USER MOD reduce.3.24.130724 H: found=0, std=0, add=1088, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1080 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 667 HIS : no HD1:sc= -6.51! C(o=-9.3!,f=-7.2!) USER MOD Set 1.2: A 671 ASN : amide:sc= -2.82 K(o=-9.3,f=-6.2) USER MOD Set 2.1: A 588 TYR OH : rot 180:sc= -0.266 USER MOD Set 2.2: A 622 GLN : amide:sc= -2.34 K(o=-2.6,f=-6.4!) USER MOD Set 3.1: A 553 GLN : amide:sc= -3.35! C(o=-6.2!,f=-12!) USER MOD Set 3.2: A 565 HIS : no HD1:sc= -2.81! C(o=-6.2!,f=-6.1!) USER MOD Single : A 544 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 545 MET CE :methyl -151:sc= 0 (180deg=-0.00518) USER MOD Single : A 546 GLN : amide:sc= -0.25 X(o=-0.25,f=0) USER MOD Single : A 551 HIS : no HD1:sc= -1.49 K(o=-1.5,f=-2.6) USER MOD Single : A 558 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 560 MET CE :methyl 137:sc= -0.206 (180deg=-0.914) USER MOD Single : A 567 SER OG : rot 180:sc= 0 USER MOD Single : A 571 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 575 THR OG1 : rot -159:sc= -1.02 USER MOD Single : A 576 HIS : no HD1:sc= -2.77 K(o=-2.8,f=-3.7!) USER MOD Single : A 577 HIS : no HE2:sc= -14.7! C(o=-15!,f=-15!) USER MOD Single : A 579 ASN : amide:sc= -8.29! C(o=-8.3!,f=-6.2!) USER MOD Single : A 581 ASN : amide:sc= -1.04! X(o=-1!,f=-1.1) USER MOD Single : A 583 ASN : amide:sc= -0.844! C(o=-0.84!,f=-4.4!) USER MOD Single : A 585 SER OG : rot -78:sc= 1.07 USER MOD Single : A 586 ASN : amide:sc= -0.0168 X(o=-0.017,f=-0.0082) USER MOD Single : A 587 TYR OH : rot -80:sc= 0.79 USER MOD Single : A 589 ASN : amide:sc= -1.61! K(o=-1.6!,f=-0.67) USER MOD Single : A 591 SER OG : rot -89:sc= -0.377 USER MOD Single : A 598 ASN : amide:sc= -1.02 K(o=-1,f=-4!) USER MOD Single : A 599 LYS NZ :NH3+ -162:sc= -0.0122 (180deg=-0.168) USER MOD Single : A 602 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 605 LYS NZ :NH3+ -149:sc= -0.0656 (180deg=-0.681) USER MOD Single : A 611 SER OG : rot 38:sc= 0.345 USER MOD Single : A 614 ASN : amide:sc= -2.11 K(o=-2.1,f=-4.1!) USER MOD Single : A 623 MET CE :methyl -150:sc= -1.14 (180deg=-1.68) USER MOD Single : A 625 TYR OH : rot 30:sc= 0 USER MOD Single : A 626 LYS NZ :NH3+ -157:sc=0.000902 (180deg=0) USER MOD Single : A 627 SER OG : rot -48:sc= 0.556 USER MOD Single : A 629 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 637 SER OG : rot 176:sc= -1.21 USER MOD Single : A 638 MET CE :methyl -166:sc= -9.32! (180deg=-10.2!) USER MOD Single : A 642 THR OG1 : rot -89:sc= 1.38 USER MOD Single : A 644 GLN : amide:sc= -1.35! X(o=-1.4!,f=-0.91) USER MOD Single : A 648 GLN : amide:sc= -6.03! C(o=-6!,f=-6.9!) USER MOD Single : A 650 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 653 SER OG : rot 180:sc= 0 USER MOD Single : A 658 SER OG : rot 180:sc= 0 USER MOD Single : A 666 GLN : amide:sc= -0.105 K(o=-0.11,f=-1.5!) USER MOD Single : A 668 CYS SG : rot 180:sc= -1.02 USER MOD Single : A 673 SER OG : rot 180:sc= 0.0214 USER MOD Single : A 676 SER OG : rot 180:sc= -0.612 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 542 2.573 2.414 -3.686 1.00 5.21 N ATOM 2 CA GLY A 542 2.038 1.157 -3.191 1.00 52.33 C ATOM 3 C GLY A 542 2.896 0.607 -2.051 1.00 31.54 C ATOM 4 O GLY A 542 3.971 1.133 -1.767 1.00 54.43 O ATOM 0 HA2 GLY A 542 1.016 1.305 -2.843 1.00 52.33 H new ATOM 0 HA3 GLY A 542 1.996 0.431 -4.003 1.00 52.33 H new ATOM 8 N PRO A 543 2.376 -0.475 -1.410 1.00 55.42 N ATOM 9 CA PRO A 543 3.082 -1.103 -0.307 1.00 1.52 C ATOM 10 C PRO A 543 4.266 -1.929 -0.813 1.00 40.11 C ATOM 11 O PRO A 543 4.560 -1.932 -2.007 1.00 42.44 O ATOM 12 CB PRO A 543 2.033 -1.941 0.405 1.00 24.33 C ATOM 13 CG PRO A 543 0.898 -2.121 -0.589 1.00 14.32 C ATOM 14 CD PRO A 543 1.105 -1.125 -1.719 1.00 25.35 C ATOM 0 HA PRO A 543 3.524 -0.378 0.377 1.00 1.52 H new ATOM 0 HB2 PRO A 543 2.443 -2.904 0.708 1.00 24.33 H new ATOM 0 HB3 PRO A 543 1.684 -1.444 1.310 1.00 24.33 H new ATOM 0 HG2 PRO A 543 0.887 -3.140 -0.976 1.00 14.32 H new ATOM 0 HG3 PRO A 543 -0.064 -1.954 -0.104 1.00 14.32 H new ATOM 0 HD2 PRO A 543 1.141 -1.625 -2.687 1.00 25.35 H new ATOM 0 HD3 PRO A 543 0.291 -0.402 -1.764 1.00 25.35 H new ATOM 22 N HIS A 544 4.913 -2.610 0.121 1.00 62.43 N ATOM 23 CA HIS A 544 6.058 -3.439 -0.216 1.00 24.01 C ATOM 24 C HIS A 544 5.666 -4.915 -0.131 1.00 62.51 C ATOM 25 O HIS A 544 6.530 -5.790 -0.093 1.00 63.03 O ATOM 26 CB HIS A 544 7.258 -3.093 0.668 1.00 1.41 C ATOM 27 CG HIS A 544 7.796 -1.698 0.454 1.00 0.23 C ATOM 28 ND1 HIS A 544 8.782 -1.408 -0.473 1.00 31.51 N ATOM 29 CD2 HIS A 544 7.475 -0.517 1.056 1.00 13.30 C ATOM 30 CE1 HIS A 544 9.035 -0.109 -0.422 1.00 65.11 C ATOM 31 NE2 HIS A 544 8.225 0.442 0.526 1.00 33.24 N ATOM 0 H HIS A 544 4.666 -2.605 1.111 1.00 62.43 H new ATOM 0 HA HIS A 544 6.366 -3.239 -1.242 1.00 24.01 H new ATOM 0 HB2 HIS A 544 6.970 -3.204 1.713 1.00 1.41 H new ATOM 0 HB3 HIS A 544 8.055 -3.812 0.479 1.00 1.41 H new ATOM 0 HD2 HIS A 544 6.736 -0.384 1.832 1.00 13.30 H new ATOM 0 HE1 HIS A 544 9.757 0.421 -1.026 1.00 65.11 H new ATOM 0 HE2 HIS A 544 8.199 1.428 0.785 1.00 33.24 H new ATOM 39 N MET A 545 4.362 -5.147 -0.104 1.00 20.53 N ATOM 40 CA MET A 545 3.844 -6.503 -0.024 1.00 45.11 C ATOM 41 C MET A 545 4.643 -7.337 0.980 1.00 44.24 C ATOM 42 O MET A 545 5.018 -8.472 0.690 1.00 74.20 O ATOM 43 CB MET A 545 3.916 -7.159 -1.405 1.00 1.35 C ATOM 44 CG MET A 545 2.911 -6.522 -2.367 1.00 2.02 C ATOM 45 SD MET A 545 2.731 -7.539 -3.822 1.00 74.42 S ATOM 46 CE MET A 545 1.515 -8.707 -3.235 1.00 73.03 C ATOM 0 H MET A 545 3.648 -4.419 -0.136 1.00 20.53 H new ATOM 0 HA MET A 545 2.808 -6.457 0.313 1.00 45.11 H new ATOM 0 HB2 MET A 545 4.924 -7.058 -1.807 1.00 1.35 H new ATOM 0 HB3 MET A 545 3.713 -8.226 -1.316 1.00 1.35 H new ATOM 0 HG2 MET A 545 1.946 -6.405 -1.873 1.00 2.02 H new ATOM 0 HG3 MET A 545 3.247 -5.525 -2.650 1.00 2.02 H new ATOM 0 HE1 MET A 545 1.648 -9.659 -3.748 1.00 73.03 H new ATOM 0 HE2 MET A 545 1.639 -8.853 -2.162 1.00 73.03 H new ATOM 0 HE3 MET A 545 0.515 -8.323 -3.436 1.00 73.03 H new ATOM 56 N GLN A 546 4.881 -6.741 2.139 1.00 60.21 N ATOM 57 CA GLN A 546 5.629 -7.415 3.187 1.00 13.20 C ATOM 58 C GLN A 546 4.709 -7.751 4.363 1.00 61.13 C ATOM 59 O GLN A 546 3.820 -6.972 4.702 1.00 34.31 O ATOM 60 CB GLN A 546 6.816 -6.566 3.645 1.00 24.33 C ATOM 61 CG GLN A 546 6.354 -5.414 4.540 1.00 65.03 C ATOM 62 CD GLN A 546 7.546 -4.590 5.031 1.00 1.22 C ATOM 63 OE1 GLN A 546 7.740 -4.377 6.217 1.00 50.12 O ATOM 64 NE2 GLN A 546 8.331 -4.139 4.057 1.00 62.44 N ATOM 0 H GLN A 546 4.569 -5.799 2.376 1.00 60.21 H new ATOM 0 HA GLN A 546 6.025 -8.347 2.783 1.00 13.20 H new ATOM 0 HB2 GLN A 546 7.526 -7.190 4.187 1.00 24.33 H new ATOM 0 HB3 GLN A 546 7.340 -6.168 2.776 1.00 24.33 H new ATOM 0 HG2 GLN A 546 5.667 -4.773 3.988 1.00 65.03 H new ATOM 0 HG3 GLN A 546 5.804 -5.810 5.394 1.00 65.03 H new ATOM 0 HE21 GLN A 546 8.111 -4.354 3.084 1.00 62.44 H new ATOM 0 HE22 GLN A 546 9.153 -3.578 4.283 1.00 62.44 H new ATOM 73 N PHE A 547 4.955 -8.912 4.952 1.00 42.01 N ATOM 74 CA PHE A 547 4.160 -9.361 6.082 1.00 3.24 C ATOM 75 C PHE A 547 4.990 -10.237 7.023 1.00 4.20 C ATOM 76 O PHE A 547 5.217 -11.413 6.743 1.00 10.13 O ATOM 77 CB PHE A 547 3.007 -10.191 5.516 1.00 31.45 C ATOM 78 CG PHE A 547 2.479 -9.688 4.171 1.00 22.23 C ATOM 79 CD1 PHE A 547 3.104 -10.048 3.018 1.00 10.22 C ATOM 80 CD2 PHE A 547 1.385 -8.881 4.129 1.00 62.30 C ATOM 81 CE1 PHE A 547 2.614 -9.581 1.770 1.00 42.22 C ATOM 82 CE2 PHE A 547 0.895 -8.414 2.881 1.00 64.33 C ATOM 83 CZ PHE A 547 1.520 -8.774 1.727 1.00 1.14 C ATOM 0 H PHE A 547 5.694 -9.555 4.668 1.00 42.01 H new ATOM 0 HA PHE A 547 3.802 -8.502 6.650 1.00 3.24 H new ATOM 0 HB2 PHE A 547 3.338 -11.223 5.402 1.00 31.45 H new ATOM 0 HB3 PHE A 547 2.189 -10.197 6.237 1.00 31.45 H new ATOM 0 HD1 PHE A 547 3.973 -10.689 3.052 1.00 10.22 H new ATOM 0 HD2 PHE A 547 0.889 -8.595 5.045 1.00 62.30 H new ATOM 0 HE1 PHE A 547 3.110 -9.867 0.854 1.00 42.22 H new ATOM 0 HE2 PHE A 547 0.026 -7.773 2.847 1.00 64.33 H new ATOM 0 HZ PHE A 547 1.147 -8.419 0.777 1.00 1.14 H new ATOM 93 N PRO A 548 5.433 -9.614 8.148 1.00 13.40 N ATOM 94 CA PRO A 548 6.233 -10.324 9.131 1.00 13.55 C ATOM 95 C PRO A 548 5.367 -11.277 9.958 1.00 11.50 C ATOM 96 O PRO A 548 4.232 -10.950 10.302 1.00 2.52 O ATOM 97 CB PRO A 548 6.884 -9.235 9.969 1.00 53.10 C ATOM 98 CG PRO A 548 6.066 -7.977 9.725 1.00 4.41 C ATOM 99 CD PRO A 548 5.184 -8.222 8.512 1.00 12.13 C ATOM 0 HA PRO A 548 6.989 -10.963 8.675 1.00 13.55 H new ATOM 0 HB2 PRO A 548 6.884 -9.502 11.026 1.00 53.10 H new ATOM 0 HB3 PRO A 548 7.924 -9.087 9.678 1.00 53.10 H new ATOM 0 HG2 PRO A 548 5.457 -7.742 10.598 1.00 4.41 H new ATOM 0 HG3 PRO A 548 6.721 -7.123 9.554 1.00 4.41 H new ATOM 0 HD2 PRO A 548 4.133 -8.056 8.747 1.00 12.13 H new ATOM 0 HD3 PRO A 548 5.438 -7.547 7.695 1.00 12.13 H new ATOM 107 N VAL A 549 5.936 -12.436 10.253 1.00 75.42 N ATOM 108 CA VAL A 549 5.230 -13.439 11.033 1.00 71.04 C ATOM 109 C VAL A 549 4.657 -12.788 12.293 1.00 22.33 C ATOM 110 O VAL A 549 3.500 -13.015 12.642 1.00 14.10 O ATOM 111 CB VAL A 549 6.160 -14.615 11.337 1.00 71.33 C ATOM 112 CG1 VAL A 549 6.619 -15.298 10.047 1.00 24.52 C ATOM 113 CG2 VAL A 549 7.358 -14.165 12.175 1.00 15.35 C ATOM 0 H VAL A 549 6.878 -12.703 9.966 1.00 75.42 H new ATOM 0 HA VAL A 549 4.391 -13.844 10.466 1.00 71.04 H new ATOM 0 HB VAL A 549 5.598 -15.344 11.921 1.00 71.33 H new ATOM 0 HG11 VAL A 549 7.279 -16.130 10.291 1.00 24.52 H new ATOM 0 HG12 VAL A 549 5.751 -15.671 9.504 1.00 24.52 H new ATOM 0 HG13 VAL A 549 7.155 -14.580 9.426 1.00 24.52 H new ATOM 0 HG21 VAL A 549 8.003 -15.020 12.377 1.00 15.35 H new ATOM 0 HG22 VAL A 549 7.920 -13.408 11.629 1.00 15.35 H new ATOM 0 HG23 VAL A 549 7.006 -13.746 13.118 1.00 15.35 H new ATOM 123 N GLU A 550 5.494 -11.993 12.942 1.00 4.35 N ATOM 124 CA GLU A 550 5.086 -11.308 14.157 1.00 51.50 C ATOM 125 C GLU A 550 3.805 -10.508 13.910 1.00 31.22 C ATOM 126 O GLU A 550 2.999 -10.323 14.821 1.00 22.31 O ATOM 127 CB GLU A 550 6.204 -10.403 14.679 1.00 23.40 C ATOM 128 CG GLU A 550 6.649 -9.407 13.607 1.00 41.41 C ATOM 129 CD GLU A 550 7.290 -8.170 14.240 1.00 1.01 C ATOM 130 OE1 GLU A 550 8.493 -8.181 14.541 1.00 11.41 O ATOM 131 OE2 GLU A 550 6.492 -7.172 14.416 1.00 11.12 O ATOM 0 H GLU A 550 6.453 -11.808 12.650 1.00 4.35 H new ATOM 0 HA GLU A 550 4.883 -12.057 14.922 1.00 51.50 H new ATOM 0 HB2 GLU A 550 5.858 -9.863 15.561 1.00 23.40 H new ATOM 0 HB3 GLU A 550 7.053 -11.011 14.990 1.00 23.40 H new ATOM 0 HG2 GLU A 550 7.360 -9.885 12.934 1.00 41.41 H new ATOM 0 HG3 GLU A 550 5.791 -9.108 13.004 1.00 41.41 H new ATOM 139 N HIS A 551 3.657 -10.056 12.674 1.00 54.41 N ATOM 140 CA HIS A 551 2.487 -9.280 12.296 1.00 62.41 C ATOM 141 C HIS A 551 1.375 -10.223 11.832 1.00 51.24 C ATOM 142 O HIS A 551 0.194 -9.893 11.932 1.00 2.24 O ATOM 143 CB HIS A 551 2.849 -8.228 11.246 1.00 2.12 C ATOM 144 CG HIS A 551 3.320 -6.916 11.828 1.00 30.45 C ATOM 145 ND1 HIS A 551 3.658 -5.827 11.045 1.00 12.41 N ATOM 146 CD2 HIS A 551 3.504 -6.532 13.124 1.00 45.51 C ATOM 147 CE1 HIS A 551 4.028 -4.836 11.844 1.00 64.54 C ATOM 148 NE2 HIS A 551 3.933 -5.275 13.131 1.00 22.45 N ATOM 0 H HIS A 551 4.327 -10.212 11.921 1.00 54.41 H new ATOM 0 HA HIS A 551 2.114 -8.732 13.161 1.00 62.41 H new ATOM 0 HB2 HIS A 551 3.630 -8.628 10.600 1.00 2.12 H new ATOM 0 HB3 HIS A 551 1.978 -8.043 10.617 1.00 2.12 H new ATOM 0 HD2 HIS A 551 3.330 -7.145 13.996 1.00 45.51 H new ATOM 0 HE1 HIS A 551 4.348 -3.853 11.530 1.00 64.54 H new ATOM 0 HE2 HIS A 551 4.155 -4.728 13.963 1.00 22.45 H new ATOM 156 N VAL A 552 1.791 -11.377 11.333 1.00 64.33 N ATOM 157 CA VAL A 552 0.845 -12.370 10.852 1.00 22.05 C ATOM 158 C VAL A 552 0.355 -13.213 12.031 1.00 22.42 C ATOM 159 O VAL A 552 1.158 -13.799 12.756 1.00 10.03 O ATOM 160 CB VAL A 552 1.484 -13.208 9.743 1.00 54.44 C ATOM 161 CG1 VAL A 552 0.614 -14.419 9.401 1.00 51.03 C ATOM 162 CG2 VAL A 552 1.752 -12.357 8.500 1.00 64.14 C ATOM 0 H VAL A 552 2.771 -11.647 11.251 1.00 64.33 H new ATOM 0 HA VAL A 552 -0.027 -11.886 10.413 1.00 22.05 H new ATOM 0 HB VAL A 552 2.442 -13.577 10.110 1.00 54.44 H new ATOM 0 HG11 VAL A 552 1.091 -14.998 8.610 1.00 51.03 H new ATOM 0 HG12 VAL A 552 0.495 -15.043 10.286 1.00 51.03 H new ATOM 0 HG13 VAL A 552 -0.365 -14.080 9.062 1.00 51.03 H new ATOM 0 HG21 VAL A 552 2.206 -12.976 7.726 1.00 64.14 H new ATOM 0 HG22 VAL A 552 0.812 -11.946 8.131 1.00 64.14 H new ATOM 0 HG23 VAL A 552 2.429 -11.542 8.756 1.00 64.14 H new ATOM 172 N GLN A 553 -0.960 -13.248 12.186 1.00 31.51 N ATOM 173 CA GLN A 553 -1.567 -14.010 13.264 1.00 23.55 C ATOM 174 C GLN A 553 -2.352 -15.196 12.700 1.00 21.22 C ATOM 175 O GLN A 553 -2.879 -15.125 11.591 1.00 64.01 O ATOM 176 CB GLN A 553 -2.463 -13.121 14.128 1.00 2.41 C ATOM 177 CG GLN A 553 -2.895 -13.849 15.402 1.00 73.51 C ATOM 178 CD GLN A 553 -3.053 -12.871 16.567 1.00 5.52 C ATOM 179 OE1 GLN A 553 -2.252 -12.826 17.487 1.00 61.13 O ATOM 180 NE2 GLN A 553 -4.126 -12.091 16.478 1.00 53.14 N ATOM 0 H GLN A 553 -1.623 -12.761 11.583 1.00 31.51 H new ATOM 0 HA GLN A 553 -0.771 -14.396 13.901 1.00 23.55 H new ATOM 0 HB2 GLN A 553 -1.930 -12.207 14.390 1.00 2.41 H new ATOM 0 HB3 GLN A 553 -3.344 -12.824 13.559 1.00 2.41 H new ATOM 0 HG2 GLN A 553 -3.838 -14.367 15.227 1.00 73.51 H new ATOM 0 HG3 GLN A 553 -2.157 -14.609 15.658 1.00 73.51 H new ATOM 0 HE21 GLN A 553 -4.756 -12.180 15.681 1.00 53.14 H new ATOM 0 HE22 GLN A 553 -4.319 -11.404 17.207 1.00 53.14 H new ATOM 189 N LEU A 554 -2.406 -16.259 13.490 1.00 44.13 N ATOM 190 CA LEU A 554 -3.118 -17.458 13.083 1.00 62.33 C ATOM 191 C LEU A 554 -4.550 -17.401 13.617 1.00 74.44 C ATOM 192 O LEU A 554 -4.768 -17.447 14.826 1.00 31.34 O ATOM 193 CB LEU A 554 -2.350 -18.709 13.514 1.00 60.52 C ATOM 194 CG LEU A 554 -1.137 -19.080 12.658 1.00 72.42 C ATOM 195 CD1 LEU A 554 -0.956 -20.598 12.592 1.00 74.14 C ATOM 196 CD2 LEU A 554 -1.236 -18.454 11.266 1.00 53.44 C ATOM 0 H LEU A 554 -1.968 -16.314 14.410 1.00 44.13 H new ATOM 0 HA LEU A 554 -3.185 -17.512 11.996 1.00 62.33 H new ATOM 0 HB2 LEU A 554 -2.015 -18.569 14.542 1.00 60.52 H new ATOM 0 HB3 LEU A 554 -3.040 -19.552 13.515 1.00 60.52 H new ATOM 0 HG LEU A 554 -0.246 -18.670 13.133 1.00 72.42 H new ATOM 0 HD11 LEU A 554 -0.087 -20.834 11.978 1.00 74.14 H new ATOM 0 HD12 LEU A 554 -0.807 -20.991 13.598 1.00 74.14 H new ATOM 0 HD13 LEU A 554 -1.845 -21.052 12.153 1.00 74.14 H new ATOM 0 HD21 LEU A 554 -0.362 -18.733 10.678 1.00 53.44 H new ATOM 0 HD22 LEU A 554 -2.137 -18.813 10.769 1.00 53.44 H new ATOM 0 HD23 LEU A 554 -1.280 -17.369 11.357 1.00 53.44 H new ATOM 208 N LEU A 555 -5.490 -17.302 12.688 1.00 35.42 N ATOM 209 CA LEU A 555 -6.896 -17.239 13.050 1.00 12.13 C ATOM 210 C LEU A 555 -7.694 -18.181 12.147 1.00 53.02 C ATOM 211 O LEU A 555 -7.157 -18.857 11.271 1.00 65.35 O ATOM 212 CB LEU A 555 -7.392 -15.792 13.021 1.00 52.22 C ATOM 213 CG LEU A 555 -6.348 -14.718 13.335 1.00 60.33 C ATOM 214 CD1 LEU A 555 -5.795 -14.099 12.050 1.00 63.44 C ATOM 215 CD2 LEU A 555 -6.917 -13.660 14.282 1.00 52.03 C ATOM 0 H LEU A 555 -5.305 -17.264 11.686 1.00 35.42 H new ATOM 0 HA LEU A 555 -7.041 -17.581 14.075 1.00 12.13 H new ATOM 0 HB2 LEU A 555 -7.806 -15.590 12.033 1.00 52.22 H new ATOM 0 HB3 LEU A 555 -8.210 -15.695 13.735 1.00 52.22 H new ATOM 0 HG LEU A 555 -5.513 -15.194 13.849 1.00 60.33 H new ATOM 0 HD11 LEU A 555 -5.055 -13.339 12.301 1.00 63.44 H new ATOM 0 HD12 LEU A 555 -5.327 -14.875 11.445 1.00 63.44 H new ATOM 0 HD13 LEU A 555 -6.609 -13.641 11.487 1.00 63.44 H new ATOM 0 HD21 LEU A 555 -6.155 -12.909 14.489 1.00 52.03 H new ATOM 0 HD22 LEU A 555 -7.780 -13.183 13.818 1.00 52.03 H new ATOM 0 HD23 LEU A 555 -7.222 -14.133 15.215 1.00 52.03 H new ATOM 227 N CYS A 556 -9.003 -18.210 12.382 1.00 65.45 N ATOM 228 CA CYS A 556 -9.900 -19.058 11.606 1.00 30.14 C ATOM 229 C CYS A 556 -10.751 -18.223 10.654 1.00 65.15 C ATOM 230 O CYS A 556 -11.718 -17.604 11.095 1.00 25.31 O ATOM 231 CB CYS A 556 -10.804 -19.867 12.539 1.00 51.34 C ATOM 232 SG CYS A 556 -11.493 -21.375 11.782 1.00 3.52 S ATOM 0 H CYS A 556 -9.465 -17.656 13.103 1.00 65.45 H new ATOM 0 HA CYS A 556 -9.292 -19.743 11.015 1.00 30.14 H new ATOM 0 HB2 CYS A 556 -10.236 -20.146 13.427 1.00 51.34 H new ATOM 0 HB3 CYS A 556 -11.625 -19.233 12.872 1.00 51.34 H new ATOM 237 N ILE A 557 -10.376 -18.223 9.383 1.00 74.15 N ATOM 238 CA ILE A 557 -11.111 -17.463 8.386 1.00 14.20 C ATOM 239 C ILE A 557 -12.601 -17.477 8.736 1.00 3.25 C ATOM 240 O ILE A 557 -13.307 -16.497 8.501 1.00 24.44 O ATOM 241 CB ILE A 557 -10.805 -17.985 6.981 1.00 54.32 C ATOM 242 CG1 ILE A 557 -11.795 -19.079 6.575 1.00 64.21 C ATOM 243 CG2 ILE A 557 -9.354 -18.456 6.875 1.00 23.42 C ATOM 244 CD1 ILE A 557 -11.565 -19.516 5.127 1.00 52.14 C ATOM 0 H ILE A 557 -9.573 -18.737 9.021 1.00 74.15 H new ATOM 0 HA ILE A 557 -10.792 -16.421 8.390 1.00 14.20 H new ATOM 0 HB ILE A 557 -10.928 -17.162 6.276 1.00 54.32 H new ATOM 0 HG12 ILE A 557 -11.687 -19.937 7.239 1.00 64.21 H new ATOM 0 HG13 ILE A 557 -12.815 -18.713 6.690 1.00 64.21 H new ATOM 0 HG21 ILE A 557 -9.163 -18.822 5.866 1.00 23.42 H new ATOM 0 HG22 ILE A 557 -8.685 -17.624 7.092 1.00 23.42 H new ATOM 0 HG23 ILE A 557 -9.179 -19.259 7.591 1.00 23.42 H new ATOM 0 HD11 ILE A 557 -12.281 -20.294 4.864 1.00 52.14 H new ATOM 0 HD12 ILE A 557 -11.697 -18.661 4.464 1.00 52.14 H new ATOM 0 HD13 ILE A 557 -10.552 -19.904 5.021 1.00 52.14 H new ATOM 256 N ASN A 558 -13.034 -18.598 9.293 1.00 34.30 N ATOM 257 CA ASN A 558 -14.427 -18.753 9.678 1.00 1.22 C ATOM 258 C ASN A 558 -14.699 -17.924 10.935 1.00 1.11 C ATOM 259 O ASN A 558 -15.509 -16.999 10.910 1.00 50.34 O ATOM 260 CB ASN A 558 -14.752 -20.214 9.996 1.00 44.31 C ATOM 261 CG ASN A 558 -15.078 -20.993 8.720 1.00 14.33 C ATOM 262 OD1 ASN A 558 -14.437 -20.849 7.693 1.00 63.23 O ATOM 263 ND2 ASN A 558 -16.110 -21.823 8.843 1.00 61.20 N ATOM 0 H ASN A 558 -12.445 -19.408 9.487 1.00 34.30 H new ATOM 0 HA ASN A 558 -15.046 -18.419 8.845 1.00 1.22 H new ATOM 0 HB2 ASN A 558 -13.905 -20.677 10.503 1.00 44.31 H new ATOM 0 HB3 ASN A 558 -15.598 -20.261 10.682 1.00 44.31 H new ATOM 0 HD21 ASN A 558 -16.408 -22.388 8.047 1.00 61.20 H new ATOM 0 HD22 ASN A 558 -16.603 -21.895 9.733 1.00 61.20 H new ATOM 270 N CYS A 559 -14.006 -18.286 12.005 1.00 12.41 N ATOM 271 CA CYS A 559 -14.163 -17.587 13.269 1.00 1.24 C ATOM 272 C CYS A 559 -13.340 -16.298 13.211 1.00 32.22 C ATOM 273 O CYS A 559 -13.898 -15.202 13.188 1.00 62.11 O ATOM 274 CB CYS A 559 -13.762 -18.467 14.455 1.00 13.33 C ATOM 275 SG CYS A 559 -13.984 -20.263 14.187 1.00 22.32 S ATOM 0 H CYS A 559 -13.335 -19.054 12.022 1.00 12.41 H new ATOM 0 HA CYS A 559 -15.213 -17.340 13.423 1.00 1.24 H new ATOM 0 HB2 CYS A 559 -12.716 -18.276 14.694 1.00 13.33 H new ATOM 0 HB3 CYS A 559 -14.347 -18.169 15.325 1.00 13.33 H new ATOM 280 N MET A 560 -12.027 -16.473 13.189 1.00 10.34 N ATOM 281 CA MET A 560 -11.122 -15.337 13.134 1.00 21.34 C ATOM 282 C MET A 560 -10.982 -14.680 14.509 1.00 31.52 C ATOM 283 O MET A 560 -11.082 -13.461 14.631 1.00 13.44 O ATOM 284 CB MET A 560 -11.650 -14.311 12.130 1.00 71.53 C ATOM 285 CG MET A 560 -12.063 -14.988 10.821 1.00 34.31 C ATOM 286 SD MET A 560 -12.751 -13.781 9.700 1.00 24.21 S ATOM 287 CE MET A 560 -14.492 -14.077 9.956 1.00 73.24 C ATOM 0 H MET A 560 -11.568 -17.384 13.208 1.00 10.34 H new ATOM 0 HA MET A 560 -10.141 -15.694 12.821 1.00 21.34 H new ATOM 0 HB2 MET A 560 -12.504 -13.785 12.557 1.00 71.53 H new ATOM 0 HB3 MET A 560 -10.882 -13.563 11.931 1.00 71.53 H new ATOM 0 HG2 MET A 560 -11.199 -15.471 10.363 1.00 34.31 H new ATOM 0 HG3 MET A 560 -12.796 -15.769 11.022 1.00 34.31 H new ATOM 0 HE1 MET A 560 -15.017 -13.124 10.025 1.00 73.24 H new ATOM 0 HE2 MET A 560 -14.890 -14.651 9.119 1.00 73.24 H new ATOM 0 HE3 MET A 560 -14.634 -14.637 10.880 1.00 73.24 H new ATOM 297 N VAL A 561 -10.753 -15.518 15.509 1.00 23.54 N ATOM 298 CA VAL A 561 -10.598 -15.035 16.871 1.00 50.42 C ATOM 299 C VAL A 561 -9.134 -15.175 17.294 1.00 14.41 C ATOM 300 O VAL A 561 -8.763 -14.777 18.397 1.00 43.51 O ATOM 301 CB VAL A 561 -11.563 -15.773 17.801 1.00 3.53 C ATOM 302 CG1 VAL A 561 -12.840 -16.174 17.060 1.00 2.35 C ATOM 303 CG2 VAL A 561 -10.889 -16.992 18.434 1.00 73.25 C ATOM 0 H VAL A 561 -10.671 -16.529 15.403 1.00 23.54 H new ATOM 0 HA VAL A 561 -10.854 -13.977 16.933 1.00 50.42 H new ATOM 0 HB VAL A 561 -11.843 -15.091 18.604 1.00 3.53 H new ATOM 0 HG11 VAL A 561 -13.509 -16.697 17.744 1.00 2.35 H new ATOM 0 HG12 VAL A 561 -13.336 -15.281 16.680 1.00 2.35 H new ATOM 0 HG13 VAL A 561 -12.587 -16.830 16.228 1.00 2.35 H new ATOM 0 HG21 VAL A 561 -11.596 -17.499 19.090 1.00 73.25 H new ATOM 0 HG22 VAL A 561 -10.566 -17.677 17.650 1.00 73.25 H new ATOM 0 HG23 VAL A 561 -10.024 -16.670 19.013 1.00 73.25 H new ATOM 313 N ALA A 562 -8.343 -15.742 16.395 1.00 14.31 N ATOM 314 CA ALA A 562 -6.929 -15.939 16.662 1.00 63.34 C ATOM 315 C ALA A 562 -6.741 -17.228 17.464 1.00 25.14 C ATOM 316 O ALA A 562 -6.935 -17.241 18.679 1.00 73.12 O ATOM 317 CB ALA A 562 -6.370 -14.714 17.387 1.00 43.41 C ATOM 0 H ALA A 562 -8.655 -16.071 15.481 1.00 14.31 H new ATOM 0 HA ALA A 562 -6.374 -16.047 15.730 1.00 63.34 H new ATOM 0 HB1 ALA A 562 -5.309 -14.862 17.587 1.00 43.41 H new ATOM 0 HB2 ALA A 562 -6.501 -13.830 16.763 1.00 43.41 H new ATOM 0 HB3 ALA A 562 -6.901 -14.575 18.329 1.00 43.41 H new ATOM 323 N VAL A 563 -6.364 -18.281 16.753 1.00 1.34 N ATOM 324 CA VAL A 563 -6.147 -19.571 17.385 1.00 72.45 C ATOM 325 C VAL A 563 -4.654 -19.754 17.664 1.00 40.53 C ATOM 326 O VAL A 563 -4.250 -20.735 18.286 1.00 53.22 O ATOM 327 CB VAL A 563 -6.733 -20.685 16.513 1.00 3.24 C ATOM 328 CG1 VAL A 563 -8.248 -20.786 16.698 1.00 51.42 C ATOM 329 CG2 VAL A 563 -6.372 -20.476 15.041 1.00 0.03 C ATOM 0 H VAL A 563 -6.203 -18.267 15.746 1.00 1.34 H new ATOM 0 HA VAL A 563 -6.664 -19.619 18.343 1.00 72.45 H new ATOM 0 HB VAL A 563 -6.293 -21.629 16.834 1.00 3.24 H new ATOM 0 HG11 VAL A 563 -8.639 -21.585 16.068 1.00 51.42 H new ATOM 0 HG12 VAL A 563 -8.473 -21.004 17.742 1.00 51.42 H new ATOM 0 HG13 VAL A 563 -8.713 -19.841 16.417 1.00 51.42 H new ATOM 0 HG21 VAL A 563 -6.800 -21.281 14.444 1.00 0.03 H new ATOM 0 HG22 VAL A 563 -6.770 -19.520 14.701 1.00 0.03 H new ATOM 0 HG23 VAL A 563 -5.288 -20.478 14.928 1.00 0.03 H new ATOM 339 N GLY A 564 -3.875 -18.792 17.190 1.00 24.50 N ATOM 340 CA GLY A 564 -2.435 -18.834 17.381 1.00 63.42 C ATOM 341 C GLY A 564 -1.759 -17.631 16.720 1.00 22.23 C ATOM 342 O GLY A 564 -2.410 -16.627 16.438 1.00 40.42 O ATOM 0 H GLY A 564 -4.214 -17.980 16.675 1.00 24.50 H new ATOM 0 HA2 GLY A 564 -2.206 -18.844 18.447 1.00 63.42 H new ATOM 0 HA3 GLY A 564 -2.035 -19.757 16.960 1.00 63.42 H new ATOM 346 N HIS A 565 -0.461 -17.773 16.493 1.00 12.34 N ATOM 347 CA HIS A 565 0.310 -16.710 15.871 1.00 1.25 C ATOM 348 C HIS A 565 1.042 -17.257 14.644 1.00 33.23 C ATOM 349 O HIS A 565 1.432 -18.423 14.619 1.00 60.44 O ATOM 350 CB HIS A 565 1.255 -16.060 16.884 1.00 22.33 C ATOM 351 CG HIS A 565 0.599 -15.013 17.752 1.00 4.30 C ATOM 352 ND1 HIS A 565 0.881 -13.662 17.639 1.00 74.30 N ATOM 353 CD2 HIS A 565 -0.327 -15.131 18.746 1.00 20.21 C ATOM 354 CE1 HIS A 565 0.152 -13.007 18.530 1.00 35.23 C ATOM 355 NE2 HIS A 565 -0.596 -13.919 19.216 1.00 62.31 N ATOM 0 H HIS A 565 0.076 -18.608 16.729 1.00 12.34 H new ATOM 0 HA HIS A 565 -0.361 -15.922 15.529 1.00 1.25 H new ATOM 0 HB2 HIS A 565 1.675 -16.836 17.524 1.00 22.33 H new ATOM 0 HB3 HIS A 565 2.087 -15.604 16.348 1.00 22.33 H new ATOM 0 HD2 HIS A 565 -0.767 -16.054 19.092 1.00 20.21 H new ATOM 0 HE1 HIS A 565 0.150 -11.938 18.686 1.00 35.23 H new ATOM 0 HE2 HIS A 565 -1.253 -13.705 19.966 1.00 62.31 H new ATOM 363 N GLY A 566 1.205 -16.389 13.657 1.00 63.22 N ATOM 364 CA GLY A 566 1.883 -16.771 12.429 1.00 0.14 C ATOM 365 C GLY A 566 3.385 -16.948 12.664 1.00 15.14 C ATOM 366 O GLY A 566 4.088 -17.497 11.818 1.00 4.31 O ATOM 0 H GLY A 566 0.880 -15.423 13.682 1.00 63.22 H new ATOM 0 HA2 GLY A 566 1.459 -17.700 12.049 1.00 0.14 H new ATOM 0 HA3 GLY A 566 1.718 -16.010 11.666 1.00 0.14 H new ATOM 370 N SER A 567 3.831 -16.473 13.818 1.00 55.30 N ATOM 371 CA SER A 567 5.236 -16.572 14.175 1.00 54.40 C ATOM 372 C SER A 567 5.434 -17.671 15.220 1.00 32.32 C ATOM 373 O SER A 567 6.523 -17.819 15.773 1.00 52.53 O ATOM 374 CB SER A 567 5.765 -15.237 14.702 1.00 1.42 C ATOM 375 OG SER A 567 5.419 -15.027 16.069 1.00 65.41 O ATOM 0 H SER A 567 3.244 -16.019 14.518 1.00 55.30 H new ATOM 0 HA SER A 567 5.800 -16.827 13.278 1.00 54.40 H new ATOM 0 HB2 SER A 567 6.849 -15.209 14.594 1.00 1.42 H new ATOM 0 HB3 SER A 567 5.363 -14.424 14.097 1.00 1.42 H new ATOM 0 HG SER A 567 5.776 -14.165 16.368 1.00 65.41 H new ATOM 381 N ASP A 568 4.364 -18.415 15.460 1.00 70.32 N ATOM 382 CA ASP A 568 4.407 -19.497 16.429 1.00 74.12 C ATOM 383 C ASP A 568 4.323 -20.837 15.695 1.00 64.01 C ATOM 384 O ASP A 568 4.591 -21.886 16.278 1.00 21.24 O ATOM 385 CB ASP A 568 3.226 -19.415 17.398 1.00 32.02 C ATOM 386 CG ASP A 568 3.457 -18.531 18.625 1.00 12.51 C ATOM 387 OD1 ASP A 568 2.653 -18.525 19.569 1.00 32.31 O ATOM 388 OD2 ASP A 568 4.529 -17.815 18.587 1.00 4.12 O ATOM 0 H ASP A 568 3.462 -18.290 15.000 1.00 70.32 H new ATOM 0 HA ASP A 568 5.339 -19.413 16.988 1.00 74.12 H new ATOM 0 HB2 ASP A 568 2.357 -19.040 16.857 1.00 32.02 H new ATOM 0 HB3 ASP A 568 2.981 -20.422 17.735 1.00 32.02 H new ATOM 394 N LEU A 569 3.951 -20.758 14.426 1.00 61.12 N ATOM 395 CA LEU A 569 3.829 -21.952 13.606 1.00 43.40 C ATOM 396 C LEU A 569 5.181 -22.261 12.960 1.00 61.42 C ATOM 397 O LEU A 569 5.974 -21.356 12.707 1.00 4.12 O ATOM 398 CB LEU A 569 2.688 -21.796 12.599 1.00 13.23 C ATOM 399 CG LEU A 569 2.677 -20.495 11.793 1.00 21.40 C ATOM 400 CD1 LEU A 569 4.094 -20.097 11.377 1.00 43.03 C ATOM 401 CD2 LEU A 569 1.736 -20.603 10.592 1.00 53.32 C ATOM 0 H LEU A 569 3.730 -19.886 13.945 1.00 61.12 H new ATOM 0 HA LEU A 569 3.565 -22.812 14.221 1.00 43.40 H new ATOM 0 HB2 LEU A 569 2.729 -22.632 11.901 1.00 13.23 H new ATOM 0 HB3 LEU A 569 1.743 -21.875 13.136 1.00 13.23 H new ATOM 0 HG LEU A 569 2.293 -19.700 12.432 1.00 21.40 H new ATOM 0 HD11 LEU A 569 4.058 -19.169 10.806 1.00 43.03 H new ATOM 0 HD12 LEU A 569 4.707 -19.952 12.266 1.00 43.03 H new ATOM 0 HD13 LEU A 569 4.528 -20.886 10.762 1.00 43.03 H new ATOM 0 HD21 LEU A 569 1.747 -19.665 10.036 1.00 53.32 H new ATOM 0 HD22 LEU A 569 2.066 -21.414 9.943 1.00 53.32 H new ATOM 0 HD23 LEU A 569 0.723 -20.807 10.940 1.00 53.32 H new ATOM 413 N ARG A 570 5.402 -23.544 12.711 1.00 52.22 N ATOM 414 CA ARG A 570 6.644 -23.984 12.099 1.00 70.32 C ATOM 415 C ARG A 570 6.355 -24.776 10.822 1.00 41.33 C ATOM 416 O ARG A 570 5.204 -24.883 10.401 1.00 63.13 O ATOM 417 CB ARG A 570 7.452 -24.858 13.060 1.00 30.13 C ATOM 418 CG ARG A 570 8.326 -24.000 13.978 1.00 34.50 C ATOM 419 CD ARG A 570 7.539 -23.535 15.205 1.00 4.32 C ATOM 420 NE ARG A 570 8.378 -22.641 16.035 1.00 65.15 N ATOM 421 CZ ARG A 570 9.435 -23.057 16.764 1.00 25.11 C ATOM 422 NH1 ARG A 570 9.792 -24.359 16.773 1.00 61.12 N ATOM 423 NH2 ARG A 570 10.115 -22.172 17.469 1.00 51.41 N ATOM 0 H ARG A 570 4.742 -24.292 12.922 1.00 52.22 H new ATOM 0 HA ARG A 570 7.227 -23.095 11.856 1.00 70.32 H new ATOM 0 HB2 ARG A 570 6.775 -25.466 13.660 1.00 30.13 H new ATOM 0 HB3 ARG A 570 8.080 -25.545 12.492 1.00 30.13 H new ATOM 0 HG2 ARG A 570 9.198 -24.572 14.296 1.00 34.50 H new ATOM 0 HG3 ARG A 570 8.696 -23.134 13.429 1.00 34.50 H new ATOM 0 HD2 ARG A 570 6.636 -23.012 14.891 1.00 4.32 H new ATOM 0 HD3 ARG A 570 7.221 -24.397 15.791 1.00 4.32 H new ATOM 0 HE ARG A 570 8.143 -21.649 16.057 1.00 65.15 H new ATOM 0 HH11 ARG A 570 9.262 -25.037 16.226 1.00 61.12 H new ATOM 0 HH12 ARG A 570 10.592 -24.665 17.327 1.00 61.12 H new ATOM 0 HH21 ARG A 570 9.839 -21.190 17.458 1.00 51.41 H new ATOM 0 HH22 ARG A 570 10.916 -22.470 18.025 1.00 51.41 H new ATOM 436 N LYS A 571 7.420 -25.310 10.241 1.00 55.51 N ATOM 437 CA LYS A 571 7.295 -26.088 9.020 1.00 13.12 C ATOM 438 C LYS A 571 7.913 -27.471 9.237 1.00 51.43 C ATOM 439 O LYS A 571 8.744 -27.651 10.126 1.00 54.33 O ATOM 440 CB LYS A 571 7.892 -25.326 7.835 1.00 12.14 C ATOM 441 CG LYS A 571 7.147 -25.655 6.540 1.00 32.12 C ATOM 442 CD LYS A 571 7.963 -25.235 5.316 1.00 11.42 C ATOM 443 CE LYS A 571 8.313 -23.746 5.376 1.00 62.52 C ATOM 444 NZ LYS A 571 8.482 -23.199 4.011 1.00 4.12 N ATOM 0 H LYS A 571 8.373 -25.219 10.593 1.00 55.51 H new ATOM 0 HA LYS A 571 6.245 -26.243 8.772 1.00 13.12 H new ATOM 0 HB2 LYS A 571 7.842 -24.254 8.025 1.00 12.14 H new ATOM 0 HB3 LYS A 571 8.946 -25.582 7.727 1.00 12.14 H new ATOM 0 HG2 LYS A 571 6.943 -26.725 6.496 1.00 32.12 H new ATOM 0 HG3 LYS A 571 6.183 -25.146 6.531 1.00 32.12 H new ATOM 0 HD2 LYS A 571 8.878 -25.826 5.264 1.00 11.42 H new ATOM 0 HD3 LYS A 571 7.397 -25.443 4.408 1.00 11.42 H new ATOM 0 HE2 LYS A 571 7.526 -23.202 5.898 1.00 62.52 H new ATOM 0 HE3 LYS A 571 9.230 -23.605 5.947 1.00 62.52 H new ATOM 0 HZ1 LYS A 571 8.719 -22.188 4.069 1.00 4.12 H new ATOM 0 HZ2 LYS A 571 9.249 -23.707 3.526 1.00 4.12 H new ATOM 0 HZ3 LYS A 571 7.597 -23.317 3.478 1.00 4.12 H new ATOM 457 N VAL A 572 7.484 -28.412 8.409 1.00 53.32 N ATOM 458 CA VAL A 572 7.985 -29.773 8.498 1.00 14.35 C ATOM 459 C VAL A 572 8.417 -30.245 7.109 1.00 71.01 C ATOM 460 O VAL A 572 7.577 -30.565 6.269 1.00 21.21 O ATOM 461 CB VAL A 572 6.929 -30.678 9.136 1.00 33.00 C ATOM 462 CG1 VAL A 572 7.117 -32.132 8.698 1.00 14.12 C ATOM 463 CG2 VAL A 572 6.952 -30.557 10.661 1.00 35.21 C ATOM 0 H VAL A 572 6.795 -28.259 7.673 1.00 53.32 H new ATOM 0 HA VAL A 572 8.863 -29.816 9.143 1.00 14.35 H new ATOM 0 HB VAL A 572 5.950 -30.347 8.789 1.00 33.00 H new ATOM 0 HG11 VAL A 572 6.354 -32.754 9.165 1.00 14.12 H new ATOM 0 HG12 VAL A 572 7.027 -32.200 7.614 1.00 14.12 H new ATOM 0 HG13 VAL A 572 8.105 -32.479 9.002 1.00 14.12 H new ATOM 0 HG21 VAL A 572 6.192 -31.210 11.089 1.00 35.21 H new ATOM 0 HG22 VAL A 572 7.934 -30.849 11.034 1.00 35.21 H new ATOM 0 HG23 VAL A 572 6.747 -29.525 10.947 1.00 35.21 H new ATOM 473 N GLU A 573 9.726 -30.274 6.909 1.00 4.55 N ATOM 474 CA GLU A 573 10.280 -30.701 5.636 1.00 23.41 C ATOM 475 C GLU A 573 9.460 -30.126 4.480 1.00 11.21 C ATOM 476 O GLU A 573 9.284 -30.780 3.453 1.00 12.23 O ATOM 477 CB GLU A 573 10.349 -32.228 5.553 1.00 0.51 C ATOM 478 CG GLU A 573 8.947 -32.840 5.539 1.00 52.40 C ATOM 479 CD GLU A 573 9.010 -34.351 5.308 1.00 45.31 C ATOM 480 OE1 GLU A 573 8.015 -34.955 4.881 1.00 45.02 O ATOM 481 OE2 GLU A 573 10.145 -34.898 5.587 1.00 12.34 O ATOM 0 H GLU A 573 10.420 -30.008 7.608 1.00 4.55 H new ATOM 0 HA GLU A 573 11.298 -30.319 5.559 1.00 23.41 H new ATOM 0 HB2 GLU A 573 10.887 -32.523 4.652 1.00 0.51 H new ATOM 0 HB3 GLU A 573 10.911 -32.617 6.402 1.00 0.51 H new ATOM 0 HG2 GLU A 573 8.447 -32.634 6.485 1.00 52.40 H new ATOM 0 HG3 GLU A 573 8.351 -32.373 4.755 1.00 52.40 H new ATOM 489 N GLY A 574 8.980 -28.908 4.686 1.00 72.21 N ATOM 490 CA GLY A 574 8.182 -28.237 3.674 1.00 61.25 C ATOM 491 C GLY A 574 7.197 -29.208 3.019 1.00 22.10 C ATOM 492 O GLY A 574 7.086 -29.253 1.795 1.00 75.41 O ATOM 0 H GLY A 574 9.129 -28.369 5.539 1.00 72.21 H new ATOM 0 HA2 GLY A 574 7.636 -27.409 4.126 1.00 61.25 H new ATOM 0 HA3 GLY A 574 8.836 -27.810 2.914 1.00 61.25 H new ATOM 496 N THR A 575 6.508 -29.961 3.864 1.00 41.12 N ATOM 497 CA THR A 575 5.536 -30.928 3.383 1.00 63.21 C ATOM 498 C THR A 575 4.119 -30.492 3.759 1.00 52.05 C ATOM 499 O THR A 575 3.206 -30.559 2.936 1.00 24.34 O ATOM 500 CB THR A 575 5.918 -32.300 3.942 1.00 22.21 C ATOM 501 OG1 THR A 575 6.968 -32.744 3.087 1.00 53.04 O ATOM 502 CG2 THR A 575 4.813 -33.340 3.747 1.00 63.42 C ATOM 0 H THR A 575 6.604 -29.921 4.879 1.00 41.12 H new ATOM 0 HA THR A 575 5.545 -30.990 2.295 1.00 63.21 H new ATOM 0 HB THR A 575 6.146 -32.208 5.004 1.00 22.21 H new ATOM 0 HG1 THR A 575 7.050 -33.719 3.148 1.00 53.04 H new ATOM 0 HG21 THR A 575 5.135 -34.295 4.161 1.00 63.42 H new ATOM 0 HG22 THR A 575 3.908 -33.010 4.258 1.00 63.42 H new ATOM 0 HG23 THR A 575 4.607 -33.457 2.683 1.00 63.42 H new ATOM 510 N HIS A 576 3.979 -30.054 5.001 1.00 34.42 N ATOM 511 CA HIS A 576 2.688 -29.607 5.496 1.00 74.21 C ATOM 512 C HIS A 576 2.890 -28.703 6.713 1.00 11.51 C ATOM 513 O HIS A 576 3.473 -29.121 7.712 1.00 1.20 O ATOM 514 CB HIS A 576 1.775 -30.800 5.789 1.00 42.13 C ATOM 515 CG HIS A 576 1.222 -31.468 4.552 1.00 11.34 C ATOM 516 ND1 HIS A 576 1.484 -32.789 4.233 1.00 41.52 N ATOM 517 CD2 HIS A 576 0.418 -30.984 3.562 1.00 31.24 C ATOM 518 CE1 HIS A 576 0.862 -33.076 3.099 1.00 12.10 C ATOM 519 NE2 HIS A 576 0.202 -31.956 2.685 1.00 61.32 N ATOM 0 H HIS A 576 4.738 -29.999 5.680 1.00 34.42 H new ATOM 0 HA HIS A 576 2.185 -29.018 4.729 1.00 74.21 H new ATOM 0 HB2 HIS A 576 2.331 -31.536 6.369 1.00 42.13 H new ATOM 0 HB3 HIS A 576 0.945 -30.465 6.411 1.00 42.13 H new ATOM 0 HD2 HIS A 576 0.024 -29.980 3.502 1.00 31.24 H new ATOM 0 HE1 HIS A 576 0.875 -34.029 2.591 1.00 12.10 H new ATOM 0 HE2 HIS A 576 -0.364 -31.879 1.840 1.00 61.32 H new ATOM 527 N HIS A 577 2.397 -27.479 6.589 1.00 35.14 N ATOM 528 CA HIS A 577 2.516 -26.512 7.667 1.00 53.41 C ATOM 529 C HIS A 577 1.851 -27.065 8.929 1.00 5.03 C ATOM 530 O HIS A 577 0.820 -27.730 8.852 1.00 74.03 O ATOM 531 CB HIS A 577 1.948 -25.155 7.244 1.00 21.22 C ATOM 532 CG HIS A 577 2.955 -24.250 6.575 1.00 75.14 C ATOM 533 ND1 HIS A 577 3.664 -24.623 5.446 1.00 21.04 N ATOM 534 CD2 HIS A 577 3.361 -22.986 6.885 1.00 4.20 C ATOM 535 CE1 HIS A 577 4.460 -23.621 5.103 1.00 71.13 C ATOM 536 NE2 HIS A 577 4.271 -22.608 5.996 1.00 42.52 N ATOM 0 H HIS A 577 1.915 -27.135 5.759 1.00 35.14 H new ATOM 0 HA HIS A 577 3.569 -26.345 7.896 1.00 53.41 H new ATOM 0 HB2 HIS A 577 1.113 -25.318 6.563 1.00 21.22 H new ATOM 0 HB3 HIS A 577 1.548 -24.650 8.123 1.00 21.22 H new ATOM 0 HD1 HIS A 577 3.587 -25.517 4.961 1.00 21.04 H new ATOM 0 HD2 HIS A 577 3.003 -22.393 7.713 1.00 4.20 H new ATOM 0 HE1 HIS A 577 5.139 -23.609 4.263 1.00 71.13 H new ATOM 544 N VAL A 578 2.471 -26.770 10.063 1.00 55.32 N ATOM 545 CA VAL A 578 1.952 -27.229 11.340 1.00 24.32 C ATOM 546 C VAL A 578 2.194 -26.153 12.401 1.00 61.24 C ATOM 547 O VAL A 578 3.330 -25.929 12.815 1.00 44.44 O ATOM 548 CB VAL A 578 2.577 -28.578 11.704 1.00 42.23 C ATOM 549 CG1 VAL A 578 2.308 -29.618 10.615 1.00 62.04 C ATOM 550 CG2 VAL A 578 4.078 -28.434 11.966 1.00 14.12 C ATOM 0 H VAL A 578 3.327 -26.219 10.123 1.00 55.32 H new ATOM 0 HA VAL A 578 0.876 -27.389 11.279 1.00 24.32 H new ATOM 0 HB VAL A 578 2.108 -28.927 12.624 1.00 42.23 H new ATOM 0 HG11 VAL A 578 2.763 -30.567 10.898 1.00 62.04 H new ATOM 0 HG12 VAL A 578 1.233 -29.752 10.497 1.00 62.04 H new ATOM 0 HG13 VAL A 578 2.737 -29.277 9.673 1.00 62.04 H new ATOM 0 HG21 VAL A 578 4.498 -29.407 12.223 1.00 14.12 H new ATOM 0 HG22 VAL A 578 4.569 -28.052 11.071 1.00 14.12 H new ATOM 0 HG23 VAL A 578 4.238 -27.741 12.792 1.00 14.12 H new ATOM 560 N ASN A 579 1.107 -25.516 12.810 1.00 72.30 N ATOM 561 CA ASN A 579 1.186 -24.469 13.814 1.00 23.22 C ATOM 562 C ASN A 579 1.270 -25.106 15.203 1.00 13.30 C ATOM 563 O ASN A 579 0.291 -25.668 15.692 1.00 61.12 O ATOM 564 CB ASN A 579 -0.055 -23.576 13.778 1.00 40.54 C ATOM 565 CG ASN A 579 -0.183 -22.761 15.067 1.00 64.25 C ATOM 566 OD1 ASN A 579 -1.267 -22.481 15.550 1.00 54.15 O ATOM 567 ND2 ASN A 579 0.983 -22.398 15.595 1.00 73.23 N ATOM 0 H ASN A 579 0.166 -25.705 12.464 1.00 72.30 H new ATOM 0 HA ASN A 579 2.070 -23.866 13.604 1.00 23.22 H new ATOM 0 HB2 ASN A 579 0.002 -22.903 12.922 1.00 40.54 H new ATOM 0 HB3 ASN A 579 -0.945 -24.190 13.642 1.00 40.54 H new ATOM 0 HD21 ASN A 579 1.005 -21.852 16.456 1.00 73.23 H new ATOM 0 HD22 ASN A 579 1.855 -22.666 15.139 1.00 73.23 H new ATOM 574 N VAL A 580 2.448 -24.996 15.799 1.00 13.25 N ATOM 575 CA VAL A 580 2.672 -25.554 17.122 1.00 14.43 C ATOM 576 C VAL A 580 2.152 -24.576 18.178 1.00 14.11 C ATOM 577 O VAL A 580 2.172 -23.364 17.970 1.00 13.22 O ATOM 578 CB VAL A 580 4.152 -25.896 17.302 1.00 0.11 C ATOM 579 CG1 VAL A 580 4.343 -26.943 18.401 1.00 70.42 C ATOM 580 CG2 VAL A 580 4.770 -26.365 15.984 1.00 63.04 C ATOM 0 H VAL A 580 3.257 -24.529 15.390 1.00 13.25 H new ATOM 0 HA VAL A 580 2.120 -26.486 17.242 1.00 14.43 H new ATOM 0 HB VAL A 580 4.671 -24.988 17.611 1.00 0.11 H new ATOM 0 HG11 VAL A 580 5.404 -27.168 18.509 1.00 70.42 H new ATOM 0 HG12 VAL A 580 3.957 -26.555 19.344 1.00 70.42 H new ATOM 0 HG13 VAL A 580 3.804 -27.852 18.135 1.00 70.42 H new ATOM 0 HG21 VAL A 580 5.823 -26.602 16.140 1.00 63.04 H new ATOM 0 HG22 VAL A 580 4.246 -27.254 15.633 1.00 63.04 H new ATOM 0 HG23 VAL A 580 4.682 -25.574 15.239 1.00 63.04 H new ATOM 590 N ASN A 581 1.698 -25.140 19.288 1.00 1.41 N ATOM 591 CA ASN A 581 1.174 -24.333 20.377 1.00 54.32 C ATOM 592 C ASN A 581 0.331 -25.215 21.300 1.00 24.41 C ATOM 593 O ASN A 581 -0.477 -26.016 20.832 1.00 1.32 O ATOM 594 CB ASN A 581 0.278 -23.211 19.849 1.00 54.33 C ATOM 595 CG ASN A 581 0.897 -21.839 20.123 1.00 65.03 C ATOM 596 OD1 ASN A 581 0.229 -20.892 20.504 1.00 43.14 O ATOM 597 ND2 ASN A 581 2.209 -21.785 19.908 1.00 31.53 N ATOM 0 H ASN A 581 1.682 -26.146 19.457 1.00 1.41 H new ATOM 0 HA ASN A 581 2.019 -23.899 20.912 1.00 54.32 H new ATOM 0 HB2 ASN A 581 0.125 -23.337 18.777 1.00 54.33 H new ATOM 0 HB3 ASN A 581 -0.703 -23.272 20.320 1.00 54.33 H new ATOM 0 HD21 ASN A 581 2.716 -20.913 20.062 1.00 31.53 H new ATOM 0 HD22 ASN A 581 2.708 -22.615 19.589 1.00 31.53 H new ATOM 604 N PRO A 582 0.555 -25.035 22.629 1.00 4.03 N ATOM 605 CA PRO A 582 -0.173 -25.806 23.622 1.00 14.54 C ATOM 606 C PRO A 582 -1.611 -25.301 23.761 1.00 12.00 C ATOM 607 O PRO A 582 -2.547 -26.096 23.834 1.00 53.50 O ATOM 608 CB PRO A 582 0.633 -25.660 24.903 1.00 62.24 C ATOM 609 CG PRO A 582 1.522 -24.444 24.699 1.00 23.23 C ATOM 610 CD PRO A 582 1.505 -24.096 23.220 1.00 70.22 C ATOM 0 HA PRO A 582 -0.274 -26.856 23.348 1.00 14.54 H new ATOM 0 HB2 PRO A 582 -0.022 -25.525 25.764 1.00 62.24 H new ATOM 0 HB3 PRO A 582 1.229 -26.552 25.093 1.00 62.24 H new ATOM 0 HG2 PRO A 582 1.162 -23.604 25.293 1.00 23.23 H new ATOM 0 HG3 PRO A 582 2.539 -24.655 25.030 1.00 23.23 H new ATOM 0 HD2 PRO A 582 1.193 -23.064 23.060 1.00 70.22 H new ATOM 0 HD3 PRO A 582 2.495 -24.203 22.777 1.00 70.22 H new ATOM 618 N ASN A 583 -1.741 -23.983 23.793 1.00 54.10 N ATOM 619 CA ASN A 583 -3.049 -23.363 23.921 1.00 13.03 C ATOM 620 C ASN A 583 -3.917 -23.761 22.726 1.00 50.13 C ATOM 621 O ASN A 583 -5.135 -23.591 22.754 1.00 1.21 O ATOM 622 CB ASN A 583 -2.936 -21.837 23.937 1.00 75.34 C ATOM 623 CG ASN A 583 -1.726 -21.385 24.756 1.00 60.12 C ATOM 624 OD1 ASN A 583 -1.080 -22.163 25.438 1.00 21.32 O ATOM 625 ND2 ASN A 583 -1.456 -20.087 24.651 1.00 60.13 N ATOM 0 H ASN A 583 -0.962 -23.327 23.733 1.00 54.10 H new ATOM 0 HA ASN A 583 -3.492 -23.701 24.858 1.00 13.03 H new ATOM 0 HB2 ASN A 583 -2.848 -21.465 22.916 1.00 75.34 H new ATOM 0 HB3 ASN A 583 -3.845 -21.406 24.357 1.00 75.34 H new ATOM 0 HD21 ASN A 583 -0.667 -19.687 25.159 1.00 60.13 H new ATOM 0 HD22 ASN A 583 -2.038 -19.491 24.062 1.00 60.13 H new ATOM 632 N PHE A 584 -3.256 -24.283 21.703 1.00 21.22 N ATOM 633 CA PHE A 584 -3.952 -24.707 20.500 1.00 43.21 C ATOM 634 C PHE A 584 -4.920 -25.852 20.801 1.00 32.40 C ATOM 635 O PHE A 584 -5.987 -25.943 20.195 1.00 21.55 O ATOM 636 CB PHE A 584 -2.887 -25.200 19.518 1.00 51.52 C ATOM 637 CG PHE A 584 -3.201 -24.890 18.053 1.00 53.04 C ATOM 638 CD1 PHE A 584 -3.282 -23.599 17.633 1.00 54.13 C ATOM 639 CD2 PHE A 584 -3.400 -25.906 17.170 1.00 4.24 C ATOM 640 CE1 PHE A 584 -3.574 -23.312 16.273 1.00 0.30 C ATOM 641 CE2 PHE A 584 -3.691 -25.618 15.811 1.00 72.53 C ATOM 642 CZ PHE A 584 -3.772 -24.327 15.391 1.00 73.43 C ATOM 0 H PHE A 584 -2.246 -24.422 21.683 1.00 21.22 H new ATOM 0 HA PHE A 584 -4.529 -23.877 20.092 1.00 43.21 H new ATOM 0 HB2 PHE A 584 -1.930 -24.747 19.778 1.00 51.52 H new ATOM 0 HB3 PHE A 584 -2.771 -26.278 19.634 1.00 51.52 H new ATOM 0 HD1 PHE A 584 -3.124 -22.792 18.333 1.00 54.13 H new ATOM 0 HD2 PHE A 584 -3.337 -26.931 17.503 1.00 4.24 H new ATOM 0 HE1 PHE A 584 -3.639 -22.287 15.940 1.00 0.30 H new ATOM 0 HE2 PHE A 584 -3.848 -26.424 15.110 1.00 72.53 H new ATOM 0 HZ PHE A 584 -3.994 -24.108 14.357 1.00 73.43 H new ATOM 652 N SER A 585 -4.514 -26.698 21.736 1.00 23.04 N ATOM 653 CA SER A 585 -5.332 -27.834 22.125 1.00 11.12 C ATOM 654 C SER A 585 -6.702 -27.352 22.606 1.00 11.43 C ATOM 655 O SER A 585 -7.684 -28.089 22.536 1.00 61.13 O ATOM 656 CB SER A 585 -4.647 -28.659 23.216 1.00 4.12 C ATOM 657 OG SER A 585 -4.165 -27.842 24.280 1.00 43.12 O ATOM 0 H SER A 585 -3.628 -26.619 22.236 1.00 23.04 H new ATOM 0 HA SER A 585 -5.464 -28.474 21.253 1.00 11.12 H new ATOM 0 HB2 SER A 585 -5.350 -29.392 23.612 1.00 4.12 H new ATOM 0 HB3 SER A 585 -3.817 -29.216 22.782 1.00 4.12 H new ATOM 0 HG SER A 585 -3.327 -27.413 24.009 1.00 43.12 H new ATOM 663 N ASN A 586 -6.724 -26.116 23.085 1.00 73.32 N ATOM 664 CA ASN A 586 -7.958 -25.527 23.578 1.00 44.35 C ATOM 665 C ASN A 586 -8.702 -24.866 22.415 1.00 22.14 C ATOM 666 O ASN A 586 -9.893 -24.578 22.520 1.00 10.21 O ATOM 667 CB ASN A 586 -7.673 -24.452 24.628 1.00 2.15 C ATOM 668 CG ASN A 586 -7.615 -25.059 26.032 1.00 53.22 C ATOM 669 OD1 ASN A 586 -8.595 -25.558 26.561 1.00 1.52 O ATOM 670 ND2 ASN A 586 -6.416 -24.989 26.603 1.00 51.14 N ATOM 0 H ASN A 586 -5.908 -25.507 23.142 1.00 73.32 H new ATOM 0 HA ASN A 586 -8.556 -26.321 24.027 1.00 44.35 H new ATOM 0 HB2 ASN A 586 -6.728 -23.959 24.402 1.00 2.15 H new ATOM 0 HB3 ASN A 586 -8.449 -23.687 24.590 1.00 2.15 H new ATOM 0 HD21 ASN A 586 -6.274 -25.367 27.540 1.00 51.14 H new ATOM 0 HD22 ASN A 586 -5.638 -24.558 26.104 1.00 51.14 H new ATOM 677 N TYR A 587 -7.969 -24.645 21.334 1.00 24.51 N ATOM 678 CA TYR A 587 -8.544 -24.024 20.153 1.00 33.25 C ATOM 679 C TYR A 587 -9.056 -25.081 19.172 1.00 43.20 C ATOM 680 O TYR A 587 -9.627 -24.746 18.136 1.00 41.55 O ATOM 681 CB TYR A 587 -7.409 -23.240 19.494 1.00 43.44 C ATOM 682 CG TYR A 587 -7.275 -21.799 19.993 1.00 75.44 C ATOM 683 CD1 TYR A 587 -8.375 -20.965 19.995 1.00 70.41 C ATOM 684 CD2 TYR A 587 -6.056 -21.334 20.441 1.00 64.34 C ATOM 685 CE1 TYR A 587 -8.250 -19.610 20.465 1.00 44.04 C ATOM 686 CE2 TYR A 587 -5.930 -19.979 20.910 1.00 13.23 C ATOM 687 CZ TYR A 587 -7.033 -19.184 20.899 1.00 14.40 C ATOM 688 OH TYR A 587 -6.915 -17.903 21.343 1.00 70.44 O ATOM 0 H TYR A 587 -6.981 -24.885 21.251 1.00 24.51 H new ATOM 0 HA TYR A 587 -9.387 -23.389 20.425 1.00 33.25 H new ATOM 0 HB2 TYR A 587 -6.469 -23.764 19.671 1.00 43.44 H new ATOM 0 HB3 TYR A 587 -7.569 -23.227 18.416 1.00 43.44 H new ATOM 0 HD1 TYR A 587 -9.329 -21.329 19.644 1.00 70.41 H new ATOM 0 HD2 TYR A 587 -5.196 -21.987 20.440 1.00 64.34 H new ATOM 0 HE1 TYR A 587 -9.103 -18.947 20.473 1.00 44.04 H new ATOM 0 HE2 TYR A 587 -4.981 -19.602 21.263 1.00 13.23 H new ATOM 0 HH TYR A 587 -6.837 -17.297 20.577 1.00 70.44 H new ATOM 698 N TYR A 588 -8.832 -26.336 19.533 1.00 1.44 N ATOM 699 CA TYR A 588 -9.263 -27.443 18.698 1.00 61.44 C ATOM 700 C TYR A 588 -9.451 -28.715 19.527 1.00 30.20 C ATOM 701 O TYR A 588 -8.914 -28.828 20.628 1.00 41.12 O ATOM 702 CB TYR A 588 -8.138 -27.670 17.686 1.00 72.54 C ATOM 703 CG TYR A 588 -6.948 -28.453 18.243 1.00 21.24 C ATOM 704 CD1 TYR A 588 -7.086 -29.791 18.552 1.00 24.23 C ATOM 705 CD2 TYR A 588 -5.736 -27.821 18.438 1.00 73.32 C ATOM 706 CE1 TYR A 588 -5.965 -30.528 19.077 1.00 12.03 C ATOM 707 CE2 TYR A 588 -4.616 -28.558 18.963 1.00 70.01 C ATOM 708 CZ TYR A 588 -4.786 -29.875 19.257 1.00 62.02 C ATOM 709 OH TYR A 588 -3.728 -30.571 19.753 1.00 43.24 O ATOM 0 H TYR A 588 -8.357 -26.610 20.393 1.00 1.44 H new ATOM 0 HA TYR A 588 -10.216 -27.215 18.221 1.00 61.44 H new ATOM 0 HB2 TYR A 588 -8.540 -28.204 16.825 1.00 72.54 H new ATOM 0 HB3 TYR A 588 -7.787 -26.703 17.326 1.00 72.54 H new ATOM 0 HD1 TYR A 588 -8.034 -30.285 18.400 1.00 24.23 H new ATOM 0 HD2 TYR A 588 -5.628 -26.774 18.197 1.00 73.32 H new ATOM 0 HE1 TYR A 588 -6.059 -31.576 19.322 1.00 12.03 H new ATOM 0 HE2 TYR A 588 -3.662 -28.076 19.120 1.00 70.01 H new ATOM 0 HH TYR A 588 -2.952 -29.977 19.827 1.00 43.24 H new ATOM 719 N ASN A 589 -10.215 -29.641 18.967 1.00 74.12 N ATOM 720 CA ASN A 589 -10.481 -30.901 19.641 1.00 51.41 C ATOM 721 C ASN A 589 -10.180 -32.058 18.687 1.00 65.11 C ATOM 722 O ASN A 589 -10.726 -32.119 17.587 1.00 74.22 O ATOM 723 CB ASN A 589 -11.949 -31.003 20.059 1.00 53.43 C ATOM 724 CG ASN A 589 -12.292 -29.954 21.119 1.00 41.01 C ATOM 725 OD1 ASN A 589 -12.241 -30.201 22.313 1.00 44.34 O ATOM 726 ND2 ASN A 589 -12.643 -28.773 20.618 1.00 32.10 N ATOM 0 H ASN A 589 -10.659 -29.544 18.054 1.00 74.12 H new ATOM 0 HA ASN A 589 -9.849 -30.949 20.528 1.00 51.41 H new ATOM 0 HB2 ASN A 589 -12.589 -30.867 19.187 1.00 53.43 H new ATOM 0 HB3 ASN A 589 -12.151 -32.000 20.450 1.00 53.43 H new ATOM 0 HD21 ASN A 589 -12.890 -28.007 21.244 1.00 32.10 H new ATOM 0 HD22 ASN A 589 -12.665 -28.634 19.608 1.00 32.10 H new ATOM 733 N VAL A 590 -9.310 -32.948 19.143 1.00 12.32 N ATOM 734 CA VAL A 590 -8.929 -34.100 18.344 1.00 13.01 C ATOM 735 C VAL A 590 -10.083 -35.105 18.324 1.00 24.11 C ATOM 736 O VAL A 590 -10.673 -35.398 19.362 1.00 34.25 O ATOM 737 CB VAL A 590 -7.625 -34.697 18.876 1.00 62.43 C ATOM 738 CG1 VAL A 590 -7.442 -36.136 18.389 1.00 72.15 C ATOM 739 CG2 VAL A 590 -6.426 -33.830 18.486 1.00 20.14 C ATOM 0 H VAL A 590 -8.858 -32.894 20.056 1.00 12.32 H new ATOM 0 HA VAL A 590 -8.738 -33.804 17.313 1.00 13.01 H new ATOM 0 HB VAL A 590 -7.685 -34.716 19.964 1.00 62.43 H new ATOM 0 HG11 VAL A 590 -6.507 -36.537 18.781 1.00 72.15 H new ATOM 0 HG12 VAL A 590 -8.274 -36.747 18.739 1.00 72.15 H new ATOM 0 HG13 VAL A 590 -7.414 -36.151 17.299 1.00 72.15 H new ATOM 0 HG21 VAL A 590 -5.512 -34.277 18.877 1.00 20.14 H new ATOM 0 HG22 VAL A 590 -6.363 -33.764 17.400 1.00 20.14 H new ATOM 0 HG23 VAL A 590 -6.549 -32.831 18.903 1.00 20.14 H new ATOM 749 N SER A 591 -10.369 -35.605 17.131 1.00 23.52 N ATOM 750 CA SER A 591 -11.441 -36.572 16.962 1.00 2.43 C ATOM 751 C SER A 591 -11.170 -37.809 17.820 1.00 21.21 C ATOM 752 O SER A 591 -10.112 -37.922 18.437 1.00 2.21 O ATOM 753 CB SER A 591 -11.598 -36.968 15.493 1.00 34.21 C ATOM 754 OG SER A 591 -12.536 -38.028 15.324 1.00 63.21 O ATOM 0 H SER A 591 -9.877 -35.359 16.272 1.00 23.52 H new ATOM 0 HA SER A 591 -12.373 -36.110 17.287 1.00 2.43 H new ATOM 0 HB2 SER A 591 -11.922 -36.102 14.916 1.00 34.21 H new ATOM 0 HB3 SER A 591 -10.630 -37.273 15.094 1.00 34.21 H new ATOM 0 HG SER A 591 -12.073 -38.889 15.392 1.00 63.21 H new ATOM 760 N ARG A 592 -12.144 -38.707 17.831 1.00 14.25 N ATOM 761 CA ARG A 592 -12.024 -39.932 18.603 1.00 14.03 C ATOM 762 C ARG A 592 -11.093 -40.917 17.894 1.00 20.11 C ATOM 763 O ARG A 592 -10.102 -41.365 18.470 1.00 53.51 O ATOM 764 CB ARG A 592 -13.390 -40.590 18.808 1.00 14.23 C ATOM 765 CG ARG A 592 -14.430 -39.564 19.263 1.00 13.30 C ATOM 766 CD ARG A 592 -15.771 -40.238 19.563 1.00 2.42 C ATOM 767 NE ARG A 592 -16.591 -40.302 18.333 1.00 35.04 N ATOM 768 CZ ARG A 592 -17.390 -39.302 17.903 1.00 31.21 C ATOM 769 NH1 ARG A 592 -17.482 -38.150 18.601 1.00 32.31 N ATOM 770 NH2 ARG A 592 -18.080 -39.468 16.790 1.00 45.23 N ATOM 0 H ARG A 592 -13.020 -38.611 17.317 1.00 14.25 H new ATOM 0 HA ARG A 592 -11.609 -39.671 19.577 1.00 14.03 H new ATOM 0 HB2 ARG A 592 -13.716 -41.056 17.878 1.00 14.23 H new ATOM 0 HB3 ARG A 592 -13.308 -41.384 19.551 1.00 14.23 H new ATOM 0 HG2 ARG A 592 -14.071 -39.048 20.153 1.00 13.30 H new ATOM 0 HG3 ARG A 592 -14.564 -38.809 18.489 1.00 13.30 H new ATOM 0 HD2 ARG A 592 -15.604 -41.243 19.951 1.00 2.42 H new ATOM 0 HD3 ARG A 592 -16.302 -39.682 20.336 1.00 2.42 H new ATOM 0 HE ARG A 592 -16.550 -41.155 17.775 1.00 35.04 H new ATOM 0 HH11 ARG A 592 -16.946 -38.030 19.460 1.00 32.31 H new ATOM 0 HH12 ARG A 592 -18.088 -37.400 18.269 1.00 32.31 H new ATOM 0 HH21 ARG A 592 -18.005 -40.342 16.269 1.00 45.23 H new ATOM 0 HH22 ARG A 592 -18.688 -38.723 16.451 1.00 45.23 H new ATOM 783 N ASP A 593 -11.444 -41.226 16.654 1.00 22.15 N ATOM 784 CA ASP A 593 -10.652 -42.150 15.861 1.00 44.03 C ATOM 785 C ASP A 593 -9.165 -41.874 16.097 1.00 54.10 C ATOM 786 O ASP A 593 -8.768 -40.728 16.301 1.00 10.14 O ATOM 787 CB ASP A 593 -10.933 -41.975 14.367 1.00 14.42 C ATOM 788 CG ASP A 593 -11.310 -40.554 13.943 1.00 53.23 C ATOM 789 OD1 ASP A 593 -12.212 -40.352 13.115 1.00 24.43 O ATOM 790 OD2 ASP A 593 -10.626 -39.617 14.507 1.00 52.33 O ATOM 0 H ASP A 593 -12.266 -40.853 16.179 1.00 22.15 H new ATOM 0 HA ASP A 593 -10.916 -43.164 16.162 1.00 44.03 H new ATOM 0 HB2 ASP A 593 -10.049 -42.283 13.808 1.00 14.42 H new ATOM 0 HB3 ASP A 593 -11.741 -42.649 14.083 1.00 14.42 H new ATOM 796 N PRO A 594 -8.364 -42.972 16.060 1.00 2.01 N ATOM 797 CA PRO A 594 -6.930 -42.859 16.268 1.00 72.42 C ATOM 798 C PRO A 594 -6.242 -42.273 15.034 1.00 43.32 C ATOM 799 O PRO A 594 -6.087 -41.057 14.924 1.00 75.44 O ATOM 800 CB PRO A 594 -6.468 -44.271 16.592 1.00 44.44 C ATOM 801 CG PRO A 594 -7.570 -45.194 16.099 1.00 11.12 C ATOM 802 CD PRO A 594 -8.800 -44.345 15.821 1.00 45.33 C ATOM 0 HA PRO A 594 -6.674 -42.175 17.077 1.00 72.42 H new ATOM 0 HB2 PRO A 594 -5.522 -44.495 16.099 1.00 44.44 H new ATOM 0 HB3 PRO A 594 -6.307 -44.393 17.663 1.00 44.44 H new ATOM 0 HG2 PRO A 594 -7.255 -45.716 15.196 1.00 11.12 H new ATOM 0 HG3 PRO A 594 -7.793 -45.956 16.846 1.00 11.12 H new ATOM 0 HD2 PRO A 594 -9.149 -44.477 14.797 1.00 45.33 H new ATOM 0 HD3 PRO A 594 -9.626 -44.618 16.477 1.00 45.33 H new ATOM 810 N VAL A 595 -5.846 -43.164 14.137 1.00 54.24 N ATOM 811 CA VAL A 595 -5.178 -42.750 12.915 1.00 51.34 C ATOM 812 C VAL A 595 -6.171 -42.803 11.752 1.00 15.31 C ATOM 813 O VAL A 595 -6.794 -43.836 11.509 1.00 5.41 O ATOM 814 CB VAL A 595 -3.936 -43.612 12.679 1.00 11.44 C ATOM 815 CG1 VAL A 595 -3.402 -43.427 11.258 1.00 44.22 C ATOM 816 CG2 VAL A 595 -2.853 -43.307 13.716 1.00 31.14 C ATOM 0 H VAL A 595 -5.975 -44.171 14.232 1.00 54.24 H new ATOM 0 HA VAL A 595 -4.832 -41.720 13.000 1.00 51.34 H new ATOM 0 HB VAL A 595 -4.226 -44.656 12.794 1.00 11.44 H new ATOM 0 HG11 VAL A 595 -2.519 -44.051 11.117 1.00 44.22 H new ATOM 0 HG12 VAL A 595 -4.170 -43.717 10.540 1.00 44.22 H new ATOM 0 HG13 VAL A 595 -3.136 -42.381 11.103 1.00 44.22 H new ATOM 0 HG21 VAL A 595 -1.981 -43.933 13.526 1.00 31.14 H new ATOM 0 HG22 VAL A 595 -2.568 -42.257 13.647 1.00 31.14 H new ATOM 0 HG23 VAL A 595 -3.237 -43.514 14.715 1.00 31.14 H new ATOM 826 N VAL A 596 -6.289 -41.676 11.065 1.00 74.34 N ATOM 827 CA VAL A 596 -7.197 -41.581 9.933 1.00 25.44 C ATOM 828 C VAL A 596 -6.488 -40.878 8.774 1.00 4.03 C ATOM 829 O VAL A 596 -6.713 -39.693 8.531 1.00 31.53 O ATOM 830 CB VAL A 596 -8.489 -40.881 10.357 1.00 74.32 C ATOM 831 CG1 VAL A 596 -9.642 -41.243 9.417 1.00 5.42 C ATOM 832 CG2 VAL A 596 -8.842 -41.211 11.809 1.00 65.34 C ATOM 0 H VAL A 596 -5.772 -40.821 11.270 1.00 74.34 H new ATOM 0 HA VAL A 596 -7.480 -42.574 9.585 1.00 25.44 H new ATOM 0 HB VAL A 596 -8.325 -39.806 10.289 1.00 74.32 H new ATOM 0 HG11 VAL A 596 -10.549 -40.732 9.740 1.00 5.42 H new ATOM 0 HG12 VAL A 596 -9.394 -40.934 8.401 1.00 5.42 H new ATOM 0 HG13 VAL A 596 -9.805 -42.321 9.439 1.00 5.42 H new ATOM 0 HG21 VAL A 596 -9.765 -40.700 12.084 1.00 65.34 H new ATOM 0 HG22 VAL A 596 -8.978 -42.287 11.915 1.00 65.34 H new ATOM 0 HG23 VAL A 596 -8.035 -40.881 12.464 1.00 65.34 H new ATOM 842 N ILE A 597 -5.645 -41.637 8.090 1.00 71.43 N ATOM 843 CA ILE A 597 -4.902 -41.102 6.962 1.00 43.41 C ATOM 844 C ILE A 597 -4.771 -42.180 5.884 1.00 3.05 C ATOM 845 O ILE A 597 -4.704 -43.368 6.195 1.00 30.22 O ATOM 846 CB ILE A 597 -3.561 -40.531 7.427 1.00 45.31 C ATOM 847 CG1 ILE A 597 -3.737 -39.133 8.025 1.00 71.43 C ATOM 848 CG2 ILE A 597 -2.536 -40.543 6.291 1.00 50.25 C ATOM 849 CD1 ILE A 597 -2.408 -38.375 8.048 1.00 75.11 C ATOM 0 H ILE A 597 -5.460 -42.619 8.295 1.00 71.43 H new ATOM 0 HA ILE A 597 -5.440 -40.267 6.513 1.00 43.41 H new ATOM 0 HB ILE A 597 -3.173 -41.173 8.218 1.00 45.31 H new ATOM 0 HG12 ILE A 597 -4.469 -38.574 7.442 1.00 71.43 H new ATOM 0 HG13 ILE A 597 -4.131 -39.214 9.038 1.00 71.43 H new ATOM 0 HG21 ILE A 597 -1.592 -40.132 6.648 1.00 50.25 H new ATOM 0 HG22 ILE A 597 -2.381 -41.567 5.952 1.00 50.25 H new ATOM 0 HG23 ILE A 597 -2.904 -39.938 5.462 1.00 50.25 H new ATOM 0 HD11 ILE A 597 -2.561 -37.385 8.477 1.00 75.11 H new ATOM 0 HD12 ILE A 597 -1.686 -38.925 8.652 1.00 75.11 H new ATOM 0 HD13 ILE A 597 -2.029 -38.275 7.031 1.00 75.11 H new ATOM 861 N ASN A 598 -4.738 -41.727 4.640 1.00 42.21 N ATOM 862 CA ASN A 598 -4.616 -42.638 3.515 1.00 70.04 C ATOM 863 C ASN A 598 -3.449 -43.596 3.764 1.00 52.14 C ATOM 864 O ASN A 598 -3.623 -44.813 3.731 1.00 30.23 O ATOM 865 CB ASN A 598 -4.334 -41.877 2.218 1.00 54.03 C ATOM 866 CG ASN A 598 -4.062 -42.843 1.063 1.00 72.20 C ATOM 867 OD1 ASN A 598 -3.100 -43.593 1.061 1.00 43.15 O ATOM 868 ND2 ASN A 598 -4.961 -42.784 0.085 1.00 51.34 N ATOM 0 H ASN A 598 -4.794 -40.741 4.386 1.00 42.21 H new ATOM 0 HA ASN A 598 -5.556 -43.181 3.418 1.00 70.04 H new ATOM 0 HB2 ASN A 598 -5.185 -41.242 1.973 1.00 54.03 H new ATOM 0 HB3 ASN A 598 -3.475 -41.220 2.357 1.00 54.03 H new ATOM 0 HD21 ASN A 598 -4.868 -43.390 -0.730 1.00 51.34 H new ATOM 0 HD22 ASN A 598 -5.743 -42.133 0.150 1.00 51.34 H new ATOM 875 N LYS A 599 -2.286 -43.010 4.006 1.00 21.14 N ATOM 876 CA LYS A 599 -1.091 -43.796 4.261 1.00 63.32 C ATOM 877 C LYS A 599 -0.277 -43.134 5.375 1.00 73.04 C ATOM 878 O LYS A 599 -0.166 -41.910 5.423 1.00 10.00 O ATOM 879 CB LYS A 599 -0.303 -44.008 2.966 1.00 1.33 C ATOM 880 CG LYS A 599 1.180 -44.245 3.260 1.00 71.35 C ATOM 881 CD LYS A 599 1.940 -42.920 3.352 1.00 35.55 C ATOM 882 CE LYS A 599 2.461 -42.490 1.980 1.00 22.21 C ATOM 883 NZ LYS A 599 3.613 -43.328 1.578 1.00 41.15 N ATOM 0 H LYS A 599 -2.146 -42.000 4.031 1.00 21.14 H new ATOM 0 HA LYS A 599 -1.359 -44.793 4.611 1.00 63.32 H new ATOM 0 HB2 LYS A 599 -0.711 -44.861 2.423 1.00 1.33 H new ATOM 0 HB3 LYS A 599 -0.415 -43.137 2.321 1.00 1.33 H new ATOM 0 HG2 LYS A 599 1.286 -44.794 4.195 1.00 71.35 H new ATOM 0 HG3 LYS A 599 1.615 -44.864 2.476 1.00 71.35 H new ATOM 0 HD2 LYS A 599 1.284 -42.148 3.754 1.00 35.55 H new ATOM 0 HD3 LYS A 599 2.774 -43.023 4.046 1.00 35.55 H new ATOM 0 HE2 LYS A 599 1.666 -42.575 1.239 1.00 22.21 H new ATOM 0 HE3 LYS A 599 2.759 -41.442 2.009 1.00 22.21 H new ATOM 0 HZ1 LYS A 599 4.140 -42.852 0.819 1.00 41.15 H new ATOM 0 HZ2 LYS A 599 4.239 -43.473 2.396 1.00 41.15 H new ATOM 0 HZ3 LYS A 599 3.270 -44.249 1.237 1.00 41.15 H new ATOM 896 N VAL A 600 0.270 -43.972 6.242 1.00 24.32 N ATOM 897 CA VAL A 600 1.070 -43.483 7.352 1.00 23.44 C ATOM 898 C VAL A 600 2.504 -43.242 6.875 1.00 32.21 C ATOM 899 O VAL A 600 3.018 -43.987 6.042 1.00 50.53 O ATOM 900 CB VAL A 600 0.988 -44.460 8.527 1.00 73.40 C ATOM 901 CG1 VAL A 600 1.613 -43.857 9.787 1.00 71.55 C ATOM 902 CG2 VAL A 600 -0.459 -44.888 8.783 1.00 24.35 C ATOM 0 H VAL A 600 0.175 -44.987 6.199 1.00 24.32 H new ATOM 0 HA VAL A 600 0.682 -42.530 7.711 1.00 23.44 H new ATOM 0 HB VAL A 600 1.560 -45.350 8.264 1.00 73.40 H new ATOM 0 HG11 VAL A 600 1.541 -44.572 10.607 1.00 71.55 H new ATOM 0 HG12 VAL A 600 2.661 -43.625 9.598 1.00 71.55 H new ATOM 0 HG13 VAL A 600 1.082 -42.943 10.055 1.00 71.55 H new ATOM 0 HG21 VAL A 600 -0.490 -45.582 9.623 1.00 24.35 H new ATOM 0 HG22 VAL A 600 -1.062 -44.010 9.015 1.00 24.35 H new ATOM 0 HG23 VAL A 600 -0.857 -45.377 7.894 1.00 24.35 H new ATOM 912 N PHE A 601 3.109 -42.199 7.424 1.00 14.00 N ATOM 913 CA PHE A 601 4.473 -41.850 7.065 1.00 73.32 C ATOM 914 C PHE A 601 5.452 -42.259 8.168 1.00 54.44 C ATOM 915 O PHE A 601 5.038 -42.603 9.274 1.00 52.53 O ATOM 916 CB PHE A 601 4.516 -40.330 6.898 1.00 65.24 C ATOM 917 CG PHE A 601 3.554 -39.793 5.837 1.00 54.12 C ATOM 918 CD1 PHE A 601 2.249 -39.571 6.152 1.00 23.50 C ATOM 919 CD2 PHE A 601 4.002 -39.537 4.579 1.00 41.34 C ATOM 920 CE1 PHE A 601 1.356 -39.073 5.168 1.00 53.34 C ATOM 921 CE2 PHE A 601 3.108 -39.038 3.594 1.00 25.12 C ATOM 922 CZ PHE A 601 1.804 -38.817 3.909 1.00 2.44 C ATOM 0 H PHE A 601 2.679 -41.584 8.115 1.00 14.00 H new ATOM 0 HA PHE A 601 4.762 -42.368 6.150 1.00 73.32 H new ATOM 0 HB2 PHE A 601 4.283 -39.863 7.855 1.00 65.24 H new ATOM 0 HB3 PHE A 601 5.531 -40.032 6.637 1.00 65.24 H new ATOM 0 HD1 PHE A 601 1.893 -39.774 7.151 1.00 23.50 H new ATOM 0 HD2 PHE A 601 5.038 -39.713 4.328 1.00 41.34 H new ATOM 0 HE1 PHE A 601 0.320 -38.897 5.419 1.00 53.34 H new ATOM 0 HE2 PHE A 601 3.464 -38.834 2.595 1.00 25.12 H new ATOM 0 HZ PHE A 601 1.124 -38.438 3.160 1.00 2.44 H new ATOM 932 N LYS A 602 6.731 -42.207 7.828 1.00 41.12 N ATOM 933 CA LYS A 602 7.772 -42.567 8.775 1.00 22.14 C ATOM 934 C LYS A 602 8.312 -41.299 9.440 1.00 33.01 C ATOM 935 O LYS A 602 8.327 -41.195 10.666 1.00 44.24 O ATOM 936 CB LYS A 602 8.851 -43.410 8.092 1.00 51.44 C ATOM 937 CG LYS A 602 8.225 -44.508 7.230 1.00 34.22 C ATOM 938 CD LYS A 602 7.796 -45.700 8.088 1.00 22.33 C ATOM 939 CE LYS A 602 8.735 -46.890 7.881 1.00 22.34 C ATOM 940 NZ LYS A 602 7.961 -48.115 7.577 1.00 2.44 N ATOM 0 H LYS A 602 7.070 -41.921 6.910 1.00 41.12 H new ATOM 0 HA LYS A 602 7.364 -43.195 9.568 1.00 22.14 H new ATOM 0 HB2 LYS A 602 9.479 -42.770 7.472 1.00 51.44 H new ATOM 0 HB3 LYS A 602 9.498 -43.859 8.846 1.00 51.44 H new ATOM 0 HG2 LYS A 602 7.362 -44.109 6.697 1.00 34.22 H new ATOM 0 HG3 LYS A 602 8.941 -44.836 6.477 1.00 34.22 H new ATOM 0 HD2 LYS A 602 7.793 -45.413 9.140 1.00 22.33 H new ATOM 0 HD3 LYS A 602 6.776 -45.988 7.833 1.00 22.33 H new ATOM 0 HE2 LYS A 602 9.426 -46.678 7.065 1.00 22.34 H new ATOM 0 HE3 LYS A 602 9.337 -47.046 8.776 1.00 22.34 H new ATOM 0 HZ1 LYS A 602 8.614 -48.913 7.439 1.00 2.44 H new ATOM 0 HZ2 LYS A 602 7.319 -48.325 8.368 1.00 2.44 H new ATOM 0 HZ3 LYS A 602 7.406 -47.969 6.710 1.00 2.44 H new ATOM 953 N ASP A 603 8.741 -40.367 8.602 1.00 13.31 N ATOM 954 CA ASP A 603 9.280 -39.110 9.093 1.00 14.22 C ATOM 955 C ASP A 603 8.445 -38.632 10.283 1.00 33.20 C ATOM 956 O ASP A 603 8.981 -38.069 11.236 1.00 21.21 O ATOM 957 CB ASP A 603 9.225 -38.028 8.013 1.00 43.21 C ATOM 958 CG ASP A 603 10.454 -37.959 7.104 1.00 5.14 C ATOM 959 OD1 ASP A 603 11.361 -37.140 7.317 1.00 54.51 O ATOM 960 OD2 ASP A 603 10.460 -38.804 6.130 1.00 41.03 O ATOM 0 H ASP A 603 8.726 -40.457 7.586 1.00 13.31 H new ATOM 0 HA ASP A 603 10.317 -39.278 9.383 1.00 14.22 H new ATOM 0 HB2 ASP A 603 8.343 -38.197 7.395 1.00 43.21 H new ATOM 0 HB3 ASP A 603 9.094 -37.060 8.496 1.00 43.21 H new ATOM 966 N TRP A 604 7.146 -38.874 10.189 1.00 74.43 N ATOM 967 CA TRP A 604 6.231 -38.476 11.245 1.00 23.05 C ATOM 968 C TRP A 604 4.981 -39.353 11.145 1.00 44.33 C ATOM 969 O TRP A 604 4.676 -39.884 10.078 1.00 32.03 O ATOM 970 CB TRP A 604 5.920 -36.980 11.166 1.00 23.13 C ATOM 971 CG TRP A 604 5.097 -36.580 9.940 1.00 3.33 C ATOM 972 CD1 TRP A 604 4.862 -37.298 8.834 1.00 45.03 C ATOM 973 CD2 TRP A 604 4.405 -35.329 9.740 1.00 21.14 C ATOM 974 NE1 TRP A 604 4.073 -36.605 7.939 1.00 40.23 N ATOM 975 CE2 TRP A 604 3.786 -35.370 8.508 1.00 50.52 C ATOM 976 CE3 TRP A 604 4.305 -34.201 10.574 1.00 64.12 C ATOM 977 CZ2 TRP A 604 3.024 -34.312 7.998 1.00 50.34 C ATOM 978 CZ3 TRP A 604 3.540 -33.152 10.049 1.00 23.43 C ATOM 979 CH2 TRP A 604 2.911 -33.177 8.810 1.00 32.44 C ATOM 0 H TRP A 604 6.705 -39.341 9.397 1.00 74.43 H new ATOM 0 HA TRP A 604 6.684 -38.628 12.225 1.00 23.05 H new ATOM 0 HB2 TRP A 604 5.381 -36.683 12.066 1.00 23.13 H new ATOM 0 HB3 TRP A 604 6.858 -36.424 11.159 1.00 23.13 H new ATOM 0 HD1 TRP A 604 5.242 -38.294 8.664 1.00 45.03 H new ATOM 0 HE1 TRP A 604 3.758 -36.938 7.028 1.00 40.23 H new ATOM 0 HE3 TRP A 604 4.780 -34.148 11.542 1.00 64.12 H new ATOM 0 HZ2 TRP A 604 2.549 -34.368 7.030 1.00 50.34 H new ATOM 0 HZ3 TRP A 604 3.431 -32.261 10.649 1.00 23.43 H new ATOM 0 HH2 TRP A 604 2.338 -32.325 8.475 1.00 32.44 H new ATOM 990 N LYS A 605 4.292 -39.477 12.270 1.00 44.24 N ATOM 991 CA LYS A 605 3.083 -40.280 12.321 1.00 14.14 C ATOM 992 C LYS A 605 1.879 -39.366 12.559 1.00 12.04 C ATOM 993 O LYS A 605 2.037 -38.222 12.983 1.00 24.32 O ATOM 994 CB LYS A 605 3.223 -41.394 13.360 1.00 25.41 C ATOM 995 CG LYS A 605 2.773 -40.916 14.742 1.00 70.20 C ATOM 996 CD LYS A 605 3.542 -41.639 15.850 1.00 41.32 C ATOM 997 CE LYS A 605 4.810 -40.871 16.228 1.00 42.44 C ATOM 998 NZ LYS A 605 5.951 -41.312 15.395 1.00 61.24 N ATOM 0 H LYS A 605 4.548 -39.035 13.153 1.00 44.24 H new ATOM 0 HA LYS A 605 2.919 -40.783 11.368 1.00 14.14 H new ATOM 0 HB2 LYS A 605 2.627 -42.255 13.057 1.00 25.41 H new ATOM 0 HB3 LYS A 605 4.261 -41.725 13.406 1.00 25.41 H new ATOM 0 HG2 LYS A 605 2.930 -39.841 14.828 1.00 70.20 H new ATOM 0 HG3 LYS A 605 1.704 -41.093 14.862 1.00 70.20 H new ATOM 0 HD2 LYS A 605 2.905 -41.750 16.727 1.00 41.32 H new ATOM 0 HD3 LYS A 605 3.806 -42.643 15.519 1.00 41.32 H new ATOM 0 HE2 LYS A 605 4.647 -39.801 16.096 1.00 42.44 H new ATOM 0 HE3 LYS A 605 5.038 -41.031 17.282 1.00 42.44 H new ATOM 0 HZ1 LYS A 605 6.833 -41.226 15.940 1.00 61.24 H new ATOM 0 HZ2 LYS A 605 5.813 -42.304 15.114 1.00 61.24 H new ATOM 0 HZ3 LYS A 605 6.010 -40.717 14.544 1.00 61.24 H new ATOM 1011 N PRO A 606 0.671 -39.919 12.269 1.00 71.22 N ATOM 1012 CA PRO A 606 -0.559 -39.167 12.447 1.00 52.33 C ATOM 1013 C PRO A 606 -0.926 -39.058 13.928 1.00 33.21 C ATOM 1014 O PRO A 606 -0.196 -39.545 14.790 1.00 43.04 O ATOM 1015 CB PRO A 606 -1.600 -39.915 11.630 1.00 21.10 C ATOM 1016 CG PRO A 606 -1.031 -41.307 11.405 1.00 52.31 C ATOM 1017 CD PRO A 606 0.445 -41.271 11.765 1.00 10.21 C ATOM 0 HA PRO A 606 -0.473 -38.135 12.108 1.00 52.33 H new ATOM 0 HB2 PRO A 606 -2.552 -39.963 12.159 1.00 21.10 H new ATOM 0 HB3 PRO A 606 -1.788 -39.412 10.682 1.00 21.10 H new ATOM 0 HG2 PRO A 606 -1.556 -42.038 12.020 1.00 52.31 H new ATOM 0 HG3 PRO A 606 -1.163 -41.610 10.366 1.00 52.31 H new ATOM 0 HD2 PRO A 606 0.687 -42.020 12.519 1.00 10.21 H new ATOM 0 HD3 PRO A 606 1.070 -41.479 10.896 1.00 10.21 H new ATOM 1025 N GLY A 607 -2.058 -38.417 14.179 1.00 73.11 N ATOM 1026 CA GLY A 607 -2.531 -38.239 15.541 1.00 15.22 C ATOM 1027 C GLY A 607 -4.054 -38.372 15.615 1.00 61.03 C ATOM 1028 O GLY A 607 -4.574 -39.454 15.885 1.00 4.42 O ATOM 0 H GLY A 607 -2.661 -38.014 13.462 1.00 73.11 H new ATOM 0 HA2 GLY A 607 -2.066 -38.980 16.191 1.00 15.22 H new ATOM 0 HA3 GLY A 607 -2.230 -37.258 15.909 1.00 15.22 H new ATOM 1032 N GLY A 608 -4.726 -37.257 15.369 1.00 31.02 N ATOM 1033 CA GLY A 608 -6.179 -37.236 15.404 1.00 4.32 C ATOM 1034 C GLY A 608 -6.728 -36.034 14.633 1.00 11.10 C ATOM 1035 O GLY A 608 -6.127 -34.961 14.639 1.00 40.35 O ATOM 0 H GLY A 608 -4.292 -36.362 15.145 1.00 31.02 H new ATOM 0 HA2 GLY A 608 -6.570 -38.158 14.974 1.00 4.32 H new ATOM 0 HA3 GLY A 608 -6.521 -37.196 16.438 1.00 4.32 H new ATOM 1039 N VAL A 609 -7.864 -36.254 13.988 1.00 32.41 N ATOM 1040 CA VAL A 609 -8.501 -35.203 13.214 1.00 55.22 C ATOM 1041 C VAL A 609 -8.665 -33.958 14.089 1.00 64.50 C ATOM 1042 O VAL A 609 -9.199 -34.038 15.194 1.00 23.21 O ATOM 1043 CB VAL A 609 -9.826 -35.707 12.638 1.00 15.31 C ATOM 1044 CG1 VAL A 609 -10.418 -34.694 11.656 1.00 40.41 C ATOM 1045 CG2 VAL A 609 -9.652 -37.075 11.976 1.00 44.21 C ATOM 0 H VAL A 609 -8.360 -37.145 13.986 1.00 32.41 H new ATOM 0 HA VAL A 609 -7.878 -34.924 12.365 1.00 55.22 H new ATOM 0 HB VAL A 609 -10.528 -35.822 13.464 1.00 15.31 H new ATOM 0 HG11 VAL A 609 -11.359 -35.077 11.261 1.00 40.41 H new ATOM 0 HG12 VAL A 609 -10.598 -33.750 12.171 1.00 40.41 H new ATOM 0 HG13 VAL A 609 -9.720 -34.532 10.835 1.00 40.41 H new ATOM 0 HG21 VAL A 609 -10.609 -37.410 11.575 1.00 44.21 H new ATOM 0 HG22 VAL A 609 -8.926 -36.998 11.166 1.00 44.21 H new ATOM 0 HG23 VAL A 609 -9.297 -37.794 12.714 1.00 44.21 H new ATOM 1055 N ILE A 610 -8.195 -32.838 13.562 1.00 45.43 N ATOM 1056 CA ILE A 610 -8.282 -31.578 14.281 1.00 24.11 C ATOM 1057 C ILE A 610 -9.527 -30.818 13.821 1.00 32.00 C ATOM 1058 O ILE A 610 -9.897 -30.876 12.649 1.00 23.13 O ATOM 1059 CB ILE A 610 -6.984 -30.782 14.127 1.00 22.43 C ATOM 1060 CG1 ILE A 610 -5.785 -31.717 13.951 1.00 73.00 C ATOM 1061 CG2 ILE A 610 -6.791 -29.817 15.298 1.00 25.14 C ATOM 1062 CD1 ILE A 610 -4.475 -30.993 14.267 1.00 63.54 C ATOM 0 H ILE A 610 -7.752 -32.776 12.645 1.00 45.43 H new ATOM 0 HA ILE A 610 -8.394 -31.757 15.350 1.00 24.11 H new ATOM 0 HB ILE A 610 -7.058 -30.179 13.222 1.00 22.43 H new ATOM 0 HG12 ILE A 610 -5.894 -32.582 14.606 1.00 73.00 H new ATOM 0 HG13 ILE A 610 -5.759 -32.093 12.928 1.00 73.00 H new ATOM 0 HG21 ILE A 610 -5.861 -29.264 15.164 1.00 25.14 H new ATOM 0 HG22 ILE A 610 -7.627 -29.118 15.335 1.00 25.14 H new ATOM 0 HG23 ILE A 610 -6.747 -30.380 16.230 1.00 25.14 H new ATOM 0 HD11 ILE A 610 -3.639 -31.679 14.134 1.00 63.54 H new ATOM 0 HD12 ILE A 610 -4.357 -30.143 13.594 1.00 63.54 H new ATOM 0 HD13 ILE A 610 -4.494 -30.640 15.298 1.00 63.54 H new ATOM 1074 N SER A 611 -10.140 -30.123 14.768 1.00 52.44 N ATOM 1075 CA SER A 611 -11.337 -29.352 14.474 1.00 4.12 C ATOM 1076 C SER A 611 -11.315 -28.035 15.254 1.00 72.54 C ATOM 1077 O SER A 611 -11.200 -28.037 16.478 1.00 2.22 O ATOM 1078 CB SER A 611 -12.600 -30.147 14.810 1.00 41.04 C ATOM 1079 OG SER A 611 -12.351 -31.161 15.780 1.00 42.32 O ATOM 0 H SER A 611 -9.831 -30.077 15.739 1.00 52.44 H new ATOM 0 HA SER A 611 -11.351 -29.135 13.406 1.00 4.12 H new ATOM 0 HB2 SER A 611 -13.367 -29.468 15.184 1.00 41.04 H new ATOM 0 HB3 SER A 611 -12.993 -30.603 13.902 1.00 41.04 H new ATOM 0 HG SER A 611 -11.709 -30.830 16.442 1.00 42.32 H new ATOM 1085 N CYS A 612 -11.428 -26.944 14.512 1.00 54.34 N ATOM 1086 CA CYS A 612 -11.424 -25.623 15.118 1.00 65.12 C ATOM 1087 C CYS A 612 -12.542 -25.569 16.160 1.00 11.12 C ATOM 1088 O CYS A 612 -13.721 -25.554 15.810 1.00 32.34 O ATOM 1089 CB CYS A 612 -11.567 -24.519 14.069 1.00 51.33 C ATOM 1090 SG CYS A 612 -11.282 -22.823 14.695 1.00 23.23 S ATOM 0 H CYS A 612 -11.523 -26.947 13.496 1.00 54.34 H new ATOM 0 HA CYS A 612 -10.465 -25.447 15.606 1.00 65.12 H new ATOM 0 HB2 CYS A 612 -10.865 -24.715 13.258 1.00 51.33 H new ATOM 0 HB3 CYS A 612 -12.569 -24.570 13.643 1.00 51.33 H new ATOM 1095 N ARG A 613 -12.133 -25.541 17.420 1.00 44.41 N ATOM 1096 CA ARG A 613 -13.086 -25.488 18.516 1.00 64.34 C ATOM 1097 C ARG A 613 -13.864 -24.172 18.479 1.00 13.25 C ATOM 1098 O ARG A 613 -15.034 -24.128 18.859 1.00 44.44 O ATOM 1099 CB ARG A 613 -12.379 -25.618 19.867 1.00 72.25 C ATOM 1100 CG ARG A 613 -13.312 -25.222 21.013 1.00 24.01 C ATOM 1101 CD ARG A 613 -12.672 -25.525 22.370 1.00 41.24 C ATOM 1102 NE ARG A 613 -13.702 -25.997 23.321 1.00 74.41 N ATOM 1103 CZ ARG A 613 -13.493 -26.160 24.645 1.00 62.34 C ATOM 1104 NH1 ARG A 613 -12.286 -25.889 25.186 1.00 61.55 N ATOM 1105 NH2 ARG A 613 -14.486 -26.588 25.402 1.00 65.41 N ATOM 0 H ARG A 613 -11.154 -25.554 17.706 1.00 44.41 H new ATOM 0 HA ARG A 613 -13.775 -26.324 18.398 1.00 64.34 H new ATOM 0 HB2 ARG A 613 -12.040 -26.644 20.007 1.00 72.25 H new ATOM 0 HB3 ARG A 613 -11.492 -24.985 19.880 1.00 72.25 H new ATOM 0 HG2 ARG A 613 -13.546 -24.159 20.946 1.00 24.01 H new ATOM 0 HG3 ARG A 613 -14.255 -25.762 20.923 1.00 24.01 H new ATOM 0 HD2 ARG A 613 -11.897 -26.283 22.255 1.00 41.24 H new ATOM 0 HD3 ARG A 613 -12.187 -24.630 22.761 1.00 41.24 H new ATOM 0 HE ARG A 613 -14.629 -26.213 22.953 1.00 74.41 H new ATOM 0 HH11 ARG A 613 -11.524 -25.559 24.594 1.00 61.55 H new ATOM 0 HH12 ARG A 613 -12.136 -26.015 26.187 1.00 61.55 H new ATOM 0 HH21 ARG A 613 -15.395 -26.790 24.985 1.00 65.41 H new ATOM 0 HH22 ARG A 613 -14.345 -26.716 26.404 1.00 65.41 H new ATOM 1118 N ASN A 614 -13.185 -23.132 18.020 1.00 5.40 N ATOM 1119 CA ASN A 614 -13.798 -21.817 17.929 1.00 30.55 C ATOM 1120 C ASN A 614 -15.044 -21.901 17.046 1.00 73.12 C ATOM 1121 O ASN A 614 -16.105 -21.397 17.413 1.00 63.23 O ATOM 1122 CB ASN A 614 -12.840 -20.804 17.300 1.00 24.45 C ATOM 1123 CG ASN A 614 -11.996 -20.109 18.371 1.00 34.33 C ATOM 1124 OD1 ASN A 614 -10.780 -20.053 18.301 1.00 63.05 O ATOM 1125 ND2 ASN A 614 -12.709 -19.585 19.364 1.00 5.44 N ATOM 0 H ASN A 614 -12.215 -23.173 17.707 1.00 5.40 H new ATOM 0 HA ASN A 614 -14.052 -21.493 18.938 1.00 30.55 H new ATOM 0 HB2 ASN A 614 -12.187 -21.309 16.588 1.00 24.45 H new ATOM 0 HB3 ASN A 614 -13.407 -20.061 16.740 1.00 24.45 H new ATOM 0 HD21 ASN A 614 -12.239 -19.100 20.129 1.00 5.44 H new ATOM 0 HD22 ASN A 614 -13.726 -19.668 19.361 1.00 5.44 H new ATOM 1132 N CYS A 615 -14.875 -22.541 15.898 1.00 30.22 N ATOM 1133 CA CYS A 615 -15.973 -22.697 14.959 1.00 20.23 C ATOM 1134 C CYS A 615 -16.246 -24.192 14.784 1.00 72.31 C ATOM 1135 O CYS A 615 -17.243 -24.708 15.288 1.00 64.21 O ATOM 1136 CB CYS A 615 -15.678 -22.010 13.624 1.00 24.54 C ATOM 1137 SG CYS A 615 -14.647 -20.503 13.748 1.00 31.33 S ATOM 0 H CYS A 615 -13.994 -22.958 15.597 1.00 30.22 H new ATOM 0 HA CYS A 615 -16.865 -22.210 15.354 1.00 20.23 H new ATOM 0 HB2 CYS A 615 -15.178 -22.722 12.968 1.00 24.54 H new ATOM 0 HB3 CYS A 615 -16.624 -21.748 13.149 1.00 24.54 H new ATOM 1142 N GLY A 616 -15.344 -24.846 14.068 1.00 64.25 N ATOM 1143 CA GLY A 616 -15.475 -26.272 13.819 1.00 2.13 C ATOM 1144 C GLY A 616 -14.750 -26.674 12.533 1.00 4.43 C ATOM 1145 O GLY A 616 -14.414 -27.842 12.345 1.00 40.23 O ATOM 0 H GLY A 616 -14.519 -24.415 13.652 1.00 64.25 H new ATOM 0 HA2 GLY A 616 -15.066 -26.831 14.661 1.00 2.13 H new ATOM 0 HA3 GLY A 616 -16.530 -26.536 13.744 1.00 2.13 H new ATOM 1149 N GLU A 617 -14.529 -25.683 11.682 1.00 54.32 N ATOM 1150 CA GLU A 617 -13.850 -25.918 10.419 1.00 32.10 C ATOM 1151 C GLU A 617 -12.663 -26.861 10.623 1.00 61.44 C ATOM 1152 O GLU A 617 -11.614 -26.448 11.114 1.00 10.31 O ATOM 1153 CB GLU A 617 -13.401 -24.601 9.784 1.00 10.41 C ATOM 1154 CG GLU A 617 -13.199 -24.760 8.276 1.00 41.42 C ATOM 1155 CD GLU A 617 -14.542 -24.789 7.543 1.00 64.22 C ATOM 1156 OE1 GLU A 617 -14.577 -24.669 6.309 1.00 13.02 O ATOM 1157 OE2 GLU A 617 -15.573 -24.945 8.301 1.00 15.12 O ATOM 0 H GLU A 617 -14.808 -24.715 11.842 1.00 54.32 H new ATOM 0 HA GLU A 617 -14.553 -26.392 9.734 1.00 32.10 H new ATOM 0 HB2 GLU A 617 -14.146 -23.828 9.975 1.00 10.41 H new ATOM 0 HB3 GLU A 617 -12.471 -24.269 10.246 1.00 10.41 H new ATOM 0 HG2 GLU A 617 -12.592 -23.937 7.898 1.00 41.42 H new ATOM 0 HG3 GLU A 617 -12.650 -25.680 8.074 1.00 41.42 H new ATOM 1165 N VAL A 618 -12.868 -28.111 10.234 1.00 21.55 N ATOM 1166 CA VAL A 618 -11.827 -29.117 10.368 1.00 14.13 C ATOM 1167 C VAL A 618 -10.550 -28.616 9.691 1.00 11.12 C ATOM 1168 O VAL A 618 -10.549 -28.328 8.495 1.00 32.03 O ATOM 1169 CB VAL A 618 -12.316 -30.454 9.808 1.00 54.15 C ATOM 1170 CG1 VAL A 618 -11.155 -31.435 9.637 1.00 3.32 C ATOM 1171 CG2 VAL A 618 -13.413 -31.051 10.692 1.00 51.14 C ATOM 0 H VAL A 618 -13.739 -28.450 9.826 1.00 21.55 H new ATOM 0 HA VAL A 618 -11.593 -29.287 11.419 1.00 14.13 H new ATOM 0 HB VAL A 618 -12.744 -30.267 8.823 1.00 54.15 H new ATOM 0 HG11 VAL A 618 -11.531 -32.377 9.238 1.00 3.32 H new ATOM 0 HG12 VAL A 618 -10.422 -31.015 8.948 1.00 3.32 H new ATOM 0 HG13 VAL A 618 -10.684 -31.613 10.604 1.00 3.32 H new ATOM 0 HG21 VAL A 618 -13.743 -32.001 10.271 1.00 51.14 H new ATOM 0 HG22 VAL A 618 -13.022 -31.215 11.696 1.00 51.14 H new ATOM 0 HG23 VAL A 618 -14.257 -30.363 10.739 1.00 51.14 H new ATOM 1181 N TRP A 619 -9.493 -28.527 10.485 1.00 33.23 N ATOM 1182 CA TRP A 619 -8.212 -28.066 9.978 1.00 53.04 C ATOM 1183 C TRP A 619 -7.551 -29.230 9.236 1.00 2.44 C ATOM 1184 O TRP A 619 -6.961 -29.039 8.174 1.00 53.41 O ATOM 1185 CB TRP A 619 -7.345 -27.506 11.106 1.00 2.24 C ATOM 1186 CG TRP A 619 -7.872 -26.201 11.708 1.00 61.34 C ATOM 1187 CD1 TRP A 619 -8.711 -25.316 11.152 1.00 64.33 C ATOM 1188 CD2 TRP A 619 -7.559 -25.668 13.012 1.00 55.44 C ATOM 1189 NE1 TRP A 619 -8.961 -24.256 11.998 1.00 4.54 N ATOM 1190 CE2 TRP A 619 -8.238 -24.476 13.165 1.00 34.14 C ATOM 1191 CE3 TRP A 619 -6.731 -26.175 14.028 1.00 63.13 C ATOM 1192 CZ2 TRP A 619 -8.158 -23.692 14.322 1.00 12.14 C ATOM 1193 CZ3 TRP A 619 -6.661 -25.379 15.178 1.00 72.43 C ATOM 1194 CH2 TRP A 619 -7.338 -24.178 15.348 1.00 53.41 C ATOM 0 H TRP A 619 -9.498 -28.767 11.476 1.00 33.23 H new ATOM 0 HA TRP A 619 -8.348 -27.240 9.280 1.00 53.04 H new ATOM 0 HB2 TRP A 619 -7.268 -28.253 11.896 1.00 2.24 H new ATOM 0 HB3 TRP A 619 -6.337 -27.338 10.726 1.00 2.24 H new ATOM 0 HD1 TRP A 619 -9.138 -25.420 10.165 1.00 64.33 H new ATOM 0 HE1 TRP A 619 -9.565 -23.458 11.803 1.00 4.54 H new ATOM 0 HE3 TRP A 619 -6.191 -27.105 13.930 1.00 63.13 H new ATOM 0 HZ2 TRP A 619 -8.699 -22.762 14.418 1.00 12.14 H new ATOM 0 HZ3 TRP A 619 -6.037 -25.723 15.990 1.00 72.43 H new ATOM 0 HH2 TRP A 619 -7.232 -23.621 16.267 1.00 53.41 H new ATOM 1205 N GLY A 620 -7.671 -30.410 9.826 1.00 1.24 N ATOM 1206 CA GLY A 620 -7.092 -31.604 9.235 1.00 21.33 C ATOM 1207 C GLY A 620 -6.885 -32.693 10.290 1.00 35.21 C ATOM 1208 O GLY A 620 -7.851 -33.243 10.817 1.00 14.02 O ATOM 0 H GLY A 620 -8.161 -30.565 10.707 1.00 1.24 H new ATOM 0 HA2 GLY A 620 -7.745 -31.977 8.446 1.00 21.33 H new ATOM 0 HA3 GLY A 620 -6.138 -31.358 8.769 1.00 21.33 H new ATOM 1212 N LEU A 621 -5.620 -32.972 10.567 1.00 72.34 N ATOM 1213 CA LEU A 621 -5.275 -33.986 11.549 1.00 43.40 C ATOM 1214 C LEU A 621 -3.979 -33.583 12.256 1.00 20.32 C ATOM 1215 O LEU A 621 -3.164 -32.852 11.697 1.00 43.41 O ATOM 1216 CB LEU A 621 -5.215 -35.368 10.895 1.00 42.51 C ATOM 1217 CG LEU A 621 -3.854 -35.785 10.333 1.00 33.31 C ATOM 1218 CD1 LEU A 621 -3.328 -34.746 9.341 1.00 33.12 C ATOM 1219 CD2 LEU A 621 -2.856 -36.059 11.460 1.00 12.31 C ATOM 0 H LEU A 621 -4.821 -32.514 10.129 1.00 72.34 H new ATOM 0 HA LEU A 621 -6.049 -34.055 12.314 1.00 43.40 H new ATOM 0 HB2 LEU A 621 -5.525 -36.110 11.631 1.00 42.51 H new ATOM 0 HB3 LEU A 621 -5.945 -35.397 10.086 1.00 42.51 H new ATOM 0 HG LEU A 621 -3.983 -36.717 9.783 1.00 33.31 H new ATOM 0 HD11 LEU A 621 -2.360 -35.067 8.957 1.00 33.12 H new ATOM 0 HD12 LEU A 621 -4.031 -34.644 8.514 1.00 33.12 H new ATOM 0 HD13 LEU A 621 -3.218 -33.785 9.844 1.00 33.12 H new ATOM 0 HD21 LEU A 621 -1.897 -36.353 11.033 1.00 12.31 H new ATOM 0 HD22 LEU A 621 -2.726 -35.157 12.058 1.00 12.31 H new ATOM 0 HD23 LEU A 621 -3.233 -36.862 12.093 1.00 12.31 H new ATOM 1231 N GLN A 622 -3.830 -34.079 13.476 1.00 65.13 N ATOM 1232 CA GLN A 622 -2.647 -33.780 14.265 1.00 22.53 C ATOM 1233 C GLN A 622 -1.521 -34.760 13.927 1.00 74.21 C ATOM 1234 O GLN A 622 -1.754 -35.963 13.814 1.00 43.24 O ATOM 1235 CB GLN A 622 -2.965 -33.807 15.761 1.00 14.14 C ATOM 1236 CG GLN A 622 -2.153 -32.751 16.514 1.00 62.12 C ATOM 1237 CD GLN A 622 -1.825 -33.220 17.933 1.00 64.33 C ATOM 1238 OE1 GLN A 622 -0.748 -33.719 18.216 1.00 43.02 O ATOM 1239 NE2 GLN A 622 -2.810 -33.033 18.806 1.00 72.21 N ATOM 0 H GLN A 622 -4.508 -34.685 13.937 1.00 65.13 H new ATOM 0 HA GLN A 622 -2.313 -32.773 14.015 1.00 22.53 H new ATOM 0 HB2 GLN A 622 -4.030 -33.629 15.913 1.00 14.14 H new ATOM 0 HB3 GLN A 622 -2.746 -34.795 16.165 1.00 14.14 H new ATOM 0 HG2 GLN A 622 -1.230 -32.543 15.973 1.00 62.12 H new ATOM 0 HG3 GLN A 622 -2.714 -31.818 16.556 1.00 62.12 H new ATOM 0 HE21 GLN A 622 -3.687 -32.609 18.503 1.00 72.21 H new ATOM 0 HE22 GLN A 622 -2.689 -33.313 19.779 1.00 72.21 H new ATOM 1248 N MET A 623 -0.326 -34.209 13.775 1.00 31.30 N ATOM 1249 CA MET A 623 0.836 -35.020 13.452 1.00 51.41 C ATOM 1250 C MET A 623 1.859 -34.989 14.589 1.00 44.41 C ATOM 1251 O MET A 623 2.019 -33.968 15.257 1.00 23.42 O ATOM 1252 CB MET A 623 1.483 -34.496 12.168 1.00 13.11 C ATOM 1253 CG MET A 623 0.809 -35.094 10.931 1.00 13.44 C ATOM 1254 SD MET A 623 1.383 -36.764 10.670 1.00 14.45 S ATOM 1255 CE MET A 623 0.374 -37.223 9.272 1.00 73.15 C ATOM 0 H MET A 623 -0.137 -33.211 13.869 1.00 31.30 H new ATOM 0 HA MET A 623 0.509 -36.050 13.311 1.00 51.41 H new ATOM 0 HB2 MET A 623 1.409 -33.409 12.137 1.00 13.11 H new ATOM 0 HB3 MET A 623 2.544 -34.744 12.164 1.00 13.11 H new ATOM 0 HG2 MET A 623 -0.274 -35.089 11.058 1.00 13.44 H new ATOM 0 HG3 MET A 623 1.030 -34.484 10.055 1.00 13.44 H new ATOM 0 HE1 MET A 623 0.185 -38.296 9.297 1.00 73.15 H new ATOM 0 HE2 MET A 623 -0.574 -36.686 9.315 1.00 73.15 H new ATOM 0 HE3 MET A 623 0.894 -36.968 8.349 1.00 73.15 H new ATOM 1265 N ILE A 624 2.526 -36.119 14.773 1.00 12.33 N ATOM 1266 CA ILE A 624 3.529 -36.234 15.818 1.00 44.22 C ATOM 1267 C ILE A 624 4.903 -36.443 15.178 1.00 24.11 C ATOM 1268 O ILE A 624 5.027 -37.159 14.186 1.00 64.23 O ATOM 1269 CB ILE A 624 3.142 -37.328 16.815 1.00 40.22 C ATOM 1270 CG1 ILE A 624 1.751 -37.070 17.398 1.00 23.35 C ATOM 1271 CG2 ILE A 624 4.204 -37.475 17.907 1.00 73.43 C ATOM 1272 CD1 ILE A 624 0.657 -37.480 16.410 1.00 25.23 C ATOM 0 H ILE A 624 2.391 -36.963 14.216 1.00 12.33 H new ATOM 0 HA ILE A 624 3.583 -35.312 16.398 1.00 44.22 H new ATOM 0 HB ILE A 624 3.096 -38.277 16.281 1.00 40.22 H new ATOM 0 HG12 ILE A 624 1.634 -37.627 18.328 1.00 23.35 H new ATOM 0 HG13 ILE A 624 1.646 -36.013 17.644 1.00 23.35 H new ATOM 0 HG21 ILE A 624 3.905 -38.259 18.603 1.00 73.43 H new ATOM 0 HG22 ILE A 624 5.159 -37.738 17.453 1.00 73.43 H new ATOM 0 HG23 ILE A 624 4.306 -36.532 18.445 1.00 73.43 H new ATOM 0 HD11 ILE A 624 -0.321 -37.286 16.849 1.00 25.23 H new ATOM 0 HD12 ILE A 624 0.762 -36.904 15.491 1.00 25.23 H new ATOM 0 HD13 ILE A 624 0.750 -38.543 16.185 1.00 25.23 H new ATOM 1284 N TYR A 625 5.901 -35.805 15.773 1.00 72.14 N ATOM 1285 CA TYR A 625 7.261 -35.912 15.273 1.00 22.52 C ATOM 1286 C TYR A 625 8.274 -35.824 16.417 1.00 53.12 C ATOM 1287 O TYR A 625 8.395 -34.785 17.065 1.00 75.24 O ATOM 1288 CB TYR A 625 7.462 -34.719 14.337 1.00 71.43 C ATOM 1289 CG TYR A 625 8.929 -34.354 14.100 1.00 15.34 C ATOM 1290 CD1 TYR A 625 9.625 -34.933 13.059 1.00 23.35 C ATOM 1291 CD2 TYR A 625 9.555 -33.444 14.928 1.00 31.21 C ATOM 1292 CE1 TYR A 625 11.006 -34.589 12.837 1.00 32.11 C ATOM 1293 CE2 TYR A 625 10.935 -33.100 14.706 1.00 44.03 C ATOM 1294 CZ TYR A 625 11.593 -33.689 13.671 1.00 34.42 C ATOM 1295 OH TYR A 625 12.896 -33.364 13.461 1.00 24.31 O ATOM 0 H TYR A 625 5.795 -35.212 16.596 1.00 72.14 H new ATOM 0 HA TYR A 625 7.411 -36.867 14.770 1.00 22.52 H new ATOM 0 HB2 TYR A 625 6.994 -34.940 13.378 1.00 71.43 H new ATOM 0 HB3 TYR A 625 6.945 -33.854 14.752 1.00 71.43 H new ATOM 0 HD1 TYR A 625 9.135 -35.644 12.411 1.00 23.35 H new ATOM 0 HD2 TYR A 625 9.009 -32.990 15.742 1.00 31.21 H new ATOM 0 HE1 TYR A 625 11.563 -35.036 12.027 1.00 32.11 H new ATOM 0 HE2 TYR A 625 11.437 -32.390 15.347 1.00 44.03 H new ATOM 0 HH TYR A 625 13.103 -33.441 12.506 1.00 24.31 H new ATOM 1305 N LYS A 626 8.975 -36.927 16.630 1.00 24.21 N ATOM 1306 CA LYS A 626 9.974 -36.987 17.684 1.00 33.33 C ATOM 1307 C LYS A 626 9.280 -36.888 19.044 1.00 14.12 C ATOM 1308 O LYS A 626 9.921 -36.599 20.053 1.00 24.10 O ATOM 1309 CB LYS A 626 11.050 -35.923 17.464 1.00 2.30 C ATOM 1310 CG LYS A 626 11.485 -35.878 15.998 1.00 42.13 C ATOM 1311 CD LYS A 626 12.453 -37.019 15.678 1.00 50.01 C ATOM 1312 CE LYS A 626 11.701 -38.246 15.159 1.00 21.43 C ATOM 1313 NZ LYS A 626 11.613 -38.214 13.682 1.00 21.42 N ATOM 0 H LYS A 626 8.871 -37.787 16.091 1.00 24.21 H new ATOM 0 HA LYS A 626 10.496 -37.944 17.660 1.00 33.33 H new ATOM 0 HB2 LYS A 626 10.668 -34.947 17.764 1.00 2.30 H new ATOM 0 HB3 LYS A 626 11.912 -36.136 18.096 1.00 2.30 H new ATOM 0 HG2 LYS A 626 10.609 -35.948 15.353 1.00 42.13 H new ATOM 0 HG3 LYS A 626 11.962 -34.921 15.786 1.00 42.13 H new ATOM 0 HD2 LYS A 626 13.176 -36.689 14.932 1.00 50.01 H new ATOM 0 HD3 LYS A 626 13.016 -37.285 16.573 1.00 50.01 H new ATOM 0 HE2 LYS A 626 12.211 -39.155 15.479 1.00 21.43 H new ATOM 0 HE3 LYS A 626 10.699 -38.274 15.588 1.00 21.43 H new ATOM 0 HZ1 LYS A 626 10.808 -38.794 13.370 1.00 21.42 H new ATOM 0 HZ2 LYS A 626 11.477 -37.233 13.363 1.00 21.42 H new ATOM 0 HZ3 LYS A 626 12.492 -38.592 13.274 1.00 21.42 H new ATOM 1326 N SER A 627 7.978 -37.133 19.028 1.00 54.35 N ATOM 1327 CA SER A 627 7.190 -37.074 20.247 1.00 75.41 C ATOM 1328 C SER A 627 6.743 -35.635 20.513 1.00 23.32 C ATOM 1329 O SER A 627 6.738 -35.185 21.658 1.00 73.12 O ATOM 1330 CB SER A 627 7.980 -37.614 21.440 1.00 23.31 C ATOM 1331 OG SER A 627 8.710 -36.587 22.106 1.00 71.11 O ATOM 0 H SER A 627 7.449 -37.373 18.190 1.00 54.35 H new ATOM 0 HA SER A 627 6.309 -37.702 20.115 1.00 75.41 H new ATOM 0 HB2 SER A 627 7.295 -38.087 22.144 1.00 23.31 H new ATOM 0 HB3 SER A 627 8.670 -38.386 21.099 1.00 23.31 H new ATOM 0 HG SER A 627 9.205 -36.057 21.447 1.00 71.11 H new ATOM 1337 N VAL A 628 6.380 -34.954 19.437 1.00 40.52 N ATOM 1338 CA VAL A 628 5.933 -33.575 19.540 1.00 43.32 C ATOM 1339 C VAL A 628 4.556 -33.439 18.887 1.00 62.31 C ATOM 1340 O VAL A 628 4.387 -33.765 17.713 1.00 30.41 O ATOM 1341 CB VAL A 628 6.979 -32.639 18.930 1.00 52.14 C ATOM 1342 CG1 VAL A 628 6.426 -31.220 18.784 1.00 10.33 C ATOM 1343 CG2 VAL A 628 8.267 -32.644 19.755 1.00 41.11 C ATOM 0 H VAL A 628 6.386 -35.331 18.489 1.00 40.52 H new ATOM 0 HA VAL A 628 5.827 -33.285 20.585 1.00 43.32 H new ATOM 0 HB VAL A 628 7.219 -33.009 17.933 1.00 52.14 H new ATOM 0 HG11 VAL A 628 7.189 -30.575 18.348 1.00 10.33 H new ATOM 0 HG12 VAL A 628 5.550 -31.236 18.135 1.00 10.33 H new ATOM 0 HG13 VAL A 628 6.144 -30.837 19.765 1.00 10.33 H new ATOM 0 HG21 VAL A 628 8.993 -31.971 19.300 1.00 41.11 H new ATOM 0 HG22 VAL A 628 8.050 -32.311 20.770 1.00 41.11 H new ATOM 0 HG23 VAL A 628 8.677 -33.654 19.784 1.00 41.11 H new ATOM 1353 N LYS A 629 3.607 -32.958 19.676 1.00 3.42 N ATOM 1354 CA LYS A 629 2.250 -32.775 19.190 1.00 44.03 C ATOM 1355 C LYS A 629 2.198 -31.539 18.290 1.00 52.31 C ATOM 1356 O LYS A 629 2.132 -30.412 18.780 1.00 71.32 O ATOM 1357 CB LYS A 629 1.264 -32.727 20.358 1.00 20.44 C ATOM 1358 CG LYS A 629 1.607 -33.785 21.409 1.00 23.41 C ATOM 1359 CD LYS A 629 1.781 -35.162 20.764 1.00 32.15 C ATOM 1360 CE LYS A 629 0.433 -35.730 20.314 1.00 25.33 C ATOM 1361 NZ LYS A 629 -0.166 -36.554 21.388 1.00 73.02 N ATOM 0 H LYS A 629 3.751 -32.689 20.649 1.00 3.42 H new ATOM 0 HA LYS A 629 1.945 -33.626 18.581 1.00 44.03 H new ATOM 0 HB2 LYS A 629 1.283 -31.737 20.814 1.00 20.44 H new ATOM 0 HB3 LYS A 629 0.251 -32.890 19.990 1.00 20.44 H new ATOM 0 HG2 LYS A 629 2.524 -33.504 21.928 1.00 23.41 H new ATOM 0 HG3 LYS A 629 0.817 -33.828 22.159 1.00 23.41 H new ATOM 0 HD2 LYS A 629 2.451 -35.085 19.908 1.00 32.15 H new ATOM 0 HD3 LYS A 629 2.248 -35.844 21.474 1.00 32.15 H new ATOM 0 HE2 LYS A 629 -0.243 -34.916 20.053 1.00 25.33 H new ATOM 0 HE3 LYS A 629 0.567 -36.333 19.416 1.00 25.33 H new ATOM 0 HZ1 LYS A 629 -1.080 -36.932 21.067 1.00 73.02 H new ATOM 0 HZ2 LYS A 629 0.473 -37.342 21.618 1.00 73.02 H new ATOM 0 HZ3 LYS A 629 -0.312 -35.968 22.235 1.00 73.02 H new ATOM 1374 N LEU A 630 2.229 -31.791 16.990 1.00 50.24 N ATOM 1375 CA LEU A 630 2.186 -30.712 16.017 1.00 72.31 C ATOM 1376 C LEU A 630 0.950 -30.880 15.130 1.00 65.51 C ATOM 1377 O LEU A 630 0.874 -31.818 14.337 1.00 11.13 O ATOM 1378 CB LEU A 630 3.499 -30.643 15.235 1.00 2.22 C ATOM 1379 CG LEU A 630 4.778 -30.607 16.074 1.00 21.05 C ATOM 1380 CD1 LEU A 630 6.018 -30.761 15.191 1.00 12.04 C ATOM 1381 CD2 LEU A 630 4.837 -29.340 16.930 1.00 43.22 C ATOM 0 H LEU A 630 2.283 -32.727 16.587 1.00 50.24 H new ATOM 0 HA LEU A 630 2.090 -29.749 16.520 1.00 72.31 H new ATOM 0 HB2 LEU A 630 3.549 -31.505 14.570 1.00 2.22 H new ATOM 0 HB3 LEU A 630 3.477 -29.754 14.604 1.00 2.22 H new ATOM 0 HG LEU A 630 4.762 -31.456 16.757 1.00 21.05 H new ATOM 0 HD11 LEU A 630 6.913 -30.732 15.812 1.00 12.04 H new ATOM 0 HD12 LEU A 630 5.973 -31.714 14.664 1.00 12.04 H new ATOM 0 HD13 LEU A 630 6.052 -29.947 14.467 1.00 12.04 H new ATOM 0 HD21 LEU A 630 5.756 -29.340 17.516 1.00 43.22 H new ATOM 0 HD22 LEU A 630 4.819 -28.463 16.283 1.00 43.22 H new ATOM 0 HD23 LEU A 630 3.978 -29.314 17.601 1.00 43.22 H new ATOM 1393 N PRO A 631 -0.011 -29.933 15.298 1.00 62.14 N ATOM 1394 CA PRO A 631 -1.239 -29.967 14.522 1.00 62.43 C ATOM 1395 C PRO A 631 -0.991 -29.511 13.083 1.00 50.34 C ATOM 1396 O PRO A 631 -0.297 -28.521 12.852 1.00 34.41 O ATOM 1397 CB PRO A 631 -2.204 -29.066 15.273 1.00 13.52 C ATOM 1398 CG PRO A 631 -1.345 -28.197 16.178 1.00 32.42 C ATOM 1399 CD PRO A 631 0.046 -28.808 16.227 1.00 73.51 C ATOM 0 HA PRO A 631 -1.648 -30.973 14.425 1.00 62.43 H new ATOM 0 HB2 PRO A 631 -2.786 -28.455 14.583 1.00 13.52 H new ATOM 0 HB3 PRO A 631 -2.914 -29.653 15.855 1.00 13.52 H new ATOM 0 HG2 PRO A 631 -1.301 -27.177 15.797 1.00 32.42 H new ATOM 0 HG3 PRO A 631 -1.775 -28.146 17.178 1.00 32.42 H new ATOM 0 HD2 PRO A 631 0.806 -28.086 15.929 1.00 73.51 H new ATOM 0 HD3 PRO A 631 0.298 -29.139 17.235 1.00 73.51 H new ATOM 1407 N VAL A 632 -1.572 -30.253 12.152 1.00 62.43 N ATOM 1408 CA VAL A 632 -1.423 -29.937 10.741 1.00 20.13 C ATOM 1409 C VAL A 632 -2.704 -29.271 10.235 1.00 62.15 C ATOM 1410 O VAL A 632 -3.688 -29.950 9.947 1.00 55.33 O ATOM 1411 CB VAL A 632 -1.055 -31.199 9.958 1.00 10.11 C ATOM 1412 CG1 VAL A 632 -0.672 -30.857 8.517 1.00 71.42 C ATOM 1413 CG2 VAL A 632 0.068 -31.969 10.656 1.00 74.51 C ATOM 0 H VAL A 632 -2.147 -31.073 12.347 1.00 62.43 H new ATOM 0 HA VAL A 632 -0.608 -29.229 10.591 1.00 20.13 H new ATOM 0 HB VAL A 632 -1.934 -31.843 9.927 1.00 10.11 H new ATOM 0 HG11 VAL A 632 -0.415 -31.771 7.982 1.00 71.42 H new ATOM 0 HG12 VAL A 632 -1.513 -30.372 8.022 1.00 71.42 H new ATOM 0 HG13 VAL A 632 0.185 -30.184 8.518 1.00 71.42 H new ATOM 0 HG21 VAL A 632 0.310 -32.861 10.079 1.00 74.51 H new ATOM 0 HG22 VAL A 632 0.951 -31.335 10.732 1.00 74.51 H new ATOM 0 HG23 VAL A 632 -0.257 -32.260 11.655 1.00 74.51 H new ATOM 1423 N LEU A 633 -2.649 -27.951 10.141 1.00 41.32 N ATOM 1424 CA LEU A 633 -3.792 -27.185 9.674 1.00 74.43 C ATOM 1425 C LEU A 633 -3.570 -26.784 8.214 1.00 1.43 C ATOM 1426 O LEU A 633 -2.483 -26.978 7.672 1.00 51.11 O ATOM 1427 CB LEU A 633 -4.060 -26.000 10.604 1.00 71.42 C ATOM 1428 CG LEU A 633 -3.778 -26.236 12.089 1.00 31.40 C ATOM 1429 CD1 LEU A 633 -3.982 -27.707 12.459 1.00 53.21 C ATOM 1430 CD2 LEU A 633 -2.382 -25.739 12.468 1.00 42.32 C ATOM 0 H LEU A 633 -1.830 -27.392 10.380 1.00 41.32 H new ATOM 0 HA LEU A 633 -4.696 -27.794 9.704 1.00 74.43 H new ATOM 0 HB2 LEU A 633 -3.456 -25.157 10.269 1.00 71.42 H new ATOM 0 HB3 LEU A 633 -5.104 -25.707 10.495 1.00 71.42 H new ATOM 0 HG LEU A 633 -4.495 -25.655 12.669 1.00 31.40 H new ATOM 0 HD11 LEU A 633 -3.775 -27.847 13.520 1.00 53.21 H new ATOM 0 HD12 LEU A 633 -5.012 -27.996 12.249 1.00 53.21 H new ATOM 0 HD13 LEU A 633 -3.305 -28.327 11.872 1.00 53.21 H new ATOM 0 HD21 LEU A 633 -2.207 -25.919 13.529 1.00 42.32 H new ATOM 0 HD22 LEU A 633 -1.634 -26.273 11.882 1.00 42.32 H new ATOM 0 HD23 LEU A 633 -2.308 -24.671 12.264 1.00 42.32 H new ATOM 1442 N LYS A 634 -4.617 -26.231 7.620 1.00 40.31 N ATOM 1443 CA LYS A 634 -4.550 -25.800 6.234 1.00 44.22 C ATOM 1444 C LYS A 634 -4.228 -24.305 6.184 1.00 41.10 C ATOM 1445 O LYS A 634 -4.013 -23.678 7.220 1.00 4.20 O ATOM 1446 CB LYS A 634 -5.833 -26.178 5.492 1.00 15.33 C ATOM 1447 CG LYS A 634 -6.225 -27.629 5.779 1.00 53.23 C ATOM 1448 CD LYS A 634 -7.737 -27.760 5.974 1.00 30.13 C ATOM 1449 CE LYS A 634 -8.496 -26.854 5.003 1.00 72.33 C ATOM 1450 NZ LYS A 634 -9.819 -27.434 4.679 1.00 21.43 N ATOM 0 H LYS A 634 -5.517 -26.071 8.073 1.00 40.31 H new ATOM 0 HA LYS A 634 -3.744 -26.318 5.713 1.00 44.22 H new ATOM 0 HB2 LYS A 634 -6.642 -25.512 5.794 1.00 15.33 H new ATOM 0 HB3 LYS A 634 -5.691 -26.041 4.420 1.00 15.33 H new ATOM 0 HG2 LYS A 634 -5.904 -28.266 4.955 1.00 53.23 H new ATOM 0 HG3 LYS A 634 -5.708 -27.979 6.672 1.00 53.23 H new ATOM 0 HD2 LYS A 634 -8.038 -28.796 5.821 1.00 30.13 H new ATOM 0 HD3 LYS A 634 -7.999 -27.500 7.000 1.00 30.13 H new ATOM 0 HE2 LYS A 634 -8.624 -25.865 5.443 1.00 72.33 H new ATOM 0 HE3 LYS A 634 -7.916 -26.723 4.089 1.00 72.33 H new ATOM 0 HZ1 LYS A 634 -10.321 -26.806 4.019 1.00 21.43 H new ATOM 0 HZ2 LYS A 634 -9.690 -28.368 4.239 1.00 21.43 H new ATOM 0 HZ3 LYS A 634 -10.376 -27.536 5.551 1.00 21.43 H new ATOM 1463 N VAL A 635 -4.206 -23.777 4.969 1.00 65.21 N ATOM 1464 CA VAL A 635 -3.914 -22.368 4.770 1.00 3.44 C ATOM 1465 C VAL A 635 -5.200 -21.635 4.383 1.00 3.31 C ATOM 1466 O VAL A 635 -5.314 -20.426 4.583 1.00 32.53 O ATOM 1467 CB VAL A 635 -2.798 -22.205 3.736 1.00 11.31 C ATOM 1468 CG1 VAL A 635 -3.314 -22.487 2.324 1.00 73.21 C ATOM 1469 CG2 VAL A 635 -2.170 -20.812 3.822 1.00 22.42 C ATOM 0 H VAL A 635 -4.386 -24.300 4.112 1.00 65.21 H new ATOM 0 HA VAL A 635 -3.550 -21.919 5.694 1.00 3.44 H new ATOM 0 HB VAL A 635 -2.022 -22.937 3.962 1.00 11.31 H new ATOM 0 HG11 VAL A 635 -2.501 -22.364 1.608 1.00 73.21 H new ATOM 0 HG12 VAL A 635 -3.692 -23.508 2.272 1.00 73.21 H new ATOM 0 HG13 VAL A 635 -4.117 -21.790 2.084 1.00 73.21 H new ATOM 0 HG21 VAL A 635 -1.380 -20.722 3.077 1.00 22.42 H new ATOM 0 HG22 VAL A 635 -2.933 -20.057 3.634 1.00 22.42 H new ATOM 0 HG23 VAL A 635 -1.749 -20.663 4.816 1.00 22.42 H new ATOM 1479 N ARG A 636 -6.135 -22.397 3.835 1.00 11.55 N ATOM 1480 CA ARG A 636 -7.409 -21.835 3.418 1.00 5.43 C ATOM 1481 C ARG A 636 -8.386 -21.804 4.595 1.00 72.23 C ATOM 1482 O ARG A 636 -9.497 -21.292 4.470 1.00 54.41 O ATOM 1483 CB ARG A 636 -8.021 -22.647 2.276 1.00 72.22 C ATOM 1484 CG ARG A 636 -8.553 -23.990 2.782 1.00 45.15 C ATOM 1485 CD ARG A 636 -9.150 -24.810 1.636 1.00 12.41 C ATOM 1486 NE ARG A 636 -8.127 -25.723 1.080 1.00 51.01 N ATOM 1487 CZ ARG A 636 -8.383 -26.672 0.154 1.00 3.03 C ATOM 1488 NH1 ARG A 636 -9.633 -26.840 -0.327 1.00 64.34 N ATOM 1489 NH2 ARG A 636 -7.392 -27.433 -0.272 1.00 52.04 N ATOM 0 H ARG A 636 -6.036 -23.399 3.670 1.00 11.55 H new ATOM 0 HA ARG A 636 -7.225 -20.819 3.068 1.00 5.43 H new ATOM 0 HB2 ARG A 636 -8.831 -22.081 1.816 1.00 72.22 H new ATOM 0 HB3 ARG A 636 -7.271 -22.817 1.503 1.00 72.22 H new ATOM 0 HG2 ARG A 636 -7.746 -24.551 3.253 1.00 45.15 H new ATOM 0 HG3 ARG A 636 -9.312 -23.820 3.546 1.00 45.15 H new ATOM 0 HD2 ARG A 636 -10.004 -25.384 1.995 1.00 12.41 H new ATOM 0 HD3 ARG A 636 -9.518 -24.145 0.855 1.00 12.41 H new ATOM 0 HE ARG A 636 -7.169 -25.630 1.417 1.00 51.01 H new ATOM 0 HH11 ARG A 636 -10.393 -26.248 0.009 1.00 64.34 H new ATOM 0 HH12 ARG A 636 -9.818 -27.559 -1.026 1.00 64.34 H new ATOM 0 HH21 ARG A 636 -6.451 -27.299 0.098 1.00 52.04 H new ATOM 0 HH22 ARG A 636 -7.567 -28.155 -0.971 1.00 52.04 H new ATOM 1502 N SER A 637 -7.937 -22.360 5.711 1.00 51.34 N ATOM 1503 CA SER A 637 -8.759 -22.403 6.908 1.00 5.54 C ATOM 1504 C SER A 637 -8.190 -21.455 7.967 1.00 61.30 C ATOM 1505 O SER A 637 -8.872 -21.118 8.934 1.00 65.12 O ATOM 1506 CB SER A 637 -8.849 -23.825 7.463 1.00 33.43 C ATOM 1507 OG SER A 637 -9.827 -24.604 6.778 1.00 23.23 O ATOM 0 H SER A 637 -7.015 -22.784 5.811 1.00 51.34 H new ATOM 0 HA SER A 637 -9.766 -22.081 6.644 1.00 5.54 H new ATOM 0 HB2 SER A 637 -7.876 -24.309 7.379 1.00 33.43 H new ATOM 0 HB3 SER A 637 -9.095 -23.785 8.524 1.00 33.43 H new ATOM 0 HG SER A 637 -9.809 -25.523 7.117 1.00 23.23 H new ATOM 1513 N MET A 638 -6.947 -21.053 7.748 1.00 3.23 N ATOM 1514 CA MET A 638 -6.279 -20.151 8.671 1.00 23.13 C ATOM 1515 C MET A 638 -6.167 -18.745 8.080 1.00 52.53 C ATOM 1516 O MET A 638 -5.675 -18.573 6.966 1.00 62.04 O ATOM 1517 CB MET A 638 -4.880 -20.686 8.985 1.00 42.41 C ATOM 1518 CG MET A 638 -4.955 -21.931 9.870 1.00 23.41 C ATOM 1519 SD MET A 638 -5.547 -21.491 11.495 1.00 3.23 S ATOM 1520 CE MET A 638 -7.099 -22.372 11.509 1.00 21.22 C ATOM 0 H MET A 638 -6.385 -21.335 6.945 1.00 3.23 H new ATOM 0 HA MET A 638 -6.870 -20.094 9.585 1.00 23.13 H new ATOM 0 HB2 MET A 638 -4.362 -20.926 8.057 1.00 42.41 H new ATOM 0 HB3 MET A 638 -4.296 -19.914 9.486 1.00 42.41 H new ATOM 0 HG2 MET A 638 -5.620 -22.668 9.419 1.00 23.41 H new ATOM 0 HG3 MET A 638 -3.971 -22.393 9.945 1.00 23.41 H new ATOM 0 HE1 MET A 638 -7.712 -22.016 12.337 1.00 21.22 H new ATOM 0 HE2 MET A 638 -7.623 -22.200 10.569 1.00 21.22 H new ATOM 0 HE3 MET A 638 -6.911 -23.439 11.630 1.00 21.22 H new ATOM 1530 N LEU A 639 -6.633 -17.774 8.852 1.00 42.21 N ATOM 1531 CA LEU A 639 -6.592 -16.388 8.418 1.00 5.42 C ATOM 1532 C LEU A 639 -5.277 -15.753 8.877 1.00 60.12 C ATOM 1533 O LEU A 639 -4.801 -16.029 9.977 1.00 62.42 O ATOM 1534 CB LEU A 639 -7.836 -15.639 8.898 1.00 13.35 C ATOM 1535 CG LEU A 639 -8.106 -14.289 8.231 1.00 52.24 C ATOM 1536 CD1 LEU A 639 -7.887 -14.372 6.719 1.00 53.42 C ATOM 1537 CD2 LEU A 639 -9.504 -13.774 8.580 1.00 10.00 C ATOM 0 H LEU A 639 -7.041 -17.920 9.775 1.00 42.21 H new ATOM 0 HA LEU A 639 -6.613 -16.329 7.330 1.00 5.42 H new ATOM 0 HB2 LEU A 639 -8.704 -16.279 8.741 1.00 13.35 H new ATOM 0 HB3 LEU A 639 -7.748 -15.479 9.973 1.00 13.35 H new ATOM 0 HG LEU A 639 -7.390 -13.566 8.622 1.00 52.24 H new ATOM 0 HD11 LEU A 639 -8.085 -13.399 6.269 1.00 53.42 H new ATOM 0 HD12 LEU A 639 -6.856 -14.662 6.516 1.00 53.42 H new ATOM 0 HD13 LEU A 639 -8.563 -15.114 6.294 1.00 53.42 H new ATOM 0 HD21 LEU A 639 -9.670 -12.813 8.093 1.00 10.00 H new ATOM 0 HD22 LEU A 639 -10.251 -14.489 8.236 1.00 10.00 H new ATOM 0 HD23 LEU A 639 -9.588 -13.653 9.660 1.00 10.00 H new ATOM 1549 N LEU A 640 -4.728 -14.915 8.010 1.00 3.34 N ATOM 1550 CA LEU A 640 -3.477 -14.239 8.313 1.00 54.23 C ATOM 1551 C LEU A 640 -3.752 -12.754 8.561 1.00 73.23 C ATOM 1552 O LEU A 640 -3.789 -11.961 7.622 1.00 53.25 O ATOM 1553 CB LEU A 640 -2.448 -14.498 7.211 1.00 52.13 C ATOM 1554 CG LEU A 640 -2.003 -15.952 7.037 1.00 52.51 C ATOM 1555 CD1 LEU A 640 -2.158 -16.732 8.343 1.00 30.25 C ATOM 1556 CD2 LEU A 640 -2.749 -16.618 5.879 1.00 24.40 C ATOM 0 H LEU A 640 -5.126 -14.689 7.098 1.00 3.34 H new ATOM 0 HA LEU A 640 -3.039 -14.640 9.227 1.00 54.23 H new ATOM 0 HB2 LEU A 640 -2.863 -14.150 6.265 1.00 52.13 H new ATOM 0 HB3 LEU A 640 -1.566 -13.891 7.415 1.00 52.13 H new ATOM 0 HG LEU A 640 -0.943 -15.958 6.783 1.00 52.51 H new ATOM 0 HD11 LEU A 640 -1.835 -17.762 8.192 1.00 30.25 H new ATOM 0 HD12 LEU A 640 -1.546 -16.270 9.118 1.00 30.25 H new ATOM 0 HD13 LEU A 640 -3.203 -16.721 8.651 1.00 30.25 H new ATOM 0 HD21 LEU A 640 -2.414 -17.650 5.776 1.00 24.40 H new ATOM 0 HD22 LEU A 640 -3.820 -16.602 6.079 1.00 24.40 H new ATOM 0 HD23 LEU A 640 -2.544 -16.077 4.955 1.00 24.40 H new ATOM 1568 N GLU A 641 -3.938 -12.424 9.830 1.00 0.42 N ATOM 1569 CA GLU A 641 -4.208 -11.048 10.214 1.00 73.45 C ATOM 1570 C GLU A 641 -2.935 -10.207 10.104 1.00 12.25 C ATOM 1571 O GLU A 641 -1.934 -10.502 10.755 1.00 30.21 O ATOM 1572 CB GLU A 641 -4.793 -10.978 11.626 1.00 40.44 C ATOM 1573 CG GLU A 641 -6.296 -10.697 11.583 1.00 14.32 C ATOM 1574 CD GLU A 641 -6.895 -10.703 12.991 1.00 12.52 C ATOM 1575 OE1 GLU A 641 -8.124 -10.779 13.142 1.00 4.32 O ATOM 1576 OE2 GLU A 641 -6.035 -10.625 13.950 1.00 72.53 O ATOM 0 H GLU A 641 -3.907 -13.085 10.606 1.00 0.42 H new ATOM 0 HA GLU A 641 -4.950 -10.638 9.529 1.00 73.45 H new ATOM 0 HB2 GLU A 641 -4.610 -11.918 12.146 1.00 40.44 H new ATOM 0 HB3 GLU A 641 -4.289 -10.196 12.194 1.00 40.44 H new ATOM 0 HG2 GLU A 641 -6.476 -9.731 11.112 1.00 14.32 H new ATOM 0 HG3 GLU A 641 -6.793 -11.448 10.969 1.00 14.32 H new ATOM 1584 N THR A 642 -3.015 -9.175 9.277 1.00 71.20 N ATOM 1585 CA THR A 642 -1.882 -8.289 9.074 1.00 3.23 C ATOM 1586 C THR A 642 -2.320 -6.828 9.190 1.00 51.43 C ATOM 1587 O THR A 642 -3.502 -6.518 9.053 1.00 55.24 O ATOM 1588 CB THR A 642 -1.251 -8.629 7.723 1.00 72.15 C ATOM 1589 OG1 THR A 642 -1.771 -7.640 6.838 1.00 32.21 O ATOM 1590 CG2 THR A 642 -1.770 -9.950 7.151 1.00 65.25 C ATOM 0 H THR A 642 -3.847 -8.933 8.740 1.00 71.20 H new ATOM 0 HA THR A 642 -1.126 -8.431 9.846 1.00 3.23 H new ATOM 0 HB THR A 642 -0.168 -8.680 7.831 1.00 72.15 H new ATOM 0 HG1 THR A 642 -2.612 -7.959 6.449 1.00 32.21 H new ATOM 0 HG21 THR A 642 -1.291 -10.144 6.192 1.00 65.25 H new ATOM 0 HG22 THR A 642 -1.541 -10.761 7.842 1.00 65.25 H new ATOM 0 HG23 THR A 642 -2.849 -9.887 7.011 1.00 65.25 H new ATOM 1598 N PRO A 643 -1.318 -5.945 9.447 1.00 24.54 N ATOM 1599 CA PRO A 643 -1.588 -4.524 9.583 1.00 63.32 C ATOM 1600 C PRO A 643 -1.848 -3.883 8.218 1.00 30.12 C ATOM 1601 O PRO A 643 -2.066 -2.676 8.127 1.00 43.11 O ATOM 1602 CB PRO A 643 -0.364 -3.956 10.282 1.00 23.13 C ATOM 1603 CG PRO A 643 0.739 -4.986 10.096 1.00 75.10 C ATOM 1604 CD PRO A 643 0.094 -6.276 9.616 1.00 64.41 C ATOM 0 HA PRO A 643 -2.490 -4.320 10.160 1.00 63.32 H new ATOM 0 HB2 PRO A 643 -0.079 -2.996 9.851 1.00 23.13 H new ATOM 0 HB3 PRO A 643 -0.563 -3.784 11.340 1.00 23.13 H new ATOM 0 HG2 PRO A 643 1.473 -4.633 9.371 1.00 75.10 H new ATOM 0 HG3 PRO A 643 1.270 -5.150 11.033 1.00 75.10 H new ATOM 0 HD2 PRO A 643 0.536 -6.615 8.679 1.00 64.41 H new ATOM 0 HD3 PRO A 643 0.228 -7.079 10.341 1.00 64.41 H new ATOM 1612 N GLN A 644 -1.817 -4.720 7.191 1.00 11.24 N ATOM 1613 CA GLN A 644 -2.047 -4.250 5.836 1.00 52.22 C ATOM 1614 C GLN A 644 -3.377 -4.790 5.305 1.00 2.23 C ATOM 1615 O GLN A 644 -3.799 -4.438 4.205 1.00 12.40 O ATOM 1616 CB GLN A 644 -0.890 -4.642 4.916 1.00 62.45 C ATOM 1617 CG GLN A 644 0.446 -4.586 5.660 1.00 51.13 C ATOM 1618 CD GLN A 644 1.618 -4.523 4.678 1.00 1.14 C ATOM 1619 OE1 GLN A 644 2.297 -3.518 4.546 1.00 53.34 O ATOM 1620 NE2 GLN A 644 1.817 -5.650 4.000 1.00 3.35 N ATOM 0 H GLN A 644 -1.636 -5.721 7.271 1.00 11.24 H new ATOM 0 HA GLN A 644 -2.101 -3.161 5.854 1.00 52.22 H new ATOM 0 HB2 GLN A 644 -1.053 -5.648 4.529 1.00 62.45 H new ATOM 0 HB3 GLN A 644 -0.860 -3.971 4.057 1.00 62.45 H new ATOM 0 HG2 GLN A 644 0.467 -3.713 6.313 1.00 51.13 H new ATOM 0 HG3 GLN A 644 0.548 -5.464 6.298 1.00 51.13 H new ATOM 0 HE21 GLN A 644 1.211 -6.455 4.159 1.00 3.35 H new ATOM 0 HE22 GLN A 644 2.576 -5.709 3.321 1.00 3.35 H new ATOM 1629 N GLY A 645 -4.000 -5.636 6.112 1.00 4.04 N ATOM 1630 CA GLY A 645 -5.273 -6.228 5.738 1.00 23.00 C ATOM 1631 C GLY A 645 -5.199 -7.756 5.775 1.00 10.23 C ATOM 1632 O GLY A 645 -4.169 -8.340 5.441 1.00 12.51 O ATOM 0 H GLY A 645 -3.647 -5.926 7.024 1.00 4.04 H new ATOM 0 HA2 GLY A 645 -6.053 -5.882 6.416 1.00 23.00 H new ATOM 0 HA3 GLY A 645 -5.552 -5.898 4.737 1.00 23.00 H new ATOM 1636 N ARG A 646 -6.305 -8.360 6.185 1.00 42.12 N ATOM 1637 CA ARG A 646 -6.379 -9.809 6.270 1.00 4.51 C ATOM 1638 C ARG A 646 -6.110 -10.435 4.900 1.00 33.34 C ATOM 1639 O ARG A 646 -6.374 -9.819 3.869 1.00 3.43 O ATOM 1640 CB ARG A 646 -7.752 -10.262 6.770 1.00 4.44 C ATOM 1641 CG ARG A 646 -7.825 -10.204 8.298 1.00 51.24 C ATOM 1642 CD ARG A 646 -9.212 -10.615 8.796 1.00 52.33 C ATOM 1643 NE ARG A 646 -10.120 -9.446 8.786 1.00 72.00 N ATOM 1644 CZ ARG A 646 -10.150 -8.503 9.751 1.00 15.05 C ATOM 1645 NH1 ARG A 646 -9.322 -8.583 10.814 1.00 23.51 N ATOM 1646 NH2 ARG A 646 -11.003 -7.501 9.641 1.00 23.10 N ATOM 0 H ARG A 646 -7.157 -7.872 6.462 1.00 42.12 H new ATOM 0 HA ARG A 646 -5.620 -10.139 6.979 1.00 4.51 H new ATOM 0 HB2 ARG A 646 -8.527 -9.627 6.341 1.00 4.44 H new ATOM 0 HB3 ARG A 646 -7.949 -11.279 6.431 1.00 4.44 H new ATOM 0 HG2 ARG A 646 -7.070 -10.863 8.727 1.00 51.24 H new ATOM 0 HG3 ARG A 646 -7.597 -9.194 8.639 1.00 51.24 H new ATOM 0 HD2 ARG A 646 -9.616 -11.405 8.163 1.00 52.33 H new ATOM 0 HD3 ARG A 646 -9.140 -11.021 9.805 1.00 52.33 H new ATOM 0 HE ARG A 646 -10.763 -9.347 8.001 1.00 72.00 H new ATOM 0 HH11 ARG A 646 -8.667 -9.361 10.893 1.00 23.51 H new ATOM 0 HH12 ARG A 646 -9.352 -7.866 11.539 1.00 23.51 H new ATOM 0 HH21 ARG A 646 -11.626 -7.448 8.835 1.00 23.10 H new ATOM 0 HH22 ARG A 646 -11.038 -6.780 10.362 1.00 23.10 H new ATOM 1659 N ILE A 647 -5.590 -11.653 4.934 1.00 25.11 N ATOM 1660 CA ILE A 647 -5.283 -12.370 3.708 1.00 24.11 C ATOM 1661 C ILE A 647 -5.726 -13.828 3.850 1.00 2.42 C ATOM 1662 O ILE A 647 -5.355 -14.502 4.810 1.00 54.01 O ATOM 1663 CB ILE A 647 -3.804 -12.209 3.349 1.00 71.00 C ATOM 1664 CG1 ILE A 647 -3.487 -10.762 2.967 1.00 52.30 C ATOM 1665 CG2 ILE A 647 -3.396 -13.194 2.252 1.00 70.04 C ATOM 1666 CD1 ILE A 647 -2.058 -10.389 3.368 1.00 74.21 C ATOM 0 H ILE A 647 -5.373 -12.162 5.791 1.00 25.11 H new ATOM 0 HA ILE A 647 -5.838 -11.948 2.871 1.00 24.11 H new ATOM 0 HB ILE A 647 -3.210 -12.446 4.232 1.00 71.00 H new ATOM 0 HG12 ILE A 647 -3.613 -10.630 1.892 1.00 52.30 H new ATOM 0 HG13 ILE A 647 -4.193 -10.090 3.456 1.00 52.30 H new ATOM 0 HG21 ILE A 647 -2.341 -13.059 2.016 1.00 70.04 H new ATOM 0 HG22 ILE A 647 -3.562 -14.214 2.599 1.00 70.04 H new ATOM 0 HG23 ILE A 647 -3.994 -13.012 1.359 1.00 70.04 H new ATOM 0 HD11 ILE A 647 -1.859 -9.355 3.085 1.00 74.21 H new ATOM 0 HD12 ILE A 647 -1.942 -10.499 4.446 1.00 74.21 H new ATOM 0 HD13 ILE A 647 -1.354 -11.047 2.859 1.00 74.21 H new ATOM 1678 N GLN A 648 -6.512 -14.271 2.881 1.00 54.34 N ATOM 1679 CA GLN A 648 -7.010 -15.636 2.886 1.00 50.15 C ATOM 1680 C GLN A 648 -6.559 -16.370 1.621 1.00 51.20 C ATOM 1681 O GLN A 648 -7.203 -16.270 0.578 1.00 54.31 O ATOM 1682 CB GLN A 648 -8.534 -15.664 3.022 1.00 44.33 C ATOM 1683 CG GLN A 648 -8.979 -16.776 3.973 1.00 21.20 C ATOM 1684 CD GLN A 648 -10.210 -17.504 3.428 1.00 45.21 C ATOM 1685 OE1 GLN A 648 -11.340 -17.077 3.596 1.00 31.01 O ATOM 1686 NE2 GLN A 648 -9.928 -18.623 2.767 1.00 23.11 N ATOM 0 H GLN A 648 -6.817 -13.709 2.086 1.00 54.34 H new ATOM 0 HA GLN A 648 -6.592 -16.151 3.751 1.00 50.15 H new ATOM 0 HB2 GLN A 648 -8.887 -14.701 3.392 1.00 44.33 H new ATOM 0 HB3 GLN A 648 -8.987 -15.815 2.042 1.00 44.33 H new ATOM 0 HG2 GLN A 648 -8.165 -17.487 4.114 1.00 21.20 H new ATOM 0 HG3 GLN A 648 -9.206 -16.353 4.952 1.00 21.20 H new ATOM 0 HE21 GLN A 648 -8.959 -18.923 2.663 1.00 23.11 H new ATOM 0 HE22 GLN A 648 -10.681 -19.181 2.364 1.00 23.11 H new ATOM 1695 N ALA A 649 -5.456 -17.091 1.755 1.00 2.13 N ATOM 1696 CA ALA A 649 -4.911 -17.841 0.636 1.00 33.35 C ATOM 1697 C ALA A 649 -5.540 -19.236 0.609 1.00 2.03 C ATOM 1698 O ALA A 649 -6.315 -19.589 1.497 1.00 51.23 O ATOM 1699 CB ALA A 649 -3.386 -17.891 0.749 1.00 53.02 C ATOM 0 H ALA A 649 -4.924 -17.172 2.622 1.00 2.13 H new ATOM 0 HA ALA A 649 -5.152 -17.352 -0.308 1.00 33.35 H new ATOM 0 HB1 ALA A 649 -2.977 -18.454 -0.090 1.00 53.02 H new ATOM 0 HB2 ALA A 649 -2.987 -16.877 0.735 1.00 53.02 H new ATOM 0 HB3 ALA A 649 -3.106 -18.378 1.683 1.00 53.02 H new ATOM 1705 N LYS A 650 -5.182 -19.991 -0.419 1.00 22.55 N ATOM 1706 CA LYS A 650 -5.701 -21.340 -0.573 1.00 1.21 C ATOM 1707 C LYS A 650 -4.568 -22.345 -0.361 1.00 25.52 C ATOM 1708 O LYS A 650 -4.803 -23.466 0.089 1.00 51.12 O ATOM 1709 CB LYS A 650 -6.412 -21.489 -1.920 1.00 23.34 C ATOM 1710 CG LYS A 650 -7.615 -20.549 -2.012 1.00 0.21 C ATOM 1711 CD LYS A 650 -8.691 -21.124 -2.934 1.00 73.43 C ATOM 1712 CE LYS A 650 -9.783 -20.090 -3.216 1.00 45.31 C ATOM 1713 NZ LYS A 650 -10.830 -20.144 -2.172 1.00 53.12 N ATOM 0 H LYS A 650 -4.539 -19.695 -1.153 1.00 22.55 H new ATOM 0 HA LYS A 650 -6.456 -21.547 0.185 1.00 1.21 H new ATOM 0 HB2 LYS A 650 -5.714 -21.273 -2.729 1.00 23.34 H new ATOM 0 HB3 LYS A 650 -6.741 -22.520 -2.049 1.00 23.34 H new ATOM 0 HG2 LYS A 650 -8.032 -20.387 -1.018 1.00 0.21 H new ATOM 0 HG3 LYS A 650 -7.293 -19.577 -2.385 1.00 0.21 H new ATOM 0 HD2 LYS A 650 -8.238 -21.444 -3.872 1.00 73.43 H new ATOM 0 HD3 LYS A 650 -9.133 -22.009 -2.475 1.00 73.43 H new ATOM 0 HE2 LYS A 650 -9.347 -19.092 -3.250 1.00 45.31 H new ATOM 0 HE3 LYS A 650 -10.226 -20.278 -4.194 1.00 45.31 H new ATOM 0 HZ1 LYS A 650 -11.563 -19.436 -2.379 1.00 53.12 H new ATOM 0 HZ2 LYS A 650 -11.258 -21.092 -2.158 1.00 53.12 H new ATOM 0 HZ3 LYS A 650 -10.406 -19.942 -1.244 1.00 53.12 H new ATOM 1726 N LYS A 651 -3.362 -21.909 -0.694 1.00 41.13 N ATOM 1727 CA LYS A 651 -2.191 -22.757 -0.546 1.00 14.11 C ATOM 1728 C LYS A 651 -1.135 -22.021 0.281 1.00 51.23 C ATOM 1729 O LYS A 651 -1.123 -20.792 0.327 1.00 54.33 O ATOM 1730 CB LYS A 651 -1.688 -23.220 -1.915 1.00 33.14 C ATOM 1731 CG LYS A 651 -2.370 -24.523 -2.337 1.00 60.12 C ATOM 1732 CD LYS A 651 -1.722 -25.728 -1.653 1.00 23.04 C ATOM 1733 CE LYS A 651 -0.521 -26.234 -2.455 1.00 74.30 C ATOM 1734 NZ LYS A 651 -0.963 -27.172 -3.511 1.00 63.43 N ATOM 0 H LYS A 651 -3.170 -20.979 -1.066 1.00 41.13 H new ATOM 0 HA LYS A 651 -2.445 -23.666 -0.002 1.00 14.11 H new ATOM 0 HB2 LYS A 651 -1.882 -22.447 -2.658 1.00 33.14 H new ATOM 0 HB3 LYS A 651 -0.608 -23.365 -1.880 1.00 33.14 H new ATOM 0 HG2 LYS A 651 -3.429 -24.482 -2.083 1.00 60.12 H new ATOM 0 HG3 LYS A 651 -2.306 -24.637 -3.419 1.00 60.12 H new ATOM 0 HD2 LYS A 651 -1.402 -25.452 -0.648 1.00 23.04 H new ATOM 0 HD3 LYS A 651 -2.455 -26.527 -1.546 1.00 23.04 H new ATOM 0 HE2 LYS A 651 0.005 -25.392 -2.905 1.00 74.30 H new ATOM 0 HE3 LYS A 651 0.185 -26.732 -1.790 1.00 74.30 H new ATOM 0 HZ1 LYS A 651 -0.137 -27.506 -4.046 1.00 63.43 H new ATOM 0 HZ2 LYS A 651 -1.445 -27.984 -3.075 1.00 63.43 H new ATOM 0 HZ3 LYS A 651 -1.619 -26.686 -4.155 1.00 63.43 H new ATOM 1747 N TRP A 652 -0.273 -22.804 0.913 1.00 15.43 N ATOM 1748 CA TRP A 652 0.784 -22.241 1.736 1.00 63.52 C ATOM 1749 C TRP A 652 1.838 -21.639 0.804 1.00 30.12 C ATOM 1750 O TRP A 652 2.776 -20.988 1.261 1.00 1.21 O ATOM 1751 CB TRP A 652 1.358 -23.294 2.686 1.00 61.31 C ATOM 1752 CG TRP A 652 0.329 -23.891 3.648 1.00 21.12 C ATOM 1753 CD1 TRP A 652 -0.594 -24.828 3.392 1.00 62.31 C ATOM 1754 CD2 TRP A 652 0.155 -23.551 5.040 1.00 51.01 C ATOM 1755 NE1 TRP A 652 -1.347 -25.116 4.512 1.00 51.11 N ATOM 1756 CE2 TRP A 652 -0.877 -24.315 5.546 1.00 52.51 C ATOM 1757 CE3 TRP A 652 0.847 -22.629 5.845 1.00 53.34 C ATOM 1758 CZ2 TRP A 652 -1.310 -24.234 6.875 1.00 73.02 C ATOM 1759 CZ3 TRP A 652 0.402 -22.560 7.170 1.00 33.13 C ATOM 1760 CH2 TRP A 652 -0.636 -23.322 7.695 1.00 2.20 C ATOM 0 H TRP A 652 -0.285 -23.823 0.872 1.00 15.43 H new ATOM 0 HA TRP A 652 0.394 -21.451 2.378 1.00 63.52 H new ATOM 0 HB2 TRP A 652 1.799 -24.098 2.097 1.00 61.31 H new ATOM 0 HB3 TRP A 652 2.164 -22.845 3.266 1.00 61.31 H new ATOM 0 HD1 TRP A 652 -0.731 -25.299 2.430 1.00 62.31 H new ATOM 0 HE1 TRP A 652 -2.108 -25.792 4.570 1.00 51.11 H new ATOM 0 HE3 TRP A 652 1.658 -22.022 5.470 1.00 53.34 H new ATOM 0 HZ2 TRP A 652 -2.121 -24.843 7.247 1.00 73.02 H new ATOM 0 HZ3 TRP A 652 0.900 -21.866 7.831 1.00 33.13 H new ATOM 0 HH2 TRP A 652 -0.921 -23.210 8.731 1.00 2.20 H new ATOM 1771 N SER A 653 1.648 -21.878 -0.485 1.00 72.10 N ATOM 1772 CA SER A 653 2.570 -21.367 -1.485 1.00 22.31 C ATOM 1773 C SER A 653 2.385 -19.857 -1.645 1.00 10.04 C ATOM 1774 O SER A 653 3.268 -19.170 -2.155 1.00 63.24 O ATOM 1775 CB SER A 653 2.371 -22.072 -2.828 1.00 43.54 C ATOM 1776 OG SER A 653 3.137 -21.466 -3.867 1.00 30.41 O ATOM 0 H SER A 653 0.869 -22.419 -0.860 1.00 72.10 H new ATOM 0 HA SER A 653 3.587 -21.567 -1.147 1.00 22.31 H new ATOM 0 HB2 SER A 653 2.654 -23.120 -2.733 1.00 43.54 H new ATOM 0 HB3 SER A 653 1.315 -22.050 -3.096 1.00 43.54 H new ATOM 0 HG SER A 653 2.984 -21.945 -4.708 1.00 30.41 H new ATOM 1782 N ARG A 654 1.231 -19.384 -1.198 1.00 74.22 N ATOM 1783 CA ARG A 654 0.918 -17.968 -1.285 1.00 41.22 C ATOM 1784 C ARG A 654 1.123 -17.295 0.073 1.00 14.35 C ATOM 1785 O ARG A 654 1.188 -16.069 0.160 1.00 61.44 O ATOM 1786 CB ARG A 654 -0.525 -17.749 -1.743 1.00 34.43 C ATOM 1787 CG ARG A 654 -0.838 -18.583 -2.987 1.00 52.21 C ATOM 1788 CD ARG A 654 -0.035 -18.091 -4.193 1.00 1.33 C ATOM 1789 NE ARG A 654 -0.896 -17.271 -5.074 1.00 2.40 N ATOM 1790 CZ ARG A 654 -1.034 -15.932 -4.965 1.00 24.11 C ATOM 1791 NH1 ARG A 654 -0.367 -15.250 -4.009 1.00 63.34 N ATOM 1792 NH2 ARG A 654 -1.830 -15.300 -5.806 1.00 52.04 N ATOM 0 H ARG A 654 0.501 -19.957 -0.774 1.00 74.22 H new ATOM 0 HA ARG A 654 1.591 -17.525 -2.019 1.00 41.22 H new ATOM 0 HB2 ARG A 654 -1.210 -18.017 -0.939 1.00 34.43 H new ATOM 0 HB3 ARG A 654 -0.685 -16.693 -1.959 1.00 34.43 H new ATOM 0 HG2 ARG A 654 -0.607 -19.631 -2.795 1.00 52.21 H new ATOM 0 HG3 ARG A 654 -1.904 -18.527 -3.208 1.00 52.21 H new ATOM 0 HD2 ARG A 654 0.819 -17.503 -3.856 1.00 1.33 H new ATOM 0 HD3 ARG A 654 0.362 -18.941 -4.748 1.00 1.33 H new ATOM 0 HE ARG A 654 -1.418 -17.747 -5.810 1.00 2.40 H new ATOM 0 HH11 ARG A 654 0.246 -15.746 -3.363 1.00 63.34 H new ATOM 0 HH12 ARG A 654 -0.477 -14.239 -3.933 1.00 63.34 H new ATOM 0 HH21 ARG A 654 -2.330 -15.822 -6.525 1.00 52.04 H new ATOM 0 HH22 ARG A 654 -1.945 -14.289 -5.737 1.00 52.04 H new ATOM 1805 N VAL A 655 1.218 -18.125 1.101 1.00 32.33 N ATOM 1806 CA VAL A 655 1.414 -17.626 2.452 1.00 54.24 C ATOM 1807 C VAL A 655 2.399 -16.456 2.420 1.00 12.31 C ATOM 1808 O VAL A 655 3.497 -16.578 1.879 1.00 34.32 O ATOM 1809 CB VAL A 655 1.865 -18.763 3.370 1.00 63.10 C ATOM 1810 CG1 VAL A 655 2.723 -18.231 4.520 1.00 63.43 C ATOM 1811 CG2 VAL A 655 0.665 -19.550 3.900 1.00 52.32 C ATOM 0 H VAL A 655 1.163 -19.141 1.026 1.00 32.33 H new ATOM 0 HA VAL A 655 0.476 -17.250 2.861 1.00 54.24 H new ATOM 0 HB VAL A 655 2.478 -19.445 2.781 1.00 63.10 H new ATOM 0 HG11 VAL A 655 3.031 -19.060 5.158 1.00 63.43 H new ATOM 0 HG12 VAL A 655 3.606 -17.736 4.116 1.00 63.43 H new ATOM 0 HG13 VAL A 655 2.144 -17.517 5.106 1.00 63.43 H new ATOM 0 HG21 VAL A 655 1.014 -20.352 4.550 1.00 52.32 H new ATOM 0 HG22 VAL A 655 0.013 -18.883 4.465 1.00 52.32 H new ATOM 0 HG23 VAL A 655 0.111 -19.976 3.063 1.00 52.32 H new ATOM 1821 N PRO A 656 1.960 -15.318 3.022 1.00 34.13 N ATOM 1822 CA PRO A 656 2.790 -14.127 3.068 1.00 3.12 C ATOM 1823 C PRO A 656 3.912 -14.280 4.097 1.00 10.05 C ATOM 1824 O PRO A 656 5.079 -14.047 3.788 1.00 44.20 O ATOM 1825 CB PRO A 656 1.833 -12.992 3.397 1.00 65.44 C ATOM 1826 CG PRO A 656 0.592 -13.649 3.978 1.00 22.23 C ATOM 1827 CD PRO A 656 0.665 -15.136 3.673 1.00 23.40 C ATOM 0 HA PRO A 656 3.304 -13.936 2.126 1.00 3.12 H new ATOM 0 HB2 PRO A 656 2.279 -12.300 4.111 1.00 65.44 H new ATOM 0 HB3 PRO A 656 1.589 -12.416 2.504 1.00 65.44 H new ATOM 0 HG2 PRO A 656 0.540 -13.482 5.054 1.00 22.23 H new ATOM 0 HG3 PRO A 656 -0.309 -13.214 3.544 1.00 22.23 H new ATOM 0 HD2 PRO A 656 0.592 -15.731 4.583 1.00 23.40 H new ATOM 0 HD3 PRO A 656 -0.152 -15.447 3.023 1.00 23.40 H new ATOM 1835 N PHE A 657 3.518 -14.671 5.301 1.00 64.04 N ATOM 1836 CA PHE A 657 4.476 -14.858 6.377 1.00 21.12 C ATOM 1837 C PHE A 657 5.400 -16.043 6.090 1.00 71.35 C ATOM 1838 O PHE A 657 5.100 -16.876 5.235 1.00 50.41 O ATOM 1839 CB PHE A 657 3.672 -15.150 7.646 1.00 53.14 C ATOM 1840 CG PHE A 657 2.903 -16.472 7.604 1.00 20.25 C ATOM 1841 CD1 PHE A 657 1.648 -16.513 7.082 1.00 32.13 C ATOM 1842 CD2 PHE A 657 3.475 -17.607 8.090 1.00 12.51 C ATOM 1843 CE1 PHE A 657 0.934 -17.740 7.044 1.00 24.23 C ATOM 1844 CE2 PHE A 657 2.761 -18.834 8.052 1.00 3.31 C ATOM 1845 CZ PHE A 657 1.506 -18.875 7.530 1.00 41.41 C ATOM 0 H PHE A 657 2.549 -14.863 5.554 1.00 64.04 H new ATOM 0 HA PHE A 657 5.095 -13.967 6.483 1.00 21.12 H new ATOM 0 HB2 PHE A 657 4.351 -15.163 8.499 1.00 53.14 H new ATOM 0 HB3 PHE A 657 2.966 -14.336 7.812 1.00 53.14 H new ATOM 0 HD1 PHE A 657 1.194 -15.612 6.696 1.00 32.13 H new ATOM 0 HD2 PHE A 657 4.472 -17.575 8.505 1.00 12.51 H new ATOM 0 HE1 PHE A 657 -0.063 -17.772 6.629 1.00 24.23 H new ATOM 0 HE2 PHE A 657 3.215 -19.735 8.438 1.00 3.31 H new ATOM 0 HZ PHE A 657 0.963 -19.808 7.501 1.00 41.41 H new ATOM 1855 N SER A 658 6.505 -16.082 6.819 1.00 31.04 N ATOM 1856 CA SER A 658 7.475 -17.151 6.653 1.00 35.44 C ATOM 1857 C SER A 658 7.468 -18.060 7.885 1.00 50.43 C ATOM 1858 O SER A 658 7.179 -17.608 8.992 1.00 73.32 O ATOM 1859 CB SER A 658 8.878 -16.590 6.415 1.00 32.41 C ATOM 1860 OG SER A 658 8.842 -15.306 5.800 1.00 53.35 O ATOM 0 H SER A 658 6.751 -15.390 7.527 1.00 31.04 H new ATOM 0 HA SER A 658 7.194 -17.735 5.777 1.00 35.44 H new ATOM 0 HB2 SER A 658 9.407 -16.522 7.365 1.00 32.41 H new ATOM 0 HB3 SER A 658 9.442 -17.278 5.785 1.00 32.41 H new ATOM 0 HG SER A 658 9.757 -14.981 5.666 1.00 53.35 H new ATOM 1866 N VAL A 659 7.790 -19.323 7.650 1.00 23.12 N ATOM 1867 CA VAL A 659 7.825 -20.299 8.726 1.00 3.35 C ATOM 1868 C VAL A 659 8.855 -21.381 8.395 1.00 53.12 C ATOM 1869 O VAL A 659 8.603 -22.247 7.558 1.00 0.41 O ATOM 1870 CB VAL A 659 6.423 -20.861 8.968 1.00 22.44 C ATOM 1871 CG1 VAL A 659 5.576 -20.789 7.696 1.00 24.22 C ATOM 1872 CG2 VAL A 659 6.492 -22.294 9.501 1.00 72.10 C ATOM 0 H VAL A 659 8.029 -19.693 6.730 1.00 23.12 H new ATOM 0 HA VAL A 659 8.137 -19.829 9.658 1.00 3.35 H new ATOM 0 HB VAL A 659 5.941 -20.244 9.726 1.00 22.44 H new ATOM 0 HG11 VAL A 659 4.584 -21.195 7.896 1.00 24.22 H new ATOM 0 HG12 VAL A 659 5.486 -19.751 7.377 1.00 24.22 H new ATOM 0 HG13 VAL A 659 6.054 -21.370 6.907 1.00 24.22 H new ATOM 0 HG21 VAL A 659 5.482 -22.670 9.665 1.00 72.10 H new ATOM 0 HG22 VAL A 659 7.002 -22.928 8.776 1.00 72.10 H new ATOM 0 HG23 VAL A 659 7.041 -22.306 10.443 1.00 72.10 H new ATOM 1882 N PRO A 660 10.023 -21.294 9.086 1.00 72.10 N ATOM 1883 CA PRO A 660 11.091 -22.255 8.873 1.00 24.33 C ATOM 1884 C PRO A 660 10.761 -23.597 9.531 1.00 5.44 C ATOM 1885 O PRO A 660 9.977 -23.652 10.478 1.00 45.34 O ATOM 1886 CB PRO A 660 12.333 -21.598 9.454 1.00 71.21 C ATOM 1887 CG PRO A 660 11.830 -20.503 10.381 1.00 63.24 C ATOM 1888 CD PRO A 660 10.356 -20.282 10.084 1.00 31.45 C ATOM 0 HA PRO A 660 11.238 -22.493 7.820 1.00 24.33 H new ATOM 0 HB2 PRO A 660 12.940 -22.322 9.998 1.00 71.21 H new ATOM 0 HB3 PRO A 660 12.961 -21.184 8.665 1.00 71.21 H new ATOM 0 HG2 PRO A 660 11.971 -20.790 11.423 1.00 63.24 H new ATOM 0 HG3 PRO A 660 12.393 -19.583 10.226 1.00 63.24 H new ATOM 0 HD2 PRO A 660 9.749 -20.397 10.982 1.00 31.45 H new ATOM 0 HD3 PRO A 660 10.175 -19.277 9.704 1.00 31.45 H new ATOM 1896 N ASP A 661 11.377 -24.645 9.005 1.00 74.15 N ATOM 1897 CA ASP A 661 11.158 -25.982 9.529 1.00 22.51 C ATOM 1898 C ASP A 661 11.149 -25.931 11.058 1.00 4.22 C ATOM 1899 O ASP A 661 11.629 -24.967 11.653 1.00 41.10 O ATOM 1900 CB ASP A 661 12.275 -26.934 9.095 1.00 40.43 C ATOM 1901 CG ASP A 661 11.944 -28.422 9.223 1.00 14.33 C ATOM 1902 OD1 ASP A 661 10.835 -28.796 9.634 1.00 51.04 O ATOM 1903 OD2 ASP A 661 12.893 -29.224 8.877 1.00 51.41 O ATOM 0 H ASP A 661 12.028 -24.595 8.221 1.00 74.15 H new ATOM 0 HA ASP A 661 10.205 -26.343 9.142 1.00 22.51 H new ATOM 0 HB2 ASP A 661 12.529 -26.722 8.056 1.00 40.43 H new ATOM 0 HB3 ASP A 661 13.163 -26.723 9.690 1.00 40.43 H new ATOM 1909 N PHE A 662 10.599 -26.980 11.651 1.00 54.03 N ATOM 1910 CA PHE A 662 10.521 -27.066 13.099 1.00 20.22 C ATOM 1911 C PHE A 662 11.868 -27.479 13.697 1.00 53.12 C ATOM 1912 O PHE A 662 12.348 -28.584 13.449 1.00 3.22 O ATOM 1913 CB PHE A 662 9.480 -28.138 13.428 1.00 24.42 C ATOM 1914 CG PHE A 662 9.429 -28.522 14.908 1.00 22.44 C ATOM 1915 CD1 PHE A 662 10.287 -29.457 15.399 1.00 41.14 C ATOM 1916 CD2 PHE A 662 8.526 -27.929 15.734 1.00 72.00 C ATOM 1917 CE1 PHE A 662 10.240 -29.813 16.772 1.00 34.23 C ATOM 1918 CE2 PHE A 662 8.478 -28.285 17.108 1.00 64.33 C ATOM 1919 CZ PHE A 662 9.336 -29.220 17.598 1.00 42.21 C ATOM 0 H PHE A 662 10.203 -27.778 11.155 1.00 54.03 H new ATOM 0 HA PHE A 662 10.251 -26.096 13.515 1.00 20.22 H new ATOM 0 HB2 PHE A 662 8.497 -27.781 13.122 1.00 24.42 H new ATOM 0 HB3 PHE A 662 9.693 -29.030 12.839 1.00 24.42 H new ATOM 0 HD1 PHE A 662 11.004 -29.928 14.743 1.00 41.14 H new ATOM 0 HD2 PHE A 662 7.845 -27.187 15.345 1.00 72.00 H new ATOM 0 HE1 PHE A 662 10.922 -30.555 17.161 1.00 34.23 H new ATOM 0 HE2 PHE A 662 7.761 -27.814 17.764 1.00 64.33 H new ATOM 0 HZ PHE A 662 9.300 -29.492 18.643 1.00 42.21 H new ATOM 1929 N ASP A 663 12.438 -26.569 14.472 1.00 25.04 N ATOM 1930 CA ASP A 663 13.720 -26.825 15.107 1.00 2.44 C ATOM 1931 C ASP A 663 13.524 -27.801 16.268 1.00 34.44 C ATOM 1932 O ASP A 663 12.984 -27.432 17.310 1.00 23.24 O ATOM 1933 CB ASP A 663 14.322 -25.536 15.671 1.00 45.14 C ATOM 1934 CG ASP A 663 14.559 -24.429 14.641 1.00 11.24 C ATOM 1935 OD1 ASP A 663 13.693 -24.143 13.801 1.00 2.51 O ATOM 1936 OD2 ASP A 663 15.704 -23.841 14.726 1.00 1.14 O ATOM 0 H ASP A 663 12.036 -25.654 14.675 1.00 25.04 H new ATOM 0 HA ASP A 663 14.392 -27.239 14.355 1.00 2.44 H new ATOM 0 HB2 ASP A 663 13.660 -25.153 16.448 1.00 45.14 H new ATOM 0 HB3 ASP A 663 15.271 -25.775 16.150 1.00 45.14 H new ATOM 1942 N PHE A 664 13.972 -29.029 16.049 1.00 12.24 N ATOM 1943 CA PHE A 664 13.852 -30.062 17.065 1.00 51.54 C ATOM 1944 C PHE A 664 14.832 -29.817 18.214 1.00 62.33 C ATOM 1945 O PHE A 664 14.526 -30.109 19.369 1.00 74.45 O ATOM 1946 CB PHE A 664 14.195 -31.392 16.392 1.00 73.14 C ATOM 1947 CG PHE A 664 14.104 -32.602 17.324 1.00 61.25 C ATOM 1948 CD1 PHE A 664 13.010 -32.772 18.113 1.00 31.02 C ATOM 1949 CD2 PHE A 664 15.118 -33.508 17.362 1.00 12.03 C ATOM 1950 CE1 PHE A 664 12.926 -33.895 18.978 1.00 31.00 C ATOM 1951 CE2 PHE A 664 15.034 -34.631 18.227 1.00 32.03 C ATOM 1952 CZ PHE A 664 13.940 -34.801 19.017 1.00 54.21 C ATOM 0 H PHE A 664 14.418 -29.332 15.183 1.00 12.24 H new ATOM 0 HA PHE A 664 12.843 -30.063 17.478 1.00 51.54 H new ATOM 0 HB2 PHE A 664 13.522 -31.545 15.548 1.00 73.14 H new ATOM 0 HB3 PHE A 664 15.205 -31.333 15.987 1.00 73.14 H new ATOM 0 HD1 PHE A 664 12.205 -32.053 18.082 1.00 31.02 H new ATOM 0 HD2 PHE A 664 15.987 -33.373 16.735 1.00 12.03 H new ATOM 0 HE1 PHE A 664 12.057 -34.030 19.605 1.00 31.00 H new ATOM 0 HE2 PHE A 664 15.839 -35.350 18.258 1.00 32.03 H new ATOM 0 HZ PHE A 664 13.876 -35.655 19.675 1.00 54.21 H new ATOM 1962 N LEU A 665 15.991 -29.284 17.857 1.00 64.20 N ATOM 1963 CA LEU A 665 17.019 -28.997 18.844 1.00 74.41 C ATOM 1964 C LEU A 665 16.492 -27.957 19.835 1.00 75.43 C ATOM 1965 O LEU A 665 16.501 -28.186 21.043 1.00 1.54 O ATOM 1966 CB LEU A 665 18.322 -28.587 18.157 1.00 43.44 C ATOM 1967 CG LEU A 665 18.845 -29.543 17.083 1.00 73.22 C ATOM 1968 CD1 LEU A 665 20.264 -29.165 16.655 1.00 0.20 C ATOM 1969 CD2 LEU A 665 18.756 -30.996 17.553 1.00 20.51 C ATOM 0 H LEU A 665 16.241 -29.043 16.898 1.00 64.20 H new ATOM 0 HA LEU A 665 17.257 -29.893 19.418 1.00 74.41 H new ATOM 0 HB2 LEU A 665 18.177 -27.607 17.703 1.00 43.44 H new ATOM 0 HB3 LEU A 665 19.092 -28.474 18.920 1.00 43.44 H new ATOM 0 HG LEU A 665 18.208 -29.449 16.203 1.00 73.22 H new ATOM 0 HD11 LEU A 665 20.611 -29.861 15.891 1.00 0.20 H new ATOM 0 HD12 LEU A 665 20.265 -28.153 16.251 1.00 0.20 H new ATOM 0 HD13 LEU A 665 20.929 -29.212 17.517 1.00 0.20 H new ATOM 0 HD21 LEU A 665 19.134 -31.655 16.771 1.00 20.51 H new ATOM 0 HD22 LEU A 665 19.354 -31.124 18.456 1.00 20.51 H new ATOM 0 HD23 LEU A 665 17.717 -31.246 17.767 1.00 20.51 H new ATOM 1981 N GLN A 666 16.044 -26.838 19.286 1.00 42.51 N ATOM 1982 CA GLN A 666 15.514 -25.762 20.106 1.00 2.34 C ATOM 1983 C GLN A 666 14.289 -26.243 20.886 1.00 21.13 C ATOM 1984 O GLN A 666 14.278 -26.207 22.116 1.00 60.33 O ATOM 1985 CB GLN A 666 15.175 -24.538 19.253 1.00 10.24 C ATOM 1986 CG GLN A 666 14.880 -23.321 20.133 1.00 73.20 C ATOM 1987 CD GLN A 666 16.161 -22.542 20.439 1.00 35.10 C ATOM 1988 OE1 GLN A 666 17.092 -22.496 19.653 1.00 44.20 O ATOM 1989 NE2 GLN A 666 16.154 -21.934 21.622 1.00 25.51 N ATOM 0 H GLN A 666 16.037 -26.653 18.283 1.00 42.51 H new ATOM 0 HA GLN A 666 16.282 -25.464 20.820 1.00 2.34 H new ATOM 0 HB2 GLN A 666 16.006 -24.315 18.584 1.00 10.24 H new ATOM 0 HB3 GLN A 666 14.311 -24.756 18.626 1.00 10.24 H new ATOM 0 HG2 GLN A 666 14.165 -22.669 19.631 1.00 73.20 H new ATOM 0 HG3 GLN A 666 14.416 -23.645 21.065 1.00 73.20 H new ATOM 0 HE21 GLN A 666 15.340 -22.014 22.232 1.00 25.51 H new ATOM 0 HE22 GLN A 666 16.962 -21.388 21.919 1.00 25.51 H new ATOM 1998 N HIS A 667 13.287 -26.682 20.139 1.00 32.43 N ATOM 1999 CA HIS A 667 12.060 -27.170 20.745 1.00 33.33 C ATOM 2000 C HIS A 667 12.395 -28.198 21.828 1.00 63.11 C ATOM 2001 O HIS A 667 11.736 -28.250 22.865 1.00 24.23 O ATOM 2002 CB HIS A 667 11.109 -27.720 19.680 1.00 20.21 C ATOM 2003 CG HIS A 667 9.646 -27.548 20.014 1.00 5.42 C ATOM 2004 ND1 HIS A 667 8.843 -26.604 19.398 1.00 1.24 N ATOM 2005 CD2 HIS A 667 8.852 -28.208 20.904 1.00 33.14 C ATOM 2006 CE1 HIS A 667 7.622 -26.700 19.904 1.00 62.13 C ATOM 2007 NE2 HIS A 667 7.630 -27.695 20.837 1.00 14.42 N ATOM 0 H HIS A 667 13.300 -26.710 19.119 1.00 32.43 H new ATOM 0 HA HIS A 667 11.535 -26.345 21.226 1.00 33.33 H new ATOM 0 HB2 HIS A 667 11.315 -27.223 18.732 1.00 20.21 H new ATOM 0 HB3 HIS A 667 11.316 -28.780 19.536 1.00 20.21 H new ATOM 0 HD2 HIS A 667 9.165 -29.012 21.554 1.00 33.14 H new ATOM 0 HE1 HIS A 667 6.770 -26.097 19.626 1.00 62.13 H new ATOM 0 HE2 HIS A 667 6.829 -27.995 21.392 1.00 14.42 H new ATOM 2015 N CYS A 668 13.420 -28.990 21.549 1.00 30.42 N ATOM 2016 CA CYS A 668 13.851 -30.014 22.486 1.00 2.22 C ATOM 2017 C CYS A 668 14.546 -29.326 23.663 1.00 41.32 C ATOM 2018 O CYS A 668 14.517 -29.828 24.785 1.00 0.13 O ATOM 2019 CB CYS A 668 14.756 -31.050 21.816 1.00 52.44 C ATOM 2020 SG CYS A 668 15.315 -32.283 23.047 1.00 40.33 S ATOM 0 H CYS A 668 13.964 -28.943 20.688 1.00 30.42 H new ATOM 0 HA CYS A 668 12.984 -30.566 22.849 1.00 2.22 H new ATOM 0 HB2 CYS A 668 14.218 -31.548 21.009 1.00 52.44 H new ATOM 0 HB3 CYS A 668 15.618 -30.556 21.367 1.00 52.44 H new ATOM 0 HG CYS A 668 16.081 -33.159 22.467 1.00 40.33 H new ATOM 2026 N ALA A 669 15.155 -28.187 23.366 1.00 55.13 N ATOM 2027 CA ALA A 669 15.856 -27.425 24.385 1.00 14.20 C ATOM 2028 C ALA A 669 14.835 -26.725 25.285 1.00 71.40 C ATOM 2029 O ALA A 669 15.189 -26.198 26.338 1.00 21.55 O ATOM 2030 CB ALA A 669 16.815 -26.439 23.716 1.00 42.22 C ATOM 0 H ALA A 669 15.177 -27.774 22.434 1.00 55.13 H new ATOM 0 HA ALA A 669 16.453 -28.085 25.014 1.00 14.20 H new ATOM 0 HB1 ALA A 669 17.341 -25.867 24.481 1.00 42.22 H new ATOM 0 HB2 ALA A 669 17.538 -26.987 23.112 1.00 42.22 H new ATOM 0 HB3 ALA A 669 16.251 -25.759 23.078 1.00 42.22 H new ATOM 2036 N GLU A 670 13.588 -26.743 24.837 1.00 63.22 N ATOM 2037 CA GLU A 670 12.514 -26.117 25.588 1.00 33.34 C ATOM 2038 C GLU A 670 11.505 -27.171 26.049 1.00 14.14 C ATOM 2039 O GLU A 670 10.537 -26.850 26.738 1.00 4.21 O ATOM 2040 CB GLU A 670 11.829 -25.027 24.762 1.00 60.13 C ATOM 2041 CG GLU A 670 12.500 -23.670 24.982 1.00 54.42 C ATOM 2042 CD GLU A 670 11.724 -22.834 26.003 1.00 62.25 C ATOM 2043 OE1 GLU A 670 11.612 -21.610 25.844 1.00 54.51 O ATOM 2044 OE2 GLU A 670 11.227 -23.501 26.989 1.00 65.44 O ATOM 0 H GLU A 670 13.298 -27.182 23.963 1.00 63.22 H new ATOM 0 HA GLU A 670 12.943 -25.642 26.470 1.00 33.34 H new ATOM 0 HB2 GLU A 670 11.868 -25.289 23.705 1.00 60.13 H new ATOM 0 HB3 GLU A 670 10.776 -24.965 25.037 1.00 60.13 H new ATOM 0 HG2 GLU A 670 13.522 -23.818 25.329 1.00 54.42 H new ATOM 0 HG3 GLU A 670 12.560 -23.132 24.036 1.00 54.42 H new ATOM 2052 N ASN A 671 11.765 -28.407 25.651 1.00 33.50 N ATOM 2053 CA ASN A 671 10.891 -29.510 26.015 1.00 62.23 C ATOM 2054 C ASN A 671 11.579 -30.371 27.076 1.00 32.13 C ATOM 2055 O ASN A 671 10.931 -31.177 27.742 1.00 71.41 O ATOM 2056 CB ASN A 671 10.594 -30.399 24.805 1.00 14.05 C ATOM 2057 CG ASN A 671 9.364 -29.897 24.046 1.00 71.42 C ATOM 2058 OD1 ASN A 671 8.546 -30.663 23.563 1.00 53.23 O ATOM 2059 ND2 ASN A 671 9.280 -28.572 23.967 1.00 34.54 N ATOM 0 H ASN A 671 12.568 -28.670 25.080 1.00 33.50 H new ATOM 0 HA ASN A 671 9.958 -29.091 26.393 1.00 62.23 H new ATOM 0 HB2 ASN A 671 11.457 -30.413 24.139 1.00 14.05 H new ATOM 0 HB3 ASN A 671 10.429 -31.425 25.134 1.00 14.05 H new ATOM 0 HD21 ASN A 671 8.496 -28.139 23.479 1.00 34.54 H new ATOM 0 HD22 ASN A 671 10.000 -27.989 24.394 1.00 34.54 H new ATOM 2066 N LEU A 672 12.882 -30.171 27.201 1.00 5.55 N ATOM 2067 CA LEU A 672 13.665 -30.918 28.171 1.00 60.41 C ATOM 2068 C LEU A 672 13.674 -30.166 29.503 1.00 54.52 C ATOM 2069 O LEU A 672 13.017 -29.134 29.641 1.00 23.43 O ATOM 2070 CB LEU A 672 15.062 -31.210 27.621 1.00 65.45 C ATOM 2071 CG LEU A 672 15.146 -32.292 26.541 1.00 11.14 C ATOM 2072 CD1 LEU A 672 16.596 -32.712 26.298 1.00 65.34 C ATOM 2073 CD2 LEU A 672 14.254 -33.485 26.891 1.00 23.10 C ATOM 0 H LEU A 672 13.416 -29.502 26.646 1.00 5.55 H new ATOM 0 HA LEU A 672 13.211 -31.891 28.358 1.00 60.41 H new ATOM 0 HB2 LEU A 672 15.471 -30.285 27.213 1.00 65.45 H new ATOM 0 HB3 LEU A 672 15.704 -31.503 28.452 1.00 65.45 H new ATOM 0 HG LEU A 672 14.772 -31.873 25.607 1.00 11.14 H new ATOM 0 HD11 LEU A 672 16.628 -33.481 25.527 1.00 65.34 H new ATOM 0 HD12 LEU A 672 17.175 -31.848 25.973 1.00 65.34 H new ATOM 0 HD13 LEU A 672 17.020 -33.106 27.221 1.00 65.34 H new ATOM 0 HD21 LEU A 672 14.332 -34.239 26.108 1.00 23.10 H new ATOM 0 HD22 LEU A 672 14.575 -33.913 27.841 1.00 23.10 H new ATOM 0 HD23 LEU A 672 13.219 -33.153 26.974 1.00 23.10 H new ATOM 2085 N SER A 673 14.424 -30.710 30.449 1.00 21.20 N ATOM 2086 CA SER A 673 14.527 -30.103 31.765 1.00 13.11 C ATOM 2087 C SER A 673 15.836 -29.319 31.879 1.00 54.31 C ATOM 2088 O SER A 673 16.188 -28.845 32.958 1.00 55.51 O ATOM 2089 CB SER A 673 14.444 -31.160 32.868 1.00 60.44 C ATOM 2090 OG SER A 673 14.964 -32.417 32.442 1.00 71.11 O ATOM 0 H SER A 673 14.967 -31.565 30.331 1.00 21.20 H new ATOM 0 HA SER A 673 13.688 -29.418 31.892 1.00 13.11 H new ATOM 0 HB2 SER A 673 14.997 -30.816 33.742 1.00 60.44 H new ATOM 0 HB3 SER A 673 13.406 -31.283 33.176 1.00 60.44 H new ATOM 0 HG SER A 673 14.895 -33.065 33.174 1.00 71.11 H new ATOM 2096 N ASP A 674 16.521 -29.206 30.751 1.00 71.44 N ATOM 2097 CA ASP A 674 17.783 -28.488 30.710 1.00 42.10 C ATOM 2098 C ASP A 674 17.565 -27.054 31.197 1.00 53.00 C ATOM 2099 O ASP A 674 18.517 -26.368 31.566 1.00 72.02 O ATOM 2100 CB ASP A 674 18.335 -28.424 29.284 1.00 30.15 C ATOM 2101 CG ASP A 674 19.810 -28.032 29.179 1.00 22.20 C ATOM 2102 OD1 ASP A 674 20.705 -28.887 29.256 1.00 61.12 O ATOM 2103 OD2 ASP A 674 20.029 -26.772 29.009 1.00 73.34 O ATOM 0 H ASP A 674 16.226 -29.600 29.858 1.00 71.44 H new ATOM 0 HA ASP A 674 18.492 -29.016 31.348 1.00 42.10 H new ATOM 0 HB2 ASP A 674 18.199 -29.398 28.814 1.00 30.15 H new ATOM 0 HB3 ASP A 674 17.743 -27.709 28.713 1.00 30.15 H new ATOM 2109 N LEU A 675 16.305 -26.644 31.182 1.00 1.55 N ATOM 2110 CA LEU A 675 15.949 -25.304 31.618 1.00 5.31 C ATOM 2111 C LEU A 675 15.817 -25.286 33.142 1.00 34.12 C ATOM 2112 O LEU A 675 16.668 -24.733 33.837 1.00 61.33 O ATOM 2113 CB LEU A 675 14.697 -24.817 30.886 1.00 43.11 C ATOM 2114 CG LEU A 675 14.683 -25.026 29.370 1.00 13.13 C ATOM 2115 CD1 LEU A 675 16.018 -24.614 28.747 1.00 32.02 C ATOM 2116 CD2 LEU A 675 14.307 -26.467 29.019 1.00 14.21 C ATOM 0 H LEU A 675 15.518 -27.216 30.875 1.00 1.55 H new ATOM 0 HA LEU A 675 16.737 -24.597 31.358 1.00 5.31 H new ATOM 0 HB2 LEU A 675 13.831 -25.325 31.311 1.00 43.11 H new ATOM 0 HB3 LEU A 675 14.573 -23.753 31.087 1.00 43.11 H new ATOM 0 HG LEU A 675 13.916 -24.380 28.943 1.00 13.13 H new ATOM 0 HD11 LEU A 675 15.981 -24.773 27.669 1.00 32.02 H new ATOM 0 HD12 LEU A 675 16.206 -23.560 28.952 1.00 32.02 H new ATOM 0 HD13 LEU A 675 16.820 -25.215 29.175 1.00 32.02 H new ATOM 0 HD21 LEU A 675 14.304 -26.589 27.936 1.00 14.21 H new ATOM 0 HD22 LEU A 675 15.033 -27.150 29.459 1.00 14.21 H new ATOM 0 HD23 LEU A 675 13.315 -26.690 29.412 1.00 14.21 H new ATOM 2128 N SER A 676 14.742 -25.898 33.618 1.00 52.33 N ATOM 2129 CA SER A 676 14.486 -25.959 35.047 1.00 65.22 C ATOM 2130 C SER A 676 13.515 -27.100 35.356 1.00 23.31 C ATOM 2131 O SER A 676 12.645 -27.416 34.546 1.00 30.34 O ATOM 2132 CB SER A 676 13.928 -24.632 35.564 1.00 22.11 C ATOM 2133 OG SER A 676 14.424 -23.520 34.824 1.00 11.41 O ATOM 0 H SER A 676 14.038 -26.356 33.039 1.00 52.33 H new ATOM 0 HA SER A 676 15.431 -26.147 35.556 1.00 65.22 H new ATOM 0 HB2 SER A 676 12.840 -24.649 35.506 1.00 22.11 H new ATOM 0 HB3 SER A 676 14.190 -24.514 36.615 1.00 22.11 H new ATOM 0 HG SER A 676 14.043 -22.692 35.184 1.00 11.41 H new ATOM 2139 N LEU A 677 13.697 -27.687 36.530 1.00 71.31 N ATOM 2140 CA LEU A 677 12.848 -28.787 36.956 1.00 14.54 C ATOM 2141 C LEU A 677 11.472 -28.241 37.345 1.00 72.32 C ATOM 2142 O LEU A 677 10.470 -28.561 36.706 1.00 24.22 O ATOM 2143 CB LEU A 677 13.527 -29.589 38.068 1.00 44.23 C ATOM 2144 CG LEU A 677 15.009 -29.906 37.856 1.00 70.44 C ATOM 2145 CD1 LEU A 677 15.508 -30.914 38.893 1.00 13.13 C ATOM 2146 CD2 LEU A 677 15.269 -30.381 36.425 1.00 75.44 C ATOM 0 H LEU A 677 14.420 -27.422 37.199 1.00 71.31 H new ATOM 0 HA LEU A 677 12.694 -29.489 36.137 1.00 14.54 H new ATOM 0 HB2 LEU A 677 13.424 -29.037 39.002 1.00 44.23 H new ATOM 0 HB3 LEU A 677 12.989 -30.529 38.192 1.00 44.23 H new ATOM 0 HG LEU A 677 15.578 -28.988 37.999 1.00 70.44 H new ATOM 0 HD11 LEU A 677 16.564 -31.122 38.720 1.00 13.13 H new ATOM 0 HD12 LEU A 677 15.379 -30.501 39.893 1.00 13.13 H new ATOM 0 HD13 LEU A 677 14.937 -31.839 38.806 1.00 13.13 H new ATOM 0 HD21 LEU A 677 16.330 -30.599 36.301 1.00 75.44 H new ATOM 0 HD22 LEU A 677 14.688 -31.282 36.229 1.00 75.44 H new ATOM 0 HD23 LEU A 677 14.975 -29.600 35.723 1.00 75.44 H new ATOM 2158 N ASP A 678 11.467 -27.427 38.390 1.00 31.11 N ATOM 2159 CA ASP A 678 10.231 -26.834 38.871 1.00 34.42 C ATOM 2160 C ASP A 678 9.374 -26.411 37.676 1.00 20.41 C ATOM 2161 O ASP A 678 8.213 -26.040 37.840 1.00 31.25 O ATOM 2162 CB ASP A 678 10.509 -25.590 39.717 1.00 30.42 C ATOM 2163 CG ASP A 678 9.371 -25.177 40.653 1.00 41.34 C ATOM 2164 OD1 ASP A 678 8.217 -25.594 40.478 1.00 73.23 O ATOM 2165 OD2 ASP A 678 9.713 -24.380 41.608 1.00 41.01 O ATOM 0 H ASP A 678 12.300 -27.164 38.917 1.00 31.11 H new ATOM 0 HA ASP A 678 9.716 -27.577 39.480 1.00 34.42 H new ATOM 0 HB2 ASP A 678 11.404 -25.767 40.314 1.00 30.42 H new ATOM 0 HB3 ASP A 678 10.731 -24.757 39.050 1.00 30.42 H new TER 2171 ASP A 678 HETATM 2172 ZN ZN A 679 -13.283 -22.408 13.570 1.00 43.33 ZN