 1.00 0.00 C ATOM 1545 O PHE A 670 1.939 -0.593 -9.916 1.00 0.00 O ATOM 1546 CB PHE A 670 4.352 -2.327 -10.783 1.00 0.00 C ATOM 1547 CG PHE A 670 5.558 -1.847 -11.547 1.00 0.00 C ATOM 1548 CD1 PHE A 670 6.152 -0.629 -11.253 1.00 0.00 C ATOM 1549 CD2 PHE A 670 6.091 -2.613 -12.570 1.00 0.00 C ATOM 1550 CE1 PHE A 670 7.250 -0.188 -11.959 1.00 0.00 C ATOM 1551 CE2 PHE A 670 7.190 -2.174 -13.284 1.00 0.00 C ATOM 1552 CZ PHE A 670 7.770 -0.960 -12.977 1.00 0.00 C ATOM 0 H PHE A 670 2.513 -2.556 -8.500 1.00 0.00 H new ATOM 0 HA PHE A 670 5.027 -1.178 -9.089 1.00 0.00 H new ATOM 0 HB2 PHE A 670 4.479 -3.386 -10.556 1.00 0.00 H new ATOM 0 HB3 PHE A 670 3.474 -2.241 -11.423 1.00 0.00 H new ATOM 0 HD1 PHE A 670 5.748 -0.017 -10.460 1.00 0.00 H new ATOM 0 HD2 PHE A 670 5.643 -3.565 -12.813 1.00 0.00 H new ATOM 0 HE1 PHE A 670 7.703 0.762 -11.715 1.00 0.00 H new ATOM 0 HE2 PHE A 670 7.594 -2.780 -14.081 1.00 0.00 H new ATOM 0 HZ PHE A 670 8.629 -0.615 -13.533 1.00 0.00 H new ATOM 1562 N LEU A 671 3.690 0.808 -9.798 1.00 0.00 N ATOM 1563 CA LEU A 671 2.889 1.998 -10.055 1.00 0.00 C ATOM 1564 C LEU A 671 2.369 2.001 -11.489 1.00 0.00 C ATOM 1565 O LEU A 671 3.079 1.612 -12.417 1.00 0.00 O ATOM 1566 CB LEU A 671 3.723 3.262 -9.806 1.00 0.00 C ATOM 1567 CG LEU A 671 3.164 4.251 -8.772 1.00 0.00 C ATOM 1568 CD1 LEU A 671 3.533 5.671 -9.155 1.00 0.00 C ATOM 1569 CD2 LEU A 671 1.656 4.125 -8.632 1.00 0.00 C ATOM 0 H LEU A 671 4.685 0.989 -9.663 1.00 0.00 H new ATOM 0 HA LEU A 671 2.038 1.988 -9.374 1.00 0.00 H new ATOM 0 HB2 LEU A 671 4.719 2.957 -9.485 1.00 0.00 H new ATOM 0 HB3 LEU A 671 3.840 3.787 -10.754 1.00 0.00 H new ATOM 0 HG LEU A 671 3.610 4.008 -7.807 1.00 0.00 H new ATOM 0 HD11 LEU A 671 3.132 6.363 -8.415 1.00 0.00 H new ATOM 0 HD12 LEU A 671 4.618 5.768 -9.191 1.00 0.00 H new ATOM 0 HD13 LEU A 671 3.115 5.904 -10.134 1.00 0.00 H new ATOM 0 HD21 LEU A 671 1.298 4.841 -7.892 1.00 0.00 H new ATOM 0 HD22 LEU A 671 1.183 4.329 -9.593 1.00 0.00 H new ATOM 0 HD23 LEU A 671 1.404 3.114 -8.311 1.00 0.00 H new ATOM 1581 N LEU A 672 1.126 2.435 -11.661 1.00 0.00 N ATOM 1582 CA LEU A 672 0.513 2.479 -12.984 1.00 0.00 C ATOM 1583 C LEU A 672 0.321 3.913 -13.476 1.00 0.00 C ATOM 1584 O LEU A 672 -0.342 4.726 -12.832 1.00 0.00 O ATOM 1585 CB LEU A 672 -0.835 1.751 -12.973 1.00 0.00 C ATOM 1586 CG LEU A 672 -0.767 0.230 -12.777 1.00 0.00 C ATOM 1587 CD1 LEU A 672 -2.038 -0.424 -13.292 1.00 0.00 C ATOM 1588 CD2 LEU A 672 0.449 -0.359 -13.478 1.00 0.00 C ATOM 0 H LEU A 672 0.524 2.760 -10.904 1.00 0.00 H new ATOM 0 HA LEU A 672 1.193 1.976 -13.672 1.00 0.00 H new ATOM 0 HB2 LEU A 672 -1.450 2.174 -12.179 1.00 0.00 H new ATOM 0 HB3 LEU A 672 -1.345 1.955 -13.914 1.00 0.00 H new ATOM 0 HG LEU A 672 -0.673 0.030 -11.710 1.00 0.00 H new ATOM 0 HD11 LEU A 672 -1.977 -1.503 -13.147 1.00 0.00 H new ATOM 0 HD12 LEU A 672 -2.896 -0.033 -12.745 1.00 0.00 H new ATOM 0 HD13 LEU A 672 -2.155 -0.207 -14.354 1.00 0.00 H new ATOM 0 HD21 LEU A 672 0.472 -1.438 -13.322 1.00 0.00 H new ATOM 0 HD22 LEU A 672 0.391 -0.148 -14.546 1.00 0.00 H new ATOM 0 HD23 LEU A 672 1.356 0.086 -13.069 1.00 0.00 H new ATOM 1600 N GLN A 673 0.903 4.199 -14.635 1.00 0.00 N ATOM 1601 CA GLN A 673 0.810 5.513 -15.264 1.00 0.00 C ATOM 1602 C GLN A 673 -0.174 5.454 -16.430 1.00 0.00 C ATOM 1603 O GLN A 673 -0.166 4.493 -17.199 1.00 0.00 O ATOM 1604 CB GLN A 673 2.192 5.931 -15.770 1.00 0.00 C ATOM 1605 CG GLN A 673 3.282 5.790 -14.725 1.00 0.00 C ATOM 1606 CD GLN A 673 4.671 5.870 -15.321 1.00 0.00 C ATOM 1607 OE1 GLN A 673 5.649 5.332 -14.605 1.00 0.00 O flip ATOM 1608 NE2 GLN A 673 4.863 6.408 -16.411 1.00 0.00 N flip ATOM 0 H GLN A 673 1.454 3.525 -15.167 1.00 0.00 H new ATOM 0 HA GLN A 673 0.456 6.243 -14.536 1.00 0.00 H new ATOM 0 HB2 GLN A 673 2.451 5.326 -16.639 1.00 0.00 H new ATOM 0 HB3 GLN A 673 2.151 6.968 -16.104 1.00 0.00 H new ATOM 0 HG2 GLN A 673 3.166 6.573 -13.976 1.00 0.00 H new ATOM 0 HG3 GLN A 673 3.166 4.836 -14.210 1.00 0.00 H new ATOM 0 HE21 GLN A 673 4.080 6.809 -16.927 1.00 0.00 H new ATOM 0 HE22 GLN A 673 5.805 6.453 -16.799 1.00 0.00 H new ATOM 1617 N ASP A 674 -1.021 6.473 -16.562 1.00 0.00 N ATOM 1618 CA ASP A 674 -2.008 6.516 -17.643 1.00 0.00 C ATOM 1619 C ASP A 674 -1.406 6.016 -18.954 1.00 0.00 C ATOM 1620 O ASP A 674 -0.558 6.676 -19.554 1.00 0.00 O ATOM 1621 CB ASP A 674 -2.545 7.939 -17.818 1.00 0.00 C ATOM 1622 CG ASP A 674 -3.573 8.040 -18.927 1.00 0.00 C ATOM 1623 OD1 ASP A 674 -3.171 8.052 -20.110 1.00 0.00 O ATOM 1624 OD2 ASP A 674 -4.780 8.109 -18.614 1.00 0.00 O ATOM 0 H ASP A 674 -1.045 7.278 -15.937 1.00 0.00 H new ATOM 0 HA ASP A 674 -2.833 5.857 -17.373 1.00 0.00 H new ATOM 0 HB2 ASP A 674 -2.992 8.273 -16.882 1.00 0.00 H new ATOM 0 HB3 ASP A 674 -1.716 8.613 -18.033 1.00 0.00 H new ATOM 1629 N GLY A 675 -1.839 4.834 -19.373 1.00 0.00 N ATOM 1630 CA GLY A 675 -1.323 4.243 -20.589 1.00 0.00 C ATOM 1631 C GLY A 675 -0.252 3.218 -20.289 1.00 0.00 C ATOM 1632 O GLY A 675 0.722 3.082 -21.030 1.00 0.00 O ATOM 0 H GLY A 675 -2.541 4.274 -18.889 1.00 0.00 H new ATOM 0 HA2 GLY A 675 -2.136 3.772 -21.141 1.00 0.00 H new ATOM 0 HA3 GLY A 675 -0.913 5.024 -21.230 1.00 0.00 H new ATOM 1636 N ASP A 676 -0.437 2.501 -19.184 1.00 0.00 N ATOM 1637 CA ASP A 676 0.516 1.481 -18.758 1.00 0.00 C ATOM 1638 C ASP A 676 0.091 0.102 -19.236 1.00 0.00 C ATOM 1639 O ASP A 676 -1.001 -0.365 -18.919 1.00 0.00 O ATOM 1640 CB ASP A 676 0.646 1.478 -17.233 1.00 0.00 C ATOM 1641 CG ASP A 676 2.076 1.264 -16.772 1.00 0.00 C ATOM 1642 OD1 ASP A 676 2.996 1.406 -17.604 1.00 0.00 O ATOM 1643 OD2 ASP A 676 2.275 0.955 -15.579 1.00 0.00 O ATOM 0 H ASP A 676 -1.241 2.608 -18.566 1.00 0.00 H new ATOM 0 HA ASP A 676 1.482 1.721 -19.203 1.00 0.00 H new ATOM 0 HB2 ASP A 676 0.278 2.425 -16.838 1.00 0.00 H new ATOM 0 HB3 ASP A 676 0.013 0.693 -16.819 1.00 0.00 H new ATOM 1648 N GLU A 677 0.963 -0.559 -19.985 1.00 0.00 N ATOM 1649 CA GLU A 677 0.664 -1.892 -20.482 1.00 0.00 C ATOM 1650 C GLU A 677 1.270 -2.934 -19.553 1.00 0.00 C ATOM 1651 O GLU A 677 2.490 -3.095 -19.495 1.00 0.00 O ATOM 1652 CB GLU A 677 1.204 -2.071 -21.903 1.00 0.00 C ATOM 1653 CG GLU A 677 0.314 -2.930 -22.788 1.00 0.00 C ATOM 1654 CD GLU A 677 0.066 -2.304 -24.147 1.00 0.00 C ATOM 1655 OE1 GLU A 677 -0.715 -1.331 -24.219 1.00 0.00 O ATOM 1656 OE2 GLU A 677 0.650 -2.787 -25.139 1.00 0.00 O ATOM 0 H GLU A 677 1.876 -0.196 -20.259 1.00 0.00 H new ATOM 0 HA GLU A 677 -0.418 -2.022 -20.509 1.00 0.00 H new ATOM 0 HB2 GLU A 677 1.323 -1.090 -22.364 1.00 0.00 H new ATOM 0 HB3 GLU A 677 2.195 -2.522 -21.852 1.00 0.00 H new ATOM 0 HG2 GLU A 677 0.776 -3.908 -22.921 1.00 0.00 H new ATOM 0 HG3 GLU A 677 -0.640 -3.094 -22.288 1.00 0.00 H new ATOM 1663 N ILE A 678 0.415 -3.623 -18.805 1.00 0.00 N ATOM 1664 CA ILE A 678 0.874 -4.626 -17.854 1.00 0.00 C ATOM 1665 C ILE A 678 0.596 -6.046 -18.337 1.00 0.00 C ATOM 1666 O ILE A 678 -0.518 -6.374 -18.745 1.00 0.00 O ATOM 1667 CB ILE A 678 0.219 -4.418 -16.467 1.00 0.00 C ATOM 1668 CG1 ILE A 678 -1.203 -4.992 -16.435 1.00 0.00 C ATOM 1669 CG2 ILE A 678 0.198 -2.938 -16.100 1.00 0.00 C ATOM 1670 CD1 ILE A 678 -1.899 -4.798 -15.106 1.00 0.00 C ATOM 0 H ILE A 678 -0.598 -3.505 -18.839 1.00 0.00 H new ATOM 0 HA ILE A 678 1.953 -4.500 -17.768 1.00 0.00 H new ATOM 0 HB ILE A 678 0.819 -4.953 -15.731 1.00 0.00 H new ATOM 0 HG12 ILE A 678 -1.795 -4.520 -17.219 1.00 0.00 H new ATOM 0 HG13 ILE A 678 -1.162 -6.057 -16.663 1.00 0.00 H new ATOM 0 HG21 ILE A 678 -0.266 -2.812 -15.122 1.00 0.00 H new ATOM 0 HG22 ILE A 678 1.219 -2.556 -16.069 1.00 0.00 H new ATOM 0 HG23 ILE A 678 -0.373 -2.386 -16.846 1.00 0.00 H new ATOM 0 HD11 ILE A 678 -2.900 -5.227 -15.153 1.00 0.00 H new ATOM 0 HD12 ILE A 678 -1.328 -5.294 -14.321 1.00 0.00 H new ATOM 0 HD13 ILE A 678 -1.971 -3.733 -14.885 1.00 0.00 H new ATOM 1682 N LYS A 679 1.618 -6.888 -18.253 1.00 0.00 N ATOM 1683 CA LYS A 679 1.502 -8.286 -18.642 1.00 0.00 C ATOM 1684 C LYS A 679 1.417 -9.143 -17.390 1.00 0.00 C ATOM 1685 O LYS A 679 2.252 -9.028 -16.499 1.00 0.00 O ATOM 1686 CB LYS A 679 2.702 -8.710 -19.493 1.00 0.00 C ATOM 1687 CG LYS A 679 2.597 -8.281 -20.947 1.00 0.00 C ATOM 1688 CD LYS A 679 3.217 -9.312 -21.877 1.00 0.00 C ATOM 1689 CE LYS A 679 4.695 -9.037 -22.109 1.00 0.00 C ATOM 1690 NZ LYS A 679 5.018 -8.923 -23.559 1.00 0.00 N ATOM 0 H LYS A 679 2.544 -6.623 -17.916 1.00 0.00 H new ATOM 0 HA LYS A 679 0.600 -8.419 -19.240 1.00 0.00 H new ATOM 0 HB2 LYS A 679 3.610 -8.287 -19.063 1.00 0.00 H new ATOM 0 HB3 LYS A 679 2.803 -9.794 -19.449 1.00 0.00 H new ATOM 0 HG2 LYS A 679 1.549 -8.135 -21.210 1.00 0.00 H new ATOM 0 HG3 LYS A 679 3.096 -7.321 -21.081 1.00 0.00 H new ATOM 0 HD2 LYS A 679 3.094 -10.308 -21.452 1.00 0.00 H new ATOM 0 HD3 LYS A 679 2.691 -9.306 -22.831 1.00 0.00 H new ATOM 0 HE2 LYS A 679 4.977 -8.115 -21.601 1.00 0.00 H new ATOM 0 HE3 LYS A 679 5.287 -9.838 -21.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 679 6.031 -8.719 -23.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 679 4.789 -9.818 -24.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 679 4.460 -8.153 -23.980 1.00 0.00 H new ATOM 1704 N ILE A 680 0.399 -9.984 -17.308 1.00 0.00 N ATOM 1705 CA ILE A 680 0.229 -10.825 -16.134 1.00 0.00 C ATOM 1706 C ILE A 680 0.841 -12.208 -16.336 1.00 0.00 C ATOM 1707 O ILE A 680 1.215 -12.873 -15.371 1.00 0.00 O ATOM 1708 CB ILE A 680 -1.256 -10.975 -15.720 1.00 0.00 C ATOM 1709 CG1 ILE A 680 -2.166 -10.043 -16.533 1.00 0.00 C ATOM 1710 CG2 ILE A 680 -1.406 -10.687 -14.236 1.00 0.00 C ATOM 1711 CD1 ILE A 680 -3.607 -10.029 -16.057 1.00 0.00 C ATOM 0 H ILE A 680 -0.313 -10.102 -18.029 1.00 0.00 H new ATOM 0 HA ILE A 680 0.757 -10.316 -15.328 1.00 0.00 H new ATOM 0 HB ILE A 680 -1.563 -12.000 -15.927 1.00 0.00 H new ATOM 0 HG12 ILE A 680 -1.768 -9.030 -16.487 1.00 0.00 H new ATOM 0 HG13 ILE A 680 -2.141 -10.348 -17.579 1.00 0.00 H new ATOM 0 HG21 ILE A 680 -2.452 -10.794 -13.949 1.00 0.00 H new ATOM 0 HG22 ILE A 680 -0.800 -11.391 -13.666 1.00 0.00 H new ATOM 0 HG23 ILE A 680 -1.074 -9.670 -14.027 1.00 0.00 H new ATOM 0 HD11 ILE A 680 -4.189 -9.349 -16.679 1.00 0.00 H new ATOM 0 HD12 ILE A 680 -4.024 -11.033 -16.130 1.00 0.00 H new ATOM 0 HD13 ILE A 680 -3.644 -9.695 -15.020 1.00 0.00 H new ATOM 1723 N ILE A 681 0.950 -12.639 -17.589 1.00 0.00 N ATOM 1724 CA ILE A 681 1.532 -13.946 -17.884 1.00 0.00 C ATOM 1725 C ILE A 681 2.113 -14.003 -19.296 1.00 0.00 C ATOM 1726 O ILE A 681 1.461 -13.619 -20.267 1.00 0.00 O ATOM 1727 CB ILE A 681 0.495 -15.076 -17.703 1.00 0.00 C ATOM 1728 CG1 ILE A 681 1.106 -16.434 -18.056 1.00 0.00 C ATOM 1729 CG2 ILE A 681 -0.742 -14.811 -18.546 1.00 0.00 C ATOM 1730 CD1 ILE A 681 0.426 -17.597 -17.369 1.00 0.00 C ATOM 0 H ILE A 681 0.648 -12.111 -18.408 1.00 0.00 H new ATOM 0 HA ILE A 681 2.344 -14.094 -17.172 1.00 0.00 H new ATOM 0 HB ILE A 681 0.196 -15.098 -16.655 1.00 0.00 H new ATOM 0 HG12 ILE A 681 1.053 -16.578 -19.135 1.00 0.00 H new ATOM 0 HG13 ILE A 681 2.162 -16.430 -17.786 1.00 0.00 H new ATOM 0 HG21 ILE A 681 -1.459 -15.619 -18.403 1.00 0.00 H new ATOM 0 HG22 ILE A 681 -1.194 -13.867 -18.242 1.00 0.00 H new ATOM 0 HG23 ILE A 681 -0.461 -14.757 -19.598 1.00 0.00 H new ATOM 0 HD11 ILE A 681 0.910 -18.528 -17.665 1.00 0.00 H new ATOM 0 HD12 ILE A 681 0.502 -17.476 -16.288 1.00 0.00 H new ATOM 0 HD13 ILE A 681 -0.625 -17.627 -17.658 1.00 0.00 H new ATOM 1742 N TRP A 682 3.347 -14.492 -19.396 1.00 0.00 N ATOM 1743 CA TRP A 682 4.028 -14.612 -20.681 1.00 0.00 C ATOM 1744 C TRP A 682 4.746 -15.958 -20.790 1.00 0.00 C ATOM 1745 O TRP A 682 5.544 -16.314 -19.924 1.00 0.00 O ATOM 1746 CB TRP A 682 5.027 -13.461 -20.859 1.00 0.00 C ATOM 1747 CG TRP A 682 6.017 -13.684 -21.964 1.00 0.00 C ATOM 1748 CD1 TRP A 682 5.824 -14.414 -23.102 1.00 0.00 C ATOM 1749 CD2 TRP A 682 7.355 -13.178 -22.033 1.00 0.00 C ATOM 1750 NE1 TRP A 682 6.961 -14.395 -23.872 1.00 0.00 N ATOM 1751 CE2 TRP A 682 7.915 -13.641 -23.239 1.00 0.00 C ATOM 1752 CE3 TRP A 682 8.133 -12.377 -21.193 1.00 0.00 C ATOM 1753 CZ2 TRP A 682 9.216 -13.330 -23.624 1.00 0.00 C ATOM 1754 CZ3 TRP A 682 9.425 -12.068 -21.576 1.00 0.00 C ATOM 1755 CH2 TRP A 682 9.955 -12.544 -22.783 1.00 0.00 C ATOM 0 H TRP A 682 3.897 -14.812 -18.599 1.00 0.00 H new ATOM 0 HA TRP A 682 3.281 -14.557 -21.473 1.00 0.00 H new ATOM 0 HB2 TRP A 682 4.476 -12.542 -21.057 1.00 0.00 H new ATOM 0 HB3 TRP A 682 5.567 -13.313 -19.924 1.00 0.00 H new ATOM 0 HD1 TRP A 682 4.911 -14.931 -23.359 1.00 0.00 H new ATOM 0 HE1 TRP A 682 7.077 -14.866 -24.769 1.00 0.00 H new ATOM 0 HE3 TRP A 682 7.732 -12.006 -20.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 682 9.627 -13.696 -24.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 682 10.036 -11.450 -20.935 1.00 0.00 H new ATOM 0 HH2 TRP A 682 10.968 -12.285 -23.055 1.00 0.00 H new ATOM 1766 N ASP A 683 4.470 -16.696 -21.862 1.00 0.00 N ATOM 1767 CA ASP A 683 5.108 -17.991 -22.079 1.00 0.00 C ATOM 1768 C ASP A 683 5.967 -17.963 -23.340 1.00 0.00 C ATOM 1769 O ASP A 683 5.460 -17.767 -24.445 1.00 0.00 O ATOM 1770 CB ASP A 683 4.053 -19.094 -22.187 1.00 0.00 C ATOM 1771 CG ASP A 683 3.319 -19.321 -20.881 1.00 0.00 C ATOM 1772 OD1 ASP A 683 2.959 -18.324 -20.221 1.00 0.00 O ATOM 1773 OD2 ASP A 683 3.104 -20.497 -20.518 1.00 0.00 O ATOM 0 H ASP A 683 3.812 -16.421 -22.591 1.00 0.00 H new ATOM 0 HA ASP A 683 5.751 -18.202 -21.225 1.00 0.00 H new ATOM 0 HB2 ASP A 683 3.335 -18.831 -22.963 1.00 0.00 H new ATOM 0 HB3 ASP A 683 4.532 -20.022 -22.497 1.00 0.00 H new ATOM 1778 N LYS A 684 7.270 -18.155 -23.163 1.00 0.00 N ATOM 1779 CA LYS A 684 8.209 -18.148 -24.280 1.00 0.00 C ATOM 1780 C LYS A 684 7.989 -19.335 -25.216 1.00 0.00 C ATOM 1781 O LYS A 684 7.969 -19.177 -26.437 1.00 0.00 O ATOM 1782 CB LYS A 684 9.646 -18.156 -23.758 1.00 0.00 C ATOM 1783 CG LYS A 684 10.232 -16.766 -23.566 1.00 0.00 C ATOM 1784 CD LYS A 684 11.486 -16.565 -24.401 1.00 0.00 C ATOM 1785 CE LYS A 684 12.431 -15.565 -23.756 1.00 0.00 C ATOM 1786 NZ LYS A 684 13.581 -15.235 -24.643 1.00 0.00 N ATOM 0 H LYS A 684 7.701 -18.318 -22.253 1.00 0.00 H new ATOM 0 HA LYS A 684 8.033 -17.237 -24.852 1.00 0.00 H new ATOM 0 HB2 LYS A 684 9.675 -18.688 -22.807 1.00 0.00 H new ATOM 0 HB3 LYS A 684 10.273 -18.713 -24.454 1.00 0.00 H new ATOM 0 HG2 LYS A 684 9.489 -16.017 -23.839 1.00 0.00 H new ATOM 0 HG3 LYS A 684 10.467 -16.612 -22.513 1.00 0.00 H new ATOM 0 HD2 LYS A 684 11.996 -17.520 -24.528 1.00 0.00 H new ATOM 0 HD3 LYS A 684 11.210 -16.216 -25.396 1.00 0.00 H new ATOM 0 HE2 LYS A 684 11.885 -14.653 -23.515 1.00 0.00 H new ATOM 0 HE3 LYS A 684 12.803 -15.972 -22.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 684 14.202 -14.550 -24.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 684 14.117 -16.101 -24.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 684 13.228 -14.823 -25.530 1.00 0.00 H new ATOM 1800 N ASN A 685 7.845 -20.524 -24.639 1.00 0.00 N ATOM 1801 CA ASN A 685 7.651 -21.738 -25.428 1.00 0.00 C ATOM 1802 C ASN A 685 6.205 -21.880 -25.894 1.00 0.00 C ATOM 1803 O ASN A 685 5.948 -22.288 -27.027 1.00 0.00 O ATOM 1804 CB ASN A 685 8.053 -22.968 -24.612 1.00 0.00 C ATOM 1805 CG ASN A 685 9.405 -22.804 -23.946 1.00 0.00 C ATOM 1806 OD1 ASN A 685 10.442 -23.100 -24.540 1.00 0.00 O ATOM 1807 ND2 ASN A 685 9.401 -22.331 -22.705 1.00 0.00 N ATOM 0 H ASN A 685 7.859 -20.674 -23.630 1.00 0.00 H new ATOM 0 HA ASN A 685 8.286 -21.662 -26.311 1.00 0.00 H new ATOM 0 HB2 ASN A 685 7.297 -23.158 -23.850 1.00 0.00 H new ATOM 0 HB3 ASN A 685 8.076 -23.841 -25.264 1.00 0.00 H new ATOM 0 HD21 ASN A 685 10.281 -22.200 -22.206 1.00 0.00 H new ATOM 0 HD22 ASN A 685 8.518 -22.099 -22.251 1.00 0.00 H new ATOM 1814 N ASN A 686 5.266 -21.550 -25.016 1.00 0.00 N ATOM 1815 CA ASN A 686 3.848 -21.652 -25.346 1.00 0.00 C ATOM 1816 C ASN A 686 3.384 -20.456 -26.175 1.00 0.00 C ATOM 1817 O ASN A 686 2.356 -20.520 -26.848 1.00 0.00 O ATOM 1818 CB ASN A 686 3.015 -21.758 -24.067 1.00 0.00 C ATOM 1819 CG ASN A 686 2.063 -22.938 -24.095 1.00 0.00 C ATOM 1820 OD1 ASN A 686 2.275 -23.904 -24.827 1.00 0.00 O ATOM 1821 ND2 ASN A 686 1.006 -22.866 -23.293 1.00 0.00 N ATOM 0 H ASN A 686 5.458 -21.211 -24.074 1.00 0.00 H new ATOM 0 HA ASN A 686 3.706 -22.553 -25.943 1.00 0.00 H new ATOM 0 HB2 ASN A 686 3.681 -21.852 -23.209 1.00 0.00 H new ATOM 0 HB3 ASN A 686 2.446 -20.838 -23.930 1.00 0.00 H new ATOM 0 HD21 ASN A 686 0.332 -23.631 -23.268 1.00 0.00 H new ATOM 0 HD22 ASN A 686 0.869 -22.046 -22.702 1.00 0.00 H new ATOM 1828 N LYS A 687 4.142 -19.364 -26.116 1.00 0.00 N ATOM 1829 CA LYS A 687 3.799 -18.154 -26.858 1.00 0.00 C ATOM 1830 C LYS A 687 2.524 -17.515 -26.314 1.00 0.00 C ATOM 1831 O LYS A 687 1.997 -16.571 -26.902 1.00 0.00 O ATOM 1832 CB LYS A 687 3.636 -18.464 -28.348 1.00 0.00 C ATOM 1833 CG LYS A 687 4.250 -17.411 -29.258 1.00 0.00 C ATOM 1834 CD LYS A 687 3.197 -16.453 -29.793 1.00 0.00 C ATOM 1835 CE LYS A 687 2.898 -16.715 -31.261 1.00 0.00 C ATOM 1836 NZ LYS A 687 1.826 -15.822 -31.778 1.00 0.00 N ATOM 0 H LYS A 687 4.996 -19.292 -25.563 1.00 0.00 H new ATOM 0 HA LYS A 687 4.617 -17.445 -26.732 1.00 0.00 H new ATOM 0 HB2 LYS A 687 4.094 -19.430 -28.562 1.00 0.00 H new ATOM 0 HB3 LYS A 687 2.575 -18.557 -28.578 1.00 0.00 H new ATOM 0 HG2 LYS A 687 5.007 -16.851 -28.709 1.00 0.00 H new ATOM 0 HG3 LYS A 687 4.756 -17.899 -30.091 1.00 0.00 H new ATOM 0 HD2 LYS A 687 2.281 -16.555 -29.210 1.00 0.00 H new ATOM 0 HD3 LYS A 687 3.541 -15.426 -29.668 1.00 0.00 H new ATOM 0 HE2 LYS A 687 3.805 -16.570 -31.848 1.00 0.00 H new ATOM 0 HE3 LYS A 687 2.598 -17.755 -31.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 687 1.653 -16.033 -32.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 687 0.953 -15.978 -31.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 687 2.123 -14.830 -31.679 1.00 0.00 H new ATOM 1850 N PHE A 688 2.040 -18.017 -25.179 1.00 0.00 N ATOM 1851 CA PHE A 688 0.843 -17.467 -24.565 1.00 0.00 C ATOM 1852 C PHE A 688 1.196 -16.165 -23.860 1.00 0.00 C ATOM 1853 O PHE A 688 1.820 -16.171 -22.799 1.00 0.00 O ATOM 1854 CB PHE A 688 0.235 -18.468 -23.575 1.00 0.00 C ATOM 1855 CG PHE A 688 -0.702 -17.844 -22.577 1.00 0.00 C ATOM 1856 CD1 PHE A 688 -1.588 -16.852 -22.964 1.00 0.00 C ATOM 1857 CD2 PHE A 688 -0.689 -18.245 -21.251 1.00 0.00 C ATOM 1858 CE1 PHE A 688 -2.445 -16.272 -22.048 1.00 0.00 C ATOM 1859 CE2 PHE A 688 -1.544 -17.671 -20.330 1.00 0.00 C ATOM 1860 CZ PHE A 688 -2.422 -16.682 -20.729 1.00 0.00 C ATOM 0 H PHE A 688 2.458 -18.798 -24.673 1.00 0.00 H new ATOM 0 HA PHE A 688 0.101 -17.269 -25.338 1.00 0.00 H new ATOM 0 HB2 PHE A 688 -0.302 -19.235 -24.133 1.00 0.00 H new ATOM 0 HB3 PHE A 688 1.041 -18.969 -23.039 1.00 0.00 H new ATOM 0 HD1 PHE A 688 -1.609 -16.528 -23.994 1.00 0.00 H new ATOM 0 HD2 PHE A 688 -0.002 -19.016 -20.933 1.00 0.00 H new ATOM 0 HE1 PHE A 688 -3.131 -15.500 -22.363 1.00 0.00 H new ATOM 0 HE2 PHE A 688 -1.526 -17.995 -19.300 1.00 0.00 H new ATOM 0 HZ PHE A 688 -3.090 -16.230 -20.011 1.00 0.00 H new ATOM 1870 N VAL A 689 0.809 -15.052 -24.464 1.00 0.00 N ATOM 1871 CA VAL A 689 1.104 -13.746 -23.902 1.00 0.00 C ATOM 1872 C VAL A 689 -0.173 -12.967 -23.600 1.00 0.00 C ATOM 1873 O VAL A 689 -0.986 -12.716 -24.489 1.00 0.00 O ATOM 1874 CB VAL A 689 2.016 -12.936 -24.852 1.00 0.00 C ATOM 1875 CG1 VAL A 689 1.213 -12.195 -25.911 1.00 0.00 C ATOM 1876 CG2 VAL A 689 2.891 -11.977 -24.063 1.00 0.00 C ATOM 0 H VAL A 689 0.291 -15.028 -25.342 1.00 0.00 H new ATOM 0 HA VAL A 689 1.631 -13.904 -22.961 1.00 0.00 H new ATOM 0 HB VAL A 689 2.661 -13.644 -25.373 1.00 0.00 H new ATOM 0 HG11 VAL A 689 1.891 -11.638 -26.558 1.00 0.00 H new ATOM 0 HG12 VAL A 689 0.649 -12.912 -26.508 1.00 0.00 H new ATOM 0 HG13 VAL A 689 0.523 -11.503 -25.427 1.00 0.00 H new ATOM 0 HG21 VAL A 689 3.526 -11.416 -24.749 1.00 0.00 H new ATOM 0 HG22 VAL A 689 2.261 -11.286 -23.504 1.00 0.00 H new ATOM 0 HG23 VAL A 689 3.515 -12.541 -23.370 1.00 0.00 H new ATOM 1886 N ILE A 690 -0.339 -12.583 -22.341 1.00 0.00 N ATOM 1887 CA ILE A 690 -1.511 -11.828 -21.926 1.00 0.00 C ATOM 1888 C ILE A 690 -1.098 -10.485 -21.329 1.00 0.00 C ATOM 1889 O ILE A 690 -0.342 -10.429 -20.358 1.00 0.00 O ATOM 1890 CB ILE A 690 -2.382 -12.627 -20.922 1.00 0.00 C ATOM 1891 CG1 ILE A 690 -3.867 -12.378 -21.195 1.00 0.00 C ATOM 1892 CG2 ILE A 690 -2.044 -12.276 -19.479 1.00 0.00 C ATOM 1893 CD1 ILE A 690 -4.788 -13.108 -20.241 1.00 0.00 C ATOM 0 H ILE A 690 0.323 -12.782 -21.591 1.00 0.00 H new ATOM 0 HA ILE A 690 -2.117 -11.646 -22.813 1.00 0.00 H new ATOM 0 HB ILE A 690 -2.164 -13.686 -21.064 1.00 0.00 H new ATOM 0 HG12 ILE A 690 -4.065 -11.308 -21.131 1.00 0.00 H new ATOM 0 HG13 ILE A 690 -4.097 -12.685 -22.215 1.00 0.00 H new ATOM 0 HG21 ILE A 690 -2.675 -12.856 -18.806 1.00 0.00 H new ATOM 0 HG22 ILE A 690 -0.997 -12.507 -19.284 1.00 0.00 H new ATOM 0 HG23 ILE A 690 -2.218 -11.213 -19.313 1.00 0.00 H new ATOM 0 HD11 ILE A 690 -5.825 -12.885 -20.494 1.00 0.00 H new ATOM 0 HD12 ILE A 690 -4.618 -14.182 -20.321 1.00 0.00 H new ATOM 0 HD13 ILE A 690 -4.586 -12.784 -19.220 1.00 0.00 H new ATOM 1905 N GLY A 691 -1.589 -9.407 -21.923 1.00 0.00 N ATOM 1906 CA GLY A 691 -1.254 -8.084 -21.443 1.00 0.00 C ATOM 1907 C GLY A 691 -2.436 -7.144 -21.479 1.00 0.00 C ATOM 1908 O GLY A 691 -3.201 -7.132 -22.444 1.00 0.00 O ATOM 0 H GLY A 691 -2.214 -9.426 -22.729 1.00 0.00 H new ATOM 0 HA2 GLY A 691 -0.880 -8.155 -20.422 1.00 0.00 H new ATOM 0 HA3 GLY A 691 -0.447 -7.673 -22.050 1.00 0.00 H new ATOM 1912 N PHE A 692 -2.586 -6.350 -20.426 1.00 0.00 N ATOM 1913 CA PHE A 692 -3.683 -5.398 -20.339 1.00 0.00 C ATOM 1914 C PHE A 692 -3.144 -3.974 -20.382 1.00 0.00 C ATOM 1915 O PHE A 692 -2.084 -3.684 -19.827 1.00 0.00 O ATOM 1916 CB PHE A 692 -4.485 -5.615 -19.047 1.00 0.00 C ATOM 1917 CG PHE A 692 -5.015 -7.016 -18.865 1.00 0.00 C ATOM 1918 CD1 PHE A 692 -5.042 -7.911 -19.923 1.00 0.00 C ATOM 1919 CD2 PHE A 692 -5.489 -7.434 -17.630 1.00 0.00 C ATOM 1920 CE1 PHE A 692 -5.528 -9.191 -19.757 1.00 0.00 C ATOM 1921 CE2 PHE A 692 -5.979 -8.717 -17.460 1.00 0.00 C ATOM 1922 CZ PHE A 692 -5.997 -9.596 -18.526 1.00 0.00 C ATOM 0 H PHE A 692 -1.960 -6.348 -19.620 1.00 0.00 H new ATOM 0 HA PHE A 692 -4.345 -5.556 -21.190 1.00 0.00 H new ATOM 0 HB2 PHE A 692 -3.851 -5.367 -18.196 1.00 0.00 H new ATOM 0 HB3 PHE A 692 -5.324 -4.919 -19.034 1.00 0.00 H new ATOM 0 HD1 PHE A 692 -4.677 -7.602 -20.891 1.00 0.00 H new ATOM 0 HD2 PHE A 692 -5.475 -6.751 -16.793 1.00 0.00 H new ATOM 0 HE1 PHE A 692 -5.541 -9.876 -20.592 1.00 0.00 H new ATOM 0 HE2 PHE A 692 -6.347 -9.031 -16.495 1.00 0.00 H new ATOM 0 HZ PHE A 692 -6.378 -10.598 -18.395 1.00 0.00 H new ATOM 1932 N LYS A 693 -3.871 -3.089 -21.054 1.00 0.00 N ATOM 1933 CA LYS A 693 -3.451 -1.700 -21.174 1.00 0.00 C ATOM 1934 C LYS A 693 -4.213 -0.816 -20.199 1.00 0.00 C ATOM 1935 O LYS A 693 -5.435 -0.687 -20.281 1.00 0.00 O ATOM 1936 CB LYS A 693 -3.665 -1.204 -22.606 1.00 0.00 C ATOM 1937 CG LYS A 693 -3.149 0.205 -22.845 1.00 0.00 C ATOM 1938 CD LYS A 693 -3.749 0.811 -24.104 1.00 0.00 C ATOM 1939 CE LYS A 693 -2.792 0.706 -25.281 1.00 0.00 C ATOM 1940 NZ LYS A 693 -2.920 -0.600 -25.985 1.00 0.00 N ATOM 0 H LYS A 693 -4.750 -3.308 -21.522 1.00 0.00 H new ATOM 0 HA LYS A 693 -2.390 -1.645 -20.932 1.00 0.00 H new ATOM 0 HB2 LYS A 693 -3.168 -1.886 -23.296 1.00 0.00 H new ATOM 0 HB3 LYS A 693 -4.730 -1.236 -22.838 1.00 0.00 H new ATOM 0 HG2 LYS A 693 -3.390 0.833 -21.987 1.00 0.00 H new ATOM 0 HG3 LYS A 693 -2.063 0.186 -22.931 1.00 0.00 H new ATOM 0 HD2 LYS A 693 -4.682 0.302 -24.345 1.00 0.00 H new ATOM 0 HD3 LYS A 693 -3.994 1.858 -23.925 1.00 0.00 H new ATOM 0 HE2 LYS A 693 -2.988 1.517 -25.982 1.00 0.00 H new ATOM 0 HE3 LYS A 693 -1.768 0.830 -24.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 693 -2.769 -0.461 -27.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 693 -2.209 -1.264 -25.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 693 -3.871 -0.988 -25.826 1.00 0.00 H new ATOM 1954 N VAL A 694 -3.478 -0.205 -19.279 1.00 0.00 N ATOM 1955 CA VAL A 694 -4.071 0.670 -18.283 1.00 0.00 C ATOM 1956 C VAL A 694 -4.262 2.072 -18.848 1.00 0.00 C ATOM 1957 O VAL A 694 -3.306 2.715 -19.280 1.00 0.00 O ATOM 1958 CB VAL A 694 -3.202 0.725 -16.998 1.00 0.00 C ATOM 1959 CG1 VAL A 694 -3.010 2.153 -16.499 1.00 0.00 C ATOM 1960 CG2 VAL A 694 -3.815 -0.140 -15.910 1.00 0.00 C ATOM 0 H VAL A 694 -2.465 -0.302 -19.204 1.00 0.00 H new ATOM 0 HA VAL A 694 -5.046 0.261 -18.018 1.00 0.00 H new ATOM 0 HB VAL A 694 -2.216 0.335 -17.252 1.00 0.00 H new ATOM 0 HG11 VAL A 694 -2.396 2.144 -15.598 1.00 0.00 H new ATOM 0 HG12 VAL A 694 -2.515 2.744 -17.270 1.00 0.00 H new ATOM 0 HG13 VAL A 694 -3.981 2.593 -16.272 1.00 0.00 H new ATOM 0 HG21 VAL A 694 -3.195 -0.092 -15.015 1.00 0.00 H new ATOM 0 HG22 VAL A 694 -4.816 0.223 -15.678 1.00 0.00 H new ATOM 0 HG23 VAL A 694 -3.874 -1.172 -16.256 1.00 0.00 H new ATOM 1970 N GLU A 695 -5.501 2.544 -18.828 1.00 0.00 N ATOM 1971 CA GLU A 695 -5.810 3.873 -19.323 1.00 0.00 C ATOM 1972 C GLU A 695 -6.698 4.618 -18.336 1.00 0.00 C ATOM 1973 O GLU A 695 -7.873 4.291 -18.170 1.00 0.00 O ATOM 1974 CB GLU A 695 -6.501 3.786 -20.684 1.00 0.00 C ATOM 1975 CG GLU A 695 -6.309 5.027 -21.540 1.00 0.00 C ATOM 1976 CD GLU A 695 -5.504 4.753 -22.795 1.00 0.00 C ATOM 1977 OE1 GLU A 695 -4.723 3.778 -22.800 1.00 0.00 O ATOM 1978 OE2 GLU A 695 -5.653 5.514 -23.774 1.00 0.00 O ATOM 0 H GLU A 695 -6.305 2.026 -18.475 1.00 0.00 H new ATOM 0 HA GLU A 695 -4.875 4.422 -19.436 1.00 0.00 H new ATOM 0 HB2 GLU A 695 -6.118 2.919 -21.223 1.00 0.00 H new ATOM 0 HB3 GLU A 695 -7.568 3.620 -20.532 1.00 0.00 H new ATOM 0 HG2 GLU A 695 -7.284 5.426 -21.819 1.00 0.00 H new ATOM 0 HG3 GLU A 695 -5.807 5.795 -20.952 1.00 0.00 H new ATOM 1985 N ILE A 696 -6.127 5.624 -17.687 1.00 0.00 N ATOM 1986 CA ILE A 696 -6.869 6.424 -16.718 1.00 0.00 C ATOM 1987 C ILE A 696 -7.783 7.419 -17.420 1.00 0.00 C ATOM 1988 O ILE A 696 -7.319 8.401 -17.999 1.00 0.00 O ATOM 1989 CB ILE A 696 -5.923 7.193 -15.776 1.00 0.00 C ATOM 1990 CG1 ILE A 696 -4.892 6.244 -15.163 1.00 0.00 C ATOM 1991 CG2 ILE A 696 -6.715 7.898 -14.684 1.00 0.00 C ATOM 1992 CD1 ILE A 696 -3.694 6.957 -14.580 1.00 0.00 C ATOM 0 H ILE A 696 -5.155 5.906 -17.812 1.00 0.00 H new ATOM 0 HA ILE A 696 -7.468 5.730 -16.128 1.00 0.00 H new ATOM 0 HB ILE A 696 -5.394 7.947 -16.358 1.00 0.00 H new ATOM 0 HG12 ILE A 696 -5.371 5.655 -14.381 1.00 0.00 H new ATOM 0 HG13 ILE A 696 -4.553 5.544 -15.927 1.00 0.00 H new ATOM 0 HG21 ILE A 696 -6.031 8.436 -14.028 1.00 0.00 H new ATOM 0 HG22 ILE A 696 -7.412 8.602 -15.137 1.00 0.00 H new ATOM 0 HG23 ILE A 696 -7.270 7.161 -14.104 1.00 0.00 H new ATOM 0 HD11 ILE A 696 -3.003 6.225 -14.162 1.00 0.00 H new ATOM 0 HD12 ILE A 696 -3.192 7.525 -15.363 1.00 0.00 H new ATOM 0 HD13 ILE A 696 -4.022 7.636 -13.793 1.00 0.00 H new ATOM 2004 N ASN A 697 -9.084 7.164 -17.356 1.00 0.00 N ATOM 2005 CA ASN A 697 -10.061 8.046 -17.978 1.00 0.00 C ATOM 2006 C ASN A 697 -10.525 9.097 -16.981 1.00 0.00 C ATOM 2007 O ASN A 697 -10.636 10.278 -17.309 1.00 0.00 O ATOM 2008 CB ASN A 697 -11.258 7.243 -18.492 1.00 0.00 C ATOM 2009 CG ASN A 697 -11.154 6.932 -19.972 1.00 0.00 C ATOM 2010 OD1 ASN A 697 -11.970 7.388 -20.773 1.00 0.00 O ATOM 2011 ND2 ASN A 697 -10.147 6.149 -20.343 1.00 0.00 N ATOM 0 H ASN A 697 -9.485 6.356 -16.881 1.00 0.00 H new ATOM 0 HA ASN A 697 -9.589 8.545 -18.825 1.00 0.00 H new ATOM 0 HB2 ASN A 697 -11.334 6.311 -17.932 1.00 0.00 H new ATOM 0 HB3 ASN A 697 -12.175 7.803 -18.305 1.00 0.00 H new ATOM 0 HD21 ASN A 697 -10.027 5.904 -21.326 1.00 0.00 H new ATOM 0 HD22 ASN A 697 -9.494 5.793 -19.645 1.00 0.00 H new ATOM 2018 N ASP A 698 -10.782 8.656 -15.755 1.00 0.00 N ATOM 2019 CA ASP A 698 -11.218 9.552 -14.695 1.00 0.00 C ATOM 2020 C ASP A 698 -10.119 9.715 -13.651 1.00 0.00 C ATOM 2021 O ASP A 698 -9.435 8.752 -13.310 1.00 0.00 O ATOM 2022 CB ASP A 698 -12.491 9.014 -14.036 1.00 0.00 C ATOM 2023 CG ASP A 698 -13.532 10.095 -13.824 1.00 0.00 C ATOM 2024 OD1 ASP A 698 -13.284 11.006 -13.007 1.00 0.00 O ATOM 2025 OD2 ASP A 698 -14.596 10.030 -14.475 1.00 0.00 O ATOM 0 H ASP A 698 -10.695 7.680 -15.472 1.00 0.00 H new ATOM 0 HA ASP A 698 -11.432 10.527 -15.133 1.00 0.00 H new ATOM 0 HB2 ASP A 698 -12.913 8.224 -14.657 1.00 0.00 H new ATOM 0 HB3 ASP A 698 -12.238 8.564 -13.076 1.00 0.00 H new ATOM 2030 N THR A 699 -9.965 10.928 -13.132 1.00 0.00 N ATOM 2031 CA THR A 699 -8.969 11.195 -12.118 1.00 0.00 C ATOM 2032 C THR A 699 -9.655 11.565 -10.811 1.00 0.00 C ATOM 2033 O THR A 699 -10.108 12.694 -10.622 1.00 0.00 O ATOM 2034 CB THR A 699 -7.990 12.316 -12.542 1.00 0.00 C ATOM 2035 OG1 THR A 699 -8.404 13.580 -12.009 1.00 0.00 O ATOM 2036 CG2 THR A 699 -7.893 12.414 -14.056 1.00 0.00 C ATOM 0 H THR A 699 -10.522 11.739 -13.402 1.00 0.00 H new ATOM 0 HA THR A 699 -8.381 10.287 -11.983 1.00 0.00 H new ATOM 0 HB THR A 699 -7.009 12.062 -12.142 1.00 0.00 H new ATOM 0 HG1 THR A 699 -9.373 13.573 -11.866 1.00 0.00 H new ATOM 0 HG21 THR A 699 -7.198 13.210 -14.325 1.00 0.00 H new ATOM 0 HG22 THR A 699 -7.534 11.467 -14.460 1.00 0.00 H new ATOM 0 HG23 THR A 699 -8.877 12.636 -14.470 1.00 0.00 H new ATOM 2044 N THR A 700 -9.729 10.599 -9.921 1.00 0.00 N ATOM 2045 CA THR A 700 -10.359 10.797 -8.621 1.00 0.00 C ATOM 2046 C THR A 700 -9.382 11.429 -7.638 1.00 0.00 C ATOM 2047 O THR A 700 -9.095 10.871 -6.578 1.00 0.00 O ATOM 2048 CB THR A 700 -10.882 9.470 -8.040 1.00 0.00 C ATOM 2049 OG1 THR A 700 -11.124 8.533 -9.095 1.00 0.00 O ATOM 2050 CG2 THR A 700 -12.163 9.693 -7.249 1.00 0.00 C ATOM 0 H THR A 700 -9.360 9.660 -10.070 1.00 0.00 H new ATOM 0 HA THR A 700 -11.205 11.468 -8.772 1.00 0.00 H new ATOM 0 HB THR A 700 -10.123 9.070 -7.368 1.00 0.00 H new ATOM 0 HG1 THR A 700 -10.380 7.897 -9.145 1.00 0.00 H new ATOM 0 HG21 THR A 700 -12.514 8.742 -6.848 1.00 0.00 H new ATOM 0 HG22 THR A 700 -11.968 10.383 -6.428 1.00 0.00 H new ATOM 0 HG23 THR A 700 -12.926 10.114 -7.903 1.00 0.00 H new ATOM 2058 N GLY A 701 -8.866 12.597 -8.001 1.00 0.00 N ATOM 2059 CA GLY A 701 -7.920 13.287 -7.149 1.00 0.00 C ATOM 2060 C GLY A 701 -6.512 12.750 -7.303 1.00 0.00 C ATOM 2061 O GLY A 701 -5.772 12.646 -6.325 1.00 0.00 O ATOM 0 H GLY A 701 -9.087 13.078 -8.873 1.00 0.00 H new ATOM 0 HA2 GLY A 701 -7.929 14.351 -7.386 1.00 0.00 H new ATOM 0 HA3 GLY A 701 -8.232 13.190 -6.109 1.00 0.00 H new ATOM 2065 N LEU A 702 -6.140 12.406 -8.533 1.00 0.00 N ATOM 2066 CA LEU A 702 -4.810 11.878 -8.807 1.00 0.00 C ATOM 2067 C LEU A 702 -3.780 13.003 -8.828 1.00 0.00 C ATOM 2068 O LEU A 702 -4.006 14.046 -9.441 1.00 0.00 O ATOM 2069 CB LEU A 702 -4.805 11.138 -10.150 1.00 0.00 C ATOM 2070 CG LEU A 702 -4.845 9.607 -10.065 1.00 0.00 C ATOM 2071 CD1 LEU A 702 -3.443 9.046 -9.897 1.00 0.00 C ATOM 2072 CD2 LEU A 702 -5.747 9.149 -8.927 1.00 0.00 C ATOM 0 H LEU A 702 -6.741 12.484 -9.354 1.00 0.00 H new ATOM 0 HA LEU A 702 -4.545 11.180 -8.013 1.00 0.00 H new ATOM 0 HB2 LEU A 702 -5.663 11.474 -10.732 1.00 0.00 H new ATOM 0 HB3 LEU A 702 -3.911 11.430 -10.702 1.00 0.00 H new ATOM 0 HG LEU A 702 -5.259 9.225 -10.998 1.00 0.00 H new ATOM 0 HD11 LEU A 702 -3.491 7.959 -9.838 1.00 0.00 H new ATOM 0 HD12 LEU A 702 -2.830 9.337 -10.750 1.00 0.00 H new ATOM 0 HD13 LEU A 702 -3.001 9.439 -8.982 1.00 0.00 H new ATOM 0 HD21 LEU A 702 -5.759 8.060 -8.888 1.00 0.00 H new ATOM 0 HD22 LEU A 702 -5.370 9.542 -7.983 1.00 0.00 H new ATOM 0 HD23 LEU A 702 -6.759 9.517 -9.095 1.00 0.00 H new ATOM 2084 N PHE A 703 -2.645 12.780 -8.166 1.00 0.00 N ATOM 2085 CA PHE A 703 -1.571 13.774 -8.121 1.00 0.00 C ATOM 2086 C PHE A 703 -1.352 14.380 -9.503 1.00 0.00 C ATOM 2087 O PHE A 703 -1.006 15.554 -9.643 1.00 0.00 O ATOM 2088 CB PHE A 703 -0.275 13.120 -7.632 1.00 0.00 C ATOM 2089 CG PHE A 703 0.385 12.276 -8.686 1.00 0.00 C ATOM 2090 CD1 PHE A 703 -0.245 11.143 -9.171 1.00 0.00 C ATOM 2091 CD2 PHE A 703 1.617 12.632 -9.207 1.00 0.00 C ATOM 2092 CE1 PHE A 703 0.341 10.378 -10.160 1.00 0.00 C ATOM 2093 CE2 PHE A 703 2.212 11.868 -10.194 1.00 0.00 C ATOM 2094 CZ PHE A 703 1.571 10.741 -10.672 1.00 0.00 C ATOM 0 H PHE A 703 -2.445 11.921 -7.654 1.00 0.00 H new ATOM 0 HA PHE A 703 -1.858 14.567 -7.430 1.00 0.00 H new ATOM 0 HB2 PHE A 703 0.418 13.896 -7.308 1.00 0.00 H new ATOM 0 HB3 PHE A 703 -0.492 12.502 -6.761 1.00 0.00 H new ATOM 0 HD1 PHE A 703 -1.206 10.854 -8.771 1.00 0.00 H new ATOM 0 HD2 PHE A 703 2.118 13.515 -8.839 1.00 0.00 H new ATOM 0 HE1 PHE A 703 -0.162 9.498 -10.532 1.00 0.00 H new ATOM 0 HE2 PHE A 703 3.176 12.152 -10.591 1.00 0.00 H new ATOM 0 HZ PHE A 703 2.032 10.144 -11.446 1.00 0.00 H new ATOM 2104 N ASN A 704 -1.563 13.552 -10.517 1.00 0.00 N ATOM 2105 CA ASN A 704 -1.404 13.956 -11.902 1.00 0.00 C ATOM 2106 C ASN A 704 -2.391 13.195 -12.774 1.00 0.00 C ATOM 2107 O ASN A 704 -3.244 13.785 -13.436 1.00 0.00 O ATOM 2108 CB ASN A 704 0.036 13.672 -12.371 1.00 0.00 C ATOM 2109 CG ASN A 704 0.102 13.041 -13.758 1.00 0.00 C ATOM 2110 OD1 ASN A 704 0.165 11.707 -13.817 1.00 0.00 O flip ATOM 2111 ND2 ASN A 704 0.096 13.745 -14.768 1.00 0.00 N flip ATOM 0 H ASN A 704 -1.850 12.580 -10.399 1.00 0.00 H new ATOM 0 HA ASN A 704 -1.600 15.025 -11.987 1.00 0.00 H new ATOM 0 HB2 ASN A 704 0.600 14.605 -12.376 1.00 0.00 H new ATOM 0 HB3 ASN A 704 0.521 13.010 -11.654 1.00 0.00 H new ATOM 0 HD21 ASN A 704 0.047 14.760 -14.682 1.00 0.00 H new ATOM 0 HD22 ASN A 704 0.140 13.313 -15.691 1.00 0.00 H new ATOM 2118 N GLU A 705 -2.231 11.873 -12.759 1.00 0.00 N ATOM 2119 CA GLU A 705 -3.045 10.936 -13.533 1.00 0.00 C ATOM 2120 C GLU A 705 -2.171 9.766 -13.977 1.00 0.00 C ATOM 2121 O GLU A 705 -2.355 9.217 -15.062 1.00 0.00 O ATOM 2122 CB GLU A 705 -3.642 11.601 -14.778 1.00 0.00 C ATOM 2123 CG GLU A 705 -2.588 12.207 -15.686 1.00 0.00 C ATOM 2124 CD GLU A 705 -3.128 12.551 -17.061 1.00 0.00 C ATOM 2125 OE1 GLU A 705 -4.359 12.711 -17.193 1.00 0.00 O ATOM 2126 OE2 GLU A 705 -2.318 12.660 -18.006 1.00 0.00 O ATOM 0 H GLU A 705 -1.516 11.413 -12.196 1.00 0.00 H new ATOM 0 HA GLU A 705 -3.863 10.595 -12.898 1.00 0.00 H new ATOM 0 HB2 GLU A 705 -4.216 10.863 -15.338 1.00 0.00 H new ATOM 0 HB3 GLU A 705 -4.339 12.380 -14.469 1.00 0.00 H new ATOM 0 HG2 GLU A 705 -2.188 13.108 -15.221 1.00 0.00 H new ATOM 0 HG3 GLU A 705 -1.759 11.508 -15.790 1.00 0.00 H new ATOM 2133 N GLY A 706 -1.204 9.403 -13.138 1.00 0.00 N ATOM 2134 CA GLY A 706 -0.303 8.317 -13.465 1.00 0.00 C ATOM 2135 C GLY A 706 0.688 8.675 -14.563 1.00 0.00 C ATOM 2136 O GLY A 706 0.608 8.147 -15.668 1.00 0.00 O ATOM 0 H GLY A 706 -1.030 9.845 -12.235 1.00 0.00 H new ATOM 0 HA2 GLY A 706 0.246 8.026 -12.569 1.00 0.00 H new ATOM 0 HA3 GLY A 706 -0.886 7.451 -13.778 1.00 0.00 H new ATOM 2140 N LEU A 707 1.627 9.572 -14.264 1.00 0.00 N ATOM 2141 CA LEU A 707 2.640 9.971 -15.243 1.00 0.00 C ATOM 2142 C LEU A 707 4.008 9.381 -14.899 1.00 0.00 C ATOM 2143 O LEU A 707 4.947 9.473 -15.688 1.00 0.00 O ATOM 2144 CB LEU A 707 2.745 11.496 -15.336 1.00 0.00 C ATOM 2145 CG LEU A 707 2.286 12.093 -16.667 1.00 0.00 C ATOM 2146 CD1 LEU A 707 3.239 11.694 -17.782 1.00 0.00 C ATOM 2147 CD2 LEU A 707 0.866 11.650 -16.994 1.00 0.00 C ATOM 0 H LEU A 707 1.708 10.034 -13.358 1.00 0.00 H new ATOM 0 HA LEU A 707 2.325 9.579 -16.210 1.00 0.00 H new ATOM 0 HB2 LEU A 707 2.153 11.936 -14.534 1.00 0.00 H new ATOM 0 HB3 LEU A 707 3.781 11.786 -15.163 1.00 0.00 H new ATOM 0 HG LEU A 707 2.292 13.179 -16.577 1.00 0.00 H new ATOM 0 HD11 LEU A 707 2.899 12.126 -18.723 1.00 0.00 H new ATOM 0 HD12 LEU A 707 4.240 12.061 -17.554 1.00 0.00 H new ATOM 0 HD13 LEU A 707 3.262 10.608 -17.869 1.00 0.00 H new ATOM 0 HD21 LEU A 707 0.559 12.086 -17.945 1.00 0.00 H new ATOM 0 HD22 LEU A 707 0.831 10.563 -17.065 1.00 0.00 H new ATOM 0 HD23 LEU A 707 0.190 11.984 -16.207 1.00 0.00 H new ATOM 2159 N GLY A 708 4.117 8.797 -13.710 1.00 0.00 N ATOM 2160 CA GLY A 708 5.376 8.227 -13.274 1.00 0.00 C ATOM 2161 C GLY A 708 5.787 8.749 -11.914 1.00 0.00 C ATOM 2162 O GLY A 708 5.087 8.529 -10.926 1.00 0.00 O ATOM 0 H GLY A 708 3.353 8.709 -13.040 1.00 0.00 H new ATOM 0 HA2 GLY A 708 5.290 7.141 -13.236 1.00 0.00 H new ATOM 0 HA3 GLY A 708 6.152 8.460 -14.003 1.00 0.00 H new ATOM 2166 N MET A 709 6.916 9.455 -11.867 1.00 0.00 N ATOM 2167 CA MET A 709 7.423 10.031 -10.619 1.00 0.00 C ATOM 2168 C MET A 709 8.879 10.464 -10.766 1.00 0.00 C ATOM 2169 O MET A 709 9.778 9.633 -10.884 1.00 0.00 O ATOM 2170 CB MET A 709 7.297 9.031 -9.460 1.00 0.00 C ATOM 2171 CG MET A 709 8.021 9.463 -8.191 1.00 0.00 C ATOM 2172 SD MET A 709 7.025 9.240 -6.702 1.00 0.00 S ATOM 2173 CE MET A 709 6.209 7.686 -7.060 1.00 0.00 C ATOM 0 H MET A 709 7.500 9.643 -12.682 1.00 0.00 H new ATOM 0 HA MET A 709 6.816 10.908 -10.396 1.00 0.00 H new ATOM 0 HB2 MET A 709 6.241 8.885 -9.232 1.00 0.00 H new ATOM 0 HB3 MET A 709 7.691 8.066 -9.781 1.00 0.00 H new ATOM 0 HG2 MET A 709 8.944 8.892 -8.093 1.00 0.00 H new ATOM 0 HG3 MET A 709 8.303 10.512 -8.279 1.00 0.00 H new ATOM 0 HE1 MET A 709 5.931 7.197 -6.126 1.00 0.00 H new ATOM 0 HE2 MET A 709 5.313 7.873 -7.652 1.00 0.00 H new ATOM 0 HE3 MET A 709 6.886 7.040 -7.620 1.00 0.00 H new ATOM 2183 N LEU A 710 9.103 11.771 -10.744 1.00 0.00 N ATOM 2184 CA LEU A 710 10.450 12.318 -10.858 1.00 0.00 C ATOM 2185 C LEU A 710 11.116 11.898 -12.167 1.00 0.00 C ATOM 2186 O LEU A 710 10.443 11.498 -13.116 1.00 0.00 O ATOM 2187 CB LEU A 710 11.291 11.879 -9.666 1.00 0.00 C ATOM 2188 CG LEU A 710 11.925 13.019 -8.865 1.00 0.00 C ATOM 2189 CD1 LEU A 710 10.886 13.688 -7.978 1.00 0.00 C ATOM 2190 CD2 LEU A 710 13.087 12.502 -8.033 1.00 0.00 C ATOM 0 H LEU A 710 8.369 12.473 -10.648 1.00 0.00 H new ATOM 0 HA LEU A 710 10.375 13.405 -10.862 1.00 0.00 H new ATOM 0 HB2 LEU A 710 10.665 11.289 -8.996 1.00 0.00 H new ATOM 0 HB3 LEU A 710 12.084 11.221 -10.023 1.00 0.00 H new ATOM 0 HG LEU A 710 12.308 13.762 -9.564 1.00 0.00 H new ATOM 0 HD11 LEU A 710 11.354 14.496 -7.416 1.00 0.00 H new ATOM 0 HD12 LEU A 710 10.085 14.093 -8.597 1.00 0.00 H new ATOM 0 HD13 LEU A 710 10.473 12.955 -7.285 1.00 0.00 H new ATOM 0 HD21 LEU A 710 13.526 13.326 -7.470 1.00 0.00 H new ATOM 0 HD22 LEU A 710 12.728 11.740 -7.341 1.00 0.00 H new ATOM 0 HD23 LEU A 710 13.841 12.069 -8.690 1.00 0.00 H new ATOM 2202 N GLN A 711 12.446 12.001 -12.212 1.00 0.00 N ATOM 2203 CA GLN A 711 13.210 11.643 -13.404 1.00 0.00 C ATOM 2204 C GLN A 711 12.755 10.302 -13.988 1.00 0.00 C ATOM 2205 O GLN A 711 11.812 10.255 -14.778 1.00 0.00 O ATOM 2206 CB GLN A 711 14.707 11.609 -13.081 1.00 0.00 C ATOM 2207 CG GLN A 711 15.379 12.971 -13.162 1.00 0.00 C ATOM 2208 CD GLN A 711 16.873 12.869 -13.400 1.00 0.00 C ATOM 2209 OE1 GLN A 711 17.582 12.165 -12.681 1.00 0.00 O ATOM 2210 NE2 GLN A 711 17.359 13.576 -14.414 1.00 0.00 N ATOM 0 H GLN A 711 13.016 12.331 -11.433 1.00 0.00 H new ATOM 0 HA GLN A 711 13.026 12.407 -14.160 1.00 0.00 H new ATOM 0 HB2 GLN A 711 14.845 11.204 -12.078 1.00 0.00 H new ATOM 0 HB3 GLN A 711 15.204 10.927 -13.771 1.00 0.00 H new ATOM 0 HG2 GLN A 711 14.925 13.549 -13.967 1.00 0.00 H new ATOM 0 HG3 GLN A 711 15.198 13.517 -12.236 1.00 0.00 H new ATOM 0 HE21 GLN A 711 16.734 14.146 -14.984 1.00 0.00 H new ATOM 0 HE22 GLN A 711 18.357 13.549 -14.623 1.00 0.00 H new ATOM 2219 N GLU A 712 13.431 9.215 -13.612 1.00 0.00 N ATOM 2220 CA GLU A 712 13.081 7.894 -14.124 1.00 0.00 C ATOM 2221 C GLU A 712 12.571 6.972 -13.019 1.00 0.00 C ATOM 2222 O GLU A 712 13.356 6.363 -12.292 1.00 0.00 O ATOM 2223 CB GLU A 712 14.293 7.259 -14.807 1.00 0.00 C ATOM 2224 CG GLU A 712 15.576 7.371 -13.998 1.00 0.00 C ATOM 2225 CD GLU A 712 16.601 6.322 -14.381 1.00 0.00 C ATOM 2226 OE1 GLU A 712 16.195 5.185 -14.702 1.00 0.00 O ATOM 2227 OE2 GLU A 712 17.809 6.637 -14.361 1.00 0.00 O ATOM 0 H GLU A 712 14.216 9.225 -12.961 1.00 0.00 H new ATOM 0 HA GLU A 712 12.276 8.025 -14.848 1.00 0.00 H new ATOM 0 HB2 GLU A 712 14.083 6.206 -14.996 1.00 0.00 H new ATOM 0 HB3 GLU A 712 14.443 7.733 -15.777 1.00 0.00 H new ATOM 0 HG2 GLU A 712 16.006 8.362 -14.141 1.00 0.00 H new ATOM 0 HG3 GLU A 712 15.342 7.275 -12.938 1.00 0.00 H new ATOM 2234 N GLN A 713 11.251 6.855 -12.919 1.00 0.00 N ATOM 2235 CA GLN A 713 10.628 5.985 -11.927 1.00 0.00 C ATOM 2236 C GLN A 713 9.849 4.876 -12.622 1.00 0.00 C ATOM 2237 O GLN A 713 9.138 5.133 -13.588 1.00 0.00 O ATOM 2238 CB GLN A 713 9.701 6.778 -11.006 1.00 0.00 C ATOM 2239 CG GLN A 713 9.045 5.922 -9.933 1.00 0.00 C ATOM 2240 CD GLN A 713 9.712 6.074 -8.580 1.00 0.00 C ATOM 2241 OE1 GLN A 713 10.289 7.117 -8.273 1.00 0.00 O ATOM 2242 NE2 GLN A 713 9.637 5.030 -7.763 1.00 0.00 N ATOM 0 H GLN A 713 10.590 7.353 -13.515 1.00 0.00 H new ATOM 0 HA GLN A 713 11.417 5.543 -11.318 1.00 0.00 H new ATOM 0 HB2 GLN A 713 10.270 7.575 -10.528 1.00 0.00 H new ATOM 0 HB3 GLN A 713 8.926 7.255 -11.605 1.00 0.00 H new ATOM 0 HG2 GLN A 713 7.993 6.194 -9.848 1.00 0.00 H new ATOM 0 HG3 GLN A 713 9.080 4.876 -10.236 1.00 0.00 H new ATOM 0 HE21 GLN A 713 9.148 4.185 -8.059 1.00 0.00 H new ATOM 0 HE22 GLN A 713 10.068 5.073 -6.840 1.00 0.00 H new ATOM 2251 N ARG A 714 9.988 3.648 -12.121 1.00 0.00 N ATOM 2252 CA ARG A 714 9.306 2.485 -12.679 1.00 0.00 C ATOM 2253 C ARG A 714 10.009 1.203 -12.237 1.00 0.00 C ATOM 2254 O ARG A 714 10.640 0.517 -13.042 1.00 0.00 O ATOM 2255 CB ARG A 714 9.257 2.546 -14.214 1.00 0.00 C ATOM 2256 CG ARG A 714 7.929 3.040 -14.779 1.00 0.00 C ATOM 2257 CD ARG A 714 6.738 2.343 -14.144 1.00 0.00 C ATOM 2258 NE ARG A 714 6.286 1.215 -14.943 1.00 0.00 N ATOM 2259 CZ ARG A 714 5.452 1.319 -15.975 1.00 0.00 C ATOM 2260 NH1 ARG A 714 4.969 2.502 -16.334 1.00 0.00 N ATOM 2261 NH2 ARG A 714 5.106 0.235 -16.653 1.00 0.00 N ATOM 0 H ARG A 714 10.577 3.434 -11.317 1.00 0.00 H new ATOM 0 HA ARG A 714 8.282 2.488 -12.305 1.00 0.00 H new ATOM 0 HB2 ARG A 714 10.054 3.200 -14.566 1.00 0.00 H new ATOM 0 HB3 ARG A 714 9.461 1.552 -14.612 1.00 0.00 H new ATOM 0 HG2 ARG A 714 7.846 4.115 -14.619 1.00 0.00 H new ATOM 0 HG3 ARG A 714 7.911 2.876 -15.856 1.00 0.00 H new ATOM 0 HD2 ARG A 714 7.008 1.997 -13.146 1.00 0.00 H new ATOM 0 HD3 ARG A 714 5.921 3.055 -14.024 1.00 0.00 H new ATOM 0 HE ARG A 714 6.629 0.287 -14.697 1.00 0.00 H new ATOM 0 HH11 ARG A 714 5.237 3.340 -15.818 1.00 0.00 H new ATOM 0 HH12 ARG A 714 4.330 2.573 -17.126 1.00 0.00 H new ATOM 0 HH21 ARG A 714 5.478 -0.676 -16.384 1.00 0.00 H new ATOM 0 HH22 ARG A 714 4.467 0.311 -17.444 1.00 0.00 H new ATOM 2275 N VAL A 715 9.896 0.886 -10.951 1.00 0.00 N ATOM 2276 CA VAL A 715 10.521 -0.311 -10.401 1.00 0.00 C ATOM 2277 C VAL A 715 9.496 -1.192 -9.697 1.00 0.00 C ATOM 2278 O VAL A 715 8.513 -0.700 -9.144 1.00 0.00 O ATOM 2279 CB VAL A 715 11.638 0.049 -9.405 1.00 0.00 C ATOM 2280 CG1 VAL A 715 12.888 0.504 -10.143 1.00 0.00 C ATOM 2281 CG2 VAL A 715 11.165 1.118 -8.432 1.00 0.00 C ATOM 0 H VAL A 715 9.377 1.442 -10.271 1.00 0.00 H new ATOM 0 HA VAL A 715 10.952 -0.858 -11.240 1.00 0.00 H new ATOM 0 HB VAL A 715 11.888 -0.844 -8.832 1.00 0.00 H new ATOM 0 HG11 VAL A 715 13.666 0.754 -9.421 1.00 0.00 H new ATOM 0 HG12 VAL A 715 13.239 -0.298 -10.792 1.00 0.00 H new ATOM 0 HG13 VAL A 715 12.656 1.383 -10.745 1.00 0.00 H new ATOM 0 HG21 VAL A 715 11.969 1.358 -7.736 1.00 0.00 H new ATOM 0 HG22 VAL A 715 10.883 2.014 -8.985 1.00 0.00 H new ATOM 0 HG23 VAL A 715 10.303 0.749 -7.876 1.00 0.00 H new ATOM 2291 N VAL A 716 9.733 -2.500 -9.720 1.00 0.00 N ATOM 2292 CA VAL A 716 8.832 -3.452 -9.083 1.00 0.00 C ATOM 2293 C VAL A 716 9.047 -3.481 -7.572 1.00 0.00 C ATOM 2294 O VAL A 716 10.132 -3.818 -7.096 1.00 0.00 O ATOM 2295 CB VAL A 716 9.022 -4.873 -9.654 1.00 0.00 C ATOM 2296 CG1 VAL A 716 8.096 -5.864 -8.960 1.00 0.00 C ATOM 2297 CG2 VAL A 716 8.789 -4.879 -11.158 1.00 0.00 C ATOM 0 H VAL A 716 10.542 -2.924 -10.173 1.00 0.00 H new ATOM 0 HA VAL A 716 7.815 -3.122 -9.294 1.00 0.00 H new ATOM 0 HB VAL A 716 10.050 -5.183 -9.465 1.00 0.00 H new ATOM 0 HG11 VAL A 716 8.248 -6.859 -9.379 1.00 0.00 H new ATOM 0 HG12 VAL A 716 8.317 -5.882 -7.893 1.00 0.00 H new ATOM 0 HG13 VAL A 716 7.060 -5.561 -9.111 1.00 0.00 H new ATOM 0 HG21 VAL A 716 8.927 -5.889 -11.544 1.00 0.00 H new ATOM 0 HG22 VAL A 716 7.773 -4.545 -11.370 1.00 0.00 H new ATOM 0 HG23 VAL A 716 9.499 -4.207 -11.639 1.00 0.00 H new ATOM 2307 N LEU A 717 8.007 -3.129 -6.824 1.00 0.00 N ATOM 2308 CA LEU A 717 8.081 -3.117 -5.368 1.00 0.00 C ATOM 2309 C LEU A 717 7.504 -4.403 -4.783 1.00 0.00 C ATOM 2310 O LEU A 717 6.924 -5.217 -5.503 1.00 0.00 O ATOM 2311 CB LEU A 717 7.329 -1.908 -4.805 1.00 0.00 C ATOM 2312 CG LEU A 717 7.966 -0.549 -5.108 1.00 0.00 C ATOM 2313 CD1 LEU A 717 7.110 0.237 -6.090 1.00 0.00 C ATOM 2314 CD2 LEU A 717 8.170 0.244 -3.825 1.00 0.00 C ATOM 0 H LEU A 717 7.102 -2.848 -7.202 1.00 0.00 H new ATOM 0 HA LEU A 717 9.131 -3.047 -5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 717 6.314 -1.913 -5.203 1.00 0.00 H new ATOM 0 HB3 LEU A 717 7.248 -2.021 -3.724 1.00 0.00 H new ATOM 0 HG LEU A 717 8.941 -0.722 -5.564 1.00 0.00 H new ATOM 0 HD11 LEU A 717 7.580 1.200 -6.293 1.00 0.00 H new ATOM 0 HD12 LEU A 717 7.016 -0.324 -7.020 1.00 0.00 H new ATOM 0 HD13 LEU A 717 6.121 0.399 -5.662 1.00 0.00 H new ATOM 0 HD21 LEU A 717 8.624 1.207 -4.061 1.00 0.00 H new ATOM 0 HD22 LEU A 717 7.207 0.405 -3.340 1.00 0.00 H new ATOM 0 HD23 LEU A 717 8.825 -0.312 -3.154 1.00 0.00 H new ATOM 2326 N LYS A 718 7.666 -4.578 -3.476 1.00 0.00 N ATOM 2327 CA LYS A 718 7.160 -5.766 -2.797 1.00 0.00 C ATOM 2328 C LYS A 718 5.859 -5.456 -2.059 1.00 0.00 C ATOM 2329 O LYS A 718 5.607 -4.313 -1.678 1.00 0.00 O ATOM 2330 CB LYS A 718 8.206 -6.303 -1.818 1.00 0.00 C ATOM 2331 CG LYS A 718 8.759 -7.664 -2.207 1.00 0.00 C ATOM 2332 CD LYS A 718 10.261 -7.742 -1.985 1.00 0.00 C ATOM 2333 CE LYS A 718 10.681 -9.116 -1.487 1.00 0.00 C ATOM 2334 NZ LYS A 718 12.140 -9.180 -1.199 1.00 0.00 N ATOM 0 H LYS A 718 8.143 -3.914 -2.866 1.00 0.00 H new ATOM 0 HA LYS A 718 6.956 -6.528 -3.549 1.00 0.00 H new ATOM 0 HB2 LYS A 718 9.029 -5.591 -1.751 1.00 0.00 H new ATOM 0 HB3 LYS A 718 7.762 -6.371 -0.825 1.00 0.00 H new ATOM 0 HG2 LYS A 718 8.264 -8.439 -1.623 1.00 0.00 H new ATOM 0 HG3 LYS A 718 8.535 -7.863 -3.255 1.00 0.00 H new ATOM 0 HD2 LYS A 718 10.780 -7.518 -2.917 1.00 0.00 H new ATOM 0 HD3 LYS A 718 10.563 -6.984 -1.262 1.00 0.00 H new ATOM 0 HE2 LYS A 718 10.122 -9.362 -0.584 1.00 0.00 H new ATOM 0 HE3 LYS A 718 10.425 -9.867 -2.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 718 12.386 -10.133 -0.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 718 12.675 -8.971 -2.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 718 12.380 -8.481 -0.467 1.00 0.00 H new ATOM 2348 N GLN A 719 5.040 -6.482 -1.861 1.00 0.00 N ATOM 2349 CA GLN A 719 3.765 -6.320 -1.169 1.00 0.00 C ATOM 2350 C GLN A 719 3.923 -6.562 0.329 1.00 0.00 C ATOM 2351 O GLN A 719 4.849 -7.248 0.762 1.00 0.00 O ATOM 2352 CB GLN A 719 2.723 -7.279 -1.746 1.00 0.00 C ATOM 2353 CG GLN A 719 2.123 -6.805 -3.059 1.00 0.00 C ATOM 2354 CD GLN A 719 1.031 -7.725 -3.568 1.00 0.00 C ATOM 2355 OE1 GLN A 719 0.077 -8.031 -2.852 1.00 0.00 O ATOM 2356 NE2 GLN A 719 1.165 -8.173 -4.810 1.00 0.00 N ATOM 0 H GLN A 719 5.235 -7.435 -2.169 1.00 0.00 H new ATOM 0 HA GLN A 719 3.427 -5.295 -1.318 1.00 0.00 H new ATOM 0 HB2 GLN A 719 3.184 -8.255 -1.898 1.00 0.00 H new ATOM 0 HB3 GLN A 719 1.923 -7.414 -1.018 1.00 0.00 H new ATOM 0 HG2 GLN A 719 1.716 -5.803 -2.927 1.00 0.00 H new ATOM 0 HG3 GLN A 719 2.911 -6.733 -3.809 1.00 0.00 H new ATOM 0 HE21 GLN A 719 1.972 -7.894 -5.369 1.00 0.00 H new ATOM 0 HE22 GLN A 719 0.461 -8.796 -5.206 1.00 0.00 H new ATOM 2365 N THR A 720 3.014 -5.994 1.114 1.00 0.00 N ATOM 2366 CA THR A 720 3.051 -6.146 2.563 1.00 0.00 C ATOM 2367 C THR A 720 1.722 -6.669 3.095 1.00 0.00 C ATOM 2368 O THR A 720 0.826 -7.012 2.325 1.00 0.00 O ATOM 2369 CB THR A 720 3.383 -4.813 3.260 1.00 0.00 C ATOM 2370 OG1 THR A 720 2.281 -3.907 3.133 1.00 0.00 O ATOM 2371 CG2 THR A 720 4.633 -4.186 2.660 1.00 0.00 C ATOM 0 H THR A 720 2.242 -5.423 0.770 1.00 0.00 H new ATOM 0 HA THR A 720 3.837 -6.868 2.785 1.00 0.00 H new ATOM 0 HB THR A 720 3.567 -5.015 4.315 1.00 0.00 H new ATOM 0 HG1 THR A 720 2.499 -3.062 3.580 1.00 0.00 H new ATOM 0 HG21 THR A 720 4.848 -3.246 3.168 1.00 0.00 H new ATOM 0 HG22 THR A 720 5.476 -4.866 2.783 1.00 0.00 H new ATOM 0 HG23 THR A 720 4.472 -3.997 1.599 1.00 0.00 H new ATOM 2379 N ALA A 721 1.601 -6.728 4.418 1.00 0.00 N ATOM 2380 CA ALA A 721 0.380 -7.210 5.056 1.00 0.00 C ATOM 2381 C ALA A 721 -0.837 -6.417 4.589 1.00 0.00 C ATOM 2382 O ALA A 721 -1.936 -6.958 4.476 1.00 0.00 O ATOM 2383 CB ALA A 721 0.511 -7.136 6.569 1.00 0.00 C ATOM 0 H ALA A 721 2.334 -6.448 5.070 1.00 0.00 H new ATOM 0 HA ALA A 721 0.235 -8.250 4.764 1.00 0.00 H new ATOM 0 HB1 ALA A 721 -0.407 -7.499 7.032 1.00 0.00 H new ATOM 0 HB2 ALA A 721 1.349 -7.754 6.892 1.00 0.00 H new ATOM 0 HB3 ALA A 721 0.685 -6.103 6.869 1.00 0.00 H new ATOM 2389 N GLU A 722 -0.631 -5.132 4.318 1.00 0.00 N ATOM 2390 CA GLU A 722 -1.712 -4.265 3.862 1.00 0.00 C ATOM 2391 C GLU A 722 -2.317 -4.792 2.565 1.00 0.00 C ATOM 2392 O GLU A 722 -3.534 -4.936 2.449 1.00 0.00 O ATOM 2393 CB GLU A 722 -1.199 -2.839 3.658 1.00 0.00 C ATOM 2394 CG GLU A 722 -2.308 -1.810 3.503 1.00 0.00 C ATOM 2395 CD GLU A 722 -1.780 -0.430 3.160 1.00 0.00 C ATOM 2396 OE1 GLU A 722 -1.415 0.314 4.094 1.00 0.00 O ATOM 2397 OE2 GLU A 722 -1.732 -0.094 1.958 1.00 0.00 O ATOM 0 H GLU A 722 0.273 -4.668 4.406 1.00 0.00 H new ATOM 0 HA GLU A 722 -2.488 -4.257 4.628 1.00 0.00 H new ATOM 0 HB2 GLU A 722 -0.573 -2.562 4.507 1.00 0.00 H new ATOM 0 HB3 GLU A 722 -0.564 -2.813 2.772 1.00 0.00 H new ATOM 0 HG2 GLU A 722 -2.995 -2.136 2.722 1.00 0.00 H new ATOM 0 HG3 GLU A 722 -2.880 -1.756 4.429 1.00 0.00 H new ATOM 2404 N GLU A 723 -1.459 -5.078 1.592 1.00 0.00 N ATOM 2405 CA GLU A 723 -1.907 -5.590 0.302 1.00 0.00 C ATOM 2406 C GLU A 723 -2.532 -6.973 0.455 1.00 0.00 C ATOM 2407 O GLU A 723 -3.637 -7.225 -0.027 1.00 0.00 O ATOM 2408 CB GLU A 723 -0.734 -5.653 -0.679 1.00 0.00 C ATOM 2409 CG GLU A 723 0.070 -4.365 -0.748 1.00 0.00 C ATOM 2410 CD GLU A 723 -0.782 -3.164 -1.111 1.00 0.00 C ATOM 2411 OE1 GLU A 723 -1.258 -3.099 -2.264 1.00 0.00 O ATOM 2412 OE2 GLU A 723 -0.973 -2.288 -0.242 1.00 0.00 O ATOM 0 H GLU A 723 -0.449 -4.964 1.672 1.00 0.00 H new ATOM 0 HA GLU A 723 -2.663 -4.910 -0.090 1.00 0.00 H new ATOM 0 HB2 GLU A 723 -0.072 -6.470 -0.390 1.00 0.00 H new ATOM 0 HB3 GLU A 723 -1.114 -5.888 -1.673 1.00 0.00 H new ATOM 0 HG2 GLU A 723 0.549 -4.188 0.215 1.00 0.00 H new ATOM 0 HG3 GLU A 723 0.866 -4.477 -1.484 1.00 0.00 H new ATOM 2419 N LYS A 724 -1.817 -7.866 1.133 1.00 0.00 N ATOM 2420 CA LYS A 724 -2.301 -9.224 1.354 1.00 0.00 C ATOM 2421 C LYS A 724 -3.643 -9.212 2.080 1.00 0.00 C ATOM 2422 O LYS A 724 -4.489 -10.079 1.859 1.00 0.00 O ATOM 2423 CB LYS A 724 -1.278 -10.025 2.163 1.00 0.00 C ATOM 2424 CG LYS A 724 -1.713 -11.452 2.454 1.00 0.00 C ATOM 2425 CD LYS A 724 -2.268 -11.591 3.862 1.00 0.00 C ATOM 2426 CE LYS A 724 -1.170 -11.492 4.910 1.00 0.00 C ATOM 2427 NZ LYS A 724 -1.283 -12.566 5.936 1.00 0.00 N ATOM 0 H LYS A 724 -0.901 -7.673 1.538 1.00 0.00 H new ATOM 0 HA LYS A 724 -2.439 -9.698 0.382 1.00 0.00 H new ATOM 0 HB2 LYS A 724 -0.334 -10.046 1.619 1.00 0.00 H new ATOM 0 HB3 LYS A 724 -1.091 -9.512 3.106 1.00 0.00 H new ATOM 0 HG2 LYS A 724 -2.471 -11.757 1.732 1.00 0.00 H new ATOM 0 HG3 LYS A 724 -0.864 -12.125 2.329 1.00 0.00 H new ATOM 0 HD2 LYS A 724 -3.011 -10.814 4.039 1.00 0.00 H new ATOM 0 HD3 LYS A 724 -2.779 -12.549 3.959 1.00 0.00 H new ATOM 0 HE2 LYS A 724 -0.197 -11.556 4.423 1.00 0.00 H new ATOM 0 HE3 LYS A 724 -1.220 -10.518 5.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 724 -0.517 -12.463 6.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 724 -2.201 -12.490 6.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 724 -1.210 -13.495 5.475 1.00 0.00 H new ATOM 2441 N ASP A 725 -3.830 -8.224 2.948 1.00 0.00 N ATOM 2442 CA ASP A 725 -5.068 -8.097 3.708 1.00 0.00 C ATOM 2443 C ASP A 725 -6.256 -7.848 2.784 1.00 0.00 C ATOM 2444 O ASP A 725 -7.348 -8.371 3.008 1.00 0.00 O ATOM 2445 CB ASP A 725 -4.951 -6.959 4.724 1.00 0.00 C ATOM 2446 CG ASP A 725 -6.175 -6.847 5.611 1.00 0.00 C ATOM 2447 OD1 ASP A 725 -7.283 -6.640 5.071 1.00 0.00 O ATOM 2448 OD2 ASP A 725 -6.028 -6.967 6.845 1.00 0.00 O ATOM 0 H ASP A 725 -3.140 -7.499 3.143 1.00 0.00 H new ATOM 0 HA ASP A 725 -5.236 -9.035 4.237 1.00 0.00 H new ATOM 0 HB2 ASP A 725 -4.069 -7.119 5.345 1.00 0.00 H new ATOM 0 HB3 ASP A 725 -4.802 -6.018 4.195 1.00 0.00 H new ATOM 2453 N LEU A 726 -6.038 -7.045 1.746 1.00 0.00 N ATOM 2454 CA LEU A 726 -7.096 -6.730 0.792 1.00 0.00 C ATOM 2455 C LEU A 726 -7.598 -7.992 0.100 1.00 0.00 C ATOM 2456 O LEU A 726 -8.803 -8.196 -0.046 1.00 0.00 O ATOM 2457 CB LEU A 726 -6.594 -5.727 -0.247 1.00 0.00 C ATOM 2458 CG LEU A 726 -5.942 -4.469 0.327 1.00 0.00 C ATOM 2459 CD1 LEU A 726 -4.979 -3.858 -0.679 1.00 0.00 C ATOM 2460 CD2 LEU A 726 -7.003 -3.457 0.732 1.00 0.00 C ATOM 0 H LEU A 726 -5.141 -6.602 1.545 1.00 0.00 H new ATOM 0 HA LEU A 726 -7.926 -6.286 1.342 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -5.874 -6.228 -0.894 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -7.433 -5.428 -0.875 1.00 0.00 H new ATOM 0 HG LEU A 726 -5.376 -4.750 1.215 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -4.525 -2.964 -0.252 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -4.199 -4.580 -0.921 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -5.521 -3.592 -1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -6.521 -2.568 1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -7.595 -3.182 -0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -7.654 -3.895 1.489 1.00 0.00 H new ATOM 2472 N VAL A 727 -6.665 -8.842 -0.320 1.00 0.00 N ATOM 2473 CA VAL A 727 -7.014 -10.089 -0.989 1.00 0.00 C ATOM 2474 C VAL A 727 -7.574 -11.101 0.005 1.00 0.00 C ATOM 2475 O VAL A 727 -8.356 -11.977 -0.359 1.00 0.00 O ATOM 2476 CB VAL A 727 -5.794 -10.702 -1.706 1.00 0.00 C ATOM 2477 CG1 VAL A 727 -4.691 -11.023 -0.710 1.00 0.00 C ATOM 2478 CG2 VAL A 727 -6.200 -11.945 -2.485 1.00 0.00 C ATOM 0 H VAL A 727 -5.663 -8.689 -0.208 1.00 0.00 H new ATOM 0 HA VAL A 727 -7.776 -9.853 -1.731 1.00 0.00 H new ATOM 0 HB VAL A 727 -5.407 -9.969 -2.414 1.00 0.00 H new ATOM 0 HG11 VAL A 727 -3.840 -11.454 -1.236 1.00 0.00 H new ATOM 0 HG12 VAL A 727 -4.380 -10.109 -0.205 1.00 0.00 H new ATOM 0 HG13 VAL A 727 -5.062 -11.736 0.026 1.00 0.00 H new ATOM 0 HG21 VAL A 727 -5.326 -12.363 -2.984 1.00 0.00 H new ATOM 0 HG22 VAL A 727 -6.615 -12.684 -1.800 1.00 0.00 H new ATOM 0 HG23 VAL A 727 -6.950 -11.679 -3.230 1.00 0.00 H new ATOM 2488 N LYS A 728 -7.168 -10.971 1.265 1.00 0.00 N ATOM 2489 CA LYS A 728 -7.630 -11.872 2.314 1.00 0.00 C ATOM 2490 C LYS A 728 -9.151 -11.833 2.432 1.00 0.00 C ATOM 2491 O LYS A 728 -9.783 -12.827 2.789 1.00 0.00 O ATOM 2492 CB LYS A 728 -6.995 -11.498 3.654 1.00 0.00 C ATOM 2493 CG LYS A 728 -6.986 -12.636 4.662 1.00 0.00 C ATOM 2494 CD LYS A 728 -7.203 -12.127 6.077 1.00 0.00 C ATOM 2495 CE LYS A 728 -8.082 -13.072 6.881 1.00 0.00 C ATOM 2496 NZ LYS A 728 -9.482 -13.093 6.375 1.00 0.00 N ATOM 0 H LYS A 728 -6.520 -10.250 1.583 1.00 0.00 H new ATOM 0 HA LYS A 728 -7.328 -12.885 2.047 1.00 0.00 H new ATOM 0 HB2 LYS A 728 -5.970 -11.168 3.482 1.00 0.00 H new ATOM 0 HB3 LYS A 728 -7.535 -10.652 4.079 1.00 0.00 H new ATOM 0 HG2 LYS A 728 -7.766 -13.354 4.409 1.00 0.00 H new ATOM 0 HG3 LYS A 728 -6.035 -13.165 4.606 1.00 0.00 H new ATOM 0 HD2 LYS A 728 -6.240 -12.012 6.575 1.00 0.00 H new ATOM 0 HD3 LYS A 728 -7.664 -11.140 6.043 1.00 0.00 H new ATOM 0 HE2 LYS A 728 -7.666 -14.079 6.840 1.00 0.00 H new ATOM 0 HE3 LYS A 728 -8.079 -12.769 7.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 728 -10.120 -13.411 7.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 728 -9.755 -12.137 6.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 728 -9.550 -13.746 5.568 1.00 0.00 H new ATOM 2510 N LYS A 729 -9.733 -10.677 2.129 1.00 0.00 N ATOM 2511 CA LYS A 729 -11.180 -10.505 2.198 1.00 0.00 C ATOM 2512 C LYS A 729 -11.850 -10.931 0.893 1.00 0.00 C ATOM 2513 O LYS A 729 -13.052 -11.190 0.860 1.00 0.00 O ATOM 2514 CB LYS A 729 -11.527 -9.048 2.512 1.00 0.00 C ATOM 2515 CG LYS A 729 -10.955 -8.557 3.832 1.00 0.00 C ATOM 2516 CD LYS A 729 -11.827 -7.476 4.450 1.00 0.00 C ATOM 2517 CE LYS A 729 -12.749 -8.046 5.515 1.00 0.00 C ATOM 2518 NZ LYS A 729 -12.041 -8.254 6.808 1.00 0.00 N ATOM 0 H LYS A 729 -9.224 -9.844 1.833 1.00 0.00 H new ATOM 0 HA LYS A 729 -11.555 -11.143 2.998 1.00 0.00 H new ATOM 0 HB2 LYS A 729 -11.157 -8.413 1.707 1.00 0.00 H new ATOM 0 HB3 LYS A 729 -12.611 -8.938 2.532 1.00 0.00 H new ATOM 0 HG2 LYS A 729 -10.866 -9.394 4.525 1.00 0.00 H new ATOM 0 HG3 LYS A 729 -9.950 -8.167 3.672 1.00 0.00 H new ATOM 0 HD2 LYS A 729 -11.195 -6.704 4.889 1.00 0.00 H new ATOM 0 HD3 LYS A 729 -12.421 -6.997 3.672 1.00 0.00 H new ATOM 0 HE2 LYS A 729 -13.591 -7.370 5.666 1.00 0.00 H new ATOM 0 HE3 LYS A 729 -13.160 -8.994 5.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 729 -12.704 -8.644 7.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 729 -11.253 -8.919 6.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 729 -11.670 -7.345 7.151 1.00 0.00 H new ATOM 2532 N LEU A 730 -11.065 -11.002 -0.181 1.00 0.00 N ATOM 2533 CA LEU A 730 -11.584 -11.397 -1.487 1.00 0.00 C ATOM 2534 C LEU A 730 -12.393 -12.689 -1.391 1.00 0.00 C ATOM 2535 O LEU A 730 -13.563 -12.687 -1.829 1.00 0.00 O ATOM 2536 CB LEU A 730 -10.431 -11.576 -2.479 1.00 0.00 C ATOM 2537 CG LEU A 730 -10.833 -12.083 -3.865 1.00 0.00 C ATOM 2538 CD1 LEU A 730 -9.811 -11.655 -4.906 1.00 0.00 C ATOM 2539 CD2 LEU A 730 -10.983 -13.596 -3.855 1.00 0.00 C ATOM 2540 OXT LEU A 730 -11.849 -13.689 -0.878 1.00 0.00 O ATOM 0 H LEU A 730 -10.067 -10.791 -0.171 1.00 0.00 H new ATOM 0 HA LEU A 730 -12.245 -10.606 -1.841 1.00 0.00 H new ATOM 0 HB2 LEU A 730 -9.921 -10.620 -2.594 1.00 0.00 H new ATOM 0 HB3 LEU A 730 -9.710 -12.272 -2.051 1.00 0.00 H new ATOM 0 HG LEU A 730 -11.795 -11.643 -4.127 1.00 0.00 H new ATOM 0 HD11 LEU A 730 -10.113 -12.024 -5.886 1.00 0.00 H new ATOM 0 HD12 LEU A 730 -9.751 -10.567 -4.931 1.00 0.00 H new ATOM 0 HD13 LEU A 730 -8.835 -12.066 -4.648 1.00 0.00 H new ATOM 0 HD21 LEU A 730 -11.269 -13.940 -4.849 1.00 0.00 H new ATOM 0 HD22 LEU A 730 -10.035 -14.054 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 730 -11.752 -13.881 -3.137 1.00 0.00 H new TER 2552 LEU A 730 ATOM 2553 N GLU P 826 -4.094 -29.723 -4.517 1.00 0.00 N ATOM 2554 CA GLU P 826 -3.773 -28.343 -4.963 1.00 0.00 C ATOM 2555 C GLU P 826 -2.560 -28.331 -5.888 1.00 0.00 C ATOM 2556 O GLU P 826 -1.557 -28.993 -5.622 1.00 0.00 O ATOM 2557 CB GLU P 826 -3.503 -27.482 -3.728 1.00 0.00 C ATOM 2558 CG GLU P 826 -4.008 -26.054 -3.859 1.00 0.00 C ATOM 2559 CD GLU P 826 -5.514 -25.954 -3.723 1.00 0.00 C ATOM 2560 OE1 GLU P 826 -6.221 -26.251 -4.710 1.00 0.00 O ATOM 2561 OE2 GLU P 826 -5.988 -25.578 -2.631 1.00 0.00 O ATOM 0 HA GLU P 826 -4.618 -27.942 -5.523 1.00 0.00 H new ATOM 0 HB2 GLU P 826 -3.973 -27.947 -2.862 1.00 0.00 H new ATOM 0 HB3 GLU P 826 -2.430 -27.463 -3.536 1.00 0.00 H new ATOM 0 HG2 GLU P 826 -3.536 -25.434 -3.097 1.00 0.00 H new ATOM 0 HG3 GLU P 826 -3.707 -25.653 -4.827 1.00 0.00 H new ATOM 2570 N ASP P 827 -2.658 -27.573 -6.976 1.00 0.00 N ATOM 2571 CA ASP P 827 -1.569 -27.476 -7.941 1.00 0.00 C ATOM 2572 C ASP P 827 -1.115 -26.029 -8.106 1.00 0.00 C ATOM 2573 O ASP P 827 -1.933 -25.109 -8.109 1.00 0.00 O ATOM 2574 CB ASP P 827 -2.007 -28.043 -9.293 1.00 0.00 C ATOM 2575 CG ASP P 827 -0.922 -28.875 -9.949 1.00 0.00 C ATOM 2576 OD1 ASP P 827 -0.579 -29.943 -9.400 1.00 0.00 O ATOM 2577 OD2 ASP P 827 -0.416 -28.457 -11.012 1.00 0.00 O ATOM 0 H ASP P 827 -3.480 -27.017 -7.211 1.00 0.00 H new ATOM 0 HA ASP P 827 -0.729 -28.060 -7.564 1.00 0.00 H new ATOM 0 HB2 ASP P 827 -2.898 -28.656 -9.156 1.00 0.00 H new ATOM 0 HB3 ASP P 827 -2.283 -27.223 -9.956 1.00 0.00 H new ATOM 2582 N ILE P 828 0.193 -25.836 -8.243 1.00 0.00 N ATOM 2583 CA ILE P 828 0.755 -24.500 -8.409 1.00 0.00 C ATOM 2584 C ILE P 828 1.220 -24.274 -9.843 1.00 0.00 C ATOM 2585 O ILE P 828 1.234 -25.200 -10.654 1.00 0.00 O ATOM 2586 CB ILE P 828 1.939 -24.265 -7.453 1.00 0.00 C ATOM 2587 CG1 ILE P 828 2.918 -25.439 -7.519 1.00 0.00 C ATOM 2588 CG2 ILE P 828 1.440 -24.064 -6.030 1.00 0.00 C ATOM 2589 CD1 ILE P 828 4.304 -25.099 -7.015 1.00 0.00 C ATOM 0 H ILE P 828 0.883 -26.587 -8.242 1.00 0.00 H new ATOM 0 HA ILE P 828 -0.039 -23.792 -8.172 1.00 0.00 H new ATOM 0 HB ILE P 828 2.463 -23.361 -7.764 1.00 0.00 H new ATOM 0 HG12 ILE P 828 2.520 -26.267 -6.933 1.00 0.00 H new ATOM 0 HG13 ILE P 828 2.990 -25.784 -8.550 1.00 0.00 H new ATOM 0 HG21 ILE P 828 2.289 -23.899 -5.367 1.00 0.00 H new ATOM 0 HG22 ILE P 828 0.779 -23.198 -5.995 1.00 0.00 H new ATOM 0 HG23 ILE P 828 0.894 -24.951 -5.707 1.00 0.00 H new ATOM 0 HD11 ILE P 828 4.945 -25.978 -7.091 1.00 0.00 H new ATOM 0 HD12 ILE P 828 4.722 -24.292 -7.617 1.00 0.00 H new ATOM 0 HD13 ILE P 828 4.245 -24.782 -5.974 1.00 0.00 H new HETATM 2601 N PTR P 829 1.599 -23.037 -10.150 1.00 0.00 N HETATM 2602 CA PTR P 829 2.064 -22.691 -11.488 1.00 0.00 C HETATM 2603 C PTR P 829 3.581 -22.535 -11.515 1.00 0.00 C HETATM 2604 O PTR P 829 4.250 -22.685 -10.493 1.00 0.00 O HETATM 2605 CB PTR P 829 1.400 -21.398 -11.963 1.00 0.00 C HETATM 2606 CG PTR P 829 -0.109 -21.477 -12.022 1.00 0.00 C HETATM 2607 CD1 PTR P 829 -0.744 -22.377 -12.871 1.00 0.00 C HETATM 2608 CD2 PTR P 829 -0.899 -20.652 -11.230 1.00 0.00 C HETATM 2609 CE1 PTR P 829 -2.123 -22.451 -12.928 1.00 0.00 C HETATM 2610 CE2 PTR P 829 -2.278 -20.722 -11.281 1.00 0.00 C HETATM 2611 CZ PTR P 829 -2.882 -21.622 -12.131 1.00 0.00 C HETATM 2612 OH PTR P 829 -4.281 -21.695 -12.186 1.00 0.00 O HETATM 2613 P PTR P 829 -5.030 -22.347 -10.983 1.00 0.00 P HETATM 2614 O1P PTR P 829 -4.725 -23.863 -11.106 1.00 0.00 O HETATM 2615 O2P PTR P 829 -4.316 -21.787 -9.726 1.00 0.00 O HETATM 2616 O3P PTR P 829 -6.501 -22.053 -10.991 1.00 0.00 O HETATM 0 HE2 PTR P 829 -2.884 -20.069 -10.653 1.00 0.00 H new HETATM 0 HE1 PTR P 829 -2.607 -23.161 -13.599 1.00 0.00 H new HETATM 0 HD2 PTR P 829 -0.423 -19.938 -10.558 1.00 0.00 H new HETATM 0 HD1 PTR P 829 -0.145 -23.034 -13.501 1.00 0.00 H new HETATM 0 HB3 PTR P 829 1.687 -20.586 -11.295 1.00 0.00 H new HETATM 0 HB2 PTR P 829 1.781 -21.146 -12.953 1.00 0.00 H new HETATM 0 HA PTR P 829 1.788 -23.503 -12.161 1.00 0.00 H new ATOM 2625 N TYR P 830 4.117 -22.234 -12.694 1.00 0.00 N ATOM 2626 CA TYR P 830 5.557 -22.057 -12.860 1.00 0.00 C ATOM 2627 C TYR P 830 5.894 -21.682 -14.299 1.00 0.00 C ATOM 2628 O TYR P 830 5.501 -22.372 -15.239 1.00 0.00 O ATOM 2629 CB TYR P 830 6.307 -23.333 -12.462 1.00 0.00 C ATOM 2630 CG TYR P 830 5.528 -24.606 -12.710 1.00 0.00 C ATOM 2631 CD1 TYR P 830 5.348 -25.097 -13.997 1.00 0.00 C ATOM 2632 CD2 TYR P 830 4.971 -25.317 -11.654 1.00 0.00 C ATOM 2633 CE1 TYR P 830 4.637 -26.259 -14.225 1.00 0.00 C ATOM 2634 CE2 TYR P 830 4.259 -26.480 -11.873 1.00 0.00 C ATOM 2635 CZ TYR P 830 4.095 -26.947 -13.160 1.00 0.00 C ATOM 2636 OH TYR P 830 3.384 -28.105 -13.383 1.00 0.00 O ATOM 0 H TYR P 830 3.576 -22.107 -13.549 1.00 0.00 H new ATOM 0 HA TYR P 830 5.873 -21.245 -12.205 1.00 0.00 H new ATOM 0 HB2 TYR P 830 7.245 -23.379 -13.016 1.00 0.00 H new ATOM 0 HB3 TYR P 830 6.564 -23.276 -11.404 1.00 0.00 H new ATOM 0 HD1 TYR P 830 5.771 -24.561 -14.834 1.00 0.00 H new ATOM 0 HD2 TYR P 830 5.097 -24.954 -10.645 1.00 0.00 H new ATOM 0 HE1 TYR P 830 4.506 -26.627 -15.232 1.00 0.00 H new ATOM 0 HE2 TYR P 830 3.833 -27.021 -11.041 1.00 0.00 H new ATOM 0 HH TYR P 830 3.071 -28.467 -12.528 1.00 0.00 H new ATOM 2646 N LEU P 831 6.626 -20.584 -14.463 1.00 0.00 N ATOM 2647 CA LEU P 831 7.016 -20.118 -15.788 1.00 0.00 C ATOM 2648 C LEU P 831 8.397 -19.472 -15.754 1.00 0.00 C ATOM 2649 O LEU P 831 8.527 -18.271 -15.521 1.00 0.00 O ATOM 2650 CB LEU P 831 5.987 -19.119 -16.323 1.00 0.00 C ATOM 2651 CG LEU P 831 4.721 -19.745 -16.909 1.00 0.00 C ATOM 2652 CD1 LEU P 831 3.573 -18.747 -16.893 1.00 0.00 C ATOM 2653 CD2 LEU P 831 4.981 -20.242 -18.324 1.00 0.00 C ATOM 0 H LEU P 831 6.960 -20.002 -13.695 1.00 0.00 H new ATOM 0 HA LEU P 831 7.055 -20.982 -16.452 1.00 0.00 H new ATOM 0 HB2 LEU P 831 5.701 -18.447 -15.514 1.00 0.00 H new ATOM 0 HB3 LEU P 831 6.461 -18.509 -17.091 1.00 0.00 H new ATOM 0 HG LEU P 831 4.439 -20.597 -16.291 1.00 0.00 H new ATOM 0 HD11 LEU P 831 2.681 -19.211 -17.314 1.00 0.00 H new ATOM 0 HD12 LEU P 831 3.372 -18.440 -15.867 1.00 0.00 H new ATOM 0 HD13 LEU P 831 3.842 -17.874 -17.487 1.00 0.00 H new ATOM 0 HD21 LEU P 831 4.070 -20.685 -18.727 1.00 0.00 H new ATOM 0 HD22 LEU P 831 5.287 -19.406 -18.953 1.00 0.00 H new ATOM 0 HD23 LEU P 831 5.772 -20.992 -18.307 1.00 0.00 H new ATOM 2665 N ASP P 832 9.427 -20.278 -15.988 1.00 0.00 N ATOM 2666 CA ASP P 832 10.800 -19.787 -15.985 1.00 0.00 C ATOM 2667 C ASP P 832 11.353 -19.708 -17.404 1.00 0.00 C ATOM 2668 O ASP P 832 10.779 -20.362 -18.299 1.00 0.00 O ATOM 2669 CB ASP P 832 11.686 -20.694 -15.129 1.00 0.00 C ATOM 2670 CG ASP P 832 12.984 -20.022 -14.726 1.00 0.00 C ATOM 2671 OD1 ASP P 832 13.008 -19.370 -13.661 1.00 0.00 O ATOM 2672 OD2 ASP P 832 13.975 -20.149 -15.474 1.00 0.00 O ATOM 2673 OXT ASP P 832 12.355 -18.992 -17.607 1.00 0.00 O ATOM 0 H ASP P 832 9.337 -21.275 -16.182 1.00 0.00 H new ATOM 0 HA ASP P 832 10.800 -18.784 -15.559 1.00 0.00 H new ATOM 0 HB2 ASP P 832 11.140 -20.990 -14.233 1.00 0.00 H new ATOM 0 HB3 ASP P 832 11.909 -21.606 -15.682 1.00 0.00 H new TER 2678 ASP P 832