USER MOD reduce.3.24.130724 H: found=0, std=0, add=1347, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1170 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 619 MET CE :methyl -170:sc= -0.14 (180deg=-0.221) USER MOD Set 1.2: B 673 MET CE :methyl -159:sc= -2.15! (180deg=-2.39!) USER MOD Set 2.1: A 75 ASN :FLIP amide:sc= -0.198 F(o=-1.1,f=-0.2) USER MOD Set 2.2: B 648 THR OG1 : rot -160:sc= -0.0026 USER MOD Set 3.1: A 66 ASN :FLIP amide:sc= -0.0754 F(o=0.33,f=1.2) USER MOD Set 3.2: A 67 THR OG1 : rot 82:sc= 1.27 USER MOD Set 4.1: A 25 MET CE :methyl -142:sc= -2.24 (180deg=-7.1!) USER MOD Set 4.2: B 663 MET CE :methyl -153:sc= -0.0999 (180deg=-0.0803) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 170:sc= 0 (180deg=-0.0744) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 HIS : no HD1:sc= -0.196 X(o=-0.2,f=-0.045) USER MOD Single : A 10 GLN : amide:sc= -0.348 X(o=-0.35,f=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot -146:sc=0.000535 USER MOD Single : A 21 LYS NZ :NH3+ 146:sc= 0 (180deg=-1.41) USER MOD Single : A 27 HIS : no HE2:sc= -0.41 K(o=-0.41,f=-1.5) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.00771 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 MET CE :methyl 167:sc=-0.00368 (180deg=-0.196) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= -0.0134 X(o=-0.013,f=-0.23) USER MOD Single : A 43 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.32) USER MOD Single : A 44 GLN : amide:sc= -0.131 K(o=-0.13,f=-1.1) USER MOD Single : A 47 SER OG : rot 61:sc= 0.254 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 55 HIS :FLIP no HD1:sc= -0.128 F(o=-0.77,f=-0.13) USER MOD Single : A 64 LYS NZ :NH3+ -174:sc= -0.788 (180deg=-0.801) USER MOD Single : A 73 GLN : amide:sc= -0.057 X(o=-0.057,f=-0.032) USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.164 USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -102:sc= 0.255 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : B 601 SER OG : rot 180:sc= 0 USER MOD Single : B 602 MET CE :methyl 151:sc= -0.0598 (180deg=-0.755) USER MOD Single : B 603 SER OG : rot 180:sc= 0 USER MOD Single : B 604 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : B 606 MET CE :methyl 163:sc= -0.0873 (180deg=-0.516) USER MOD Single : B 607 TYR OH : rot 180:sc= 0 USER MOD Single : B 608 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : B 609 TYR OH : rot 180:sc= 0 USER MOD Single : B 612 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 615 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.07) USER MOD Single : B 622 TYR OH : rot 180:sc= 0 USER MOD Single : B 625 THR OG1 : rot 180:sc= 0 USER MOD Single : B 627 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 628 SER OG : rot 180:sc= 0 USER MOD Single : B 637 GLN : amide:sc= -0.716 X(o=-0.72,f=-1.1) USER MOD Single : B 641 GLN : amide:sc= -1.24 K(o=-1.2,f=-3!) USER MOD Single : B 642 SER OG : rot 180:sc= 0 USER MOD Single : B 645 GLN : amide:sc= 0.0956 X(o=0.096,f=0) USER MOD Single : B 651 THR OG1 : rot 180:sc= 0 USER MOD Single : B 652 TYR OH : rot 180:sc= 0 USER MOD Single : B 653 GLN : amide:sc= -0.0048 K(o=-0.0048,f=-1.1) USER MOD Single : B 656 GLN : amide:sc= -0.145 K(o=-0.14,f=-1) USER MOD Single : B 658 GLN : amide:sc= -0.75 K(o=-0.75,f=-4.7!) USER MOD Single : B 660 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 661 GLN : amide:sc= -0.306 X(o=-0.31,f=-0.51) USER MOD Single : B 670 TYR OH : rot 180:sc= -0.561 USER MOD Single : B 671 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 674 SER OG : rot 180:sc= 0.0461 USER MOD Single : B 675 SER OG : rot 180:sc= 0 USER MOD Single : B 676 THR OG1 : rot 91:sc= 1.23 USER MOD Single : B 677 HIS :FLIP no HD1:sc= -0.0616 F(o=-1,f=-0.062) USER MOD Single : B 680 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 681 THR OG1 : rot 180:sc= 0.0384 USER MOD Single : B 682 MET CE :methyl -137:sc= -2.86 (180deg=-7.19!) USER MOD Single : B 684 MET CE :methyl -137:sc= 0 (180deg=-0.0457) USER MOD Single : B 685 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 689 THR OG1 : rot 180:sc= 0.0797 USER MOD Single : B 694 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.846 -5.129 12.310 1.00 0.00 N ATOM 2 CA MET A 1 -24.857 -6.167 12.583 1.00 0.00 C ATOM 3 C MET A 1 -24.413 -6.125 14.041 1.00 0.00 C ATOM 4 O MET A 1 -23.221 -6.024 14.334 1.00 0.00 O ATOM 5 CB MET A 1 -23.646 -6.002 11.663 1.00 0.00 C ATOM 6 CG MET A 1 -23.015 -4.620 11.731 1.00 0.00 C ATOM 7 SD MET A 1 -21.217 -4.671 11.609 1.00 0.00 S ATOM 8 CE MET A 1 -20.850 -2.947 11.297 1.00 0.00 C ATOM 0 H1 MET A 1 -26.008 -5.065 11.285 1.00 0.00 H new ATOM 0 H2 MET A 1 -26.739 -5.366 12.787 1.00 0.00 H new ATOM 0 H3 MET A 1 -25.497 -4.215 12.664 1.00 0.00 H new ATOM 0 HA MET A 1 -25.320 -7.135 12.391 1.00 0.00 H new ATOM 0 HB2 MET A 1 -22.896 -6.748 11.926 1.00 0.00 H new ATOM 0 HB3 MET A 1 -23.950 -6.204 10.636 1.00 0.00 H new ATOM 0 HG2 MET A 1 -23.413 -4.003 10.925 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.298 -4.141 12.668 1.00 0.00 H new ATOM 0 HE1 MET A 1 -19.772 -2.817 11.197 1.00 0.00 H new ATOM 0 HE2 MET A 1 -21.340 -2.631 10.376 1.00 0.00 H new ATOM 0 HE3 MET A 1 -21.213 -2.342 12.127 1.00 0.00 H new ATOM 16 N SER A 2 -25.377 -6.202 14.952 1.00 0.00 N ATOM 17 CA SER A 2 -25.085 -6.168 16.381 1.00 0.00 C ATOM 18 C SER A 2 -25.866 -7.249 17.121 1.00 0.00 C ATOM 19 O SER A 2 -26.919 -6.983 17.702 1.00 0.00 O ATOM 20 CB SER A 2 -25.420 -4.792 16.960 1.00 0.00 C ATOM 21 OG SER A 2 -26.335 -4.099 16.128 1.00 0.00 O ATOM 0 H SER A 2 -26.368 -6.288 14.726 1.00 0.00 H new ATOM 0 HA SER A 2 -24.020 -6.359 16.513 1.00 0.00 H new ATOM 0 HB2 SER A 2 -25.845 -4.907 17.957 1.00 0.00 H new ATOM 0 HB3 SER A 2 -24.507 -4.207 17.068 1.00 0.00 H new ATOM 0 HG SER A 2 -26.535 -3.223 16.520 1.00 0.00 H new ATOM 26 N LEU A 3 -25.344 -8.471 17.095 1.00 0.00 N ATOM 27 CA LEU A 3 -25.992 -9.593 17.764 1.00 0.00 C ATOM 28 C LEU A 3 -25.025 -10.291 18.716 1.00 0.00 C ATOM 29 O LEU A 3 -23.891 -9.849 18.900 1.00 0.00 O ATOM 30 CB LEU A 3 -26.519 -10.591 16.732 1.00 0.00 C ATOM 31 CG LEU A 3 -27.997 -10.969 16.858 1.00 0.00 C ATOM 32 CD1 LEU A 3 -28.875 -9.909 16.211 1.00 0.00 C ATOM 33 CD2 LEU A 3 -28.254 -12.332 16.231 1.00 0.00 C ATOM 0 H LEU A 3 -24.474 -8.709 16.618 1.00 0.00 H new ATOM 0 HA LEU A 3 -26.828 -9.205 18.345 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -26.354 -10.176 15.738 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -25.924 -11.502 16.800 1.00 0.00 H new ATOM 0 HG LEU A 3 -28.250 -11.025 17.917 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -29.922 -10.194 16.310 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -28.712 -8.951 16.704 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -28.621 -9.821 15.155 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -29.310 -12.585 16.330 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -27.985 -12.303 15.175 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -27.652 -13.085 16.739 1.00 0.00 H new ATOM 44 N LEU A 4 -25.481 -11.387 19.315 1.00 0.00 N ATOM 45 CA LEU A 4 -24.657 -12.149 20.246 1.00 0.00 C ATOM 46 C LEU A 4 -23.556 -12.903 19.506 1.00 0.00 C ATOM 47 O LEU A 4 -23.703 -13.243 18.333 1.00 0.00 O ATOM 48 CB LEU A 4 -25.520 -13.132 21.036 1.00 0.00 C ATOM 49 CG LEU A 4 -26.006 -12.650 22.404 1.00 0.00 C ATOM 50 CD1 LEU A 4 -27.335 -11.922 22.273 1.00 0.00 C ATOM 51 CD2 LEU A 4 -26.128 -13.819 23.369 1.00 0.00 C ATOM 0 H LEU A 4 -26.417 -11.767 19.172 1.00 0.00 H new ATOM 0 HA LEU A 4 -24.191 -11.447 20.938 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -26.391 -13.386 20.432 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -24.951 -14.051 21.178 1.00 0.00 H new ATOM 0 HG LEU A 4 -25.271 -11.951 22.803 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -27.665 -11.587 23.256 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -27.214 -11.060 21.617 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -28.080 -12.597 21.851 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -26.475 -13.457 24.337 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -26.841 -14.543 22.975 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -25.155 -14.296 23.487 1.00 0.00 H new ATOM 62 N ASP A 5 -22.453 -13.162 20.201 1.00 0.00 N ATOM 63 CA ASP A 5 -21.328 -13.879 19.611 1.00 0.00 C ATOM 64 C ASP A 5 -20.795 -13.142 18.387 1.00 0.00 C ATOM 65 O ASP A 5 -20.298 -13.759 17.447 1.00 0.00 O ATOM 66 CB ASP A 5 -21.747 -15.299 19.226 1.00 0.00 C ATOM 67 CG ASP A 5 -22.407 -16.039 20.372 1.00 0.00 C ATOM 68 OD1 ASP A 5 -22.144 -15.683 21.539 1.00 0.00 O ATOM 69 OD2 ASP A 5 -23.188 -16.976 20.102 1.00 0.00 O ATOM 0 H ASP A 5 -22.314 -12.886 21.173 1.00 0.00 H new ATOM 0 HA ASP A 5 -20.532 -13.932 20.354 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -22.435 -15.255 18.382 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -20.871 -15.856 18.895 1.00 0.00 H new ATOM 73 N ALA A 6 -20.905 -11.817 18.406 1.00 0.00 N ATOM 74 CA ALA A 6 -20.434 -10.996 17.298 1.00 0.00 C ATOM 75 C ALA A 6 -19.035 -10.453 17.573 1.00 0.00 C ATOM 76 O ALA A 6 -18.226 -10.300 16.657 1.00 0.00 O ATOM 77 CB ALA A 6 -21.404 -9.852 17.039 1.00 0.00 C ATOM 0 H ALA A 6 -21.316 -11.290 19.177 1.00 0.00 H new ATOM 0 HA ALA A 6 -20.384 -11.624 16.409 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -21.040 -9.247 16.209 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -22.385 -10.256 16.790 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -21.483 -9.232 17.932 1.00 0.00 H new ATOM 83 N HIS A 7 -18.756 -10.165 18.840 1.00 0.00 N ATOM 84 CA HIS A 7 -17.454 -9.639 19.236 1.00 0.00 C ATOM 85 C HIS A 7 -16.390 -10.732 19.188 1.00 0.00 C ATOM 86 O HIS A 7 -15.236 -10.474 18.843 1.00 0.00 O ATOM 87 CB HIS A 7 -17.527 -9.041 20.641 1.00 0.00 C ATOM 88 CG HIS A 7 -16.507 -7.974 20.892 1.00 0.00 C ATOM 89 ND1 HIS A 7 -16.079 -7.623 22.155 1.00 0.00 N ATOM 90 CD2 HIS A 7 -15.828 -7.179 20.032 1.00 0.00 C ATOM 91 CE1 HIS A 7 -15.183 -6.657 22.061 1.00 0.00 C ATOM 92 NE2 HIS A 7 -15.011 -6.370 20.784 1.00 0.00 N ATOM 0 H HIS A 7 -19.414 -10.287 19.610 1.00 0.00 H new ATOM 0 HA HIS A 7 -17.176 -8.855 18.531 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -18.522 -8.625 20.798 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -17.395 -9.838 21.373 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -15.913 -7.180 18.955 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -14.677 -6.182 22.889 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -14.375 -5.663 20.416 1.00 0.00 H new ATOM 99 N ILE A 8 -16.785 -11.951 19.540 1.00 0.00 N ATOM 100 CA ILE A 8 -15.865 -13.082 19.537 1.00 0.00 C ATOM 101 C ILE A 8 -15.379 -13.392 18.125 1.00 0.00 C ATOM 102 O ILE A 8 -16.061 -13.126 17.134 1.00 0.00 O ATOM 103 CB ILE A 8 -16.522 -14.342 20.130 1.00 0.00 C ATOM 104 CG1 ILE A 8 -17.626 -14.854 19.201 1.00 0.00 C ATOM 105 CG2 ILE A 8 -17.080 -14.047 21.514 1.00 0.00 C ATOM 106 CD1 ILE A 8 -18.343 -16.074 19.732 1.00 0.00 C ATOM 0 H ILE A 8 -17.735 -12.181 19.831 1.00 0.00 H new ATOM 0 HA ILE A 8 -15.014 -12.799 20.157 1.00 0.00 H new ATOM 0 HB ILE A 8 -15.764 -15.119 20.224 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -18.352 -14.057 19.039 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -17.192 -15.092 18.230 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -17.541 -14.947 21.920 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -16.272 -13.725 22.171 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -17.827 -13.257 21.444 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -19.112 -16.382 19.023 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -17.628 -16.886 19.867 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -18.807 -15.836 20.689 1.00 0.00 H new ATOM 117 N PRO A 9 -14.172 -13.968 18.028 1.00 0.00 N ATOM 118 CA PRO A 9 -13.567 -14.329 16.743 1.00 0.00 C ATOM 119 C PRO A 9 -14.287 -15.494 16.071 1.00 0.00 C ATOM 120 O PRO A 9 -13.822 -16.632 16.119 1.00 0.00 O ATOM 121 CB PRO A 9 -12.139 -14.729 17.121 1.00 0.00 C ATOM 122 CG PRO A 9 -12.232 -15.164 18.543 1.00 0.00 C ATOM 123 CD PRO A 9 -13.304 -14.313 19.167 1.00 0.00 C ATOM 0 HA PRO A 9 -13.618 -13.511 16.025 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -11.771 -15.533 16.484 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -11.450 -13.892 17.007 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -12.484 -16.222 18.612 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -11.279 -15.030 19.055 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -13.850 -14.856 19.938 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.887 -13.423 19.638 1.00 0.00 H new ATOM 128 N GLN A 10 -15.422 -15.201 15.446 1.00 0.00 N ATOM 129 CA GLN A 10 -16.205 -16.226 14.765 1.00 0.00 C ATOM 130 C GLN A 10 -16.054 -16.110 13.251 1.00 0.00 C ATOM 131 O GLN A 10 -15.796 -17.099 12.565 1.00 0.00 O ATOM 132 CB GLN A 10 -17.681 -16.113 15.153 1.00 0.00 C ATOM 133 CG GLN A 10 -18.596 -17.000 14.326 1.00 0.00 C ATOM 134 CD GLN A 10 -20.042 -16.932 14.780 1.00 0.00 C ATOM 135 OE1 GLN A 10 -20.712 -17.955 14.912 1.00 0.00 O ATOM 136 NE2 GLN A 10 -20.529 -15.720 15.023 1.00 0.00 N ATOM 0 H GLN A 10 -15.820 -14.263 15.397 1.00 0.00 H new ATOM 0 HA GLN A 10 -15.829 -17.201 15.076 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -17.792 -16.372 16.206 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.998 -15.076 15.044 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -18.534 -16.704 13.279 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.248 -18.031 14.387 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -19.937 -14.898 14.900 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -21.495 -15.611 15.332 1.00 0.00 H new ATOM 143 N LEU A 11 -16.219 -14.896 12.738 1.00 0.00 N ATOM 144 CA LEU A 11 -16.101 -14.650 11.304 1.00 0.00 C ATOM 145 C LEU A 11 -15.011 -13.623 11.016 1.00 0.00 C ATOM 146 O LEU A 11 -15.034 -12.952 9.984 1.00 0.00 O ATOM 147 CB LEU A 11 -17.437 -14.164 10.739 1.00 0.00 C ATOM 148 CG LEU A 11 -18.039 -15.011 9.616 1.00 0.00 C ATOM 149 CD1 LEU A 11 -18.460 -16.374 10.142 1.00 0.00 C ATOM 150 CD2 LEU A 11 -19.221 -14.293 8.981 1.00 0.00 C ATOM 0 H LEU A 11 -16.435 -14.067 13.292 1.00 0.00 H new ATOM 0 HA LEU A 11 -15.828 -15.588 10.820 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -18.157 -14.114 11.555 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -17.304 -13.147 10.369 1.00 0.00 H new ATOM 0 HG LEU A 11 -17.277 -15.160 8.851 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -18.886 -16.962 9.329 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -17.591 -16.892 10.548 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -19.206 -16.247 10.927 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -19.636 -14.910 8.184 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -19.986 -14.113 9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -18.889 -13.341 8.567 1.00 0.00 H new ATOM 161 N VAL A 12 -14.056 -13.508 11.932 1.00 0.00 N ATOM 162 CA VAL A 12 -12.954 -12.567 11.774 1.00 0.00 C ATOM 163 C VAL A 12 -11.845 -13.157 10.911 1.00 0.00 C ATOM 164 O VAL A 12 -11.080 -12.427 10.281 1.00 0.00 O ATOM 165 CB VAL A 12 -12.365 -12.158 13.138 1.00 0.00 C ATOM 166 CG1 VAL A 12 -13.442 -11.555 14.026 1.00 0.00 C ATOM 167 CG2 VAL A 12 -11.712 -13.354 13.815 1.00 0.00 C ATOM 0 H VAL A 12 -14.023 -14.055 12.792 1.00 0.00 H new ATOM 0 HA VAL A 12 -13.361 -11.684 11.282 1.00 0.00 H new ATOM 0 HB VAL A 12 -11.600 -11.400 12.972 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -13.007 -11.272 14.985 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -13.860 -10.672 13.543 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -14.232 -12.288 14.188 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -11.301 -13.048 14.777 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -12.456 -14.135 13.970 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -10.910 -13.737 13.183 1.00 0.00 H new ATOM 177 N ALA A 13 -11.766 -14.483 10.884 1.00 0.00 N ATOM 178 CA ALA A 13 -10.752 -15.172 10.095 1.00 0.00 C ATOM 179 C ALA A 13 -11.123 -16.636 9.882 1.00 0.00 C ATOM 180 O ALA A 13 -10.265 -17.517 9.933 1.00 0.00 O ATOM 181 CB ALA A 13 -9.393 -15.062 10.769 1.00 0.00 C ATOM 0 H ALA A 13 -12.392 -15.102 11.399 1.00 0.00 H new ATOM 0 HA ALA A 13 -10.700 -14.692 9.118 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -8.646 -15.581 10.169 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -9.117 -14.012 10.863 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -9.440 -15.514 11.760 1.00 0.00 H new ATOM 187 N SER A 14 -12.406 -16.887 9.644 1.00 0.00 N ATOM 188 CA SER A 14 -12.891 -18.245 9.429 1.00 0.00 C ATOM 189 C SER A 14 -12.711 -18.662 7.971 1.00 0.00 C ATOM 190 O SER A 14 -12.076 -19.675 7.680 1.00 0.00 O ATOM 191 CB SER A 14 -14.366 -18.352 9.822 1.00 0.00 C ATOM 192 OG SER A 14 -14.630 -19.575 10.488 1.00 0.00 O ATOM 0 H SER A 14 -13.128 -16.168 9.595 1.00 0.00 H new ATOM 0 HA SER A 14 -12.305 -18.916 10.057 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.634 -17.517 10.469 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.989 -18.278 8.931 1.00 0.00 H new ATOM 0 HG SER A 14 -15.579 -19.618 10.730 1.00 0.00 H new ATOM 197 N GLN A 15 -13.273 -17.872 7.063 1.00 0.00 N ATOM 198 CA GLN A 15 -13.175 -18.158 5.637 1.00 0.00 C ATOM 199 C GLN A 15 -11.718 -18.259 5.201 1.00 0.00 C ATOM 200 O GLN A 15 -11.325 -19.212 4.527 1.00 0.00 O ATOM 201 CB GLN A 15 -13.889 -17.075 4.827 1.00 0.00 C ATOM 202 CG GLN A 15 -14.870 -17.626 3.804 1.00 0.00 C ATOM 203 CD GLN A 15 -16.286 -17.135 4.030 1.00 0.00 C ATOM 204 OE1 GLN A 15 -17.150 -17.886 4.487 1.00 0.00 O ATOM 205 NE2 GLN A 15 -16.533 -15.870 3.713 1.00 0.00 N ATOM 0 H GLN A 15 -13.801 -17.029 7.289 1.00 0.00 H new ATOM 0 HA GLN A 15 -13.658 -19.117 5.451 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -14.423 -16.415 5.510 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -13.144 -16.467 4.313 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -14.545 -17.339 2.804 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -14.857 -18.715 3.843 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -15.788 -15.284 3.337 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -17.468 -15.484 3.845 1.00 0.00 H new ATOM 212 N SER A 16 -10.920 -17.268 5.588 1.00 0.00 N ATOM 213 CA SER A 16 -9.506 -17.243 5.233 1.00 0.00 C ATOM 214 C SER A 16 -8.787 -16.101 5.946 1.00 0.00 C ATOM 215 O SER A 16 -9.215 -14.949 5.884 1.00 0.00 O ATOM 216 CB SER A 16 -9.340 -17.099 3.720 1.00 0.00 C ATOM 217 OG SER A 16 -10.128 -16.032 3.220 1.00 0.00 O ATOM 0 H SER A 16 -11.229 -16.473 6.147 1.00 0.00 H new ATOM 0 HA SER A 16 -9.061 -18.185 5.552 1.00 0.00 H new ATOM 0 HB2 SER A 16 -8.291 -16.924 3.481 1.00 0.00 H new ATOM 0 HB3 SER A 16 -9.628 -18.029 3.229 1.00 0.00 H new ATOM 0 HG SER A 16 -10.451 -16.256 2.322 1.00 0.00 H new ATOM 222 N ALA A 17 -7.692 -16.431 6.623 1.00 0.00 N ATOM 223 CA ALA A 17 -6.912 -15.435 7.347 1.00 0.00 C ATOM 224 C ALA A 17 -6.486 -14.296 6.425 1.00 0.00 C ATOM 225 O ALA A 17 -6.397 -13.143 6.847 1.00 0.00 O ATOM 226 CB ALA A 17 -5.694 -16.081 7.988 1.00 0.00 C ATOM 0 H ALA A 17 -7.325 -17.381 6.685 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.542 -15.017 8.132 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.121 -15.325 8.525 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.017 -16.855 8.685 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.069 -16.527 7.214 1.00 0.00 H new ATOM 232 N PHE A 18 -6.224 -14.628 5.165 1.00 0.00 N ATOM 233 CA PHE A 18 -5.805 -13.634 4.184 1.00 0.00 C ATOM 234 C PHE A 18 -6.880 -12.566 3.999 1.00 0.00 C ATOM 235 O PHE A 18 -6.600 -11.370 4.066 1.00 0.00 O ATOM 236 CB PHE A 18 -5.501 -14.305 2.844 1.00 0.00 C ATOM 237 CG PHE A 18 -4.707 -13.440 1.906 1.00 0.00 C ATOM 238 CD1 PHE A 18 -5.345 -12.573 1.035 1.00 0.00 C ATOM 239 CD2 PHE A 18 -3.323 -13.495 1.897 1.00 0.00 C ATOM 240 CE1 PHE A 18 -4.618 -11.776 0.171 1.00 0.00 C ATOM 241 CE2 PHE A 18 -2.590 -12.700 1.036 1.00 0.00 C ATOM 242 CZ PHE A 18 -3.238 -11.839 0.172 1.00 0.00 C ATOM 0 H PHE A 18 -6.294 -15.578 4.799 1.00 0.00 H new ATOM 0 HA PHE A 18 -4.900 -13.153 4.555 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.952 -15.229 3.026 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.440 -14.581 2.364 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -6.424 -12.519 1.031 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.811 -14.167 2.570 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.128 -11.105 -0.504 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.511 -12.752 1.039 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.667 -11.217 -0.501 1.00 0.00 H new ATOM 251 N ALA A 19 -8.111 -13.009 3.766 1.00 0.00 N ATOM 252 CA ALA A 19 -9.228 -12.093 3.573 1.00 0.00 C ATOM 253 C ALA A 19 -9.344 -11.115 4.737 1.00 0.00 C ATOM 254 O ALA A 19 -9.651 -9.939 4.543 1.00 0.00 O ATOM 255 CB ALA A 19 -10.525 -12.871 3.404 1.00 0.00 C ATOM 0 H ALA A 19 -8.360 -13.996 3.706 1.00 0.00 H new ATOM 0 HA ALA A 19 -9.041 -11.517 2.666 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -11.351 -12.174 3.261 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -10.447 -13.525 2.535 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -10.708 -13.472 4.295 1.00 0.00 H new ATOM 261 N ALA A 20 -9.097 -11.609 5.946 1.00 0.00 N ATOM 262 CA ALA A 20 -9.172 -10.777 7.141 1.00 0.00 C ATOM 263 C ALA A 20 -8.244 -9.572 7.030 1.00 0.00 C ATOM 264 O ALA A 20 -8.592 -8.467 7.448 1.00 0.00 O ATOM 265 CB ALA A 20 -8.832 -11.597 8.376 1.00 0.00 C ATOM 0 H ALA A 20 -8.843 -12.581 6.124 1.00 0.00 H new ATOM 0 HA ALA A 20 -10.193 -10.408 7.234 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -8.892 -10.964 9.261 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.539 -12.421 8.471 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -7.821 -11.995 8.282 1.00 0.00 H new ATOM 271 N LYS A 21 -7.061 -9.792 6.466 1.00 0.00 N ATOM 272 CA LYS A 21 -6.081 -8.725 6.301 1.00 0.00 C ATOM 273 C LYS A 21 -6.555 -7.708 5.266 1.00 0.00 C ATOM 274 O LYS A 21 -6.376 -6.503 5.439 1.00 0.00 O ATOM 275 CB LYS A 21 -4.730 -9.305 5.878 1.00 0.00 C ATOM 276 CG LYS A 21 -4.044 -10.105 6.973 1.00 0.00 C ATOM 277 CD LYS A 21 -2.724 -9.473 7.382 1.00 0.00 C ATOM 278 CE LYS A 21 -2.935 -8.118 8.040 1.00 0.00 C ATOM 279 NZ LYS A 21 -2.124 -7.972 9.281 1.00 0.00 N ATOM 0 H LYS A 21 -6.758 -10.700 6.115 1.00 0.00 H new ATOM 0 HA LYS A 21 -5.968 -8.218 7.259 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -4.875 -9.945 5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -4.075 -8.491 5.569 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -4.700 -10.173 7.841 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -3.869 -11.123 6.626 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -2.200 -10.136 8.071 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -2.087 -9.358 6.505 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -2.670 -7.328 7.338 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -3.991 -7.991 8.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -1.821 -6.982 9.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -2.697 -8.245 10.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -1.287 -8.586 9.223 1.00 0.00 H new ATOM 289 N ALA A 22 -7.161 -8.203 4.192 1.00 0.00 N ATOM 290 CA ALA A 22 -7.663 -7.337 3.132 1.00 0.00 C ATOM 291 C ALA A 22 -8.643 -6.307 3.682 1.00 0.00 C ATOM 292 O ALA A 22 -8.515 -5.112 3.420 1.00 0.00 O ATOM 293 CB ALA A 22 -8.324 -8.166 2.041 1.00 0.00 C ATOM 0 H ALA A 22 -7.316 -9.198 4.033 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.816 -6.802 2.704 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.694 -7.506 1.256 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.596 -8.859 1.619 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -9.156 -8.728 2.465 1.00 0.00 H new ATOM 299 N GLY A 23 -9.622 -6.778 4.448 1.00 0.00 N ATOM 300 CA GLY A 23 -10.610 -5.884 5.023 1.00 0.00 C ATOM 301 C GLY A 23 -10.026 -4.987 6.095 1.00 0.00 C ATOM 302 O GLY A 23 -10.520 -3.883 6.330 1.00 0.00 O ATOM 0 H GLY A 23 -9.749 -7.763 4.681 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -11.041 -5.268 4.234 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -11.423 -6.472 5.449 1.00 0.00 H new ATOM 306 N LEU A 24 -8.972 -5.460 6.751 1.00 0.00 N ATOM 307 CA LEU A 24 -8.319 -4.692 7.806 1.00 0.00 C ATOM 308 C LEU A 24 -7.485 -3.559 7.219 1.00 0.00 C ATOM 309 O LEU A 24 -7.364 -2.490 7.818 1.00 0.00 O ATOM 310 CB LEU A 24 -7.433 -5.607 8.655 1.00 0.00 C ATOM 311 CG LEU A 24 -7.821 -5.739 10.128 1.00 0.00 C ATOM 312 CD1 LEU A 24 -7.576 -4.430 10.864 1.00 0.00 C ATOM 313 CD2 LEU A 24 -9.276 -6.164 10.261 1.00 0.00 C ATOM 0 H LEU A 24 -8.551 -6.372 6.571 1.00 0.00 H new ATOM 0 HA LEU A 24 -9.094 -4.257 8.438 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.438 -6.601 8.208 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.408 -5.239 8.601 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.196 -6.509 10.581 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -7.858 -4.543 11.911 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.520 -4.168 10.799 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -8.174 -3.640 10.410 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.534 -6.253 11.316 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -9.917 -5.418 9.792 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -9.420 -7.126 9.770 1.00 0.00 H new ATOM 324 N MET A 25 -6.914 -3.798 6.044 1.00 0.00 N ATOM 325 CA MET A 25 -6.094 -2.795 5.375 1.00 0.00 C ATOM 326 C MET A 25 -6.911 -1.543 5.068 1.00 0.00 C ATOM 327 O MET A 25 -6.572 -0.446 5.513 1.00 0.00 O ATOM 328 CB MET A 25 -5.507 -3.365 4.082 1.00 0.00 C ATOM 329 CG MET A 25 -4.817 -2.323 3.217 1.00 0.00 C ATOM 330 SD MET A 25 -3.419 -2.997 2.299 1.00 0.00 S ATOM 331 CE MET A 25 -2.068 -2.611 3.410 1.00 0.00 C ATOM 0 H MET A 25 -7.004 -4.677 5.535 1.00 0.00 H new ATOM 0 HA MET A 25 -5.279 -2.521 6.045 1.00 0.00 H new ATOM 0 HB2 MET A 25 -4.792 -4.149 4.332 1.00 0.00 H new ATOM 0 HB3 MET A 25 -6.305 -3.833 3.506 1.00 0.00 H new ATOM 0 HG2 MET A 25 -5.538 -1.903 2.516 1.00 0.00 H new ATOM 0 HG3 MET A 25 -4.471 -1.504 3.848 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.193 -2.317 2.830 1.00 0.00 H new ATOM 0 HE2 MET A 25 -2.360 -1.792 4.067 1.00 0.00 H new ATOM 0 HE3 MET A 25 -1.828 -3.489 4.010 1.00 0.00 H new ATOM 339 N ARG A 26 -7.985 -1.714 4.304 1.00 0.00 N ATOM 340 CA ARG A 26 -8.848 -0.598 3.937 1.00 0.00 C ATOM 341 C ARG A 26 -9.281 0.184 5.173 1.00 0.00 C ATOM 342 O ARG A 26 -9.401 1.408 5.136 1.00 0.00 O ATOM 343 CB ARG A 26 -10.078 -1.104 3.182 1.00 0.00 C ATOM 344 CG ARG A 26 -9.770 -1.606 1.781 1.00 0.00 C ATOM 345 CD ARG A 26 -11.017 -2.141 1.095 1.00 0.00 C ATOM 346 NE ARG A 26 -11.380 -3.470 1.578 1.00 0.00 N ATOM 347 CZ ARG A 26 -12.434 -4.149 1.141 1.00 0.00 C ATOM 348 NH1 ARG A 26 -13.226 -3.626 0.215 1.00 0.00 N ATOM 349 NH2 ARG A 26 -12.700 -5.354 1.631 1.00 0.00 N ATOM 0 H ARG A 26 -8.278 -2.615 3.927 1.00 0.00 H new ATOM 0 HA ARG A 26 -8.281 0.069 3.288 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.539 -1.909 3.754 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -10.810 -0.299 3.117 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -9.346 -0.796 1.188 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.016 -2.392 1.832 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -11.847 -1.455 1.265 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -10.850 -2.180 0.019 1.00 0.00 H new ATOM 0 HE ARG A 26 -10.791 -3.901 2.291 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -13.026 -2.700 -0.163 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -14.035 -4.150 -0.119 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -12.094 -5.760 2.344 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -13.510 -5.874 1.294 1.00 0.00 H new ATOM 360 N HIS A 27 -9.515 -0.533 6.268 1.00 0.00 N ATOM 361 CA HIS A 27 -9.936 0.093 7.517 1.00 0.00 C ATOM 362 C HIS A 27 -8.887 1.088 8.006 1.00 0.00 C ATOM 363 O HIS A 27 -9.215 2.205 8.409 1.00 0.00 O ATOM 364 CB HIS A 27 -10.185 -0.970 8.587 1.00 0.00 C ATOM 365 CG HIS A 27 -10.461 -0.401 9.944 1.00 0.00 C ATOM 366 ND1 HIS A 27 -10.984 0.861 10.140 1.00 0.00 N ATOM 367 CD2 HIS A 27 -10.284 -0.928 11.178 1.00 0.00 C ATOM 368 CE1 HIS A 27 -11.115 1.085 11.435 1.00 0.00 C ATOM 369 NE2 HIS A 27 -10.699 0.014 12.087 1.00 0.00 N ATOM 0 H HIS A 27 -9.420 -1.547 6.316 1.00 0.00 H new ATOM 0 HA HIS A 27 -10.864 0.633 7.329 1.00 0.00 H new ATOM 0 HB2 HIS A 27 -11.029 -1.589 8.283 1.00 0.00 H new ATOM 0 HB3 HIS A 27 -9.315 -1.624 8.647 1.00 0.00 H new ATOM 0 HD1 HIS A 27 -11.231 1.518 9.400 1.00 0.00 H new ATOM 0 HD2 HIS A 27 -9.890 -1.907 11.406 1.00 0.00 H new ATOM 0 HE1 HIS A 27 -11.497 1.990 11.884 1.00 0.00 H new ATOM 376 N THR A 28 -7.624 0.675 7.967 1.00 0.00 N ATOM 377 CA THR A 28 -6.528 1.528 8.408 1.00 0.00 C ATOM 378 C THR A 28 -6.403 2.765 7.524 1.00 0.00 C ATOM 379 O THR A 28 -5.970 3.823 7.979 1.00 0.00 O ATOM 380 CB THR A 28 -5.187 0.770 8.401 1.00 0.00 C ATOM 381 OG1 THR A 28 -5.384 -0.575 8.852 1.00 0.00 O ATOM 382 CG2 THR A 28 -4.168 1.464 9.292 1.00 0.00 C ATOM 0 H THR A 28 -7.335 -0.245 7.634 1.00 0.00 H new ATOM 0 HA THR A 28 -6.759 1.835 9.428 1.00 0.00 H new ATOM 0 HB THR A 28 -4.806 0.760 7.380 1.00 0.00 H new ATOM 0 HG1 THR A 28 -4.528 -1.052 8.843 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.229 0.910 9.271 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.999 2.478 8.930 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.544 1.501 10.314 1.00 0.00 H new ATOM 390 N ILE A 29 -6.786 2.623 6.259 1.00 0.00 N ATOM 391 CA ILE A 29 -6.718 3.728 5.313 1.00 0.00 C ATOM 392 C ILE A 29 -7.708 4.829 5.681 1.00 0.00 C ATOM 393 O ILE A 29 -7.353 6.006 5.735 1.00 0.00 O ATOM 394 CB ILE A 29 -7.004 3.257 3.875 1.00 0.00 C ATOM 395 CG1 ILE A 29 -6.005 2.175 3.462 1.00 0.00 C ATOM 396 CG2 ILE A 29 -6.948 4.433 2.911 1.00 0.00 C ATOM 397 CD1 ILE A 29 -4.561 2.623 3.540 1.00 0.00 C ATOM 0 H ILE A 29 -7.146 1.753 5.867 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.703 4.123 5.362 1.00 0.00 H new ATOM 0 HB ILE A 29 -8.007 2.832 3.840 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.141 1.303 4.102 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.224 1.860 2.442 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.152 4.084 1.899 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.695 5.174 3.197 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -5.957 4.885 2.946 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -3.909 1.805 3.233 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -4.409 3.476 2.879 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.324 2.911 4.564 1.00 0.00 H new ATOM 408 N GLY A 30 -8.953 4.437 5.936 1.00 0.00 N ATOM 409 CA GLY A 30 -9.975 5.401 6.298 1.00 0.00 C ATOM 410 C GLY A 30 -9.700 6.063 7.633 1.00 0.00 C ATOM 411 O GLY A 30 -10.051 7.225 7.842 1.00 0.00 O ATOM 0 H GLY A 30 -9.272 3.469 5.898 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.040 6.165 5.523 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.943 4.902 6.336 1.00 0.00 H new ATOM 415 N GLN A 31 -9.074 5.322 8.542 1.00 0.00 N ATOM 416 CA GLN A 31 -8.756 5.844 9.865 1.00 0.00 C ATOM 417 C GLN A 31 -7.615 6.854 9.792 1.00 0.00 C ATOM 418 O GLN A 31 -7.633 7.877 10.477 1.00 0.00 O ATOM 419 CB GLN A 31 -8.380 4.702 10.812 1.00 0.00 C ATOM 420 CG GLN A 31 -9.370 4.503 11.948 1.00 0.00 C ATOM 421 CD GLN A 31 -9.035 5.339 13.167 1.00 0.00 C ATOM 422 OE1 GLN A 31 -8.188 4.962 13.979 1.00 0.00 O ATOM 423 NE2 GLN A 31 -9.699 6.481 13.303 1.00 0.00 N ATOM 0 H GLN A 31 -8.777 4.359 8.386 1.00 0.00 H new ATOM 0 HA GLN A 31 -9.642 6.349 10.250 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -8.305 3.777 10.240 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -7.393 4.899 11.231 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.371 4.758 11.601 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -9.389 3.450 12.228 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -10.392 6.754 12.606 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -9.516 7.085 14.104 1.00 0.00 H new ATOM 430 N ALA A 32 -6.624 6.560 8.958 1.00 0.00 N ATOM 431 CA ALA A 32 -5.476 7.443 8.794 1.00 0.00 C ATOM 432 C ALA A 32 -5.826 8.644 7.920 1.00 0.00 C ATOM 433 O ALA A 32 -5.406 9.766 8.194 1.00 0.00 O ATOM 434 CB ALA A 32 -4.303 6.680 8.199 1.00 0.00 C ATOM 0 H ALA A 32 -6.593 5.717 8.385 1.00 0.00 H new ATOM 0 HA ALA A 32 -5.192 7.814 9.779 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.453 7.352 8.082 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.028 5.860 8.862 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -4.585 6.280 7.225 1.00 0.00 H new ATOM 440 N GLU A 33 -6.598 8.396 6.866 1.00 0.00 N ATOM 441 CA GLU A 33 -7.003 9.457 5.952 1.00 0.00 C ATOM 442 C GLU A 33 -7.766 10.552 6.692 1.00 0.00 C ATOM 443 O GLU A 33 -7.426 11.732 6.596 1.00 0.00 O ATOM 444 CB GLU A 33 -7.871 8.888 4.827 1.00 0.00 C ATOM 445 CG GLU A 33 -7.085 8.515 3.581 1.00 0.00 C ATOM 446 CD GLU A 33 -7.970 8.342 2.362 1.00 0.00 C ATOM 447 OE1 GLU A 33 -9.179 8.643 2.459 1.00 0.00 O ATOM 448 OE2 GLU A 33 -7.455 7.907 1.312 1.00 0.00 O ATOM 0 H GLU A 33 -6.955 7.471 6.625 1.00 0.00 H new ATOM 0 HA GLU A 33 -6.102 9.893 5.522 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -8.394 8.005 5.194 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -8.632 9.621 4.560 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.343 9.287 3.380 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.540 7.589 3.764 1.00 0.00 H new ATOM 453 N GLN A 34 -8.797 10.153 7.429 1.00 0.00 N ATOM 454 CA GLN A 34 -9.607 11.100 8.185 1.00 0.00 C ATOM 455 C GLN A 34 -8.752 11.877 9.181 1.00 0.00 C ATOM 456 O GLN A 34 -9.008 13.049 9.451 1.00 0.00 O ATOM 457 CB GLN A 34 -10.731 10.368 8.921 1.00 0.00 C ATOM 458 CG GLN A 34 -11.643 11.292 9.713 1.00 0.00 C ATOM 459 CD GLN A 34 -13.095 10.858 9.667 1.00 0.00 C ATOM 460 OE1 GLN A 34 -13.442 9.766 10.117 1.00 0.00 O ATOM 461 NE2 GLN A 34 -13.952 11.713 9.121 1.00 0.00 N ATOM 0 H GLN A 34 -9.091 9.180 7.519 1.00 0.00 H new ATOM 0 HA GLN A 34 -10.044 11.808 7.481 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -11.329 9.815 8.196 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -10.293 9.635 9.599 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -11.310 11.324 10.750 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -11.558 12.305 9.320 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.620 12.608 8.761 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.942 11.475 9.062 1.00 0.00 H new ATOM 468 N ALA A 35 -7.736 11.214 9.723 1.00 0.00 N ATOM 469 CA ALA A 35 -6.841 11.842 10.687 1.00 0.00 C ATOM 470 C ALA A 35 -6.227 13.116 10.116 1.00 0.00 C ATOM 471 O ALA A 35 -6.081 14.115 10.820 1.00 0.00 O ATOM 472 CB ALA A 35 -5.749 10.869 11.106 1.00 0.00 C ATOM 0 H ALA A 35 -7.512 10.242 9.511 1.00 0.00 H new ATOM 0 HA ALA A 35 -7.426 12.114 11.566 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.088 11.352 11.826 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -6.202 9.989 11.562 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.174 10.569 10.230 1.00 0.00 H new ATOM 478 N ALA A 36 -5.869 13.074 8.837 1.00 0.00 N ATOM 479 CA ALA A 36 -5.271 14.226 8.173 1.00 0.00 C ATOM 480 C ALA A 36 -6.164 15.455 8.296 1.00 0.00 C ATOM 481 O ALA A 36 -5.793 16.442 8.930 1.00 0.00 O ATOM 482 CB ALA A 36 -5.003 13.910 6.708 1.00 0.00 C ATOM 0 H ALA A 36 -5.983 12.255 8.240 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.324 14.447 8.665 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.557 14.779 6.224 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.319 13.064 6.637 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.941 13.661 6.212 1.00 0.00 H new ATOM 488 N MET A 37 -7.343 15.387 7.686 1.00 0.00 N ATOM 489 CA MET A 37 -8.290 16.496 7.729 1.00 0.00 C ATOM 490 C MET A 37 -8.719 16.789 9.162 1.00 0.00 C ATOM 491 O MET A 37 -9.088 17.918 9.491 1.00 0.00 O ATOM 492 CB MET A 37 -9.517 16.180 6.871 1.00 0.00 C ATOM 493 CG MET A 37 -10.296 14.965 7.349 1.00 0.00 C ATOM 494 SD MET A 37 -11.796 14.681 6.389 1.00 0.00 S ATOM 495 CE MET A 37 -11.102 14.148 4.826 1.00 0.00 C ATOM 0 H MET A 37 -7.665 14.577 7.157 1.00 0.00 H new ATOM 0 HA MET A 37 -7.794 17.381 7.329 1.00 0.00 H new ATOM 0 HB2 MET A 37 -10.179 17.046 6.865 1.00 0.00 H new ATOM 0 HB3 MET A 37 -9.198 16.015 5.842 1.00 0.00 H new ATOM 0 HG2 MET A 37 -9.659 14.083 7.289 1.00 0.00 H new ATOM 0 HG3 MET A 37 -10.560 15.097 8.398 1.00 0.00 H new ATOM 0 HE1 MET A 37 -11.889 13.717 4.207 1.00 0.00 H new ATOM 0 HE2 MET A 37 -10.663 15.003 4.312 1.00 0.00 H new ATOM 0 HE3 MET A 37 -10.331 13.399 5.007 1.00 0.00 H new ATOM 503 N SER A 38 -8.670 15.768 10.012 1.00 0.00 N ATOM 504 CA SER A 38 -9.058 15.916 11.409 1.00 0.00 C ATOM 505 C SER A 38 -8.149 16.912 12.122 1.00 0.00 C ATOM 506 O SER A 38 -8.604 17.951 12.602 1.00 0.00 O ATOM 507 CB SER A 38 -9.007 14.563 12.120 1.00 0.00 C ATOM 508 OG SER A 38 -9.458 14.673 13.460 1.00 0.00 O ATOM 0 H SER A 38 -8.365 14.829 9.757 1.00 0.00 H new ATOM 0 HA SER A 38 -10.079 16.296 11.439 1.00 0.00 H new ATOM 0 HB2 SER A 38 -9.625 13.843 11.583 1.00 0.00 H new ATOM 0 HB3 SER A 38 -7.987 14.180 12.107 1.00 0.00 H new ATOM 0 HG SER A 38 -9.417 13.794 13.892 1.00 0.00 H new ATOM 513 N ALA A 39 -6.861 16.589 12.187 1.00 0.00 N ATOM 514 CA ALA A 39 -5.888 17.456 12.840 1.00 0.00 C ATOM 515 C ALA A 39 -5.663 18.732 12.036 1.00 0.00 C ATOM 516 O ALA A 39 -5.537 19.817 12.601 1.00 0.00 O ATOM 517 CB ALA A 39 -4.573 16.716 13.038 1.00 0.00 C ATOM 0 H ALA A 39 -6.468 15.733 11.795 1.00 0.00 H new ATOM 0 HA ALA A 39 -6.285 17.738 13.815 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -3.855 17.375 13.527 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -4.740 15.837 13.660 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.180 16.406 12.069 1.00 0.00 H new ATOM 523 N GLN A 40 -5.614 18.592 10.715 1.00 0.00 N ATOM 524 CA GLN A 40 -5.404 19.735 9.834 1.00 0.00 C ATOM 525 C GLN A 40 -6.456 20.812 10.077 1.00 0.00 C ATOM 526 O GLN A 40 -6.226 21.991 9.809 1.00 0.00 O ATOM 527 CB GLN A 40 -5.440 19.292 8.370 1.00 0.00 C ATOM 528 CG GLN A 40 -5.421 20.447 7.383 1.00 0.00 C ATOM 529 CD GLN A 40 -4.794 20.071 6.055 1.00 0.00 C ATOM 530 OE1 GLN A 40 -3.696 19.516 6.010 1.00 0.00 O ATOM 531 NE2 GLN A 40 -5.491 20.371 4.966 1.00 0.00 N ATOM 0 H GLN A 40 -5.717 17.700 10.232 1.00 0.00 H new ATOM 0 HA GLN A 40 -4.423 20.155 10.055 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -4.586 18.644 8.174 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -6.337 18.696 8.202 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -6.441 20.792 7.214 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -4.870 21.281 7.817 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -6.397 20.831 5.051 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -5.120 20.141 4.044 1.00 0.00 H new ATOM 538 N ALA A 41 -7.612 20.398 10.587 1.00 0.00 N ATOM 539 CA ALA A 41 -8.699 21.327 10.867 1.00 0.00 C ATOM 540 C ALA A 41 -8.247 22.428 11.820 1.00 0.00 C ATOM 541 O ALA A 41 -8.343 23.615 11.504 1.00 0.00 O ATOM 542 CB ALA A 41 -9.894 20.583 11.446 1.00 0.00 C ATOM 0 H ALA A 41 -7.819 19.425 10.814 1.00 0.00 H new ATOM 0 HA ALA A 41 -8.996 21.794 9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.698 21.290 11.650 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -10.239 19.837 10.731 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.601 20.089 12.372 1.00 0.00 H new ATOM 548 N PHE A 42 -7.756 22.029 12.988 1.00 0.00 N ATOM 549 CA PHE A 42 -7.291 22.983 13.989 1.00 0.00 C ATOM 550 C PHE A 42 -8.333 24.071 14.229 1.00 0.00 C ATOM 551 O PHE A 42 -8.072 25.255 14.009 1.00 0.00 O ATOM 552 CB PHE A 42 -5.969 23.614 13.547 1.00 0.00 C ATOM 553 CG PHE A 42 -4.866 22.616 13.343 1.00 0.00 C ATOM 554 CD1 PHE A 42 -4.413 21.840 14.398 1.00 0.00 C ATOM 555 CD2 PHE A 42 -4.281 22.453 12.097 1.00 0.00 C ATOM 556 CE1 PHE A 42 -3.398 20.920 14.214 1.00 0.00 C ATOM 557 CE2 PHE A 42 -3.266 21.535 11.908 1.00 0.00 C ATOM 558 CZ PHE A 42 -2.823 20.768 12.968 1.00 0.00 C ATOM 0 H PHE A 42 -7.670 21.051 13.265 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.134 22.444 14.923 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.130 24.161 12.618 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -5.655 24.342 14.295 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -4.858 21.955 15.375 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -4.622 23.050 11.265 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -3.055 20.321 15.044 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -2.819 21.417 10.932 1.00 0.00 H new ATOM 0 HZ PHE A 42 -2.029 20.051 12.822 1.00 0.00 H new ATOM 567 N HIS A 43 -9.514 23.662 14.679 1.00 0.00 N ATOM 568 CA HIS A 43 -10.597 24.602 14.949 1.00 0.00 C ATOM 569 C HIS A 43 -11.038 25.306 13.668 1.00 0.00 C ATOM 570 O HIS A 43 -11.185 26.526 13.640 1.00 0.00 O ATOM 571 CB HIS A 43 -10.157 25.635 15.987 1.00 0.00 C ATOM 572 CG HIS A 43 -11.299 26.341 16.652 1.00 0.00 C ATOM 573 ND1 HIS A 43 -12.490 25.718 16.962 1.00 0.00 N ATOM 574 CD2 HIS A 43 -11.428 27.623 17.066 1.00 0.00 C ATOM 575 CE1 HIS A 43 -13.301 26.587 17.538 1.00 0.00 C ATOM 576 NE2 HIS A 43 -12.681 27.751 17.613 1.00 0.00 N ATOM 0 H HIS A 43 -9.746 22.686 14.865 1.00 0.00 H new ATOM 0 HA HIS A 43 -11.443 24.040 15.343 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -9.555 25.139 16.748 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -9.516 26.373 15.504 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -10.684 28.401 16.982 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -14.302 26.381 17.888 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -13.070 28.605 18.012 1.00 0.00 H new ATOM 583 N GLN A 44 -11.245 24.526 12.612 1.00 0.00 N ATOM 584 CA GLN A 44 -11.666 25.075 11.330 1.00 0.00 C ATOM 585 C GLN A 44 -12.694 24.168 10.660 1.00 0.00 C ATOM 586 O GLN A 44 -13.870 24.515 10.559 1.00 0.00 O ATOM 587 CB GLN A 44 -10.459 25.263 10.409 1.00 0.00 C ATOM 588 CG GLN A 44 -10.780 26.021 9.132 1.00 0.00 C ATOM 589 CD GLN A 44 -9.651 26.935 8.696 1.00 0.00 C ATOM 590 OE1 GLN A 44 -8.508 26.777 9.126 1.00 0.00 O ATOM 591 NE2 GLN A 44 -9.965 27.898 7.838 1.00 0.00 N ATOM 0 H GLN A 44 -11.128 23.513 12.620 1.00 0.00 H new ATOM 0 HA GLN A 44 -12.128 26.045 11.514 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -9.678 25.796 10.951 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -10.055 24.285 10.149 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -10.994 25.309 8.335 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -11.683 26.612 9.282 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -10.925 27.993 7.507 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -9.246 28.543 7.510 1.00 0.00 H new ATOM 598 N GLY A 45 -12.242 23.003 10.206 1.00 0.00 N ATOM 599 CA GLY A 45 -13.135 22.065 9.552 1.00 0.00 C ATOM 600 C GLY A 45 -12.470 21.337 8.401 1.00 0.00 C ATOM 601 O GLY A 45 -11.925 20.249 8.580 1.00 0.00 O ATOM 0 H GLY A 45 -11.273 22.692 10.280 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -13.490 21.337 10.282 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -14.011 22.599 9.183 1.00 0.00 H new ATOM 605 N GLU A 46 -12.517 21.938 7.217 1.00 0.00 N ATOM 606 CA GLU A 46 -11.915 21.338 6.032 1.00 0.00 C ATOM 607 C GLU A 46 -12.043 22.266 4.827 1.00 0.00 C ATOM 608 O GLU A 46 -13.145 22.652 4.441 1.00 0.00 O ATOM 609 CB GLU A 46 -12.576 19.992 5.724 1.00 0.00 C ATOM 610 CG GLU A 46 -11.584 18.889 5.395 1.00 0.00 C ATOM 611 CD GLU A 46 -11.566 18.540 3.919 1.00 0.00 C ATOM 612 OE1 GLU A 46 -12.649 18.260 3.363 1.00 0.00 O ATOM 613 OE2 GLU A 46 -10.470 18.547 3.322 1.00 0.00 O ATOM 0 H GLU A 46 -12.965 22.839 7.052 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.856 21.178 6.235 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -13.175 19.686 6.581 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -13.260 20.116 4.885 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -10.586 19.200 5.703 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -11.833 17.998 5.972 1.00 0.00 H new ATOM 618 N SER A 47 -10.904 22.622 4.239 1.00 0.00 N ATOM 619 CA SER A 47 -10.886 23.508 3.082 1.00 0.00 C ATOM 620 C SER A 47 -9.461 23.726 2.585 1.00 0.00 C ATOM 621 O SER A 47 -8.642 24.343 3.266 1.00 0.00 O ATOM 622 CB SER A 47 -11.528 24.852 3.432 1.00 0.00 C ATOM 623 OG SER A 47 -12.789 24.996 2.803 1.00 0.00 O ATOM 0 H SER A 47 -9.983 22.310 4.546 1.00 0.00 H new ATOM 0 HA SER A 47 -11.461 23.035 2.285 1.00 0.00 H new ATOM 0 HB2 SER A 47 -11.646 24.931 4.513 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.870 25.664 3.123 1.00 0.00 H new ATOM 0 HG SER A 47 -13.392 24.288 3.113 1.00 0.00 H new ATOM 628 N SER A 48 -9.170 23.213 1.394 1.00 0.00 N ATOM 629 CA SER A 48 -7.842 23.346 0.807 1.00 0.00 C ATOM 630 C SER A 48 -7.817 22.791 -0.614 1.00 0.00 C ATOM 631 O SER A 48 -8.310 21.693 -0.871 1.00 0.00 O ATOM 632 CB SER A 48 -6.805 22.623 1.668 1.00 0.00 C ATOM 633 OG SER A 48 -5.488 22.918 1.237 1.00 0.00 O ATOM 0 H SER A 48 -9.837 22.701 0.816 1.00 0.00 H new ATOM 0 HA SER A 48 -7.594 24.407 0.768 1.00 0.00 H new ATOM 0 HB2 SER A 48 -6.924 22.918 2.711 1.00 0.00 H new ATOM 0 HB3 SER A 48 -6.974 21.547 1.620 1.00 0.00 H new ATOM 0 HG SER A 48 -4.844 22.445 1.805 1.00 0.00 H new ATOM 638 N ALA A 49 -7.240 23.559 -1.532 1.00 0.00 N ATOM 639 CA ALA A 49 -7.148 23.143 -2.926 1.00 0.00 C ATOM 640 C ALA A 49 -5.954 22.223 -3.148 1.00 0.00 C ATOM 641 O ALA A 49 -6.105 21.095 -3.617 1.00 0.00 O ATOM 642 CB ALA A 49 -7.055 24.360 -3.835 1.00 0.00 C ATOM 0 H ALA A 49 -6.830 24.472 -1.336 1.00 0.00 H new ATOM 0 HA ALA A 49 -8.052 22.586 -3.173 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -6.987 24.034 -4.873 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -7.943 24.979 -3.706 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -6.168 24.940 -3.578 1.00 0.00 H new ATOM 648 N ALA A 50 -4.765 22.711 -2.809 1.00 0.00 N ATOM 649 CA ALA A 50 -3.544 21.932 -2.969 1.00 0.00 C ATOM 650 C ALA A 50 -3.677 20.562 -2.312 1.00 0.00 C ATOM 651 O ALA A 50 -3.072 19.587 -2.757 1.00 0.00 O ATOM 652 CB ALA A 50 -2.357 22.685 -2.390 1.00 0.00 C ATOM 0 H ALA A 50 -4.622 23.644 -2.421 1.00 0.00 H new ATOM 0 HA ALA A 50 -3.377 21.780 -4.035 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -1.452 22.091 -2.517 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -2.242 23.637 -2.909 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -2.525 22.868 -1.329 1.00 0.00 H new ATOM 658 N PHE A 51 -4.470 20.496 -1.247 1.00 0.00 N ATOM 659 CA PHE A 51 -4.681 19.247 -0.527 1.00 0.00 C ATOM 660 C PHE A 51 -5.341 18.204 -1.425 1.00 0.00 C ATOM 661 O PHE A 51 -5.067 17.010 -1.314 1.00 0.00 O ATOM 662 CB PHE A 51 -5.544 19.487 0.713 1.00 0.00 C ATOM 663 CG PHE A 51 -5.966 18.222 1.404 1.00 0.00 C ATOM 664 CD1 PHE A 51 -7.130 17.569 1.032 1.00 0.00 C ATOM 665 CD2 PHE A 51 -5.200 17.687 2.427 1.00 0.00 C ATOM 666 CE1 PHE A 51 -7.521 16.405 1.667 1.00 0.00 C ATOM 667 CE2 PHE A 51 -5.586 16.523 3.064 1.00 0.00 C ATOM 668 CZ PHE A 51 -6.748 15.882 2.684 1.00 0.00 C ATOM 0 H PHE A 51 -4.977 21.294 -0.864 1.00 0.00 H new ATOM 0 HA PHE A 51 -3.707 18.869 -0.216 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -4.990 20.108 1.417 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -6.433 20.048 0.424 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -7.739 17.974 0.237 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -4.291 18.185 2.730 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.430 15.905 1.368 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -4.979 16.115 3.859 1.00 0.00 H new ATOM 0 HZ PHE A 51 -7.052 14.973 3.182 1.00 0.00 H new ATOM 677 N GLN A 52 -6.213 18.667 -2.316 1.00 0.00 N ATOM 678 CA GLN A 52 -6.914 17.776 -3.233 1.00 0.00 C ATOM 679 C GLN A 52 -5.925 16.956 -4.056 1.00 0.00 C ATOM 680 O GLN A 52 -5.998 15.728 -4.086 1.00 0.00 O ATOM 681 CB GLN A 52 -7.826 18.580 -4.161 1.00 0.00 C ATOM 682 CG GLN A 52 -8.604 17.719 -5.144 1.00 0.00 C ATOM 683 CD GLN A 52 -10.013 17.423 -4.672 1.00 0.00 C ATOM 684 OE1 GLN A 52 -10.815 18.334 -4.464 1.00 0.00 O ATOM 685 NE2 GLN A 52 -10.324 16.143 -4.501 1.00 0.00 N ATOM 0 H GLN A 52 -6.450 19.653 -2.422 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.523 17.091 -2.642 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -8.529 19.154 -3.558 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.223 19.298 -4.717 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -8.647 18.224 -6.109 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -8.072 16.780 -5.299 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -9.628 15.420 -4.685 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -11.258 15.883 -4.186 1.00 0.00 H new ATOM 692 N ALA A 53 -5.005 17.644 -4.723 1.00 0.00 N ATOM 693 CA ALA A 53 -4.001 16.979 -5.546 1.00 0.00 C ATOM 694 C ALA A 53 -3.290 15.880 -4.762 1.00 0.00 C ATOM 695 O ALA A 53 -3.025 14.801 -5.291 1.00 0.00 O ATOM 696 CB ALA A 53 -2.995 17.991 -6.071 1.00 0.00 C ATOM 0 H ALA A 53 -4.933 18.661 -4.710 1.00 0.00 H new ATOM 0 HA ALA A 53 -4.508 16.516 -6.392 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -2.252 17.481 -6.684 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -3.511 18.738 -6.674 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -2.500 18.481 -5.232 1.00 0.00 H new ATOM 702 N ALA A 54 -2.983 16.163 -3.500 1.00 0.00 N ATOM 703 CA ALA A 54 -2.303 15.198 -2.645 1.00 0.00 C ATOM 704 C ALA A 54 -3.255 14.091 -2.202 1.00 0.00 C ATOM 705 O ALA A 54 -2.837 12.957 -1.966 1.00 0.00 O ATOM 706 CB ALA A 54 -1.705 15.897 -1.433 1.00 0.00 C ATOM 0 H ALA A 54 -3.194 17.052 -3.048 1.00 0.00 H new ATOM 0 HA ALA A 54 -1.499 14.741 -3.222 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -1.200 15.165 -0.803 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -0.987 16.648 -1.763 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -2.499 16.380 -0.863 1.00 0.00 H new ATOM 712 N HIS A 55 -4.536 14.428 -2.092 1.00 0.00 N ATOM 713 CA HIS A 55 -5.547 13.461 -1.678 1.00 0.00 C ATOM 714 C HIS A 55 -5.866 12.489 -2.809 1.00 0.00 C ATOM 715 O HIS A 55 -6.163 11.318 -2.570 1.00 0.00 O ATOM 716 CB HIS A 55 -6.821 14.182 -1.235 1.00 0.00 C ATOM 717 CG HIS A 55 -7.963 13.257 -0.949 1.00 0.00 C ATOM 718 ND1 HIS A 55 -8.784 12.578 -1.785 1.00 0.00 N flip ATOM 719 CD2 HIS A 55 -8.376 12.942 0.329 1.00 0.00 C flip ATOM 720 CE1 HIS A 55 -9.667 11.872 -1.005 1.00 0.00 C flip ATOM 721 NE2 HIS A 55 -9.399 12.110 0.267 1.00 0.00 N flip ATOM 0 H HIS A 55 -4.898 15.362 -2.283 1.00 0.00 H new ATOM 0 HA HIS A 55 -5.148 12.893 -0.837 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -6.605 14.767 -0.341 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -7.120 14.885 -2.012 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -7.931 13.318 1.239 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -10.452 11.227 -1.371 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -9.898 11.717 1.065 1.00 0.00 H new ATOM 728 N ALA A 56 -5.802 12.982 -4.041 1.00 0.00 N ATOM 729 CA ALA A 56 -6.083 12.156 -5.210 1.00 0.00 C ATOM 730 C ALA A 56 -4.991 11.113 -5.419 1.00 0.00 C ATOM 731 O ALA A 56 -5.252 10.019 -5.923 1.00 0.00 O ATOM 732 CB ALA A 56 -6.227 13.028 -6.450 1.00 0.00 C ATOM 0 H ALA A 56 -5.558 13.949 -4.256 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.023 11.631 -5.037 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.436 12.399 -7.315 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.047 13.732 -6.306 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -5.301 13.578 -6.617 1.00 0.00 H new ATOM 738 N ARG A 57 -3.767 11.456 -5.031 1.00 0.00 N ATOM 739 CA ARG A 57 -2.635 10.549 -5.177 1.00 0.00 C ATOM 740 C ARG A 57 -2.833 9.293 -4.335 1.00 0.00 C ATOM 741 O ARG A 57 -2.572 8.179 -4.790 1.00 0.00 O ATOM 742 CB ARG A 57 -1.337 11.249 -4.773 1.00 0.00 C ATOM 743 CG ARG A 57 -0.839 12.252 -5.801 1.00 0.00 C ATOM 744 CD ARG A 57 0.295 13.100 -5.248 1.00 0.00 C ATOM 745 NE ARG A 57 1.102 13.694 -6.311 1.00 0.00 N ATOM 746 CZ ARG A 57 2.022 13.024 -6.995 1.00 0.00 C ATOM 747 NH1 ARG A 57 2.250 11.745 -6.731 1.00 0.00 N ATOM 748 NH2 ARG A 57 2.717 13.634 -7.947 1.00 0.00 N ATOM 0 H ARG A 57 -3.534 12.357 -4.613 1.00 0.00 H new ATOM 0 HA ARG A 57 -2.569 10.256 -6.225 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -1.491 11.761 -3.823 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.565 10.497 -4.608 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.499 11.723 -6.691 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.661 12.898 -6.109 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.116 13.890 -4.620 1.00 0.00 H new ATOM 0 HD3 ARG A 57 0.930 12.485 -4.611 1.00 0.00 H new ATOM 0 HE ARG A 57 0.951 14.676 -6.540 1.00 0.00 H new ATOM 0 HH11 ARG A 57 1.718 11.272 -6.000 1.00 0.00 H new ATOM 0 HH12 ARG A 57 2.958 11.234 -7.259 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.545 14.618 -8.153 1.00 0.00 H new ATOM 0 HH22 ARG A 57 3.424 13.119 -8.472 1.00 0.00 H new ATOM 759 N PHE A 58 -3.295 9.480 -3.102 1.00 0.00 N ATOM 760 CA PHE A 58 -3.526 8.362 -2.194 1.00 0.00 C ATOM 761 C PHE A 58 -4.573 7.407 -2.762 1.00 0.00 C ATOM 762 O PHE A 58 -4.329 6.209 -2.895 1.00 0.00 O ATOM 763 CB PHE A 58 -3.975 8.874 -0.825 1.00 0.00 C ATOM 764 CG PHE A 58 -3.814 7.865 0.275 1.00 0.00 C ATOM 765 CD1 PHE A 58 -4.548 6.690 0.269 1.00 0.00 C ATOM 766 CD2 PHE A 58 -2.928 8.091 1.316 1.00 0.00 C ATOM 767 CE1 PHE A 58 -4.402 5.759 1.281 1.00 0.00 C ATOM 768 CE2 PHE A 58 -2.776 7.164 2.330 1.00 0.00 C ATOM 769 CZ PHE A 58 -3.514 5.997 2.312 1.00 0.00 C ATOM 0 H PHE A 58 -3.517 10.395 -2.709 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.588 7.818 -2.081 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -3.402 9.767 -0.574 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -5.022 9.172 -0.883 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -5.243 6.499 -0.536 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -2.349 9.003 1.335 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -4.981 4.848 1.265 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.081 7.352 3.135 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.397 5.271 3.103 1.00 0.00 H new ATOM 778 N VAL A 59 -5.740 7.950 -3.095 1.00 0.00 N ATOM 779 CA VAL A 59 -6.825 7.148 -3.648 1.00 0.00 C ATOM 780 C VAL A 59 -6.413 6.499 -4.964 1.00 0.00 C ATOM 781 O VAL A 59 -6.852 5.396 -5.289 1.00 0.00 O ATOM 782 CB VAL A 59 -8.088 7.998 -3.882 1.00 0.00 C ATOM 783 CG1 VAL A 59 -7.753 9.242 -4.692 1.00 0.00 C ATOM 784 CG2 VAL A 59 -9.163 7.174 -4.575 1.00 0.00 C ATOM 0 H VAL A 59 -5.958 8.941 -2.992 1.00 0.00 H new ATOM 0 HA VAL A 59 -7.048 6.371 -2.917 1.00 0.00 H new ATOM 0 HB VAL A 59 -8.474 8.318 -2.914 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -8.658 9.830 -4.847 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -7.019 9.841 -4.152 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.342 8.948 -5.658 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -10.048 7.790 -4.733 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -8.789 6.823 -5.537 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.423 6.318 -3.953 1.00 0.00 H new ATOM 794 N ALA A 60 -5.564 7.189 -5.719 1.00 0.00 N ATOM 795 CA ALA A 60 -5.089 6.679 -6.998 1.00 0.00 C ATOM 796 C ALA A 60 -4.169 5.478 -6.803 1.00 0.00 C ATOM 797 O ALA A 60 -4.159 4.554 -7.615 1.00 0.00 O ATOM 798 CB ALA A 60 -4.372 7.776 -7.771 1.00 0.00 C ATOM 0 H ALA A 60 -5.191 8.104 -5.466 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.954 6.351 -7.574 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -4.023 7.380 -8.725 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -5.059 8.603 -7.951 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.520 8.132 -7.192 1.00 0.00 H new ATOM 804 N ALA A 61 -3.397 5.500 -5.722 1.00 0.00 N ATOM 805 CA ALA A 61 -2.474 4.412 -5.420 1.00 0.00 C ATOM 806 C ALA A 61 -3.206 3.229 -4.795 1.00 0.00 C ATOM 807 O ALA A 61 -2.868 2.073 -5.051 1.00 0.00 O ATOM 808 CB ALA A 61 -1.369 4.900 -4.495 1.00 0.00 C ATOM 0 H ALA A 61 -3.392 6.259 -5.041 1.00 0.00 H new ATOM 0 HA ALA A 61 -2.028 4.076 -6.356 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -0.687 4.078 -4.278 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -0.820 5.708 -4.978 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -1.807 5.264 -3.565 1.00 0.00 H new ATOM 814 N ALA A 62 -4.209 3.525 -3.976 1.00 0.00 N ATOM 815 CA ALA A 62 -4.990 2.485 -3.317 1.00 0.00 C ATOM 816 C ALA A 62 -5.530 1.480 -4.328 1.00 0.00 C ATOM 817 O ALA A 62 -5.690 0.300 -4.019 1.00 0.00 O ATOM 818 CB ALA A 62 -6.132 3.104 -2.525 1.00 0.00 C ATOM 0 H ALA A 62 -4.500 4.477 -3.753 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.332 1.953 -2.630 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.706 2.316 -2.038 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -5.728 3.778 -1.769 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -6.781 3.663 -3.199 1.00 0.00 H new ATOM 824 N ALA A 63 -5.809 1.956 -5.538 1.00 0.00 N ATOM 825 CA ALA A 63 -6.330 1.097 -6.595 1.00 0.00 C ATOM 826 C ALA A 63 -5.338 -0.007 -6.943 1.00 0.00 C ATOM 827 O ALA A 63 -5.728 -1.096 -7.367 1.00 0.00 O ATOM 828 CB ALA A 63 -6.660 1.922 -7.830 1.00 0.00 C ATOM 0 H ALA A 63 -5.683 2.931 -5.810 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.244 0.627 -6.231 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.048 1.268 -8.611 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.411 2.671 -7.577 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.758 2.419 -8.187 1.00 0.00 H new ATOM 834 N LYS A 64 -4.052 0.280 -6.765 1.00 0.00 N ATOM 835 CA LYS A 64 -3.004 -0.689 -7.060 1.00 0.00 C ATOM 836 C LYS A 64 -2.949 -1.775 -5.989 1.00 0.00 C ATOM 837 O LYS A 64 -2.991 -2.966 -6.298 1.00 0.00 O ATOM 838 CB LYS A 64 -1.648 0.013 -7.161 1.00 0.00 C ATOM 839 CG LYS A 64 -0.745 -0.560 -8.240 1.00 0.00 C ATOM 840 CD LYS A 64 -0.526 -2.052 -8.052 1.00 0.00 C ATOM 841 CE LYS A 64 0.330 -2.635 -9.165 1.00 0.00 C ATOM 842 NZ LYS A 64 1.751 -2.198 -9.057 1.00 0.00 N ATOM 0 H LYS A 64 -3.711 1.177 -6.418 1.00 0.00 H new ATOM 0 HA LYS A 64 -3.236 -1.159 -8.016 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -1.811 1.072 -7.360 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.140 -0.056 -6.199 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.186 -0.377 -9.220 1.00 0.00 H new ATOM 0 HG3 LYS A 64 0.216 -0.046 -8.222 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.046 -2.232 -7.090 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -1.489 -2.562 -8.027 1.00 0.00 H new ATOM 0 HE2 LYS A 64 0.281 -3.723 -9.129 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -0.072 -2.329 -10.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.281 -2.532 -9.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.793 -1.160 -9.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 2.172 -2.597 -8.194 1.00 0.00 H new ATOM 852 N VAL A 65 -2.856 -1.355 -4.733 1.00 0.00 N ATOM 853 CA VAL A 65 -2.798 -2.292 -3.616 1.00 0.00 C ATOM 854 C VAL A 65 -4.111 -3.052 -3.467 1.00 0.00 C ATOM 855 O VAL A 65 -4.126 -4.206 -3.042 1.00 0.00 O ATOM 856 CB VAL A 65 -2.484 -1.568 -2.292 1.00 0.00 C ATOM 857 CG1 VAL A 65 -3.556 -0.535 -1.981 1.00 0.00 C ATOM 858 CG2 VAL A 65 -2.352 -2.572 -1.156 1.00 0.00 C ATOM 0 H VAL A 65 -2.819 -0.372 -4.462 1.00 0.00 H new ATOM 0 HA VAL A 65 -1.996 -2.997 -3.836 1.00 0.00 H new ATOM 0 HB VAL A 65 -1.533 -1.047 -2.398 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -3.317 -0.034 -1.043 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -3.597 0.200 -2.785 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -4.523 -1.030 -1.892 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.130 -2.045 -0.228 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -3.287 -3.122 -1.046 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.544 -3.269 -1.379 1.00 0.00 H new ATOM 868 N ASN A 66 -5.211 -2.397 -3.823 1.00 0.00 N ATOM 869 CA ASN A 66 -6.531 -3.011 -3.730 1.00 0.00 C ATOM 870 C ASN A 66 -6.698 -4.100 -4.785 1.00 0.00 C ATOM 871 O ASN A 66 -7.044 -5.240 -4.469 1.00 0.00 O ATOM 872 CB ASN A 66 -7.622 -1.952 -3.895 1.00 0.00 C ATOM 873 CG ASN A 66 -8.939 -2.546 -4.355 1.00 0.00 C ATOM 874 OD1 ASN A 66 -9.113 -2.655 -5.667 1.00 0.00 O flip ATOM 875 ND2 ASN A 66 -9.790 -2.904 -3.540 1.00 0.00 N flip ATOM 0 H ASN A 66 -5.215 -1.441 -4.179 1.00 0.00 H new ATOM 0 HA ASN A 66 -6.625 -3.467 -2.744 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -7.771 -1.437 -2.946 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -7.292 -1.204 -4.616 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -9.614 -2.802 -2.541 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -10.671 -3.303 -3.864 1.00 0.00 H new ATOM 881 N THR A 67 -6.453 -3.742 -6.042 1.00 0.00 N ATOM 882 CA THR A 67 -6.578 -4.687 -7.144 1.00 0.00 C ATOM 883 C THR A 67 -5.709 -5.918 -6.915 1.00 0.00 C ATOM 884 O THR A 67 -6.121 -7.043 -7.198 1.00 0.00 O ATOM 885 CB THR A 67 -6.188 -4.040 -8.486 1.00 0.00 C ATOM 886 OG1 THR A 67 -7.055 -2.935 -8.768 1.00 0.00 O ATOM 887 CG2 THR A 67 -6.266 -5.053 -9.618 1.00 0.00 C ATOM 0 H THR A 67 -6.167 -2.804 -6.322 1.00 0.00 H new ATOM 0 HA THR A 67 -7.625 -4.988 -7.184 1.00 0.00 H new ATOM 0 HB THR A 67 -5.161 -3.685 -8.407 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.746 -2.144 -8.280 1.00 0.00 H new ATOM 0 HG21 THR A 67 -5.986 -4.573 -10.556 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.584 -5.878 -9.415 1.00 0.00 H new ATOM 0 HG23 THR A 67 -7.284 -5.434 -9.695 1.00 0.00 H new ATOM 895 N LEU A 68 -4.504 -5.697 -6.400 1.00 0.00 N ATOM 896 CA LEU A 68 -3.574 -6.789 -6.131 1.00 0.00 C ATOM 897 C LEU A 68 -4.130 -7.726 -5.063 1.00 0.00 C ATOM 898 O LEU A 68 -3.926 -8.939 -5.120 1.00 0.00 O ATOM 899 CB LEU A 68 -2.221 -6.234 -5.685 1.00 0.00 C ATOM 900 CG LEU A 68 -1.410 -5.502 -6.755 1.00 0.00 C ATOM 901 CD1 LEU A 68 -0.374 -4.594 -6.111 1.00 0.00 C ATOM 902 CD2 LEU A 68 -0.742 -6.497 -7.693 1.00 0.00 C ATOM 0 H LEU A 68 -4.148 -4.772 -6.160 1.00 0.00 H new ATOM 0 HA LEU A 68 -3.441 -7.356 -7.052 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -2.388 -5.550 -4.853 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.620 -7.060 -5.304 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.091 -4.884 -7.340 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.194 -4.081 -6.888 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.876 -3.858 -5.483 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.304 -5.191 -5.501 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.169 -5.958 -8.448 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.074 -7.142 -7.123 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -1.504 -7.105 -8.181 1.00 0.00 H new ATOM 913 N LEU A 69 -4.835 -7.156 -4.093 1.00 0.00 N ATOM 914 CA LEU A 69 -5.422 -7.941 -3.012 1.00 0.00 C ATOM 915 C LEU A 69 -6.437 -8.942 -3.556 1.00 0.00 C ATOM 916 O LEU A 69 -6.431 -10.114 -3.179 1.00 0.00 O ATOM 917 CB LEU A 69 -6.094 -7.019 -1.993 1.00 0.00 C ATOM 918 CG LEU A 69 -5.346 -6.818 -0.675 1.00 0.00 C ATOM 919 CD1 LEU A 69 -5.946 -5.660 0.108 1.00 0.00 C ATOM 920 CD2 LEU A 69 -5.372 -8.094 0.154 1.00 0.00 C ATOM 0 H LEU A 69 -5.014 -6.154 -4.032 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.621 -8.494 -2.520 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.241 -6.044 -2.457 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.083 -7.418 -1.769 1.00 0.00 H new ATOM 0 HG LEU A 69 -4.307 -6.577 -0.902 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -5.401 -5.532 1.043 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -5.875 -4.746 -0.482 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.993 -5.871 0.325 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -4.835 -7.932 1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.405 -8.365 0.372 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -4.895 -8.900 -0.404 1.00 0.00 H new ATOM 931 N ASP A 70 -7.306 -8.472 -4.444 1.00 0.00 N ATOM 932 CA ASP A 70 -8.325 -9.327 -5.043 1.00 0.00 C ATOM 933 C ASP A 70 -7.687 -10.400 -5.920 1.00 0.00 C ATOM 934 O ASP A 70 -8.137 -11.546 -5.942 1.00 0.00 O ATOM 935 CB ASP A 70 -9.302 -8.489 -5.870 1.00 0.00 C ATOM 936 CG ASP A 70 -10.730 -8.984 -5.756 1.00 0.00 C ATOM 937 OD1 ASP A 70 -10.920 -10.179 -5.445 1.00 0.00 O ATOM 938 OD2 ASP A 70 -11.658 -8.178 -5.976 1.00 0.00 O ATOM 0 H ASP A 70 -7.326 -7.504 -4.765 1.00 0.00 H new ATOM 0 HA ASP A 70 -8.871 -9.819 -4.238 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -9.253 -7.451 -5.542 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -8.997 -8.507 -6.916 1.00 0.00 H new ATOM 942 N VAL A 71 -6.638 -10.021 -6.643 1.00 0.00 N ATOM 943 CA VAL A 71 -5.939 -10.950 -7.521 1.00 0.00 C ATOM 944 C VAL A 71 -5.243 -12.046 -6.720 1.00 0.00 C ATOM 945 O VAL A 71 -5.130 -13.183 -7.175 1.00 0.00 O ATOM 946 CB VAL A 71 -4.896 -10.224 -8.390 1.00 0.00 C ATOM 947 CG1 VAL A 71 -4.207 -11.203 -9.330 1.00 0.00 C ATOM 948 CG2 VAL A 71 -5.548 -9.093 -9.171 1.00 0.00 C ATOM 0 H VAL A 71 -6.254 -9.076 -6.637 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.691 -11.400 -8.169 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.139 -9.794 -7.734 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.474 -10.671 -9.936 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -3.705 -11.975 -8.747 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.949 -11.665 -9.981 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -4.796 -8.591 -9.780 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -6.326 -9.499 -9.817 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -5.989 -8.378 -8.476 1.00 0.00 H new ATOM 958 N ALA A 72 -4.779 -11.693 -5.526 1.00 0.00 N ATOM 959 CA ALA A 72 -4.096 -12.646 -4.660 1.00 0.00 C ATOM 960 C ALA A 72 -5.038 -13.763 -4.223 1.00 0.00 C ATOM 961 O ALA A 72 -4.686 -14.941 -4.279 1.00 0.00 O ATOM 962 CB ALA A 72 -3.516 -11.936 -3.446 1.00 0.00 C ATOM 0 H ALA A 72 -4.864 -10.754 -5.136 1.00 0.00 H new ATOM 0 HA ALA A 72 -3.281 -13.095 -5.227 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -3.009 -12.660 -2.809 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.803 -11.179 -3.773 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -4.320 -11.459 -2.885 1.00 0.00 H new ATOM 968 N GLN A 73 -6.234 -13.384 -3.786 1.00 0.00 N ATOM 969 CA GLN A 73 -7.226 -14.355 -3.338 1.00 0.00 C ATOM 970 C GLN A 73 -7.794 -15.137 -4.516 1.00 0.00 C ATOM 971 O GLN A 73 -8.113 -16.319 -4.395 1.00 0.00 O ATOM 972 CB GLN A 73 -8.356 -13.650 -2.585 1.00 0.00 C ATOM 973 CG GLN A 73 -7.868 -12.687 -1.515 1.00 0.00 C ATOM 974 CD GLN A 73 -8.994 -11.891 -0.887 1.00 0.00 C ATOM 975 OE1 GLN A 73 -9.382 -10.838 -1.393 1.00 0.00 O ATOM 976 NE2 GLN A 73 -9.527 -12.392 0.221 1.00 0.00 N ATOM 0 H GLN A 73 -6.540 -12.412 -3.732 1.00 0.00 H new ATOM 0 HA GLN A 73 -6.733 -15.057 -2.665 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.972 -13.104 -3.300 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.996 -14.401 -2.121 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.347 -13.247 -0.738 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.144 -12.000 -1.953 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.174 -13.268 0.606 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -10.289 -11.901 0.688 1.00 0.00 H new ATOM 983 N ALA A 74 -7.920 -14.468 -5.659 1.00 0.00 N ATOM 984 CA ALA A 74 -8.449 -15.101 -6.860 1.00 0.00 C ATOM 985 C ALA A 74 -7.435 -16.066 -7.464 1.00 0.00 C ATOM 986 O ALA A 74 -7.803 -17.091 -8.036 1.00 0.00 O ATOM 987 CB ALA A 74 -8.849 -14.046 -7.881 1.00 0.00 C ATOM 0 H ALA A 74 -7.663 -13.488 -5.777 1.00 0.00 H new ATOM 0 HA ALA A 74 -9.333 -15.673 -6.579 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.242 -14.534 -8.773 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.615 -13.398 -7.454 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -7.977 -13.449 -8.148 1.00 0.00 H new ATOM 993 N ASN A 75 -6.156 -15.731 -7.334 1.00 0.00 N ATOM 994 CA ASN A 75 -5.087 -16.568 -7.868 1.00 0.00 C ATOM 995 C ASN A 75 -4.861 -17.791 -6.985 1.00 0.00 C ATOM 996 O ASN A 75 -4.605 -18.889 -7.480 1.00 0.00 O ATOM 997 CB ASN A 75 -3.791 -15.763 -7.985 1.00 0.00 C ATOM 998 CG ASN A 75 -3.680 -15.037 -9.312 1.00 0.00 C ATOM 999 OD1 ASN A 75 -4.715 -14.283 -9.662 1.00 0.00 O flip ATOM 1000 ND2 ASN A 75 -2.674 -15.153 -10.013 1.00 0.00 N flip ATOM 0 H ASN A 75 -5.834 -14.885 -6.863 1.00 0.00 H new ATOM 0 HA ASN A 75 -5.387 -16.908 -8.859 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -3.742 -15.038 -7.172 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -2.939 -16.432 -7.868 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -1.902 -15.744 -9.704 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.613 -14.658 -10.903 1.00 0.00 H new ATOM 1006 N LEU A 76 -4.959 -17.595 -5.675 1.00 0.00 N ATOM 1007 CA LEU A 76 -4.766 -18.682 -4.721 1.00 0.00 C ATOM 1008 C LEU A 76 -5.979 -19.607 -4.699 1.00 0.00 C ATOM 1009 O LEU A 76 -5.849 -20.812 -4.487 1.00 0.00 O ATOM 1010 CB LEU A 76 -4.513 -18.120 -3.321 1.00 0.00 C ATOM 1011 CG LEU A 76 -3.208 -17.345 -3.136 1.00 0.00 C ATOM 1012 CD1 LEU A 76 -3.196 -16.634 -1.792 1.00 0.00 C ATOM 1013 CD2 LEU A 76 -2.012 -18.277 -3.258 1.00 0.00 C ATOM 0 H LEU A 76 -5.171 -16.693 -5.249 1.00 0.00 H new ATOM 0 HA LEU A 76 -3.897 -19.259 -5.036 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -5.343 -17.463 -3.059 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.525 -18.947 -2.611 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.140 -16.594 -3.923 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.260 -16.088 -1.678 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -4.032 -15.936 -1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -3.288 -17.368 -0.991 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.092 -17.708 -3.124 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -2.075 -19.051 -2.493 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -2.011 -18.740 -4.245 1.00 0.00 H new ATOM 1024 N GLY A 77 -7.158 -19.035 -4.920 1.00 0.00 N ATOM 1025 CA GLY A 77 -8.377 -19.823 -4.922 1.00 0.00 C ATOM 1026 C GLY A 77 -8.908 -20.074 -3.524 1.00 0.00 C ATOM 1027 O GLY A 77 -10.059 -19.759 -3.225 1.00 0.00 O ATOM 0 H GLY A 77 -7.291 -18.039 -5.098 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -9.138 -19.308 -5.509 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -8.188 -20.778 -5.412 1.00 0.00 H new ATOM 1031 N GLU A 78 -8.066 -20.645 -2.667 1.00 0.00 N ATOM 1032 CA GLU A 78 -8.460 -20.940 -1.294 1.00 0.00 C ATOM 1033 C GLU A 78 -9.042 -19.703 -0.618 1.00 0.00 C ATOM 1034 O GLU A 78 -10.126 -19.753 -0.036 1.00 0.00 O ATOM 1035 CB GLU A 78 -7.260 -21.454 -0.496 1.00 0.00 C ATOM 1036 CG GLU A 78 -7.640 -22.399 0.632 1.00 0.00 C ATOM 1037 CD GLU A 78 -7.690 -23.847 0.187 1.00 0.00 C ATOM 1038 OE1 GLU A 78 -6.643 -24.525 0.249 1.00 0.00 O ATOM 1039 OE2 GLU A 78 -8.778 -24.304 -0.222 1.00 0.00 O ATOM 0 H GLU A 78 -7.109 -20.912 -2.899 1.00 0.00 H new ATOM 0 HA GLU A 78 -9.228 -21.713 -1.321 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.576 -21.966 -1.173 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -6.720 -20.604 -0.080 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -6.921 -22.297 1.444 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.613 -22.111 1.030 1.00 0.00 H new ATOM 1044 N ALA A 79 -8.315 -18.593 -0.698 1.00 0.00 N ATOM 1045 CA ALA A 79 -8.759 -17.343 -0.095 1.00 0.00 C ATOM 1046 C ALA A 79 -10.149 -16.958 -0.589 1.00 0.00 C ATOM 1047 O ALA A 79 -11.124 -17.015 0.160 1.00 0.00 O ATOM 1048 CB ALA A 79 -7.764 -16.231 -0.391 1.00 0.00 C ATOM 0 H ALA A 79 -7.415 -18.535 -1.175 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.813 -17.488 0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -8.109 -15.303 0.066 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -6.789 -16.497 0.018 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -7.680 -16.095 -1.469 1.00 0.00 H new ATOM 1054 N ALA A 80 -10.233 -16.566 -1.856 1.00 0.00 N ATOM 1055 CA ALA A 80 -11.505 -16.173 -2.452 1.00 0.00 C ATOM 1056 C ALA A 80 -11.828 -17.029 -3.672 1.00 0.00 C ATOM 1057 O ALA A 80 -10.929 -17.541 -4.338 1.00 0.00 O ATOM 1058 CB ALA A 80 -11.477 -14.699 -2.831 1.00 0.00 C ATOM 0 H ALA A 80 -9.436 -16.512 -2.490 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.289 -16.332 -1.712 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -12.432 -14.419 -3.275 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -11.301 -14.097 -1.939 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -10.678 -14.524 -3.551 1.00 0.00 H new ATOM 1064 N GLY A 81 -13.117 -17.182 -3.957 1.00 0.00 N ATOM 1065 CA GLY A 81 -13.535 -17.977 -5.097 1.00 0.00 C ATOM 1066 C GLY A 81 -14.721 -17.373 -5.823 1.00 0.00 C ATOM 1067 O GLY A 81 -15.868 -17.745 -5.573 1.00 0.00 O ATOM 0 H GLY A 81 -13.879 -16.770 -3.419 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.701 -18.077 -5.791 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.792 -18.981 -4.761 1.00 0.00 H new ATOM 1071 N THR A 82 -14.447 -16.435 -6.724 1.00 0.00 N ATOM 1072 CA THR A 82 -15.499 -15.776 -7.486 1.00 0.00 C ATOM 1073 C THR A 82 -14.971 -15.254 -8.818 1.00 0.00 C ATOM 1074 O THR A 82 -13.764 -15.266 -9.064 1.00 0.00 O ATOM 1075 CB THR A 82 -16.114 -14.605 -6.697 1.00 0.00 C ATOM 1076 OG1 THR A 82 -17.280 -14.119 -7.371 1.00 0.00 O ATOM 1077 CG2 THR A 82 -15.109 -13.475 -6.534 1.00 0.00 C ATOM 0 H THR A 82 -13.504 -16.115 -6.944 1.00 0.00 H new ATOM 0 HA THR A 82 -16.269 -16.524 -7.672 1.00 0.00 H new ATOM 0 HB THR A 82 -16.392 -14.969 -5.708 1.00 0.00 H new ATOM 0 HG1 THR A 82 -17.666 -13.376 -6.862 1.00 0.00 H new ATOM 0 HG21 THR A 82 -15.566 -12.659 -5.974 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.235 -13.840 -5.995 1.00 0.00 H new ATOM 0 HG23 THR A 82 -14.805 -13.114 -7.516 1.00 0.00 H new ATOM 1085 N TYR A 83 -15.879 -14.796 -9.671 1.00 0.00 N ATOM 1086 CA TYR A 83 -15.504 -14.272 -10.978 1.00 0.00 C ATOM 1087 C TYR A 83 -16.234 -12.966 -11.272 1.00 0.00 C ATOM 1088 O TYR A 83 -17.200 -12.615 -10.594 1.00 0.00 O ATOM 1089 CB TYR A 83 -15.812 -15.298 -12.070 1.00 0.00 C ATOM 1090 CG TYR A 83 -17.239 -15.244 -12.567 1.00 0.00 C ATOM 1091 CD1 TYR A 83 -17.600 -14.403 -13.613 1.00 0.00 C ATOM 1092 CD2 TYR A 83 -18.226 -16.034 -11.991 1.00 0.00 C ATOM 1093 CE1 TYR A 83 -18.903 -14.349 -14.069 1.00 0.00 C ATOM 1094 CE2 TYR A 83 -19.531 -15.988 -12.442 1.00 0.00 C ATOM 1095 CZ TYR A 83 -19.864 -15.143 -13.481 1.00 0.00 C ATOM 1096 OH TYR A 83 -21.164 -15.094 -13.934 1.00 0.00 O ATOM 0 H TYR A 83 -16.881 -14.777 -9.481 1.00 0.00 H new ATOM 0 HA TYR A 83 -14.432 -14.073 -10.967 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -15.137 -15.135 -12.910 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -15.608 -16.297 -11.686 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -16.849 -13.781 -14.077 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -17.969 -16.695 -11.177 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -19.167 -13.688 -14.882 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -20.286 -16.610 -11.984 1.00 0.00 H new ATOM 0 HH TYR A 83 -21.715 -15.715 -13.414 1.00 0.00 H new ATOM 1105 N VAL A 84 -15.766 -12.248 -12.288 1.00 0.00 N ATOM 1106 CA VAL A 84 -16.375 -10.981 -12.674 1.00 0.00 C ATOM 1107 C VAL A 84 -16.348 -10.797 -14.188 1.00 0.00 C ATOM 1108 O VAL A 84 -15.511 -10.067 -14.720 1.00 0.00 O ATOM 1109 CB VAL A 84 -15.660 -9.789 -12.011 1.00 0.00 C ATOM 1110 CG1 VAL A 84 -16.331 -8.481 -12.397 1.00 0.00 C ATOM 1111 CG2 VAL A 84 -15.632 -9.960 -10.499 1.00 0.00 C ATOM 0 H VAL A 84 -14.967 -12.523 -12.859 1.00 0.00 H new ATOM 0 HA VAL A 84 -17.410 -11.010 -12.332 1.00 0.00 H new ATOM 0 HB VAL A 84 -14.631 -9.759 -12.369 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -15.812 -7.651 -11.919 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -16.293 -8.358 -13.479 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -17.371 -8.495 -12.070 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -15.123 -9.109 -10.046 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -16.653 -10.016 -10.120 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.100 -10.877 -10.246 1.00 0.00 H new ATOM 1121 N ALA A 85 -17.270 -11.462 -14.876 1.00 0.00 N ATOM 1122 CA ALA A 85 -17.354 -11.370 -16.328 1.00 0.00 C ATOM 1123 C ALA A 85 -17.957 -10.038 -16.759 1.00 0.00 C ATOM 1124 O ALA A 85 -19.069 -9.991 -17.285 1.00 0.00 O ATOM 1125 CB ALA A 85 -18.171 -12.527 -16.884 1.00 0.00 C ATOM 0 H ALA A 85 -17.970 -12.071 -14.451 1.00 0.00 H new ATOM 0 HA ALA A 85 -16.343 -11.428 -16.730 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -18.225 -12.445 -17.970 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -17.696 -13.470 -16.614 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -19.178 -12.495 -16.467 1.00 0.00 H new ATOM 1131 N ALA A 86 -17.217 -8.958 -16.535 1.00 0.00 N ATOM 1132 CA ALA A 86 -17.680 -7.625 -16.901 1.00 0.00 C ATOM 1133 C ALA A 86 -16.928 -7.099 -18.120 1.00 0.00 C ATOM 1134 O ALA A 86 -17.482 -6.352 -18.927 1.00 0.00 O ATOM 1135 CB ALA A 86 -17.519 -6.669 -15.728 1.00 0.00 C ATOM 0 H ALA A 86 -16.294 -8.980 -16.102 1.00 0.00 H new ATOM 0 HA ALA A 86 -18.737 -7.693 -17.158 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -17.869 -5.678 -16.016 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -18.105 -7.029 -14.882 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -16.468 -6.615 -15.444 1.00 0.00 H new ATOM 1141 N ASP A 87 -15.667 -7.494 -18.247 1.00 0.00 N ATOM 1142 CA ASP A 87 -14.840 -7.064 -19.369 1.00 0.00 C ATOM 1143 C ASP A 87 -14.688 -5.546 -19.381 1.00 0.00 C ATOM 1144 O ASP A 87 -15.305 -4.844 -18.579 1.00 0.00 O ATOM 1145 CB ASP A 87 -15.448 -7.538 -20.690 1.00 0.00 C ATOM 1146 CG ASP A 87 -14.467 -8.335 -21.526 1.00 0.00 C ATOM 1147 OD1 ASP A 87 -13.707 -9.137 -20.945 1.00 0.00 O ATOM 1148 OD2 ASP A 87 -14.458 -8.156 -22.763 1.00 0.00 O ATOM 0 H ASP A 87 -15.194 -8.111 -17.587 1.00 0.00 H new ATOM 0 HA ASP A 87 -13.852 -7.510 -19.252 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -16.326 -8.150 -20.484 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -15.789 -6.674 -21.260 1.00 0.00 H new ATOM 1152 N ALA A 88 -13.861 -5.046 -20.293 1.00 0.00 N ATOM 1153 CA ALA A 88 -13.629 -3.612 -20.410 1.00 0.00 C ATOM 1154 C ALA A 88 -13.912 -3.122 -21.826 1.00 0.00 C ATOM 1155 O ALA A 88 -14.127 -3.922 -22.737 1.00 0.00 O ATOM 1156 CB ALA A 88 -12.201 -3.275 -20.009 1.00 0.00 C ATOM 0 H ALA A 88 -13.340 -5.613 -20.962 1.00 0.00 H new ATOM 0 HA ALA A 88 -14.316 -3.102 -19.734 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -12.041 -2.201 -20.101 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -12.031 -3.580 -18.976 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -11.506 -3.803 -20.662 1.00 0.00 H new ATOM 1162 N ALA A 89 -13.912 -1.805 -22.003 1.00 0.00 N ATOM 1163 CA ALA A 89 -14.168 -1.210 -23.309 1.00 0.00 C ATOM 1164 C ALA A 89 -12.876 -1.055 -24.104 1.00 0.00 C ATOM 1165 O ALA A 89 -12.842 -1.312 -25.306 1.00 0.00 O ATOM 1166 CB ALA A 89 -14.857 0.137 -23.149 1.00 0.00 C ATOM 0 H ALA A 89 -13.738 -1.130 -21.259 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.827 -1.879 -23.863 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -15.042 0.570 -24.132 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -15.805 0.001 -22.628 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -14.218 0.806 -22.572 1.00 0.00 H new ATOM 1172 N ALA A 90 -11.816 -0.632 -23.423 1.00 0.00 N ATOM 1173 CA ALA A 90 -10.521 -0.443 -24.067 1.00 0.00 C ATOM 1174 C ALA A 90 -10.044 -1.731 -24.729 1.00 0.00 C ATOM 1175 O ALA A 90 -9.297 -1.698 -25.705 1.00 0.00 O ATOM 1176 CB ALA A 90 -9.495 0.044 -23.055 1.00 0.00 C ATOM 0 H ALA A 90 -11.828 -0.414 -22.427 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.636 0.313 -24.844 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -8.533 0.181 -23.549 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.824 0.993 -22.632 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.392 -0.693 -22.258 1.00 0.00 H new ATOM 1182 N ALA A 91 -10.482 -2.865 -24.190 1.00 0.00 N ATOM 1183 CA ALA A 91 -10.101 -4.164 -24.730 1.00 0.00 C ATOM 1184 C ALA A 91 -10.668 -4.364 -26.132 1.00 0.00 C ATOM 1185 O ALA A 91 -9.990 -4.883 -27.018 1.00 0.00 O ATOM 1186 CB ALA A 91 -10.569 -5.278 -23.805 1.00 0.00 C ATOM 0 H ALA A 91 -11.101 -2.910 -23.380 1.00 0.00 H new ATOM 0 HA ALA A 91 -9.014 -4.196 -24.799 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -10.278 -6.243 -24.221 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -10.111 -5.153 -22.824 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -11.654 -5.238 -23.707 1.00 0.00 H new ATOM 1192 N SER A 92 -11.917 -3.951 -26.324 1.00 0.00 N ATOM 1193 CA SER A 92 -12.577 -4.089 -27.617 1.00 0.00 C ATOM 1194 C SER A 92 -12.189 -2.947 -28.550 1.00 0.00 C ATOM 1195 O SER A 92 -12.749 -1.852 -28.478 1.00 0.00 O ATOM 1196 CB SER A 92 -14.096 -4.122 -27.437 1.00 0.00 C ATOM 1197 OG SER A 92 -14.454 -4.800 -26.244 1.00 0.00 O ATOM 0 H SER A 92 -12.492 -3.518 -25.601 1.00 0.00 H new ATOM 0 HA SER A 92 -12.251 -5.028 -28.065 1.00 0.00 H new ATOM 0 HB2 SER A 92 -14.484 -3.104 -27.411 1.00 0.00 H new ATOM 0 HB3 SER A 92 -14.556 -4.617 -28.292 1.00 0.00 H new ATOM 0 HG SER A 92 -15.430 -4.806 -26.151 1.00 0.00 H new ATOM 1202 N THR A 93 -11.226 -3.209 -29.428 1.00 0.00 N ATOM 1203 CA THR A 93 -10.760 -2.204 -30.375 1.00 0.00 C ATOM 1204 C THR A 93 -10.275 -2.850 -31.668 1.00 0.00 C ATOM 1205 O THR A 93 -10.102 -4.068 -31.737 1.00 0.00 O ATOM 1206 CB THR A 93 -9.622 -1.355 -29.780 1.00 0.00 C ATOM 1207 OG1 THR A 93 -9.190 -1.917 -28.535 1.00 0.00 O ATOM 1208 CG2 THR A 93 -10.074 0.081 -29.564 1.00 0.00 C ATOM 0 H THR A 93 -10.753 -4.110 -29.503 1.00 0.00 H new ATOM 0 HA THR A 93 -11.610 -1.557 -30.592 1.00 0.00 H new ATOM 0 HB THR A 93 -8.791 -1.355 -30.486 1.00 0.00 H new ATOM 0 HG1 THR A 93 -9.570 -1.401 -27.794 1.00 0.00 H new ATOM 0 HG21 THR A 93 -9.253 0.661 -29.143 1.00 0.00 H new ATOM 0 HG22 THR A 93 -10.374 0.515 -30.518 1.00 0.00 H new ATOM 0 HG23 THR A 93 -10.920 0.097 -28.876 1.00 0.00 H new ATOM 1216 N TYR A 94 -10.056 -2.029 -32.688 1.00 0.00 N ATOM 1217 CA TYR A 94 -9.590 -2.521 -33.980 1.00 0.00 C ATOM 1218 C TYR A 94 -8.356 -1.755 -34.443 1.00 0.00 C ATOM 1219 O TYR A 94 -8.258 -0.540 -34.260 1.00 0.00 O ATOM 1220 CB TYR A 94 -10.701 -2.399 -35.024 1.00 0.00 C ATOM 1221 CG TYR A 94 -11.023 -0.972 -35.404 1.00 0.00 C ATOM 1222 CD1 TYR A 94 -11.968 -0.241 -34.694 1.00 0.00 C ATOM 1223 CD2 TYR A 94 -10.383 -0.353 -36.470 1.00 0.00 C ATOM 1224 CE1 TYR A 94 -12.266 1.064 -35.037 1.00 0.00 C ATOM 1225 CE2 TYR A 94 -10.673 0.951 -36.818 1.00 0.00 C ATOM 1226 CZ TYR A 94 -11.616 1.656 -36.099 1.00 0.00 C ATOM 1227 OH TYR A 94 -11.910 2.955 -36.444 1.00 0.00 O ATOM 0 H TYR A 94 -10.193 -1.019 -32.646 1.00 0.00 H new ATOM 0 HA TYR A 94 -9.320 -3.571 -33.865 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -10.408 -2.947 -35.920 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -11.603 -2.876 -34.640 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -12.478 -0.701 -33.860 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -9.645 -0.902 -37.037 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -13.004 1.617 -34.476 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -10.164 1.417 -37.649 1.00 0.00 H new ATOM 0 HH TYR A 94 -11.364 3.221 -37.213 1.00 0.00 H new ATOM 1236 N THR A 95 -7.412 -2.473 -35.044 1.00 0.00 N ATOM 1237 CA THR A 95 -6.182 -1.863 -35.534 1.00 0.00 C ATOM 1238 C THR A 95 -6.124 -1.889 -37.056 1.00 0.00 C ATOM 1239 O THR A 95 -6.810 -2.681 -37.700 1.00 0.00 O ATOM 1240 CB THR A 95 -4.939 -2.578 -34.971 1.00 0.00 C ATOM 1241 OG1 THR A 95 -5.298 -3.876 -34.483 1.00 0.00 O ATOM 1242 CG2 THR A 95 -4.308 -1.766 -33.851 1.00 0.00 C ATOM 0 H THR A 95 -7.476 -3.478 -35.203 1.00 0.00 H new ATOM 0 HA THR A 95 -6.183 -0.828 -35.192 1.00 0.00 H new ATOM 0 HB THR A 95 -4.212 -2.682 -35.776 1.00 0.00 H new ATOM 0 HG1 THR A 95 -4.502 -4.324 -34.129 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.432 -2.291 -33.470 1.00 0.00 H new ATOM 0 HG22 THR A 95 -4.008 -0.790 -34.233 1.00 0.00 H new ATOM 0 HG23 THR A 95 -5.031 -1.633 -33.046 1.00 0.00 H new ATOM 1250 N GLY A 96 -5.299 -1.016 -37.627 1.00 0.00 N ATOM 1251 CA GLY A 96 -5.167 -0.956 -39.071 1.00 0.00 C ATOM 1252 C GLY A 96 -5.191 0.466 -39.596 1.00 0.00 C ATOM 1253 O GLY A 96 -6.260 1.046 -39.788 1.00 0.00 O ATOM 0 H GLY A 96 -4.720 -0.350 -37.116 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.233 -1.434 -39.368 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.976 -1.524 -39.531 1.00 0.00 H new ATOM 1257 N PHE A 97 -4.011 1.030 -39.829 1.00 0.00 N ATOM 1258 CA PHE A 97 -3.901 2.394 -40.333 1.00 0.00 C ATOM 1259 C PHE A 97 -2.460 2.720 -40.711 1.00 0.00 C ATOM 1260 O PHE A 97 -1.623 1.817 -40.735 1.00 0.00 O ATOM 1261 CB PHE A 97 -4.402 3.389 -39.284 1.00 0.00 C ATOM 1262 CG PHE A 97 -4.631 4.770 -39.830 1.00 0.00 C ATOM 1263 CD1 PHE A 97 -3.562 5.611 -40.092 1.00 0.00 C ATOM 1264 CD2 PHE A 97 -5.915 5.227 -40.079 1.00 0.00 C ATOM 1265 CE1 PHE A 97 -3.768 6.883 -40.595 1.00 0.00 C ATOM 1266 CE2 PHE A 97 -6.128 6.497 -40.582 1.00 0.00 C ATOM 1267 CZ PHE A 97 -5.053 7.326 -40.839 1.00 0.00 C ATOM 0 H PHE A 97 -3.117 0.564 -39.677 1.00 0.00 H new ATOM 0 HA PHE A 97 -4.520 2.475 -41.227 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.333 3.017 -38.857 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -3.678 3.444 -38.471 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.555 5.269 -39.901 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -6.759 4.584 -39.878 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -2.926 7.528 -40.796 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -7.134 6.841 -40.774 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.217 8.319 -41.230 1.00 0.00 H new TER 1276 PHE A 97 ATOM 1277 N SER B 601 -0.033 32.853 -10.193 1.00 0.00 N ATOM 1278 CA SER B 601 0.296 32.378 -8.854 1.00 0.00 C ATOM 1279 C SER B 601 -0.778 32.792 -7.852 1.00 0.00 C ATOM 1280 O SER B 601 -1.123 33.968 -7.745 1.00 0.00 O ATOM 1281 CB SER B 601 1.656 32.925 -8.415 1.00 0.00 C ATOM 1282 OG SER B 601 2.635 31.902 -8.396 1.00 0.00 O ATOM 0 HA SER B 601 0.342 31.289 -8.883 1.00 0.00 H new ATOM 0 HB2 SER B 601 1.968 33.719 -9.093 1.00 0.00 H new ATOM 0 HB3 SER B 601 1.570 33.369 -7.423 1.00 0.00 H new ATOM 0 HG SER B 601 3.495 32.278 -8.114 1.00 0.00 H new ATOM 1287 N MET B 602 -1.303 31.814 -7.119 1.00 0.00 N ATOM 1288 CA MET B 602 -2.337 32.076 -6.125 1.00 0.00 C ATOM 1289 C MET B 602 -1.721 32.530 -4.806 1.00 0.00 C ATOM 1290 O MET B 602 -1.710 31.785 -3.826 1.00 0.00 O ATOM 1291 CB MET B 602 -3.186 30.823 -5.900 1.00 0.00 C ATOM 1292 CG MET B 602 -4.423 30.761 -6.782 1.00 0.00 C ATOM 1293 SD MET B 602 -4.515 29.238 -7.743 1.00 0.00 S ATOM 1294 CE MET B 602 -4.428 28.011 -6.442 1.00 0.00 C ATOM 0 H MET B 602 -1.029 30.834 -7.195 1.00 0.00 H new ATOM 0 HA MET B 602 -2.974 32.876 -6.502 1.00 0.00 H new ATOM 0 HB2 MET B 602 -2.573 29.941 -6.085 1.00 0.00 H new ATOM 0 HB3 MET B 602 -3.493 30.785 -4.855 1.00 0.00 H new ATOM 0 HG2 MET B 602 -5.313 30.847 -6.159 1.00 0.00 H new ATOM 0 HG3 MET B 602 -4.424 31.615 -7.460 1.00 0.00 H new ATOM 0 HE1 MET B 602 -4.962 27.113 -6.753 1.00 0.00 H new ATOM 0 HE2 MET B 602 -3.385 27.763 -6.245 1.00 0.00 H new ATOM 0 HE3 MET B 602 -4.884 28.409 -5.535 1.00 0.00 H new ATOM 1302 N SER B 603 -1.207 33.756 -4.789 1.00 0.00 N ATOM 1303 CA SER B 603 -0.585 34.307 -3.591 1.00 0.00 C ATOM 1304 C SER B 603 -1.365 35.514 -3.080 1.00 0.00 C ATOM 1305 O SER B 603 -1.305 35.849 -1.897 1.00 0.00 O ATOM 1306 CB SER B 603 0.863 34.707 -3.882 1.00 0.00 C ATOM 1307 OG SER B 603 0.921 35.920 -4.613 1.00 0.00 O ATOM 0 H SER B 603 -1.209 34.386 -5.591 1.00 0.00 H new ATOM 0 HA SER B 603 -0.594 33.537 -2.819 1.00 0.00 H new ATOM 0 HB2 SER B 603 1.408 34.817 -2.945 1.00 0.00 H new ATOM 0 HB3 SER B 603 1.356 33.915 -4.446 1.00 0.00 H new ATOM 0 HG SER B 603 1.857 36.154 -4.784 1.00 0.00 H new ATOM 1312 N GLN B 604 -2.097 36.163 -3.980 1.00 0.00 N ATOM 1313 CA GLN B 604 -2.889 37.332 -3.621 1.00 0.00 C ATOM 1314 C GLN B 604 -4.294 36.926 -3.187 1.00 0.00 C ATOM 1315 O GLN B 604 -5.176 37.772 -3.036 1.00 0.00 O ATOM 1316 CB GLN B 604 -2.967 38.303 -4.800 1.00 0.00 C ATOM 1317 CG GLN B 604 -3.767 37.767 -5.978 1.00 0.00 C ATOM 1318 CD GLN B 604 -3.008 37.857 -7.287 1.00 0.00 C ATOM 1319 OE1 GLN B 604 -1.959 37.235 -7.453 1.00 0.00 O ATOM 1320 NE2 GLN B 604 -3.536 38.634 -8.226 1.00 0.00 N ATOM 0 H GLN B 604 -2.158 35.898 -4.963 1.00 0.00 H new ATOM 0 HA GLN B 604 -2.399 37.828 -2.783 1.00 0.00 H new ATOM 0 HB2 GLN B 604 -3.416 39.237 -4.462 1.00 0.00 H new ATOM 0 HB3 GLN B 604 -1.956 38.538 -5.134 1.00 0.00 H new ATOM 0 HG2 GLN B 604 -4.034 36.728 -5.788 1.00 0.00 H new ATOM 0 HG3 GLN B 604 -4.699 38.325 -6.064 1.00 0.00 H new ATOM 0 HE21 GLN B 604 -4.408 39.132 -8.045 1.00 0.00 H new ATOM 0 HE22 GLN B 604 -3.070 38.733 -9.128 1.00 0.00 H new ATOM 1327 N ILE B 605 -4.495 35.628 -2.989 1.00 0.00 N ATOM 1328 CA ILE B 605 -5.792 35.111 -2.573 1.00 0.00 C ATOM 1329 C ILE B 605 -6.014 35.322 -1.079 1.00 0.00 C ATOM 1330 O ILE B 605 -6.851 36.129 -0.673 1.00 0.00 O ATOM 1331 CB ILE B 605 -5.930 33.611 -2.894 1.00 0.00 C ATOM 1332 CG1 ILE B 605 -5.514 33.336 -4.340 1.00 0.00 C ATOM 1333 CG2 ILE B 605 -7.358 33.146 -2.650 1.00 0.00 C ATOM 1334 CD1 ILE B 605 -6.291 34.144 -5.356 1.00 0.00 C ATOM 0 H ILE B 605 -3.776 34.915 -3.110 1.00 0.00 H new ATOM 0 HA ILE B 605 -6.546 35.665 -3.132 1.00 0.00 H new ATOM 0 HB ILE B 605 -5.269 33.051 -2.233 1.00 0.00 H new ATOM 0 HG12 ILE B 605 -4.452 33.552 -4.451 1.00 0.00 H new ATOM 0 HG13 ILE B 605 -5.647 32.275 -4.553 1.00 0.00 H new ATOM 0 HG21 ILE B 605 -7.439 32.084 -2.881 1.00 0.00 H new ATOM 0 HG22 ILE B 605 -7.621 33.311 -1.605 1.00 0.00 H new ATOM 0 HG23 ILE B 605 -8.038 33.710 -3.289 1.00 0.00 H new ATOM 0 HD11 ILE B 605 -5.943 33.898 -6.359 1.00 0.00 H new ATOM 0 HD12 ILE B 605 -7.352 33.910 -5.272 1.00 0.00 H new ATOM 0 HD13 ILE B 605 -6.138 35.207 -5.169 1.00 0.00 H new ATOM 1345 N MET B 606 -5.257 34.594 -0.265 1.00 0.00 N ATOM 1346 CA MET B 606 -5.368 34.704 1.185 1.00 0.00 C ATOM 1347 C MET B 606 -4.133 34.130 1.871 1.00 0.00 C ATOM 1348 O MET B 606 -4.242 33.321 2.793 1.00 0.00 O ATOM 1349 CB MET B 606 -6.623 33.978 1.678 1.00 0.00 C ATOM 1350 CG MET B 606 -6.658 32.505 1.306 1.00 0.00 C ATOM 1351 SD MET B 606 -7.909 31.587 2.224 1.00 0.00 S ATOM 1352 CE MET B 606 -9.337 32.644 2.001 1.00 0.00 C ATOM 0 H MET B 606 -4.560 33.921 -0.585 1.00 0.00 H new ATOM 0 HA MET B 606 -5.444 35.761 1.439 1.00 0.00 H new ATOM 0 HB2 MET B 606 -6.685 34.072 2.762 1.00 0.00 H new ATOM 0 HB3 MET B 606 -7.503 34.470 1.264 1.00 0.00 H new ATOM 0 HG2 MET B 606 -6.853 32.408 0.238 1.00 0.00 H new ATOM 0 HG3 MET B 606 -5.679 32.064 1.493 1.00 0.00 H new ATOM 0 HE1 MET B 606 -10.243 32.087 2.239 1.00 0.00 H new ATOM 0 HE2 MET B 606 -9.258 33.507 2.662 1.00 0.00 H new ATOM 0 HE3 MET B 606 -9.381 32.983 0.966 1.00 0.00 H new ATOM 1360 N TYR B 607 -2.959 34.553 1.415 1.00 0.00 N ATOM 1361 CA TYR B 607 -1.703 34.078 1.983 1.00 0.00 C ATOM 1362 C TYR B 607 -0.858 35.245 2.487 1.00 0.00 C ATOM 1363 O TYR B 607 0.239 35.491 1.989 1.00 0.00 O ATOM 1364 CB TYR B 607 -0.918 33.278 0.941 1.00 0.00 C ATOM 1365 CG TYR B 607 -1.700 32.130 0.346 1.00 0.00 C ATOM 1366 CD1 TYR B 607 -2.634 32.347 -0.660 1.00 0.00 C ATOM 1367 CD2 TYR B 607 -1.502 30.827 0.787 1.00 0.00 C ATOM 1368 CE1 TYR B 607 -3.350 31.299 -1.207 1.00 0.00 C ATOM 1369 CE2 TYR B 607 -2.214 29.774 0.245 1.00 0.00 C ATOM 1370 CZ TYR B 607 -3.136 30.016 -0.751 1.00 0.00 C ATOM 1371 OH TYR B 607 -3.847 28.970 -1.294 1.00 0.00 O ATOM 0 H TYR B 607 -2.851 35.224 0.654 1.00 0.00 H new ATOM 0 HA TYR B 607 -1.937 33.430 2.828 1.00 0.00 H new ATOM 0 HB2 TYR B 607 -0.606 33.948 0.140 1.00 0.00 H new ATOM 0 HB3 TYR B 607 -0.011 32.888 1.402 1.00 0.00 H new ATOM 0 HD1 TYR B 607 -2.803 33.351 -1.020 1.00 0.00 H new ATOM 0 HD2 TYR B 607 -0.780 30.634 1.566 1.00 0.00 H new ATOM 0 HE1 TYR B 607 -4.073 31.484 -1.987 1.00 0.00 H new ATOM 0 HE2 TYR B 607 -2.049 28.767 0.600 1.00 0.00 H new ATOM 0 HH TYR B 607 -3.577 28.132 -0.863 1.00 0.00 H new ATOM 1380 N ASN B 608 -1.379 35.958 3.480 1.00 0.00 N ATOM 1381 CA ASN B 608 -0.674 37.099 4.053 1.00 0.00 C ATOM 1382 C ASN B 608 0.704 36.687 4.563 1.00 0.00 C ATOM 1383 O ASN B 608 1.689 37.397 4.361 1.00 0.00 O ATOM 1384 CB ASN B 608 -1.491 37.708 5.195 1.00 0.00 C ATOM 1385 CG ASN B 608 -1.293 39.207 5.311 1.00 0.00 C ATOM 1386 OD1 ASN B 608 -0.396 39.674 6.011 1.00 0.00 O ATOM 1387 ND2 ASN B 608 -2.135 39.970 4.622 1.00 0.00 N ATOM 0 H ASN B 608 -2.286 35.766 3.905 1.00 0.00 H new ATOM 0 HA ASN B 608 -0.544 37.845 3.269 1.00 0.00 H new ATOM 0 HB2 ASN B 608 -2.548 37.495 5.036 1.00 0.00 H new ATOM 0 HB3 ASN B 608 -1.208 37.233 6.134 1.00 0.00 H new ATOM 0 HD21 ASN B 608 -2.052 40.986 4.661 1.00 0.00 H new ATOM 0 HD22 ASN B 608 -2.865 39.540 4.054 1.00 0.00 H new ATOM 1393 N TYR B 609 0.764 35.536 5.224 1.00 0.00 N ATOM 1394 CA TYR B 609 2.020 35.030 5.764 1.00 0.00 C ATOM 1395 C TYR B 609 2.238 33.573 5.364 1.00 0.00 C ATOM 1396 O TYR B 609 1.306 32.859 4.993 1.00 0.00 O ATOM 1397 CB TYR B 609 2.034 35.159 7.287 1.00 0.00 C ATOM 1398 CG TYR B 609 2.743 36.398 7.783 1.00 0.00 C ATOM 1399 CD1 TYR B 609 2.327 37.666 7.394 1.00 0.00 C ATOM 1400 CD2 TYR B 609 3.831 36.302 8.643 1.00 0.00 C ATOM 1401 CE1 TYR B 609 2.973 38.800 7.843 1.00 0.00 C ATOM 1402 CE2 TYR B 609 4.482 37.432 9.100 1.00 0.00 C ATOM 1403 CZ TYR B 609 4.050 38.678 8.696 1.00 0.00 C ATOM 1404 OH TYR B 609 4.696 39.806 9.149 1.00 0.00 O ATOM 0 H TYR B 609 -0.042 34.936 5.399 1.00 0.00 H new ATOM 0 HA TYR B 609 2.831 35.628 5.348 1.00 0.00 H new ATOM 0 HB2 TYR B 609 1.007 35.168 7.652 1.00 0.00 H new ATOM 0 HB3 TYR B 609 2.516 34.279 7.713 1.00 0.00 H new ATOM 0 HD1 TYR B 609 1.483 37.766 6.728 1.00 0.00 H new ATOM 0 HD2 TYR B 609 4.173 35.328 8.959 1.00 0.00 H new ATOM 0 HE1 TYR B 609 2.637 39.777 7.528 1.00 0.00 H new ATOM 0 HE2 TYR B 609 5.324 37.340 9.770 1.00 0.00 H new ATOM 0 HH TYR B 609 5.432 39.546 9.742 1.00 0.00 H new ATOM 1413 N PRO B 610 3.499 33.121 5.440 1.00 0.00 N ATOM 1414 CA PRO B 610 3.869 31.747 5.093 1.00 0.00 C ATOM 1415 C PRO B 610 3.339 30.731 6.100 1.00 0.00 C ATOM 1416 O PRO B 610 3.258 29.538 5.807 1.00 0.00 O ATOM 1417 CB PRO B 610 5.400 31.776 5.117 1.00 0.00 C ATOM 1418 CG PRO B 610 5.742 32.891 6.043 1.00 0.00 C ATOM 1419 CD PRO B 610 4.658 33.918 5.874 1.00 0.00 C ATOM 0 HA PRO B 610 3.449 31.441 4.135 1.00 0.00 H new ATOM 0 HB2 PRO B 610 5.809 30.829 5.469 1.00 0.00 H new ATOM 0 HB3 PRO B 610 5.809 31.949 4.121 1.00 0.00 H new ATOM 0 HG2 PRO B 610 5.790 32.541 7.074 1.00 0.00 H new ATOM 0 HG3 PRO B 610 6.719 33.312 5.803 1.00 0.00 H new ATOM 0 HD2 PRO B 610 4.456 34.447 6.806 1.00 0.00 H new ATOM 0 HD3 PRO B 610 4.929 34.670 5.133 1.00 0.00 H new ATOM 1424 N ALA B 611 2.982 31.212 7.285 1.00 0.00 N ATOM 1425 CA ALA B 611 2.457 30.345 8.334 1.00 0.00 C ATOM 1426 C ALA B 611 1.236 29.572 7.848 1.00 0.00 C ATOM 1427 O ALA B 611 1.008 28.434 8.255 1.00 0.00 O ATOM 1428 CB ALA B 611 2.110 31.163 9.569 1.00 0.00 C ATOM 0 H ALA B 611 3.046 32.197 7.544 1.00 0.00 H new ATOM 0 HA ALA B 611 3.230 29.623 8.595 1.00 0.00 H new ATOM 0 HB1 ALA B 611 1.719 30.504 10.344 1.00 0.00 H new ATOM 0 HB2 ALA B 611 3.005 31.665 9.937 1.00 0.00 H new ATOM 0 HB3 ALA B 611 1.356 31.908 9.312 1.00 0.00 H new ATOM 1434 N MET B 612 0.453 30.199 6.977 1.00 0.00 N ATOM 1435 CA MET B 612 -0.745 29.569 6.435 1.00 0.00 C ATOM 1436 C MET B 612 -0.381 28.469 5.445 1.00 0.00 C ATOM 1437 O MET B 612 -0.900 27.354 5.520 1.00 0.00 O ATOM 1438 CB MET B 612 -1.633 30.613 5.753 1.00 0.00 C ATOM 1439 CG MET B 612 -2.672 31.226 6.678 1.00 0.00 C ATOM 1440 SD MET B 612 -2.969 32.970 6.331 1.00 0.00 S ATOM 1441 CE MET B 612 -3.442 33.563 7.953 1.00 0.00 C ATOM 0 H MET B 612 0.626 31.143 6.631 1.00 0.00 H new ATOM 0 HA MET B 612 -1.295 29.120 7.262 1.00 0.00 H new ATOM 0 HB2 MET B 612 -1.003 31.407 5.351 1.00 0.00 H new ATOM 0 HB3 MET B 612 -2.140 30.149 4.907 1.00 0.00 H new ATOM 0 HG2 MET B 612 -3.608 30.676 6.582 1.00 0.00 H new ATOM 0 HG3 MET B 612 -2.343 31.116 7.711 1.00 0.00 H new ATOM 0 HE1 MET B 612 -3.658 34.630 7.902 1.00 0.00 H new ATOM 0 HE2 MET B 612 -4.330 33.029 8.291 1.00 0.00 H new ATOM 0 HE3 MET B 612 -2.626 33.392 8.655 1.00 0.00 H new ATOM 1449 N LEU B 613 0.514 28.788 4.516 1.00 0.00 N ATOM 1450 CA LEU B 613 0.948 27.825 3.509 1.00 0.00 C ATOM 1451 C LEU B 613 1.797 26.725 4.138 1.00 0.00 C ATOM 1452 O LEU B 613 2.951 26.949 4.502 1.00 0.00 O ATOM 1453 CB LEU B 613 1.742 28.532 2.409 1.00 0.00 C ATOM 1454 CG LEU B 613 1.445 28.087 0.976 1.00 0.00 C ATOM 1455 CD1 LEU B 613 2.275 28.888 -0.014 1.00 0.00 C ATOM 1456 CD2 LEU B 613 1.709 26.597 0.815 1.00 0.00 C ATOM 0 H LEU B 613 0.953 29.705 4.439 1.00 0.00 H new ATOM 0 HA LEU B 613 0.060 27.368 3.072 1.00 0.00 H new ATOM 0 HB2 LEU B 613 1.552 29.603 2.482 1.00 0.00 H new ATOM 0 HB3 LEU B 613 2.804 28.383 2.602 1.00 0.00 H new ATOM 0 HG LEU B 613 0.391 28.273 0.769 1.00 0.00 H new ATOM 0 HD11 LEU B 613 2.050 28.558 -1.028 1.00 0.00 H new ATOM 0 HD12 LEU B 613 2.036 29.947 0.084 1.00 0.00 H new ATOM 0 HD13 LEU B 613 3.334 28.735 0.191 1.00 0.00 H new ATOM 0 HD21 LEU B 613 1.492 26.298 -0.211 1.00 0.00 H new ATOM 0 HD22 LEU B 613 2.754 26.386 1.042 1.00 0.00 H new ATOM 0 HD23 LEU B 613 1.070 26.038 1.499 1.00 0.00 H new ATOM 1467 N GLY B 614 1.218 25.535 4.260 1.00 0.00 N ATOM 1468 CA GLY B 614 1.936 24.417 4.843 1.00 0.00 C ATOM 1469 C GLY B 614 1.545 24.164 6.286 1.00 0.00 C ATOM 1470 O GLY B 614 0.903 25.004 6.918 1.00 0.00 O ATOM 0 H GLY B 614 0.264 25.325 3.965 1.00 0.00 H new ATOM 0 HA2 GLY B 614 1.743 23.520 4.255 1.00 0.00 H new ATOM 0 HA3 GLY B 614 3.007 24.610 4.789 1.00 0.00 H new ATOM 1474 N HIS B 615 1.930 23.005 6.807 1.00 0.00 N ATOM 1475 CA HIS B 615 1.614 22.643 8.185 1.00 0.00 C ATOM 1476 C HIS B 615 2.494 21.491 8.661 1.00 0.00 C ATOM 1477 O HIS B 615 3.319 20.976 7.906 1.00 0.00 O ATOM 1478 CB HIS B 615 0.139 22.259 8.309 1.00 0.00 C ATOM 1479 CG HIS B 615 -0.650 23.185 9.182 1.00 0.00 C ATOM 1480 ND1 HIS B 615 -1.456 24.186 8.684 1.00 0.00 N ATOM 1481 CD2 HIS B 615 -0.755 23.255 10.530 1.00 0.00 C ATOM 1482 CE1 HIS B 615 -2.021 24.835 9.687 1.00 0.00 C ATOM 1483 NE2 HIS B 615 -1.612 24.288 10.818 1.00 0.00 N ATOM 0 H HIS B 615 2.461 22.299 6.297 1.00 0.00 H new ATOM 0 HA HIS B 615 1.810 23.510 8.816 1.00 0.00 H new ATOM 0 HB2 HIS B 615 -0.308 22.241 7.315 1.00 0.00 H new ATOM 0 HB3 HIS B 615 0.068 21.247 8.709 1.00 0.00 H new ATOM 0 HD2 HIS B 615 -0.257 22.617 11.245 1.00 0.00 H new ATOM 0 HE1 HIS B 615 -2.701 25.670 9.598 1.00 0.00 H new ATOM 0 HE2 HIS B 615 -1.888 24.585 11.754 1.00 0.00 H new ATOM 1490 N ALA B 616 2.312 21.092 9.916 1.00 0.00 N ATOM 1491 CA ALA B 616 3.088 20.001 10.489 1.00 0.00 C ATOM 1492 C ALA B 616 2.351 19.359 11.660 1.00 0.00 C ATOM 1493 O ALA B 616 1.312 19.852 12.097 1.00 0.00 O ATOM 1494 CB ALA B 616 4.454 20.501 10.935 1.00 0.00 C ATOM 0 H ALA B 616 1.634 21.508 10.554 1.00 0.00 H new ATOM 0 HA ALA B 616 3.225 19.242 9.718 1.00 0.00 H new ATOM 0 HB1 ALA B 616 5.023 19.674 11.361 1.00 0.00 H new ATOM 0 HB2 ALA B 616 4.991 20.907 10.077 1.00 0.00 H new ATOM 0 HB3 ALA B 616 4.329 21.281 11.686 1.00 0.00 H new ATOM 1500 N GLY B 617 2.895 18.255 12.164 1.00 0.00 N ATOM 1501 CA GLY B 617 2.274 17.564 13.278 1.00 0.00 C ATOM 1502 C GLY B 617 2.786 16.147 13.441 1.00 0.00 C ATOM 1503 O GLY B 617 3.893 15.826 13.004 1.00 0.00 O ATOM 0 H GLY B 617 3.755 17.827 11.820 1.00 0.00 H new ATOM 0 HA2 GLY B 617 2.460 18.122 14.196 1.00 0.00 H new ATOM 0 HA3 GLY B 617 1.194 17.542 13.131 1.00 0.00 H new ATOM 1507 N ASP B 618 1.983 15.297 14.071 1.00 0.00 N ATOM 1508 CA ASP B 618 2.362 13.906 14.291 1.00 0.00 C ATOM 1509 C ASP B 618 1.420 12.963 13.550 1.00 0.00 C ATOM 1510 O ASP B 618 1.174 11.841 13.994 1.00 0.00 O ATOM 1511 CB ASP B 618 2.357 13.584 15.786 1.00 0.00 C ATOM 1512 CG ASP B 618 1.108 14.086 16.482 1.00 0.00 C ATOM 1513 OD1 ASP B 618 1.119 15.240 16.960 1.00 0.00 O ATOM 1514 OD2 ASP B 618 0.119 13.326 16.549 1.00 0.00 O ATOM 0 H ASP B 618 1.065 15.547 14.439 1.00 0.00 H new ATOM 0 HA ASP B 618 3.370 13.763 13.901 1.00 0.00 H new ATOM 0 HB2 ASP B 618 2.437 12.506 15.923 1.00 0.00 H new ATOM 0 HB3 ASP B 618 3.234 14.031 16.254 1.00 0.00 H new ATOM 1518 N MET B 619 0.894 13.426 12.421 1.00 0.00 N ATOM 1519 CA MET B 619 -0.023 12.623 11.620 1.00 0.00 C ATOM 1520 C MET B 619 0.742 11.625 10.757 1.00 0.00 C ATOM 1521 O MET B 619 0.226 10.560 10.418 1.00 0.00 O ATOM 1522 CB MET B 619 -0.885 13.525 10.734 1.00 0.00 C ATOM 1523 CG MET B 619 -0.076 14.400 9.791 1.00 0.00 C ATOM 1524 SD MET B 619 -0.520 16.145 9.911 1.00 0.00 S ATOM 1525 CE MET B 619 -2.232 16.095 9.388 1.00 0.00 C ATOM 0 H MET B 619 1.087 14.352 12.040 1.00 0.00 H new ATOM 0 HA MET B 619 -0.670 12.069 12.300 1.00 0.00 H new ATOM 0 HB2 MET B 619 -1.564 12.905 10.149 1.00 0.00 H new ATOM 0 HB3 MET B 619 -1.502 14.162 11.368 1.00 0.00 H new ATOM 0 HG2 MET B 619 0.985 14.283 10.013 1.00 0.00 H new ATOM 0 HG3 MET B 619 -0.227 14.060 8.766 1.00 0.00 H new ATOM 0 HE1 MET B 619 -2.596 17.111 9.238 1.00 0.00 H new ATOM 0 HE2 MET B 619 -2.311 15.539 8.454 1.00 0.00 H new ATOM 0 HE3 MET B 619 -2.832 15.604 10.154 1.00 0.00 H new ATOM 1533 N ALA B 620 1.975 11.974 10.406 1.00 0.00 N ATOM 1534 CA ALA B 620 2.810 11.108 9.585 1.00 0.00 C ATOM 1535 C ALA B 620 3.054 9.768 10.272 1.00 0.00 C ATOM 1536 O ALA B 620 3.210 8.741 9.612 1.00 0.00 O ATOM 1537 CB ALA B 620 4.134 11.792 9.273 1.00 0.00 C ATOM 0 H ALA B 620 2.418 12.852 10.678 1.00 0.00 H new ATOM 0 HA ALA B 620 2.283 10.917 8.650 1.00 0.00 H new ATOM 0 HB1 ALA B 620 4.748 11.133 8.659 1.00 0.00 H new ATOM 0 HB2 ALA B 620 3.946 12.720 8.733 1.00 0.00 H new ATOM 0 HB3 ALA B 620 4.657 12.013 10.203 1.00 0.00 H new ATOM 1543 N GLY B 621 3.086 9.787 11.600 1.00 0.00 N ATOM 1544 CA GLY B 621 3.312 8.567 12.354 1.00 0.00 C ATOM 1545 C GLY B 621 2.302 7.487 12.023 1.00 0.00 C ATOM 1546 O GLY B 621 2.663 6.322 11.850 1.00 0.00 O ATOM 0 H GLY B 621 2.960 10.625 12.168 1.00 0.00 H new ATOM 0 HA2 GLY B 621 4.316 8.197 12.148 1.00 0.00 H new ATOM 0 HA3 GLY B 621 3.266 8.789 13.420 1.00 0.00 H new ATOM 1550 N TYR B 622 1.034 7.870 11.937 1.00 0.00 N ATOM 1551 CA TYR B 622 -0.033 6.925 11.630 1.00 0.00 C ATOM 1552 C TYR B 622 0.179 6.293 10.257 1.00 0.00 C ATOM 1553 O TYR B 622 -0.095 5.110 10.058 1.00 0.00 O ATOM 1554 CB TYR B 622 -1.393 7.623 11.679 1.00 0.00 C ATOM 1555 CG TYR B 622 -2.334 7.045 12.710 1.00 0.00 C ATOM 1556 CD1 TYR B 622 -2.149 7.289 14.065 1.00 0.00 C ATOM 1557 CD2 TYR B 622 -3.411 6.252 12.329 1.00 0.00 C ATOM 1558 CE1 TYR B 622 -3.007 6.762 15.010 1.00 0.00 C ATOM 1559 CE2 TYR B 622 -4.275 5.722 13.268 1.00 0.00 C ATOM 1560 CZ TYR B 622 -4.068 5.979 14.606 1.00 0.00 C ATOM 1561 OH TYR B 622 -4.925 5.452 15.545 1.00 0.00 O ATOM 0 H TYR B 622 0.719 8.830 12.076 1.00 0.00 H new ATOM 0 HA TYR B 622 -0.012 6.136 12.381 1.00 0.00 H new ATOM 0 HB2 TYR B 622 -1.241 8.681 11.891 1.00 0.00 H new ATOM 0 HB3 TYR B 622 -1.860 7.559 10.696 1.00 0.00 H new ATOM 0 HD1 TYR B 622 -1.319 7.902 14.385 1.00 0.00 H new ATOM 0 HD2 TYR B 622 -3.575 6.047 11.281 1.00 0.00 H new ATOM 0 HE1 TYR B 622 -2.848 6.962 16.059 1.00 0.00 H new ATOM 0 HE2 TYR B 622 -5.108 5.110 12.955 1.00 0.00 H new ATOM 0 HH TYR B 622 -5.619 4.926 15.096 1.00 0.00 H new ATOM 1570 N ALA B 623 0.667 7.092 9.314 1.00 0.00 N ATOM 1571 CA ALA B 623 0.918 6.612 7.961 1.00 0.00 C ATOM 1572 C ALA B 623 1.940 5.480 7.961 1.00 0.00 C ATOM 1573 O ALA B 623 1.868 4.566 7.141 1.00 0.00 O ATOM 1574 CB ALA B 623 1.394 7.754 7.076 1.00 0.00 C ATOM 0 H ALA B 623 0.896 8.075 9.462 1.00 0.00 H new ATOM 0 HA ALA B 623 -0.018 6.222 7.561 1.00 0.00 H new ATOM 0 HB1 ALA B 623 1.578 7.381 6.068 1.00 0.00 H new ATOM 0 HB2 ALA B 623 0.630 8.531 7.042 1.00 0.00 H new ATOM 0 HB3 ALA B 623 2.316 8.170 7.483 1.00 0.00 H new ATOM 1580 N GLY B 624 2.893 5.548 8.886 1.00 0.00 N ATOM 1581 CA GLY B 624 3.916 4.523 8.974 1.00 0.00 C ATOM 1582 C GLY B 624 3.332 3.134 9.136 1.00 0.00 C ATOM 1583 O GLY B 624 3.866 2.161 8.599 1.00 0.00 O ATOM 0 H GLY B 624 2.974 6.295 9.576 1.00 0.00 H new ATOM 0 HA2 GLY B 624 4.533 4.552 8.076 1.00 0.00 H new ATOM 0 HA3 GLY B 624 4.571 4.739 9.818 1.00 0.00 H new ATOM 1587 N THR B 625 2.233 3.037 9.878 1.00 0.00 N ATOM 1588 CA THR B 625 1.578 1.756 10.110 1.00 0.00 C ATOM 1589 C THR B 625 1.224 1.073 8.794 1.00 0.00 C ATOM 1590 O THR B 625 1.447 -0.127 8.627 1.00 0.00 O ATOM 1591 CB THR B 625 0.298 1.924 10.950 1.00 0.00 C ATOM 1592 OG1 THR B 625 0.618 2.494 12.223 1.00 0.00 O ATOM 1593 CG2 THR B 625 -0.400 0.588 11.147 1.00 0.00 C ATOM 0 H THR B 625 1.778 3.831 10.329 1.00 0.00 H new ATOM 0 HA THR B 625 2.285 1.134 10.659 1.00 0.00 H new ATOM 0 HB THR B 625 -0.376 2.592 10.414 1.00 0.00 H new ATOM 0 HG1 THR B 625 -0.202 2.599 12.750 1.00 0.00 H new ATOM 0 HG21 THR B 625 -1.301 0.733 11.743 1.00 0.00 H new ATOM 0 HG22 THR B 625 -0.670 0.172 10.176 1.00 0.00 H new ATOM 0 HG23 THR B 625 0.270 -0.100 11.663 1.00 0.00 H new ATOM 1601 N LEU B 626 0.671 1.843 7.864 1.00 0.00 N ATOM 1602 CA LEU B 626 0.287 1.311 6.561 1.00 0.00 C ATOM 1603 C LEU B 626 1.448 0.563 5.913 1.00 0.00 C ATOM 1604 O LEU B 626 1.257 -0.486 5.300 1.00 0.00 O ATOM 1605 CB LEU B 626 -0.181 2.442 5.643 1.00 0.00 C ATOM 1606 CG LEU B 626 -1.654 2.834 5.761 1.00 0.00 C ATOM 1607 CD1 LEU B 626 -2.015 3.126 7.209 1.00 0.00 C ATOM 1608 CD2 LEU B 626 -1.957 4.039 4.881 1.00 0.00 C ATOM 0 H LEU B 626 0.478 2.837 7.987 1.00 0.00 H new ATOM 0 HA LEU B 626 -0.534 0.610 6.711 1.00 0.00 H new ATOM 0 HB2 LEU B 626 0.427 3.324 5.847 1.00 0.00 H new ATOM 0 HB3 LEU B 626 0.016 2.151 4.611 1.00 0.00 H new ATOM 0 HG LEU B 626 -2.261 1.996 5.419 1.00 0.00 H new ATOM 0 HD11 LEU B 626 -3.067 3.403 7.273 1.00 0.00 H new ATOM 0 HD12 LEU B 626 -1.836 2.238 7.815 1.00 0.00 H new ATOM 0 HD13 LEU B 626 -1.400 3.947 7.579 1.00 0.00 H new ATOM 0 HD21 LEU B 626 -3.010 4.304 4.977 1.00 0.00 H new ATOM 0 HD22 LEU B 626 -1.340 4.882 5.193 1.00 0.00 H new ATOM 0 HD23 LEU B 626 -1.738 3.795 3.842 1.00 0.00 H new ATOM 1619 N GLN B 627 2.651 1.111 6.055 1.00 0.00 N ATOM 1620 CA GLN B 627 3.843 0.495 5.486 1.00 0.00 C ATOM 1621 C GLN B 627 3.959 -0.964 5.913 1.00 0.00 C ATOM 1622 O GLN B 627 4.134 -1.853 5.080 1.00 0.00 O ATOM 1623 CB GLN B 627 5.094 1.264 5.912 1.00 0.00 C ATOM 1624 CG GLN B 627 6.318 0.951 5.067 1.00 0.00 C ATOM 1625 CD GLN B 627 7.422 1.976 5.237 1.00 0.00 C ATOM 1626 OE1 GLN B 627 7.698 2.764 4.332 1.00 0.00 O ATOM 1627 NE2 GLN B 627 8.061 1.970 6.401 1.00 0.00 N ATOM 0 H GLN B 627 2.825 1.980 6.559 1.00 0.00 H new ATOM 0 HA GLN B 627 3.756 0.531 4.400 1.00 0.00 H new ATOM 0 HB2 GLN B 627 4.889 2.333 5.858 1.00 0.00 H new ATOM 0 HB3 GLN B 627 5.314 1.034 6.955 1.00 0.00 H new ATOM 0 HG2 GLN B 627 6.698 -0.035 5.336 1.00 0.00 H new ATOM 0 HG3 GLN B 627 6.028 0.905 4.017 1.00 0.00 H new ATOM 0 HE21 GLN B 627 7.799 1.299 7.123 1.00 0.00 H new ATOM 0 HE22 GLN B 627 8.814 2.636 6.573 1.00 0.00 H new ATOM 1634 N SER B 628 3.860 -1.204 7.217 1.00 0.00 N ATOM 1635 CA SER B 628 3.958 -2.556 7.755 1.00 0.00 C ATOM 1636 C SER B 628 2.670 -3.334 7.506 1.00 0.00 C ATOM 1637 O SER B 628 2.689 -4.556 7.352 1.00 0.00 O ATOM 1638 CB SER B 628 4.258 -2.509 9.255 1.00 0.00 C ATOM 1639 OG SER B 628 4.209 -3.805 9.825 1.00 0.00 O ATOM 0 H SER B 628 3.712 -0.480 7.920 1.00 0.00 H new ATOM 0 HA SER B 628 4.774 -3.067 7.244 1.00 0.00 H new ATOM 0 HB2 SER B 628 5.244 -2.073 9.419 1.00 0.00 H new ATOM 0 HB3 SER B 628 3.537 -1.861 9.753 1.00 0.00 H new ATOM 0 HG SER B 628 4.406 -3.748 10.783 1.00 0.00 H new ATOM 1644 N LEU B 629 1.551 -2.619 7.469 1.00 0.00 N ATOM 1645 CA LEU B 629 0.252 -3.241 7.238 1.00 0.00 C ATOM 1646 C LEU B 629 0.266 -4.073 5.959 1.00 0.00 C ATOM 1647 O LEU B 629 -0.096 -5.248 5.968 1.00 0.00 O ATOM 1648 CB LEU B 629 -0.840 -2.173 7.153 1.00 0.00 C ATOM 1649 CG LEU B 629 -2.229 -2.593 7.636 1.00 0.00 C ATOM 1650 CD1 LEU B 629 -2.665 -3.879 6.952 1.00 0.00 C ATOM 1651 CD2 LEU B 629 -2.239 -2.761 9.148 1.00 0.00 C ATOM 0 H LEU B 629 1.517 -1.608 7.596 1.00 0.00 H new ATOM 0 HA LEU B 629 0.040 -3.903 8.078 1.00 0.00 H new ATOM 0 HB2 LEU B 629 -0.521 -1.309 7.735 1.00 0.00 H new ATOM 0 HB3 LEU B 629 -0.921 -1.847 6.116 1.00 0.00 H new ATOM 0 HG LEU B 629 -2.938 -1.808 7.373 1.00 0.00 H new ATOM 0 HD11 LEU B 629 -3.655 -4.163 7.308 1.00 0.00 H new ATOM 0 HD12 LEU B 629 -2.697 -3.725 5.873 1.00 0.00 H new ATOM 0 HD13 LEU B 629 -1.955 -4.673 7.184 1.00 0.00 H new ATOM 0 HD21 LEU B 629 -3.235 -3.060 9.474 1.00 0.00 H new ATOM 0 HD22 LEU B 629 -1.518 -3.527 9.434 1.00 0.00 H new ATOM 0 HD23 LEU B 629 -1.971 -1.816 9.621 1.00 0.00 H new ATOM 1662 N GLY B 630 0.689 -3.453 4.861 1.00 0.00 N ATOM 1663 CA GLY B 630 0.744 -4.152 3.590 1.00 0.00 C ATOM 1664 C GLY B 630 1.733 -5.300 3.603 1.00 0.00 C ATOM 1665 O GLY B 630 1.484 -6.349 3.008 1.00 0.00 O ATOM 0 H GLY B 630 0.994 -2.480 4.829 1.00 0.00 H new ATOM 0 HA2 GLY B 630 -0.247 -4.533 3.345 1.00 0.00 H new ATOM 0 HA3 GLY B 630 1.018 -3.449 2.804 1.00 0.00 H new ATOM 1669 N ALA B 631 2.859 -5.101 4.280 1.00 0.00 N ATOM 1670 CA ALA B 631 3.889 -6.129 4.367 1.00 0.00 C ATOM 1671 C ALA B 631 3.309 -7.448 4.866 1.00 0.00 C ATOM 1672 O ALA B 631 3.718 -8.522 4.425 1.00 0.00 O ATOM 1673 CB ALA B 631 5.018 -5.669 5.278 1.00 0.00 C ATOM 0 H ALA B 631 3.081 -4.238 4.776 1.00 0.00 H new ATOM 0 HA ALA B 631 4.288 -6.294 3.366 1.00 0.00 H new ATOM 0 HB1 ALA B 631 5.780 -6.446 5.334 1.00 0.00 H new ATOM 0 HB2 ALA B 631 5.459 -4.756 4.878 1.00 0.00 H new ATOM 0 HB3 ALA B 631 4.624 -5.475 6.276 1.00 0.00 H new ATOM 1679 N GLU B 632 2.354 -7.359 5.786 1.00 0.00 N ATOM 1680 CA GLU B 632 1.719 -8.546 6.346 1.00 0.00 C ATOM 1681 C GLU B 632 1.036 -9.364 5.252 1.00 0.00 C ATOM 1682 O GLU B 632 1.006 -10.593 5.309 1.00 0.00 O ATOM 1683 CB GLU B 632 0.698 -8.151 7.415 1.00 0.00 C ATOM 1684 CG GLU B 632 1.305 -7.959 8.795 1.00 0.00 C ATOM 1685 CD GLU B 632 1.566 -9.273 9.504 1.00 0.00 C ATOM 1686 OE1 GLU B 632 0.586 -9.968 9.845 1.00 0.00 O ATOM 1687 OE2 GLU B 632 2.750 -9.608 9.720 1.00 0.00 O ATOM 0 H GLU B 632 2.003 -6.477 6.159 1.00 0.00 H new ATOM 0 HA GLU B 632 2.495 -9.159 6.805 1.00 0.00 H new ATOM 0 HB2 GLU B 632 0.206 -7.227 7.112 1.00 0.00 H new ATOM 0 HB3 GLU B 632 -0.073 -8.919 7.470 1.00 0.00 H new ATOM 0 HG2 GLU B 632 2.241 -7.408 8.703 1.00 0.00 H new ATOM 0 HG3 GLU B 632 0.635 -7.350 9.401 1.00 0.00 H new ATOM 1692 N ILE B 633 0.489 -8.671 4.259 1.00 0.00 N ATOM 1693 CA ILE B 633 -0.193 -9.332 3.153 1.00 0.00 C ATOM 1694 C ILE B 633 0.804 -10.006 2.217 1.00 0.00 C ATOM 1695 O ILE B 633 0.554 -11.100 1.711 1.00 0.00 O ATOM 1696 CB ILE B 633 -1.048 -8.338 2.344 1.00 0.00 C ATOM 1697 CG1 ILE B 633 -2.087 -7.673 3.249 1.00 0.00 C ATOM 1698 CG2 ILE B 633 -1.726 -9.048 1.182 1.00 0.00 C ATOM 1699 CD1 ILE B 633 -2.758 -6.473 2.618 1.00 0.00 C ATOM 0 H ILE B 633 0.505 -7.653 4.198 1.00 0.00 H new ATOM 0 HA ILE B 633 -0.845 -10.088 3.591 1.00 0.00 H new ATOM 0 HB ILE B 633 -0.396 -7.563 1.940 1.00 0.00 H new ATOM 0 HG12 ILE B 633 -2.848 -8.407 3.515 1.00 0.00 H new ATOM 0 HG13 ILE B 633 -1.605 -7.364 4.176 1.00 0.00 H new ATOM 0 HG21 ILE B 633 -2.327 -8.333 0.619 1.00 0.00 H new ATOM 0 HG22 ILE B 633 -0.969 -9.480 0.528 1.00 0.00 H new ATOM 0 HG23 ILE B 633 -2.369 -9.840 1.565 1.00 0.00 H new ATOM 0 HD11 ILE B 633 -3.482 -6.052 3.316 1.00 0.00 H new ATOM 0 HD12 ILE B 633 -2.007 -5.721 2.377 1.00 0.00 H new ATOM 0 HD13 ILE B 633 -3.269 -6.780 1.706 1.00 0.00 H new ATOM 1710 N ALA B 634 1.936 -9.347 1.992 1.00 0.00 N ATOM 1711 CA ALA B 634 2.973 -9.883 1.120 1.00 0.00 C ATOM 1712 C ALA B 634 3.652 -11.093 1.754 1.00 0.00 C ATOM 1713 O ALA B 634 4.119 -11.992 1.054 1.00 0.00 O ATOM 1714 CB ALA B 634 4.001 -8.808 0.798 1.00 0.00 C ATOM 0 H ALA B 634 2.158 -8.440 2.402 1.00 0.00 H new ATOM 0 HA ALA B 634 2.501 -10.208 0.193 1.00 0.00 H new ATOM 0 HB1 ALA B 634 4.769 -9.223 0.146 1.00 0.00 H new ATOM 0 HB2 ALA B 634 3.510 -7.974 0.296 1.00 0.00 H new ATOM 0 HB3 ALA B 634 4.460 -8.456 1.721 1.00 0.00 H new ATOM 1720 N VAL B 635 3.702 -11.109 3.082 1.00 0.00 N ATOM 1721 CA VAL B 635 4.323 -12.210 3.810 1.00 0.00 C ATOM 1722 C VAL B 635 3.428 -13.444 3.807 1.00 0.00 C ATOM 1723 O VAL B 635 3.915 -14.575 3.819 1.00 0.00 O ATOM 1724 CB VAL B 635 4.629 -11.815 5.267 1.00 0.00 C ATOM 1725 CG1 VAL B 635 5.251 -12.984 6.017 1.00 0.00 C ATOM 1726 CG2 VAL B 635 5.541 -10.599 5.309 1.00 0.00 C ATOM 0 H VAL B 635 3.320 -10.373 3.676 1.00 0.00 H new ATOM 0 HA VAL B 635 5.258 -12.442 3.299 1.00 0.00 H new ATOM 0 HB VAL B 635 3.692 -11.555 5.759 1.00 0.00 H new ATOM 0 HG11 VAL B 635 5.461 -12.687 7.045 1.00 0.00 H new ATOM 0 HG12 VAL B 635 4.559 -13.826 6.017 1.00 0.00 H new ATOM 0 HG13 VAL B 635 6.180 -13.277 5.528 1.00 0.00 H new ATOM 0 HG21 VAL B 635 5.747 -10.334 6.346 1.00 0.00 H new ATOM 0 HG22 VAL B 635 6.477 -10.829 4.801 1.00 0.00 H new ATOM 0 HG23 VAL B 635 5.054 -9.761 4.810 1.00 0.00 H new ATOM 1736 N GLU B 636 2.118 -13.220 3.789 1.00 0.00 N ATOM 1737 CA GLU B 636 1.157 -14.316 3.785 1.00 0.00 C ATOM 1738 C GLU B 636 1.131 -15.012 2.427 1.00 0.00 C ATOM 1739 O GLU B 636 1.263 -16.232 2.341 1.00 0.00 O ATOM 1740 CB GLU B 636 -0.241 -13.799 4.132 1.00 0.00 C ATOM 1741 CG GLU B 636 -0.751 -14.279 5.480 1.00 0.00 C ATOM 1742 CD GLU B 636 -1.422 -15.636 5.399 1.00 0.00 C ATOM 1743 OE1 GLU B 636 -2.346 -15.793 4.573 1.00 0.00 O ATOM 1744 OE2 GLU B 636 -1.027 -16.541 6.163 1.00 0.00 O ATOM 0 H GLU B 636 1.698 -12.290 3.777 1.00 0.00 H new ATOM 0 HA GLU B 636 1.467 -15.040 4.539 1.00 0.00 H new ATOM 0 HB2 GLU B 636 -0.228 -12.709 4.125 1.00 0.00 H new ATOM 0 HB3 GLU B 636 -0.939 -14.114 3.356 1.00 0.00 H new ATOM 0 HG2 GLU B 636 0.081 -14.330 6.182 1.00 0.00 H new ATOM 0 HG3 GLU B 636 -1.458 -13.551 5.877 1.00 0.00 H new ATOM 1749 N GLN B 637 0.961 -14.225 1.369 1.00 0.00 N ATOM 1750 CA GLN B 637 0.916 -14.766 0.015 1.00 0.00 C ATOM 1751 C GLN B 637 2.222 -15.474 -0.331 1.00 0.00 C ATOM 1752 O GLN B 637 2.237 -16.417 -1.122 1.00 0.00 O ATOM 1753 CB GLN B 637 0.644 -13.649 -0.994 1.00 0.00 C ATOM 1754 CG GLN B 637 1.841 -12.745 -1.239 1.00 0.00 C ATOM 1755 CD GLN B 637 2.691 -13.206 -2.406 1.00 0.00 C ATOM 1756 OE1 GLN B 637 2.173 -13.555 -3.467 1.00 0.00 O ATOM 1757 NE2 GLN B 637 4.005 -13.209 -2.216 1.00 0.00 N ATOM 0 H GLN B 637 0.852 -13.212 1.423 1.00 0.00 H new ATOM 0 HA GLN B 637 0.106 -15.494 -0.033 1.00 0.00 H new ATOM 0 HB2 GLN B 637 0.335 -14.093 -1.940 1.00 0.00 H new ATOM 0 HB3 GLN B 637 -0.190 -13.045 -0.638 1.00 0.00 H new ATOM 0 HG2 GLN B 637 1.492 -11.730 -1.427 1.00 0.00 H new ATOM 0 HG3 GLN B 637 2.455 -12.709 -0.339 1.00 0.00 H new ATOM 0 HE21 GLN B 637 4.391 -12.912 -1.320 1.00 0.00 H new ATOM 0 HE22 GLN B 637 4.628 -13.509 -2.966 1.00 0.00 H new ATOM 1764 N ALA B 638 3.316 -15.011 0.265 1.00 0.00 N ATOM 1765 CA ALA B 638 4.626 -15.601 0.021 1.00 0.00 C ATOM 1766 C ALA B 638 4.689 -17.033 0.539 1.00 0.00 C ATOM 1767 O ALA B 638 5.467 -17.849 0.045 1.00 0.00 O ATOM 1768 CB ALA B 638 5.714 -14.755 0.666 1.00 0.00 C ATOM 0 H ALA B 638 3.321 -14.229 0.920 1.00 0.00 H new ATOM 0 HA ALA B 638 4.791 -15.626 -1.056 1.00 0.00 H new ATOM 0 HB1 ALA B 638 6.687 -15.207 0.476 1.00 0.00 H new ATOM 0 HB2 ALA B 638 5.692 -13.750 0.244 1.00 0.00 H new ATOM 0 HB3 ALA B 638 5.543 -14.700 1.741 1.00 0.00 H new ATOM 1774 N ALA B 639 3.867 -17.333 1.539 1.00 0.00 N ATOM 1775 CA ALA B 639 3.827 -18.667 2.124 1.00 0.00 C ATOM 1776 C ALA B 639 3.027 -19.627 1.249 1.00 0.00 C ATOM 1777 O ALA B 639 3.238 -20.839 1.286 1.00 0.00 O ATOM 1778 CB ALA B 639 3.240 -18.612 3.526 1.00 0.00 C ATOM 0 H ALA B 639 3.219 -16.669 1.961 1.00 0.00 H new ATOM 0 HA ALA B 639 4.849 -19.040 2.186 1.00 0.00 H new ATOM 0 HB1 ALA B 639 3.216 -19.616 3.950 1.00 0.00 H new ATOM 0 HB2 ALA B 639 3.856 -17.967 4.153 1.00 0.00 H new ATOM 0 HB3 ALA B 639 2.227 -18.213 3.481 1.00 0.00 H new ATOM 1784 N LEU B 640 2.107 -19.076 0.465 1.00 0.00 N ATOM 1785 CA LEU B 640 1.272 -19.884 -0.418 1.00 0.00 C ATOM 1786 C LEU B 640 1.720 -19.741 -1.871 1.00 0.00 C ATOM 1787 O LEU B 640 0.922 -19.903 -2.793 1.00 0.00 O ATOM 1788 CB LEU B 640 -0.195 -19.474 -0.282 1.00 0.00 C ATOM 1789 CG LEU B 640 -0.667 -19.132 1.131 1.00 0.00 C ATOM 1790 CD1 LEU B 640 -2.043 -18.484 1.092 1.00 0.00 C ATOM 1791 CD2 LEU B 640 -0.688 -20.379 2.003 1.00 0.00 C ATOM 0 H LEU B 640 1.920 -18.074 0.422 1.00 0.00 H new ATOM 0 HA LEU B 640 1.379 -20.928 -0.124 1.00 0.00 H new ATOM 0 HB2 LEU B 640 -0.371 -18.609 -0.922 1.00 0.00 H new ATOM 0 HB3 LEU B 640 -0.815 -20.285 -0.665 1.00 0.00 H new ATOM 0 HG LEU B 640 0.035 -18.421 1.566 1.00 0.00 H new ATOM 0 HD11 LEU B 640 -2.363 -18.248 2.107 1.00 0.00 H new ATOM 0 HD12 LEU B 640 -1.997 -17.568 0.503 1.00 0.00 H new ATOM 0 HD13 LEU B 640 -2.756 -19.172 0.638 1.00 0.00 H new ATOM 0 HD21 LEU B 640 -1.026 -20.116 3.005 1.00 0.00 H new ATOM 0 HD22 LEU B 640 -1.368 -21.114 1.571 1.00 0.00 H new ATOM 0 HD23 LEU B 640 0.315 -20.801 2.058 1.00 0.00 H new ATOM 1802 N GLN B 641 3.000 -19.439 -2.062 1.00 0.00 N ATOM 1803 CA GLN B 641 3.552 -19.276 -3.402 1.00 0.00 C ATOM 1804 C GLN B 641 3.248 -20.495 -4.268 1.00 0.00 C ATOM 1805 O GLN B 641 2.878 -20.363 -5.434 1.00 0.00 O ATOM 1806 CB GLN B 641 5.063 -19.051 -3.329 1.00 0.00 C ATOM 1807 CG GLN B 641 5.449 -17.662 -2.850 1.00 0.00 C ATOM 1808 CD GLN B 641 5.434 -16.635 -3.965 1.00 0.00 C ATOM 1809 OE1 GLN B 641 6.422 -16.463 -4.681 1.00 0.00 O ATOM 1810 NE2 GLN B 641 4.311 -15.943 -4.120 1.00 0.00 N ATOM 0 H GLN B 641 3.673 -19.302 -1.308 1.00 0.00 H new ATOM 0 HA GLN B 641 3.083 -18.404 -3.858 1.00 0.00 H new ATOM 0 HB2 GLN B 641 5.500 -19.792 -2.659 1.00 0.00 H new ATOM 0 HB3 GLN B 641 5.495 -19.219 -4.316 1.00 0.00 H new ATOM 0 HG2 GLN B 641 4.762 -17.349 -2.064 1.00 0.00 H new ATOM 0 HG3 GLN B 641 6.445 -17.698 -2.408 1.00 0.00 H new ATOM 0 HE21 GLN B 641 3.516 -16.117 -3.505 1.00 0.00 H new ATOM 0 HE22 GLN B 641 4.244 -15.238 -4.854 1.00 0.00 H new ATOM 1817 N SER B 642 3.410 -21.681 -3.689 1.00 0.00 N ATOM 1818 CA SER B 642 3.157 -22.923 -4.410 1.00 0.00 C ATOM 1819 C SER B 642 1.697 -23.014 -4.840 1.00 0.00 C ATOM 1820 O SER B 642 1.368 -23.679 -5.822 1.00 0.00 O ATOM 1821 CB SER B 642 3.519 -24.126 -3.536 1.00 0.00 C ATOM 1822 OG SER B 642 2.548 -24.335 -2.527 1.00 0.00 O ATOM 0 H SER B 642 3.715 -21.808 -2.724 1.00 0.00 H new ATOM 0 HA SER B 642 3.781 -22.930 -5.303 1.00 0.00 H new ATOM 0 HB2 SER B 642 3.601 -25.018 -4.156 1.00 0.00 H new ATOM 0 HB3 SER B 642 4.495 -23.966 -3.078 1.00 0.00 H new ATOM 0 HG SER B 642 2.802 -25.110 -1.984 1.00 0.00 H new ATOM 1827 N ALA B 643 0.824 -22.342 -4.096 1.00 0.00 N ATOM 1828 CA ALA B 643 -0.601 -22.343 -4.401 1.00 0.00 C ATOM 1829 C ALA B 643 -0.911 -21.432 -5.584 1.00 0.00 C ATOM 1830 O ALA B 643 -1.829 -21.697 -6.361 1.00 0.00 O ATOM 1831 CB ALA B 643 -1.402 -21.919 -3.180 1.00 0.00 C ATOM 0 H ALA B 643 1.079 -21.790 -3.277 1.00 0.00 H new ATOM 0 HA ALA B 643 -0.888 -23.358 -4.675 1.00 0.00 H new ATOM 0 HB1 ALA B 643 -2.465 -21.924 -3.422 1.00 0.00 H new ATOM 0 HB2 ALA B 643 -1.213 -22.614 -2.362 1.00 0.00 H new ATOM 0 HB3 ALA B 643 -1.103 -20.915 -2.880 1.00 0.00 H new ATOM 1837 N TRP B 644 -0.142 -20.356 -5.713 1.00 0.00 N ATOM 1838 CA TRP B 644 -0.336 -19.405 -6.801 1.00 0.00 C ATOM 1839 C TRP B 644 -0.347 -20.116 -8.151 1.00 0.00 C ATOM 1840 O TRP B 644 0.487 -20.982 -8.412 1.00 0.00 O ATOM 1841 CB TRP B 644 0.764 -18.343 -6.780 1.00 0.00 C ATOM 1842 CG TRP B 644 0.442 -17.137 -7.609 1.00 0.00 C ATOM 1843 CD1 TRP B 644 0.604 -17.003 -8.958 1.00 0.00 C ATOM 1844 CD2 TRP B 644 -0.095 -15.894 -7.142 1.00 0.00 C ATOM 1845 NE1 TRP B 644 0.200 -15.753 -9.359 1.00 0.00 N ATOM 1846 CE2 TRP B 644 -0.235 -15.053 -8.263 1.00 0.00 C ATOM 1847 CE3 TRP B 644 -0.474 -15.412 -5.887 1.00 0.00 C ATOM 1848 CZ2 TRP B 644 -0.735 -13.758 -8.165 1.00 0.00 C ATOM 1849 CZ3 TRP B 644 -0.971 -14.126 -5.790 1.00 0.00 C ATOM 1850 CH2 TRP B 644 -1.098 -13.311 -6.924 1.00 0.00 C ATOM 0 H TRP B 644 0.621 -20.121 -5.078 1.00 0.00 H new ATOM 0 HA TRP B 644 -1.302 -18.921 -6.658 1.00 0.00 H new ATOM 0 HB2 TRP B 644 0.938 -18.031 -5.750 1.00 0.00 H new ATOM 0 HB3 TRP B 644 1.693 -18.785 -7.140 1.00 0.00 H new ATOM 0 HD1 TRP B 644 0.993 -17.768 -9.614 1.00 0.00 H new ATOM 0 HE1 TRP B 644 0.220 -15.402 -10.317 1.00 0.00 H new ATOM 0 HE3 TRP B 644 -0.380 -16.033 -5.008 1.00 0.00 H new ATOM 0 HZ2 TRP B 644 -0.833 -13.129 -9.037 1.00 0.00 H new ATOM 0 HZ3 TRP B 644 -1.266 -13.742 -4.825 1.00 0.00 H new ATOM 0 HH2 TRP B 644 -1.490 -12.311 -6.816 1.00 0.00 H new ATOM 1860 N GLN B 645 -1.298 -19.744 -9.003 1.00 0.00 N ATOM 1861 CA GLN B 645 -1.416 -20.347 -10.324 1.00 0.00 C ATOM 1862 C GLN B 645 -0.471 -19.676 -11.315 1.00 0.00 C ATOM 1863 O GLN B 645 0.510 -20.275 -11.755 1.00 0.00 O ATOM 1864 CB GLN B 645 -2.858 -20.245 -10.827 1.00 0.00 C ATOM 1865 CG GLN B 645 -3.881 -20.820 -9.862 1.00 0.00 C ATOM 1866 CD GLN B 645 -3.937 -22.335 -9.906 1.00 0.00 C ATOM 1867 OE1 GLN B 645 -4.542 -22.919 -10.804 1.00 0.00 O ATOM 1868 NE2 GLN B 645 -3.304 -22.979 -8.933 1.00 0.00 N ATOM 0 H GLN B 645 -1.997 -19.029 -8.801 1.00 0.00 H new ATOM 0 HA GLN B 645 -1.140 -21.398 -10.242 1.00 0.00 H new ATOM 0 HB2 GLN B 645 -3.096 -19.198 -11.014 1.00 0.00 H new ATOM 0 HB3 GLN B 645 -2.939 -20.765 -11.781 1.00 0.00 H new ATOM 0 HG2 GLN B 645 -3.640 -20.498 -8.849 1.00 0.00 H new ATOM 0 HG3 GLN B 645 -4.865 -20.417 -10.099 1.00 0.00 H new ATOM 0 HE21 GLN B 645 -2.815 -22.454 -8.208 1.00 0.00 H new ATOM 0 HE22 GLN B 645 -3.307 -23.999 -8.910 1.00 0.00 H new ATOM 1875 N GLY B 646 -0.773 -18.429 -11.664 1.00 0.00 N ATOM 1876 CA GLY B 646 0.060 -17.698 -12.601 1.00 0.00 C ATOM 1877 C GLY B 646 -0.539 -17.650 -13.993 1.00 0.00 C ATOM 1878 O GLY B 646 -0.180 -16.794 -14.801 1.00 0.00 O ATOM 0 H GLY B 646 -1.580 -17.912 -11.314 1.00 0.00 H new ATOM 0 HA2 GLY B 646 0.206 -16.681 -12.236 1.00 0.00 H new ATOM 0 HA3 GLY B 646 1.044 -18.164 -12.648 1.00 0.00 H new ATOM 1882 N ASP B 647 -1.453 -18.572 -14.274 1.00 0.00 N ATOM 1883 CA ASP B 647 -2.103 -18.632 -15.579 1.00 0.00 C ATOM 1884 C ASP B 647 -3.443 -17.905 -15.552 1.00 0.00 C ATOM 1885 O ASP B 647 -4.346 -18.215 -16.331 1.00 0.00 O ATOM 1886 CB ASP B 647 -2.305 -20.087 -16.005 1.00 0.00 C ATOM 1887 CG ASP B 647 -1.029 -20.722 -16.521 1.00 0.00 C ATOM 1888 OD1 ASP B 647 -0.178 -19.986 -17.064 1.00 0.00 O ATOM 1889 OD2 ASP B 647 -0.882 -21.954 -16.383 1.00 0.00 O ATOM 0 H ASP B 647 -1.761 -19.288 -13.616 1.00 0.00 H new ATOM 0 HA ASP B 647 -1.457 -18.137 -16.303 1.00 0.00 H new ATOM 0 HB2 ASP B 647 -2.677 -20.662 -15.157 1.00 0.00 H new ATOM 0 HB3 ASP B 647 -3.069 -20.133 -16.781 1.00 0.00 H new ATOM 1893 N THR B 648 -3.568 -16.938 -14.648 1.00 0.00 N ATOM 1894 CA THR B 648 -4.800 -16.168 -14.518 1.00 0.00 C ATOM 1895 C THR B 648 -4.549 -14.685 -14.766 1.00 0.00 C ATOM 1896 O THR B 648 -5.426 -13.972 -15.255 1.00 0.00 O ATOM 1897 CB THR B 648 -5.427 -16.345 -13.123 1.00 0.00 C ATOM 1898 OG1 THR B 648 -4.416 -16.236 -12.114 1.00 0.00 O ATOM 1899 CG2 THR B 648 -6.121 -17.694 -13.008 1.00 0.00 C ATOM 0 H THR B 648 -2.832 -16.669 -13.995 1.00 0.00 H new ATOM 0 HA THR B 648 -5.492 -16.547 -15.270 1.00 0.00 H new ATOM 0 HB THR B 648 -6.169 -15.559 -12.981 1.00 0.00 H new ATOM 0 HG1 THR B 648 -4.735 -16.651 -11.285 1.00 0.00 H new ATOM 0 HG21 THR B 648 -6.556 -17.796 -12.014 1.00 0.00 H new ATOM 0 HG22 THR B 648 -6.909 -17.763 -13.758 1.00 0.00 H new ATOM 0 HG23 THR B 648 -5.396 -18.491 -13.170 1.00 0.00 H new ATOM 1907 N GLY B 649 -3.349 -14.227 -14.427 1.00 0.00 N ATOM 1908 CA GLY B 649 -3.006 -12.830 -14.622 1.00 0.00 C ATOM 1909 C GLY B 649 -1.657 -12.476 -14.029 1.00 0.00 C ATOM 1910 O GLY B 649 -0.618 -12.716 -14.646 1.00 0.00 O ATOM 0 H GLY B 649 -2.608 -14.798 -14.021 1.00 0.00 H new ATOM 0 HA2 GLY B 649 -3.001 -12.606 -15.689 1.00 0.00 H new ATOM 0 HA3 GLY B 649 -3.774 -12.204 -14.169 1.00 0.00 H new ATOM 1914 N ILE B 650 -1.672 -11.904 -12.830 1.00 0.00 N ATOM 1915 CA ILE B 650 -0.441 -11.515 -12.155 1.00 0.00 C ATOM 1916 C ILE B 650 0.308 -12.737 -11.629 1.00 0.00 C ATOM 1917 O ILE B 650 -0.303 -13.709 -11.183 1.00 0.00 O ATOM 1918 CB ILE B 650 -0.720 -10.556 -10.982 1.00 0.00 C ATOM 1919 CG1 ILE B 650 -1.438 -9.300 -11.482 1.00 0.00 C ATOM 1920 CG2 ILE B 650 0.578 -10.185 -10.280 1.00 0.00 C ATOM 1921 CD1 ILE B 650 -1.758 -8.310 -10.385 1.00 0.00 C ATOM 0 H ILE B 650 -2.523 -11.700 -12.306 1.00 0.00 H new ATOM 0 HA ILE B 650 0.175 -11.003 -12.894 1.00 0.00 H new ATOM 0 HB ILE B 650 -1.367 -11.062 -10.265 1.00 0.00 H new ATOM 0 HG12 ILE B 650 -0.817 -8.811 -12.232 1.00 0.00 H new ATOM 0 HG13 ILE B 650 -2.364 -9.593 -11.977 1.00 0.00 H new ATOM 0 HG21 ILE B 650 0.364 -9.507 -9.454 1.00 0.00 H new ATOM 0 HG22 ILE B 650 1.054 -11.087 -9.895 1.00 0.00 H new ATOM 0 HG23 ILE B 650 1.247 -9.695 -10.987 1.00 0.00 H new ATOM 0 HD11 ILE B 650 -2.266 -7.445 -10.812 1.00 0.00 H new ATOM 0 HD12 ILE B 650 -2.405 -8.782 -9.646 1.00 0.00 H new ATOM 0 HD13 ILE B 650 -0.834 -7.988 -9.905 1.00 0.00 H new ATOM 1932 N THR B 651 1.634 -12.679 -11.684 1.00 0.00 N ATOM 1933 CA THR B 651 2.466 -13.780 -11.214 1.00 0.00 C ATOM 1934 C THR B 651 3.040 -13.485 -9.833 1.00 0.00 C ATOM 1935 O THR B 651 2.840 -12.401 -9.286 1.00 0.00 O ATOM 1936 CB THR B 651 3.625 -14.065 -12.189 1.00 0.00 C ATOM 1937 OG1 THR B 651 3.371 -13.434 -13.449 1.00 0.00 O ATOM 1938 CG2 THR B 651 3.806 -15.561 -12.392 1.00 0.00 C ATOM 0 H THR B 651 2.155 -11.882 -12.049 1.00 0.00 H new ATOM 0 HA THR B 651 1.824 -14.659 -11.158 1.00 0.00 H new ATOM 0 HB THR B 651 4.541 -13.660 -11.759 1.00 0.00 H new ATOM 0 HG1 THR B 651 4.113 -13.618 -14.063 1.00 0.00 H new ATOM 0 HG21 THR B 651 4.630 -15.737 -13.084 1.00 0.00 H new ATOM 0 HG22 THR B 651 4.028 -16.034 -11.435 1.00 0.00 H new ATOM 0 HG23 THR B 651 2.890 -15.986 -12.802 1.00 0.00 H new ATOM 1946 N TYR B 652 3.753 -14.456 -9.275 1.00 0.00 N ATOM 1947 CA TYR B 652 4.355 -14.301 -7.955 1.00 0.00 C ATOM 1948 C TYR B 652 5.460 -13.250 -7.981 1.00 0.00 C ATOM 1949 O TYR B 652 5.614 -12.472 -7.039 1.00 0.00 O ATOM 1950 CB TYR B 652 4.917 -15.637 -7.467 1.00 0.00 C ATOM 1951 CG TYR B 652 6.028 -16.180 -8.337 1.00 0.00 C ATOM 1952 CD1 TYR B 652 5.748 -16.993 -9.428 1.00 0.00 C ATOM 1953 CD2 TYR B 652 7.358 -15.881 -8.067 1.00 0.00 C ATOM 1954 CE1 TYR B 652 6.760 -17.493 -10.225 1.00 0.00 C ATOM 1955 CE2 TYR B 652 8.376 -16.374 -8.860 1.00 0.00 C ATOM 1956 CZ TYR B 652 8.071 -17.180 -9.937 1.00 0.00 C ATOM 1957 OH TYR B 652 9.083 -17.674 -10.728 1.00 0.00 O ATOM 0 H TYR B 652 3.929 -15.359 -9.715 1.00 0.00 H new ATOM 0 HA TYR B 652 3.578 -13.969 -7.266 1.00 0.00 H new ATOM 0 HB2 TYR B 652 5.290 -15.515 -6.450 1.00 0.00 H new ATOM 0 HB3 TYR B 652 4.109 -16.368 -7.425 1.00 0.00 H new ATOM 0 HD1 TYR B 652 4.722 -17.239 -9.657 1.00 0.00 H new ATOM 0 HD2 TYR B 652 7.600 -15.252 -7.223 1.00 0.00 H new ATOM 0 HE1 TYR B 652 6.525 -18.125 -11.069 1.00 0.00 H new ATOM 0 HE2 TYR B 652 9.404 -16.130 -8.638 1.00 0.00 H new ATOM 0 HH TYR B 652 9.947 -17.358 -10.389 1.00 0.00 H new ATOM 1966 N GLN B 653 6.227 -13.234 -9.067 1.00 0.00 N ATOM 1967 CA GLN B 653 7.319 -12.278 -9.216 1.00 0.00 C ATOM 1968 C GLN B 653 6.783 -10.879 -9.501 1.00 0.00 C ATOM 1969 O GLN B 653 7.296 -9.889 -8.979 1.00 0.00 O ATOM 1970 CB GLN B 653 8.258 -12.717 -10.340 1.00 0.00 C ATOM 1971 CG GLN B 653 7.574 -12.832 -11.693 1.00 0.00 C ATOM 1972 CD GLN B 653 8.430 -13.549 -12.720 1.00 0.00 C ATOM 1973 OE1 GLN B 653 9.548 -13.974 -12.426 1.00 0.00 O ATOM 1974 NE2 GLN B 653 7.908 -13.687 -13.933 1.00 0.00 N ATOM 0 H GLN B 653 6.113 -13.871 -9.855 1.00 0.00 H new ATOM 0 HA GLN B 653 7.874 -12.249 -8.279 1.00 0.00 H new ATOM 0 HB2 GLN B 653 9.079 -12.004 -10.416 1.00 0.00 H new ATOM 0 HB3 GLN B 653 8.696 -13.681 -10.081 1.00 0.00 H new ATOM 0 HG2 GLN B 653 6.631 -13.366 -11.575 1.00 0.00 H new ATOM 0 HG3 GLN B 653 7.332 -11.834 -12.060 1.00 0.00 H new ATOM 0 HE21 GLN B 653 6.978 -13.319 -14.133 1.00 0.00 H new ATOM 0 HE22 GLN B 653 8.437 -14.161 -14.665 1.00 0.00 H new ATOM 1981 N ALA B 654 5.749 -10.805 -10.332 1.00 0.00 N ATOM 1982 CA ALA B 654 5.143 -9.528 -10.685 1.00 0.00 C ATOM 1983 C ALA B 654 4.362 -8.947 -9.511 1.00 0.00 C ATOM 1984 O ALA B 654 4.455 -7.754 -9.222 1.00 0.00 O ATOM 1985 CB ALA B 654 4.235 -9.691 -11.896 1.00 0.00 C ATOM 0 H ALA B 654 5.314 -11.615 -10.773 1.00 0.00 H new ATOM 0 HA ALA B 654 5.943 -8.832 -10.935 1.00 0.00 H new ATOM 0 HB1 ALA B 654 3.789 -8.729 -12.148 1.00 0.00 H new ATOM 0 HB2 ALA B 654 4.819 -10.054 -12.742 1.00 0.00 H new ATOM 0 HB3 ALA B 654 3.446 -10.407 -11.666 1.00 0.00 H new ATOM 1991 N TRP B 655 3.594 -9.796 -8.840 1.00 0.00 N ATOM 1992 CA TRP B 655 2.797 -9.366 -7.697 1.00 0.00 C ATOM 1993 C TRP B 655 3.684 -8.791 -6.599 1.00 0.00 C ATOM 1994 O TRP B 655 3.354 -7.773 -5.993 1.00 0.00 O ATOM 1995 CB TRP B 655 1.980 -10.538 -7.149 1.00 0.00 C ATOM 1996 CG TRP B 655 0.944 -10.123 -6.147 1.00 0.00 C ATOM 1997 CD1 TRP B 655 -0.398 -9.996 -6.362 1.00 0.00 C ATOM 1998 CD2 TRP B 655 1.168 -9.781 -4.775 1.00 0.00 C ATOM 1999 NE1 TRP B 655 -1.023 -9.594 -5.206 1.00 0.00 N ATOM 2000 CE2 TRP B 655 -0.085 -9.456 -4.219 1.00 0.00 C ATOM 2001 CE3 TRP B 655 2.303 -9.718 -3.962 1.00 0.00 C ATOM 2002 CZ2 TRP B 655 -0.230 -9.074 -2.887 1.00 0.00 C ATOM 2003 CZ3 TRP B 655 2.157 -9.338 -2.642 1.00 0.00 C ATOM 2004 CH2 TRP B 655 0.898 -9.021 -2.114 1.00 0.00 C ATOM 0 H TRP B 655 3.506 -10.786 -9.067 1.00 0.00 H new ATOM 0 HA TRP B 655 2.117 -8.584 -8.034 1.00 0.00 H new ATOM 0 HB2 TRP B 655 1.490 -11.049 -7.978 1.00 0.00 H new ATOM 0 HB3 TRP B 655 2.655 -11.257 -6.686 1.00 0.00 H new ATOM 0 HD1 TRP B 655 -0.895 -10.184 -7.302 1.00 0.00 H new ATOM 0 HE1 TRP B 655 -2.024 -9.426 -5.101 1.00 0.00 H new ATOM 0 HE3 TRP B 655 3.277 -9.962 -4.359 1.00 0.00 H new ATOM 0 HZ2 TRP B 655 -1.199 -8.828 -2.479 1.00 0.00 H new ATOM 0 HZ3 TRP B 655 3.028 -9.284 -2.006 1.00 0.00 H new ATOM 0 HH2 TRP B 655 0.817 -8.729 -1.077 1.00 0.00 H new ATOM 2014 N GLN B 656 4.811 -9.450 -6.349 1.00 0.00 N ATOM 2015 CA GLN B 656 5.746 -9.004 -5.323 1.00 0.00 C ATOM 2016 C GLN B 656 6.230 -7.586 -5.608 1.00 0.00 C ATOM 2017 O GLN B 656 6.099 -6.695 -4.770 1.00 0.00 O ATOM 2018 CB GLN B 656 6.940 -9.956 -5.241 1.00 0.00 C ATOM 2019 CG GLN B 656 6.705 -11.148 -4.326 1.00 0.00 C ATOM 2020 CD GLN B 656 7.958 -11.566 -3.581 1.00 0.00 C ATOM 2021 OE1 GLN B 656 8.751 -10.725 -3.156 1.00 0.00 O ATOM 2022 NE2 GLN B 656 8.143 -12.871 -3.416 1.00 0.00 N ATOM 0 H GLN B 656 5.099 -10.295 -6.843 1.00 0.00 H new ATOM 0 HA GLN B 656 5.224 -9.005 -4.366 1.00 0.00 H new ATOM 0 HB2 GLN B 656 7.175 -10.318 -6.242 1.00 0.00 H new ATOM 0 HB3 GLN B 656 7.811 -9.404 -4.888 1.00 0.00 H new ATOM 0 HG2 GLN B 656 5.924 -10.901 -3.607 1.00 0.00 H new ATOM 0 HG3 GLN B 656 6.340 -11.988 -4.916 1.00 0.00 H new ATOM 0 HE21 GLN B 656 7.460 -13.533 -3.784 1.00 0.00 H new ATOM 0 HE22 GLN B 656 8.968 -13.211 -2.921 1.00 0.00 H new ATOM 2029 N ALA B 657 6.791 -7.385 -6.796 1.00 0.00 N ATOM 2030 CA ALA B 657 7.293 -6.076 -7.192 1.00 0.00 C ATOM 2031 C ALA B 657 6.166 -5.051 -7.252 1.00 0.00 C ATOM 2032 O ALA B 657 6.290 -3.947 -6.721 1.00 0.00 O ATOM 2033 CB ALA B 657 7.999 -6.166 -8.537 1.00 0.00 C ATOM 0 H ALA B 657 6.909 -8.113 -7.501 1.00 0.00 H new ATOM 0 HA ALA B 657 8.009 -5.746 -6.439 1.00 0.00 H new ATOM 0 HB1 ALA B 657 8.369 -5.181 -8.820 1.00 0.00 H new ATOM 0 HB2 ALA B 657 8.836 -6.860 -8.463 1.00 0.00 H new ATOM 0 HB3 ALA B 657 7.298 -6.522 -9.293 1.00 0.00 H new ATOM 2039 N GLN B 658 5.068 -5.422 -7.901 1.00 0.00 N ATOM 2040 CA GLN B 658 3.919 -4.533 -8.031 1.00 0.00 C ATOM 2041 C GLN B 658 3.427 -4.077 -6.662 1.00 0.00 C ATOM 2042 O GLN B 658 3.275 -2.881 -6.413 1.00 0.00 O ATOM 2043 CB GLN B 658 2.788 -5.233 -8.786 1.00 0.00 C ATOM 2044 CG GLN B 658 2.903 -5.120 -10.298 1.00 0.00 C ATOM 2045 CD GLN B 658 1.638 -5.549 -11.014 1.00 0.00 C ATOM 2046 OE1 GLN B 658 0.701 -4.766 -11.165 1.00 0.00 O ATOM 2047 NE2 GLN B 658 1.604 -6.800 -11.458 1.00 0.00 N ATOM 0 H GLN B 658 4.949 -6.332 -8.345 1.00 0.00 H new ATOM 0 HA GLN B 658 4.233 -3.655 -8.595 1.00 0.00 H new ATOM 0 HB2 GLN B 658 2.776 -6.287 -8.509 1.00 0.00 H new ATOM 0 HB3 GLN B 658 1.835 -4.809 -8.470 1.00 0.00 H new ATOM 0 HG2 GLN B 658 3.135 -4.089 -10.565 1.00 0.00 H new ATOM 0 HG3 GLN B 658 3.736 -5.733 -10.642 1.00 0.00 H new ATOM 0 HE21 GLN B 658 2.404 -7.415 -11.311 1.00 0.00 H new ATOM 0 HE22 GLN B 658 0.778 -7.146 -11.946 1.00 0.00 H new ATOM 2054 N TRP B 659 3.179 -5.037 -5.779 1.00 0.00 N ATOM 2055 CA TRP B 659 2.702 -4.733 -4.434 1.00 0.00 C ATOM 2056 C TRP B 659 3.601 -3.704 -3.758 1.00 0.00 C ATOM 2057 O TRP B 659 3.127 -2.681 -3.266 1.00 0.00 O ATOM 2058 CB TRP B 659 2.643 -6.008 -3.591 1.00 0.00 C ATOM 2059 CG TRP B 659 2.129 -5.780 -2.202 1.00 0.00 C ATOM 2060 CD1 TRP B 659 2.872 -5.555 -1.079 1.00 0.00 C ATOM 2061 CD2 TRP B 659 0.758 -5.753 -1.789 1.00 0.00 C ATOM 2062 NE1 TRP B 659 2.047 -5.392 0.007 1.00 0.00 N ATOM 2063 CE2 TRP B 659 0.746 -5.508 -0.402 1.00 0.00 C ATOM 2064 CE3 TRP B 659 -0.460 -5.912 -2.456 1.00 0.00 C ATOM 2065 CZ2 TRP B 659 -0.437 -5.419 0.327 1.00 0.00 C ATOM 2066 CZ3 TRP B 659 -1.632 -5.825 -1.731 1.00 0.00 C ATOM 2067 CH2 TRP B 659 -1.615 -5.579 -0.352 1.00 0.00 C ATOM 0 H TRP B 659 3.300 -6.032 -5.969 1.00 0.00 H new ATOM 0 HA TRP B 659 1.699 -4.314 -4.517 1.00 0.00 H new ATOM 0 HB2 TRP B 659 2.005 -6.736 -4.091 1.00 0.00 H new ATOM 0 HB3 TRP B 659 3.641 -6.444 -3.534 1.00 0.00 H new ATOM 0 HD1 TRP B 659 3.951 -5.512 -1.049 1.00 0.00 H new ATOM 0 HE1 TRP B 659 2.354 -5.213 0.963 1.00 0.00 H new ATOM 0 HE3 TRP B 659 -0.484 -6.100 -3.519 1.00 0.00 H new ATOM 0 HZ2 TRP B 659 -0.426 -5.230 1.390 1.00 0.00 H new ATOM 0 HZ3 TRP B 659 -2.579 -5.949 -2.236 1.00 0.00 H new ATOM 0 HH2 TRP B 659 -2.549 -5.514 0.186 1.00 0.00 H new ATOM 2077 N ASN B 660 4.901 -3.983 -3.736 1.00 0.00 N ATOM 2078 CA ASN B 660 5.866 -3.079 -3.120 1.00 0.00 C ATOM 2079 C ASN B 660 5.705 -1.661 -3.658 1.00 0.00 C ATOM 2080 O ASN B 660 5.583 -0.706 -2.891 1.00 0.00 O ATOM 2081 CB ASN B 660 7.292 -3.574 -3.372 1.00 0.00 C ATOM 2082 CG ASN B 660 8.164 -3.476 -2.136 1.00 0.00 C ATOM 2083 OD1 ASN B 660 8.234 -2.428 -1.493 1.00 0.00 O ATOM 2084 ND2 ASN B 660 8.836 -4.571 -1.798 1.00 0.00 N ATOM 0 H ASN B 660 5.310 -4.827 -4.137 1.00 0.00 H new ATOM 0 HA ASN B 660 5.678 -3.064 -2.046 1.00 0.00 H new ATOM 0 HB2 ASN B 660 7.260 -4.610 -3.710 1.00 0.00 H new ATOM 0 HB3 ASN B 660 7.740 -2.990 -4.176 1.00 0.00 H new ATOM 0 HD21 ASN B 660 9.440 -4.565 -0.976 1.00 0.00 H new ATOM 0 HD22 ASN B 660 8.748 -5.417 -2.360 1.00 0.00 H new ATOM 2090 N GLN B 661 5.705 -1.532 -4.982 1.00 0.00 N ATOM 2091 CA GLN B 661 5.560 -0.230 -5.622 1.00 0.00 C ATOM 2092 C GLN B 661 4.307 0.484 -5.125 1.00 0.00 C ATOM 2093 O GLN B 661 4.347 1.668 -4.794 1.00 0.00 O ATOM 2094 CB GLN B 661 5.500 -0.390 -7.142 1.00 0.00 C ATOM 2095 CG GLN B 661 6.830 -0.783 -7.765 1.00 0.00 C ATOM 2096 CD GLN B 661 7.926 0.225 -7.482 1.00 0.00 C ATOM 2097 OE1 GLN B 661 7.695 1.434 -7.503 1.00 0.00 O ATOM 2098 NE2 GLN B 661 9.130 -0.269 -7.215 1.00 0.00 N ATOM 0 H GLN B 661 5.804 -2.313 -5.631 1.00 0.00 H new ATOM 0 HA GLN B 661 6.429 0.374 -5.361 1.00 0.00 H new ATOM 0 HB2 GLN B 661 4.754 -1.145 -7.390 1.00 0.00 H new ATOM 0 HB3 GLN B 661 5.164 0.548 -7.585 1.00 0.00 H new ATOM 0 HG2 GLN B 661 7.131 -1.759 -7.384 1.00 0.00 H new ATOM 0 HG3 GLN B 661 6.706 -0.886 -8.843 1.00 0.00 H new ATOM 0 HE21 GLN B 661 9.277 -1.278 -7.208 1.00 0.00 H new ATOM 0 HE22 GLN B 661 9.907 0.361 -7.017 1.00 0.00 H new ATOM 2105 N ALA B 662 3.197 -0.244 -5.075 1.00 0.00 N ATOM 2106 CA ALA B 662 1.933 0.319 -4.616 1.00 0.00 C ATOM 2107 C ALA B 662 2.066 0.891 -3.208 1.00 0.00 C ATOM 2108 O ALA B 662 1.744 2.054 -2.967 1.00 0.00 O ATOM 2109 CB ALA B 662 0.839 -0.736 -4.657 1.00 0.00 C ATOM 0 H ALA B 662 3.147 -1.226 -5.347 1.00 0.00 H new ATOM 0 HA ALA B 662 1.662 1.134 -5.287 1.00 0.00 H new ATOM 0 HB1 ALA B 662 -0.099 -0.301 -4.312 1.00 0.00 H new ATOM 0 HB2 ALA B 662 0.718 -1.095 -5.679 1.00 0.00 H new ATOM 0 HB3 ALA B 662 1.113 -1.569 -4.010 1.00 0.00 H new ATOM 2115 N MET B 663 2.542 0.066 -2.282 1.00 0.00 N ATOM 2116 CA MET B 663 2.718 0.491 -0.898 1.00 0.00 C ATOM 2117 C MET B 663 3.539 1.775 -0.823 1.00 0.00 C ATOM 2118 O MET B 663 3.108 2.763 -0.231 1.00 0.00 O ATOM 2119 CB MET B 663 3.399 -0.612 -0.085 1.00 0.00 C ATOM 2120 CG MET B 663 3.640 -0.236 1.368 1.00 0.00 C ATOM 2121 SD MET B 663 2.568 -1.134 2.505 1.00 0.00 S ATOM 2122 CE MET B 663 0.959 -0.524 2.007 1.00 0.00 C ATOM 0 H MET B 663 2.813 -0.900 -2.464 1.00 0.00 H new ATOM 0 HA MET B 663 1.732 0.686 -0.477 1.00 0.00 H new ATOM 0 HB2 MET B 663 2.784 -1.511 -0.122 1.00 0.00 H new ATOM 0 HB3 MET B 663 4.353 -0.859 -0.551 1.00 0.00 H new ATOM 0 HG2 MET B 663 4.681 -0.435 1.623 1.00 0.00 H new ATOM 0 HG3 MET B 663 3.480 0.835 1.493 1.00 0.00 H new ATOM 0 HE1 MET B 663 0.272 -0.577 2.852 1.00 0.00 H new ATOM 0 HE2 MET B 663 1.049 0.511 1.676 1.00 0.00 H new ATOM 0 HE3 MET B 663 0.576 -1.134 1.189 1.00 0.00 H new ATOM 2130 N GLU B 664 4.723 1.750 -1.428 1.00 0.00 N ATOM 2131 CA GLU B 664 5.604 2.912 -1.427 1.00 0.00 C ATOM 2132 C GLU B 664 4.866 4.154 -1.916 1.00 0.00 C ATOM 2133 O GLU B 664 5.138 5.269 -1.467 1.00 0.00 O ATOM 2134 CB GLU B 664 6.827 2.653 -2.310 1.00 0.00 C ATOM 2135 CG GLU B 664 8.142 3.051 -1.660 1.00 0.00 C ATOM 2136 CD GLU B 664 9.003 1.854 -1.307 1.00 0.00 C ATOM 2137 OE1 GLU B 664 9.707 1.344 -2.203 1.00 0.00 O ATOM 2138 OE2 GLU B 664 8.974 1.428 -0.132 1.00 0.00 O ATOM 0 H GLU B 664 5.093 0.939 -1.924 1.00 0.00 H new ATOM 0 HA GLU B 664 5.934 3.085 -0.403 1.00 0.00 H new ATOM 0 HB2 GLU B 664 6.863 1.594 -2.565 1.00 0.00 H new ATOM 0 HB3 GLU B 664 6.713 3.202 -3.245 1.00 0.00 H new ATOM 0 HG2 GLU B 664 8.694 3.704 -2.336 1.00 0.00 H new ATOM 0 HG3 GLU B 664 7.937 3.626 -0.757 1.00 0.00 H new ATOM 2143 N ASP B 665 3.931 3.956 -2.838 1.00 0.00 N ATOM 2144 CA ASP B 665 3.152 5.058 -3.388 1.00 0.00 C ATOM 2145 C ASP B 665 2.171 5.601 -2.354 1.00 0.00 C ATOM 2146 O ASP B 665 2.074 6.812 -2.148 1.00 0.00 O ATOM 2147 CB ASP B 665 2.394 4.603 -4.637 1.00 0.00 C ATOM 2148 CG ASP B 665 2.125 5.745 -5.599 1.00 0.00 C ATOM 2149 OD1 ASP B 665 2.601 6.868 -5.334 1.00 0.00 O ATOM 2150 OD2 ASP B 665 1.435 5.515 -6.614 1.00 0.00 O ATOM 0 H ASP B 665 3.694 3.041 -3.221 1.00 0.00 H new ATOM 0 HA ASP B 665 3.843 5.856 -3.661 1.00 0.00 H new ATOM 0 HB2 ASP B 665 2.970 3.830 -5.147 1.00 0.00 H new ATOM 0 HB3 ASP B 665 1.448 4.151 -4.340 1.00 0.00 H new ATOM 2154 N LEU B 666 1.446 4.698 -1.704 1.00 0.00 N ATOM 2155 CA LEU B 666 0.470 5.085 -0.690 1.00 0.00 C ATOM 2156 C LEU B 666 1.137 5.872 0.433 1.00 0.00 C ATOM 2157 O LEU B 666 0.602 6.876 0.905 1.00 0.00 O ATOM 2158 CB LEU B 666 -0.220 3.845 -0.119 1.00 0.00 C ATOM 2159 CG LEU B 666 -0.787 2.861 -1.143 1.00 0.00 C ATOM 2160 CD1 LEU B 666 -0.742 1.442 -0.601 1.00 0.00 C ATOM 2161 CD2 LEU B 666 -2.211 3.245 -1.519 1.00 0.00 C ATOM 0 H LEU B 666 1.515 3.692 -1.860 1.00 0.00 H new ATOM 0 HA LEU B 666 -0.277 5.723 -1.163 1.00 0.00 H new ATOM 0 HB2 LEU B 666 0.495 3.313 0.509 1.00 0.00 H new ATOM 0 HB3 LEU B 666 -1.033 4.172 0.529 1.00 0.00 H new ATOM 0 HG LEU B 666 -0.170 2.905 -2.041 1.00 0.00 H new ATOM 0 HD11 LEU B 666 -1.150 0.756 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU B 666 0.290 1.169 -0.382 1.00 0.00 H new ATOM 0 HD13 LEU B 666 -1.334 1.382 0.312 1.00 0.00 H new ATOM 0 HD21 LEU B 666 -2.599 2.534 -2.249 1.00 0.00 H new ATOM 0 HD22 LEU B 666 -2.839 3.230 -0.628 1.00 0.00 H new ATOM 0 HD23 LEU B 666 -2.216 4.246 -1.950 1.00 0.00 H new ATOM 2172 N VAL B 667 2.310 5.411 0.857 1.00 0.00 N ATOM 2173 CA VAL B 667 3.052 6.074 1.922 1.00 0.00 C ATOM 2174 C VAL B 667 3.440 7.493 1.522 1.00 0.00 C ATOM 2175 O VAL B 667 3.305 8.431 2.308 1.00 0.00 O ATOM 2176 CB VAL B 667 4.326 5.291 2.291 1.00 0.00 C ATOM 2177 CG1 VAL B 667 4.979 5.884 3.530 1.00 0.00 C ATOM 2178 CG2 VAL B 667 4.003 3.819 2.502 1.00 0.00 C ATOM 0 H VAL B 667 2.766 4.581 0.479 1.00 0.00 H new ATOM 0 HA VAL B 667 2.393 6.111 2.789 1.00 0.00 H new ATOM 0 HB VAL B 667 5.032 5.371 1.465 1.00 0.00 H new ATOM 0 HG11 VAL B 667 5.877 5.317 3.775 1.00 0.00 H new ATOM 0 HG12 VAL B 667 5.247 6.923 3.338 1.00 0.00 H new ATOM 0 HG13 VAL B 667 4.282 5.837 4.366 1.00 0.00 H new ATOM 0 HG21 VAL B 667 4.914 3.280 2.762 1.00 0.00 H new ATOM 0 HG22 VAL B 667 3.278 3.718 3.310 1.00 0.00 H new ATOM 0 HG23 VAL B 667 3.585 3.403 1.585 1.00 0.00 H new ATOM 2188 N ARG B 668 3.924 7.644 0.293 1.00 0.00 N ATOM 2189 CA ARG B 668 4.333 8.948 -0.212 1.00 0.00 C ATOM 2190 C ARG B 668 3.121 9.846 -0.445 1.00 0.00 C ATOM 2191 O ARG B 668 3.189 11.059 -0.252 1.00 0.00 O ATOM 2192 CB ARG B 668 5.121 8.791 -1.514 1.00 0.00 C ATOM 2193 CG ARG B 668 6.542 8.292 -1.309 1.00 0.00 C ATOM 2194 CD ARG B 668 7.226 7.999 -2.635 1.00 0.00 C ATOM 2195 NE ARG B 668 7.356 9.197 -3.461 1.00 0.00 N ATOM 2196 CZ ARG B 668 7.992 9.220 -4.627 1.00 0.00 C ATOM 2197 NH1 ARG B 668 8.551 8.117 -5.103 1.00 0.00 N ATOM 2198 NH2 ARG B 668 8.066 10.349 -5.321 1.00 0.00 N ATOM 0 H ARG B 668 4.042 6.879 -0.371 1.00 0.00 H new ATOM 0 HA ARG B 668 4.972 9.415 0.538 1.00 0.00 H new ATOM 0 HB2 ARG B 668 4.592 8.097 -2.168 1.00 0.00 H new ATOM 0 HB3 ARG B 668 5.153 9.752 -2.028 1.00 0.00 H new ATOM 0 HG2 ARG B 668 7.115 9.039 -0.760 1.00 0.00 H new ATOM 0 HG3 ARG B 668 6.527 7.389 -0.699 1.00 0.00 H new ATOM 0 HD2 ARG B 668 8.214 7.579 -2.448 1.00 0.00 H new ATOM 0 HD3 ARG B 668 6.656 7.245 -3.178 1.00 0.00 H new ATOM 0 HE ARG B 668 6.935 10.063 -3.124 1.00 0.00 H new ATOM 0 HH11 ARG B 668 8.494 7.247 -4.574 1.00 0.00 H new ATOM 0 HH12 ARG B 668 9.039 8.138 -5.999 1.00 0.00 H new ATOM 0 HH21 ARG B 668 7.634 11.199 -4.959 1.00 0.00 H new ATOM 0 HH22 ARG B 668 8.554 10.366 -6.216 1.00 0.00 H new ATOM 2209 N ALA B 669 2.014 9.240 -0.861 1.00 0.00 N ATOM 2210 CA ALA B 669 0.787 9.983 -1.117 1.00 0.00 C ATOM 2211 C ALA B 669 0.350 10.765 0.116 1.00 0.00 C ATOM 2212 O ALA B 669 -0.176 11.874 0.007 1.00 0.00 O ATOM 2213 CB ALA B 669 -0.320 9.038 -1.564 1.00 0.00 C ATOM 0 H ALA B 669 1.942 8.236 -1.028 1.00 0.00 H new ATOM 0 HA ALA B 669 0.986 10.697 -1.916 1.00 0.00 H new ATOM 0 HB1 ALA B 669 -1.231 9.607 -1.752 1.00 0.00 H new ATOM 0 HB2 ALA B 669 -0.016 8.528 -2.478 1.00 0.00 H new ATOM 0 HB3 ALA B 669 -0.507 8.301 -0.783 1.00 0.00 H new ATOM 2219 N TYR B 670 0.571 10.182 1.290 1.00 0.00 N ATOM 2220 CA TYR B 670 0.197 10.824 2.544 1.00 0.00 C ATOM 2221 C TYR B 670 1.130 11.989 2.859 1.00 0.00 C ATOM 2222 O TYR B 670 0.689 13.128 3.021 1.00 0.00 O ATOM 2223 CB TYR B 670 0.224 9.810 3.688 1.00 0.00 C ATOM 2224 CG TYR B 670 -0.467 10.293 4.943 1.00 0.00 C ATOM 2225 CD1 TYR B 670 0.049 11.350 5.681 1.00 0.00 C ATOM 2226 CD2 TYR B 670 -1.637 9.691 5.390 1.00 0.00 C ATOM 2227 CE1 TYR B 670 -0.578 11.795 6.828 1.00 0.00 C ATOM 2228 CE2 TYR B 670 -2.273 10.130 6.535 1.00 0.00 C ATOM 2229 CZ TYR B 670 -1.739 11.181 7.251 1.00 0.00 C ATOM 2230 OH TYR B 670 -2.369 11.622 8.393 1.00 0.00 O ATOM 0 H TYR B 670 1.007 9.266 1.399 1.00 0.00 H new ATOM 0 HA TYR B 670 -0.816 11.213 2.436 1.00 0.00 H new ATOM 0 HB2 TYR B 670 -0.250 8.887 3.355 1.00 0.00 H new ATOM 0 HB3 TYR B 670 1.260 9.569 3.924 1.00 0.00 H new ATOM 0 HD1 TYR B 670 0.957 11.833 5.352 1.00 0.00 H new ATOM 0 HD2 TYR B 670 -2.056 8.866 4.833 1.00 0.00 H new ATOM 0 HE1 TYR B 670 -0.162 12.618 7.390 1.00 0.00 H new ATOM 0 HE2 TYR B 670 -3.183 9.653 6.868 1.00 0.00 H new ATOM 0 HH TYR B 670 -3.173 11.085 8.551 1.00 0.00 H new ATOM 2239 N HIS B 671 2.424 11.696 2.944 1.00 0.00 N ATOM 2240 CA HIS B 671 3.421 12.718 3.239 1.00 0.00 C ATOM 2241 C HIS B 671 3.424 13.800 2.164 1.00 0.00 C ATOM 2242 O HIS B 671 3.935 14.899 2.377 1.00 0.00 O ATOM 2243 CB HIS B 671 4.811 12.088 3.349 1.00 0.00 C ATOM 2244 CG HIS B 671 5.634 12.647 4.469 1.00 0.00 C ATOM 2245 ND1 HIS B 671 5.457 12.283 5.787 1.00 0.00 N ATOM 2246 CD2 HIS B 671 6.645 13.547 4.461 1.00 0.00 C ATOM 2247 CE1 HIS B 671 6.323 12.936 6.542 1.00 0.00 C ATOM 2248 NE2 HIS B 671 7.056 13.709 5.761 1.00 0.00 N ATOM 0 H HIS B 671 2.806 10.759 2.813 1.00 0.00 H new ATOM 0 HA HIS B 671 3.162 13.178 4.193 1.00 0.00 H new ATOM 0 HB2 HIS B 671 4.704 11.012 3.490 1.00 0.00 H new ATOM 0 HB3 HIS B 671 5.343 12.235 2.409 1.00 0.00 H new ATOM 0 HD2 HIS B 671 7.052 14.045 3.594 1.00 0.00 H new ATOM 0 HE1 HIS B 671 6.416 12.852 7.615 1.00 0.00 H new ATOM 0 HE2 HIS B 671 7.806 14.326 6.073 1.00 0.00 H new ATOM 2255 N ALA B 672 2.852 13.480 1.008 1.00 0.00 N ATOM 2256 CA ALA B 672 2.788 14.425 -0.100 1.00 0.00 C ATOM 2257 C ALA B 672 2.191 15.755 0.345 1.00 0.00 C ATOM 2258 O ALA B 672 2.737 16.820 0.058 1.00 0.00 O ATOM 2259 CB ALA B 672 1.979 13.839 -1.247 1.00 0.00 C ATOM 0 H ALA B 672 2.426 12.574 0.814 1.00 0.00 H new ATOM 0 HA ALA B 672 3.805 14.611 -0.445 1.00 0.00 H new ATOM 0 HB1 ALA B 672 1.939 14.555 -2.068 1.00 0.00 H new ATOM 0 HB2 ALA B 672 2.450 12.918 -1.591 1.00 0.00 H new ATOM 0 HB3 ALA B 672 0.967 13.623 -0.905 1.00 0.00 H new ATOM 2265 N MET B 673 1.066 15.686 1.050 1.00 0.00 N ATOM 2266 CA MET B 673 0.395 16.886 1.536 1.00 0.00 C ATOM 2267 C MET B 673 1.346 17.743 2.366 1.00 0.00 C ATOM 2268 O MET B 673 1.236 18.968 2.386 1.00 0.00 O ATOM 2269 CB MET B 673 -0.830 16.509 2.371 1.00 0.00 C ATOM 2270 CG MET B 673 -0.497 15.673 3.597 1.00 0.00 C ATOM 2271 SD MET B 673 -0.918 16.506 5.140 1.00 0.00 S ATOM 2272 CE MET B 673 -2.480 15.722 5.533 1.00 0.00 C ATOM 0 H MET B 673 0.601 14.813 1.297 1.00 0.00 H new ATOM 0 HA MET B 673 0.072 17.466 0.672 1.00 0.00 H new ATOM 0 HB2 MET B 673 -1.337 17.420 2.689 1.00 0.00 H new ATOM 0 HB3 MET B 673 -1.531 15.957 1.744 1.00 0.00 H new ATOM 0 HG2 MET B 673 -1.033 14.725 3.542 1.00 0.00 H new ATOM 0 HG3 MET B 673 0.567 15.438 3.594 1.00 0.00 H new ATOM 0 HE1 MET B 673 -3.043 16.355 6.219 1.00 0.00 H new ATOM 0 HE2 MET B 673 -3.055 15.577 4.618 1.00 0.00 H new ATOM 0 HE3 MET B 673 -2.294 14.756 6.002 1.00 0.00 H new ATOM 2280 N SER B 674 2.278 17.089 3.052 1.00 0.00 N ATOM 2281 CA SER B 674 3.246 17.790 3.888 1.00 0.00 C ATOM 2282 C SER B 674 4.330 18.439 3.034 1.00 0.00 C ATOM 2283 O SER B 674 4.969 19.406 3.451 1.00 0.00 O ATOM 2284 CB SER B 674 3.879 16.825 4.891 1.00 0.00 C ATOM 2285 OG SER B 674 3.040 15.706 5.123 1.00 0.00 O ATOM 0 H SER B 674 2.383 16.074 3.045 1.00 0.00 H new ATOM 0 HA SER B 674 2.719 18.574 4.433 1.00 0.00 H new ATOM 0 HB2 SER B 674 4.845 16.487 4.515 1.00 0.00 H new ATOM 0 HB3 SER B 674 4.066 17.344 5.831 1.00 0.00 H new ATOM 0 HG SER B 674 3.468 15.104 5.766 1.00 0.00 H new ATOM 2290 N SER B 675 4.533 17.902 1.836 1.00 0.00 N ATOM 2291 CA SER B 675 5.543 18.424 0.923 1.00 0.00 C ATOM 2292 C SER B 675 5.302 19.904 0.639 1.00 0.00 C ATOM 2293 O SER B 675 6.223 20.637 0.277 1.00 0.00 O ATOM 2294 CB SER B 675 5.537 17.633 -0.386 1.00 0.00 C ATOM 2295 OG SER B 675 6.659 17.963 -1.185 1.00 0.00 O ATOM 0 H SER B 675 4.011 17.104 1.474 1.00 0.00 H new ATOM 0 HA SER B 675 6.518 18.316 1.398 1.00 0.00 H new ATOM 0 HB2 SER B 675 5.542 16.565 -0.169 1.00 0.00 H new ATOM 0 HB3 SER B 675 4.620 17.842 -0.937 1.00 0.00 H new ATOM 0 HG SER B 675 6.633 17.443 -2.015 1.00 0.00 H new ATOM 2300 N THR B 676 4.057 20.337 0.802 1.00 0.00 N ATOM 2301 CA THR B 676 3.692 21.728 0.561 1.00 0.00 C ATOM 2302 C THR B 676 4.437 22.663 1.508 1.00 0.00 C ATOM 2303 O THR B 676 4.517 23.869 1.270 1.00 0.00 O ATOM 2304 CB THR B 676 2.177 21.949 0.727 1.00 0.00 C ATOM 2305 OG1 THR B 676 1.466 20.762 0.359 1.00 0.00 O ATOM 2306 CG2 THR B 676 1.704 23.115 -0.128 1.00 0.00 C ATOM 0 H THR B 676 3.283 19.744 1.100 1.00 0.00 H new ATOM 0 HA THR B 676 3.974 21.955 -0.467 1.00 0.00 H new ATOM 0 HB THR B 676 1.978 22.182 1.773 1.00 0.00 H new ATOM 0 HG1 THR B 676 1.349 20.193 1.148 1.00 0.00 H new ATOM 0 HG21 THR B 676 0.631 23.252 0.005 1.00 0.00 H new ATOM 0 HG22 THR B 676 2.226 24.023 0.174 1.00 0.00 H new ATOM 0 HG23 THR B 676 1.915 22.906 -1.177 1.00 0.00 H new ATOM 2314 N HIS B 677 4.982 22.099 2.581 1.00 0.00 N ATOM 2315 CA HIS B 677 5.723 22.883 3.564 1.00 0.00 C ATOM 2316 C HIS B 677 6.855 23.659 2.897 1.00 0.00 C ATOM 2317 O HIS B 677 7.285 24.698 3.397 1.00 0.00 O ATOM 2318 CB HIS B 677 6.286 21.973 4.655 1.00 0.00 C ATOM 2319 CG HIS B 677 7.508 21.217 4.232 1.00 0.00 C ATOM 2320 ND1 HIS B 677 7.702 20.344 3.216 1.00 0.00 N flip ATOM 2321 CD2 HIS B 677 8.718 21.316 4.886 1.00 0.00 C flip ATOM 2322 CE1 HIS B 677 9.012 19.937 3.273 1.00 0.00 C flip ATOM 2323 NE2 HIS B 677 9.603 20.538 4.290 1.00 0.00 N flip ATOM 0 H HIS B 677 4.925 21.103 2.792 1.00 0.00 H new ATOM 0 HA HIS B 677 5.035 23.596 4.017 1.00 0.00 H new ATOM 0 HB2 HIS B 677 6.526 22.575 5.531 1.00 0.00 H new ATOM 0 HB3 HIS B 677 5.516 21.263 4.958 1.00 0.00 H new ATOM 0 HD2 HIS B 677 8.912 21.933 5.751 1.00 0.00 H new ATOM 0 HE1 HIS B 677 9.483 19.239 2.596 1.00 0.00 H new ATOM 0 HE2 HIS B 677 10.577 20.421 4.568 1.00 0.00 H new ATOM 2330 N GLU B 678 7.333 23.147 1.767 1.00 0.00 N ATOM 2331 CA GLU B 678 8.416 23.792 1.034 1.00 0.00 C ATOM 2332 C GLU B 678 8.101 25.263 0.779 1.00 0.00 C ATOM 2333 O GLU B 678 9.001 26.096 0.697 1.00 0.00 O ATOM 2334 CB GLU B 678 8.662 23.074 -0.294 1.00 0.00 C ATOM 2335 CG GLU B 678 9.268 21.690 -0.134 1.00 0.00 C ATOM 2336 CD GLU B 678 9.742 21.105 -1.451 1.00 0.00 C ATOM 2337 OE1 GLU B 678 8.884 20.713 -2.269 1.00 0.00 O ATOM 2338 OE2 GLU B 678 10.971 21.040 -1.663 1.00 0.00 O ATOM 0 H GLU B 678 6.987 22.288 1.340 1.00 0.00 H new ATOM 0 HA GLU B 678 9.318 23.732 1.643 1.00 0.00 H new ATOM 0 HB2 GLU B 678 7.718 22.988 -0.831 1.00 0.00 H new ATOM 0 HB3 GLU B 678 9.325 23.683 -0.909 1.00 0.00 H new ATOM 0 HG2 GLU B 678 10.108 21.743 0.559 1.00 0.00 H new ATOM 0 HG3 GLU B 678 8.529 21.023 0.311 1.00 0.00 H new ATOM 2343 N ALA B 679 6.814 25.573 0.655 1.00 0.00 N ATOM 2344 CA ALA B 679 6.378 26.942 0.410 1.00 0.00 C ATOM 2345 C ALA B 679 6.990 27.902 1.424 1.00 0.00 C ATOM 2346 O ALA B 679 7.221 29.073 1.124 1.00 0.00 O ATOM 2347 CB ALA B 679 4.859 27.027 0.449 1.00 0.00 C ATOM 0 H ALA B 679 6.056 24.894 0.720 1.00 0.00 H new ATOM 0 HA ALA B 679 6.722 27.235 -0.582 1.00 0.00 H new ATOM 0 HB1 ALA B 679 4.547 28.055 0.264 1.00 0.00 H new ATOM 0 HB2 ALA B 679 4.438 26.377 -0.318 1.00 0.00 H new ATOM 0 HB3 ALA B 679 4.502 26.710 1.429 1.00 0.00 H new ATOM 2353 N ASN B 680 7.249 27.399 2.626 1.00 0.00 N ATOM 2354 CA ASN B 680 7.834 28.213 3.686 1.00 0.00 C ATOM 2355 C ASN B 680 9.160 28.820 3.237 1.00 0.00 C ATOM 2356 O ASN B 680 9.347 30.036 3.285 1.00 0.00 O ATOM 2357 CB ASN B 680 8.045 27.373 4.946 1.00 0.00 C ATOM 2358 CG ASN B 680 7.667 28.120 6.211 1.00 0.00 C ATOM 2359 OD1 ASN B 680 6.651 27.825 6.840 1.00 0.00 O ATOM 2360 ND2 ASN B 680 8.486 29.095 6.588 1.00 0.00 N ATOM 0 H ASN B 680 7.063 26.432 2.891 1.00 0.00 H new ATOM 0 HA ASN B 680 7.141 29.024 3.911 1.00 0.00 H new ATOM 0 HB2 ASN B 680 7.452 26.461 4.875 1.00 0.00 H new ATOM 0 HB3 ASN B 680 9.090 27.069 5.006 1.00 0.00 H new ATOM 0 HD21 ASN B 680 8.284 29.634 7.430 1.00 0.00 H new ATOM 0 HD22 ASN B 680 9.317 29.305 6.036 1.00 0.00 H new ATOM 2366 N THR B 681 10.078 27.964 2.800 1.00 0.00 N ATOM 2367 CA THR B 681 11.386 28.414 2.343 1.00 0.00 C ATOM 2368 C THR B 681 11.292 29.079 0.974 1.00 0.00 C ATOM 2369 O THR B 681 12.102 29.941 0.635 1.00 0.00 O ATOM 2370 CB THR B 681 12.387 27.246 2.266 1.00 0.00 C ATOM 2371 OG1 THR B 681 11.725 26.064 1.803 1.00 0.00 O ATOM 2372 CG2 THR B 681 13.017 26.982 3.625 1.00 0.00 C ATOM 0 H THR B 681 9.939 26.955 2.753 1.00 0.00 H new ATOM 0 HA THR B 681 11.742 29.141 3.073 1.00 0.00 H new ATOM 0 HB THR B 681 13.176 27.518 1.565 1.00 0.00 H new ATOM 0 HG1 THR B 681 12.368 25.326 1.755 1.00 0.00 H new ATOM 0 HG21 THR B 681 13.720 26.153 3.545 1.00 0.00 H new ATOM 0 HG22 THR B 681 13.545 27.875 3.961 1.00 0.00 H new ATOM 0 HG23 THR B 681 12.238 26.729 4.344 1.00 0.00 H new ATOM 2380 N MET B 682 10.298 28.673 0.192 1.00 0.00 N ATOM 2381 CA MET B 682 10.098 29.231 -1.140 1.00 0.00 C ATOM 2382 C MET B 682 10.053 30.756 -1.089 1.00 0.00 C ATOM 2383 O MET B 682 10.435 31.429 -2.046 1.00 0.00 O ATOM 2384 CB MET B 682 8.804 28.692 -1.753 1.00 0.00 C ATOM 2385 CG MET B 682 8.949 27.303 -2.353 1.00 0.00 C ATOM 2386 SD MET B 682 7.543 26.842 -3.385 1.00 0.00 S ATOM 2387 CE MET B 682 6.894 25.447 -2.468 1.00 0.00 C ATOM 0 H MET B 682 9.619 27.960 0.457 1.00 0.00 H new ATOM 0 HA MET B 682 10.940 28.930 -1.763 1.00 0.00 H new ATOM 0 HB2 MET B 682 8.030 28.669 -0.986 1.00 0.00 H new ATOM 0 HB3 MET B 682 8.464 29.380 -2.527 1.00 0.00 H new ATOM 0 HG2 MET B 682 9.861 27.262 -2.949 1.00 0.00 H new ATOM 0 HG3 MET B 682 9.060 26.574 -1.550 1.00 0.00 H new ATOM 0 HE1 MET B 682 6.629 24.648 -3.160 1.00 0.00 H new ATOM 0 HE2 MET B 682 7.650 25.087 -1.770 1.00 0.00 H new ATOM 0 HE3 MET B 682 6.007 25.756 -1.915 1.00 0.00 H new ATOM 2395 N ALA B 683 9.585 31.292 0.033 1.00 0.00 N ATOM 2396 CA ALA B 683 9.492 32.736 0.208 1.00 0.00 C ATOM 2397 C ALA B 683 10.846 33.404 -0.010 1.00 0.00 C ATOM 2398 O ALA B 683 10.987 34.279 -0.863 1.00 0.00 O ATOM 2399 CB ALA B 683 8.955 33.067 1.593 1.00 0.00 C ATOM 0 H ALA B 683 9.264 30.748 0.834 1.00 0.00 H new ATOM 0 HA ALA B 683 8.800 33.124 -0.540 1.00 0.00 H new ATOM 0 HB1 ALA B 683 8.891 34.149 1.709 1.00 0.00 H new ATOM 0 HB2 ALA B 683 7.964 32.630 1.713 1.00 0.00 H new ATOM 0 HB3 ALA B 683 9.625 32.660 2.350 1.00 0.00 H new ATOM 2405 N MET B 684 11.839 32.984 0.767 1.00 0.00 N ATOM 2406 CA MET B 684 13.182 33.541 0.658 1.00 0.00 C ATOM 2407 C MET B 684 13.685 33.469 -0.779 1.00 0.00 C ATOM 2408 O MET B 684 13.875 32.383 -1.326 1.00 0.00 O ATOM 2409 CB MET B 684 14.143 32.796 1.586 1.00 0.00 C ATOM 2410 CG MET B 684 13.818 32.965 3.062 1.00 0.00 C ATOM 2411 SD MET B 684 15.192 32.502 4.133 1.00 0.00 S ATOM 2412 CE MET B 684 16.238 33.948 3.987 1.00 0.00 C ATOM 0 H MET B 684 11.739 32.260 1.479 1.00 0.00 H new ATOM 0 HA MET B 684 13.140 34.588 0.957 1.00 0.00 H new ATOM 0 HB2 MET B 684 14.125 31.735 1.338 1.00 0.00 H new ATOM 0 HB3 MET B 684 15.158 33.149 1.403 1.00 0.00 H new ATOM 0 HG2 MET B 684 13.547 34.003 3.254 1.00 0.00 H new ATOM 0 HG3 MET B 684 12.948 32.357 3.310 1.00 0.00 H new ATOM 0 HE1 MET B 684 17.277 33.636 3.877 1.00 0.00 H new ATOM 0 HE2 MET B 684 15.939 34.527 3.113 1.00 0.00 H new ATOM 0 HE3 MET B 684 16.136 34.563 4.881 1.00 0.00 H new ATOM 2420 N MET B 685 13.900 34.632 -1.386 1.00 0.00 N ATOM 2421 CA MET B 685 14.383 34.698 -2.761 1.00 0.00 C ATOM 2422 C MET B 685 15.860 34.325 -2.837 1.00 0.00 C ATOM 2423 O MET B 685 16.320 33.773 -3.836 1.00 0.00 O ATOM 2424 CB MET B 685 14.170 36.102 -3.331 1.00 0.00 C ATOM 2425 CG MET B 685 12.705 36.480 -3.483 1.00 0.00 C ATOM 2426 SD MET B 685 12.408 37.547 -4.906 1.00 0.00 S ATOM 2427 CE MET B 685 11.379 38.815 -4.168 1.00 0.00 C ATOM 0 H MET B 685 13.748 35.541 -0.948 1.00 0.00 H new ATOM 0 HA MET B 685 13.815 33.982 -3.354 1.00 0.00 H new ATOM 0 HB2 MET B 685 14.658 36.827 -2.680 1.00 0.00 H new ATOM 0 HB3 MET B 685 14.657 36.168 -4.304 1.00 0.00 H new ATOM 0 HG2 MET B 685 12.108 35.573 -3.583 1.00 0.00 H new ATOM 0 HG3 MET B 685 12.368 36.986 -2.578 1.00 0.00 H new ATOM 0 HE1 MET B 685 11.111 39.552 -4.925 1.00 0.00 H new ATOM 0 HE2 MET B 685 10.473 38.361 -3.767 1.00 0.00 H new ATOM 0 HE3 MET B 685 11.926 39.305 -3.363 1.00 0.00 H new ATOM 2435 N ALA B 686 16.599 34.629 -1.774 1.00 0.00 N ATOM 2436 CA ALA B 686 18.022 34.323 -1.722 1.00 0.00 C ATOM 2437 C ALA B 686 18.272 32.832 -1.919 1.00 0.00 C ATOM 2438 O ALA B 686 19.226 32.437 -2.590 1.00 0.00 O ATOM 2439 CB ALA B 686 18.613 34.787 -0.398 1.00 0.00 C ATOM 0 H ALA B 686 16.235 35.087 -0.938 1.00 0.00 H new ATOM 0 HA ALA B 686 18.512 34.858 -2.536 1.00 0.00 H new ATOM 0 HB1 ALA B 686 19.677 34.552 -0.372 1.00 0.00 H new ATOM 0 HB2 ALA B 686 18.476 35.864 -0.296 1.00 0.00 H new ATOM 0 HB3 ALA B 686 18.109 34.278 0.424 1.00 0.00 H new ATOM 2445 N ARG B 687 17.409 32.010 -1.332 1.00 0.00 N ATOM 2446 CA ARG B 687 17.538 30.561 -1.443 1.00 0.00 C ATOM 2447 C ARG B 687 17.044 30.074 -2.803 1.00 0.00 C ATOM 2448 O ARG B 687 17.531 29.073 -3.329 1.00 0.00 O ATOM 2449 CB ARG B 687 16.752 29.871 -0.327 1.00 0.00 C ATOM 2450 CG ARG B 687 17.625 29.079 0.633 1.00 0.00 C ATOM 2451 CD ARG B 687 17.912 29.864 1.903 1.00 0.00 C ATOM 2452 NE ARG B 687 17.943 29.004 3.082 1.00 0.00 N ATOM 2453 CZ ARG B 687 18.356 29.411 4.278 1.00 0.00 C ATOM 2454 NH1 ARG B 687 18.770 30.659 4.451 1.00 0.00 N ATOM 2455 NH2 ARG B 687 18.353 28.570 5.304 1.00 0.00 N ATOM 0 H ARG B 687 16.613 32.322 -0.775 1.00 0.00 H new ATOM 0 HA ARG B 687 18.593 30.307 -1.346 1.00 0.00 H new ATOM 0 HB2 ARG B 687 16.199 30.623 0.235 1.00 0.00 H new ATOM 0 HB3 ARG B 687 16.016 29.201 -0.773 1.00 0.00 H new ATOM 0 HG2 ARG B 687 17.130 28.142 0.887 1.00 0.00 H new ATOM 0 HG3 ARG B 687 18.564 28.821 0.144 1.00 0.00 H new ATOM 0 HD2 ARG B 687 18.868 30.377 1.804 1.00 0.00 H new ATOM 0 HD3 ARG B 687 17.150 30.632 2.034 1.00 0.00 H new ATOM 0 HE ARG B 687 17.631 28.038 2.983 1.00 0.00 H new ATOM 0 HH11 ARG B 687 18.772 31.309 3.665 1.00 0.00 H new ATOM 0 HH12 ARG B 687 19.086 30.969 5.370 1.00 0.00 H new ATOM 0 HH21 ARG B 687 18.034 27.610 5.175 1.00 0.00 H new ATOM 0 HH22 ARG B 687 18.670 28.884 6.221 1.00 0.00 H new ATOM 2466 N ASP B 688 16.076 30.789 -3.365 1.00 0.00 N ATOM 2467 CA ASP B 688 15.517 30.430 -4.664 1.00 0.00 C ATOM 2468 C ASP B 688 16.315 31.072 -5.795 1.00 0.00 C ATOM 2469 O ASP B 688 16.289 32.290 -5.975 1.00 0.00 O ATOM 2470 CB ASP B 688 14.052 30.861 -4.748 1.00 0.00 C ATOM 2471 CG ASP B 688 13.119 29.876 -4.071 1.00 0.00 C ATOM 2472 OD1 ASP B 688 13.476 29.370 -2.988 1.00 0.00 O ATOM 2473 OD2 ASP B 688 12.032 29.611 -4.626 1.00 0.00 O ATOM 0 H ASP B 688 15.662 31.620 -2.942 1.00 0.00 H new ATOM 0 HA ASP B 688 15.576 29.347 -4.771 1.00 0.00 H new ATOM 0 HB2 ASP B 688 13.938 31.842 -4.286 1.00 0.00 H new ATOM 0 HB3 ASP B 688 13.767 30.967 -5.795 1.00 0.00 H new ATOM 2477 N THR B 689 17.024 30.244 -6.556 1.00 0.00 N ATOM 2478 CA THR B 689 17.832 30.729 -7.667 1.00 0.00 C ATOM 2479 C THR B 689 17.538 29.949 -8.943 1.00 0.00 C ATOM 2480 O THR B 689 16.889 30.455 -9.857 1.00 0.00 O ATOM 2481 CB THR B 689 19.336 30.632 -7.354 1.00 0.00 C ATOM 2482 OG1 THR B 689 19.610 29.423 -6.634 1.00 0.00 O ATOM 2483 CG2 THR B 689 19.798 31.829 -6.537 1.00 0.00 C ATOM 0 H THR B 689 17.055 29.233 -6.422 1.00 0.00 H new ATOM 0 HA THR B 689 17.567 31.776 -7.815 1.00 0.00 H new ATOM 0 HB THR B 689 19.881 30.625 -8.298 1.00 0.00 H new ATOM 0 HG1 THR B 689 20.569 29.368 -6.440 1.00 0.00 H new ATOM 0 HG21 THR B 689 20.864 31.738 -6.328 1.00 0.00 H new ATOM 0 HG22 THR B 689 19.615 32.745 -7.099 1.00 0.00 H new ATOM 0 HG23 THR B 689 19.246 31.863 -5.598 1.00 0.00 H new ATOM 2491 N ALA B 690 18.018 28.709 -8.996 1.00 0.00 N ATOM 2492 CA ALA B 690 17.804 27.857 -10.159 1.00 0.00 C ATOM 2493 C ALA B 690 16.316 27.644 -10.417 1.00 0.00 C ATOM 2494 O ALA B 690 15.906 27.367 -11.543 1.00 0.00 O ATOM 2495 CB ALA B 690 18.505 26.520 -9.969 1.00 0.00 C ATOM 0 H ALA B 690 18.557 28.274 -8.247 1.00 0.00 H new ATOM 0 HA ALA B 690 18.229 28.358 -11.029 1.00 0.00 H new ATOM 0 HB1 ALA B 690 18.337 25.893 -10.845 1.00 0.00 H new ATOM 0 HB2 ALA B 690 19.575 26.685 -9.841 1.00 0.00 H new ATOM 0 HB3 ALA B 690 18.106 26.022 -9.085 1.00 0.00 H new ATOM 2501 N GLU B 691 15.512 27.775 -9.366 1.00 0.00 N ATOM 2502 CA GLU B 691 14.070 27.595 -9.481 1.00 0.00 C ATOM 2503 C GLU B 691 13.424 28.798 -10.160 1.00 0.00 C ATOM 2504 O GLU B 691 12.811 28.672 -11.219 1.00 0.00 O ATOM 2505 CB GLU B 691 13.450 27.381 -8.099 1.00 0.00 C ATOM 2506 CG GLU B 691 14.293 26.512 -7.180 1.00 0.00 C ATOM 2507 CD GLU B 691 13.465 25.503 -6.409 1.00 0.00 C ATOM 2508 OE1 GLU B 691 12.418 25.894 -5.853 1.00 0.00 O ATOM 2509 OE2 GLU B 691 13.865 24.320 -6.362 1.00 0.00 O ATOM 0 H GLU B 691 15.835 28.005 -8.426 1.00 0.00 H new ATOM 0 HA GLU B 691 13.887 26.713 -10.094 1.00 0.00 H new ATOM 0 HB2 GLU B 691 13.294 28.351 -7.626 1.00 0.00 H new ATOM 0 HB3 GLU B 691 12.468 26.923 -8.218 1.00 0.00 H new ATOM 0 HG2 GLU B 691 15.043 25.986 -7.771 1.00 0.00 H new ATOM 0 HG3 GLU B 691 14.831 27.148 -6.477 1.00 0.00 H new ATOM 2514 N ALA B 692 13.566 29.966 -9.541 1.00 0.00 N ATOM 2515 CA ALA B 692 12.998 31.194 -10.085 1.00 0.00 C ATOM 2516 C ALA B 692 13.641 31.551 -11.421 1.00 0.00 C ATOM 2517 O ALA B 692 13.042 32.242 -12.244 1.00 0.00 O ATOM 2518 CB ALA B 692 13.163 32.336 -9.094 1.00 0.00 C ATOM 0 H ALA B 692 14.070 30.088 -8.662 1.00 0.00 H new ATOM 0 HA ALA B 692 11.934 31.029 -10.257 1.00 0.00 H new ATOM 0 HB1 ALA B 692 12.735 33.246 -9.513 1.00 0.00 H new ATOM 0 HB2 ALA B 692 12.650 32.088 -8.165 1.00 0.00 H new ATOM 0 HB3 ALA B 692 14.223 32.493 -8.893 1.00 0.00 H new ATOM 2524 N ALA B 693 14.865 31.075 -11.629 1.00 0.00 N ATOM 2525 CA ALA B 693 15.588 31.344 -12.866 1.00 0.00 C ATOM 2526 C ALA B 693 15.237 30.321 -13.941 1.00 0.00 C ATOM 2527 O ALA B 693 15.354 30.596 -15.136 1.00 0.00 O ATOM 2528 CB ALA B 693 17.088 31.348 -12.608 1.00 0.00 C ATOM 0 H ALA B 693 15.376 30.502 -10.957 1.00 0.00 H new ATOM 0 HA ALA B 693 15.289 32.328 -13.227 1.00 0.00 H new ATOM 0 HB1 ALA B 693 17.617 31.550 -13.539 1.00 0.00 H new ATOM 0 HB2 ALA B 693 17.330 32.121 -11.879 1.00 0.00 H new ATOM 0 HB3 ALA B 693 17.393 30.376 -12.221 1.00 0.00 H new ATOM 2534 N LYS B 694 14.805 29.142 -13.509 1.00 0.00 N ATOM 2535 CA LYS B 694 14.436 28.076 -14.435 1.00 0.00 C ATOM 2536 C LYS B 694 13.313 28.529 -15.364 1.00 0.00 C ATOM 2537 O LYS B 694 12.832 29.658 -15.268 1.00 0.00 O ATOM 2538 CB LYS B 694 14.001 26.829 -13.662 1.00 0.00 C ATOM 2539 CG LYS B 694 14.982 25.675 -13.770 1.00 0.00 C ATOM 2540 CD LYS B 694 14.621 24.545 -12.820 1.00 0.00 C ATOM 2541 CE LYS B 694 15.755 24.246 -11.852 1.00 0.00 C ATOM 2542 NZ LYS B 694 15.679 22.857 -11.321 1.00 0.00 N ATOM 0 H LYS B 694 14.701 28.899 -12.524 1.00 0.00 H new ATOM 0 HA LYS B 694 15.310 27.834 -15.040 1.00 0.00 H new ATOM 0 HB2 LYS B 694 13.873 27.089 -12.611 1.00 0.00 H new ATOM 0 HB3 LYS B 694 13.028 26.504 -14.031 1.00 0.00 H new ATOM 0 HG2 LYS B 694 14.994 25.301 -14.794 1.00 0.00 H new ATOM 0 HG3 LYS B 694 15.989 26.030 -13.549 1.00 0.00 H new ATOM 0 HD2 LYS B 694 13.724 24.811 -12.260 1.00 0.00 H new ATOM 0 HD3 LYS B 694 14.384 23.648 -13.393 1.00 0.00 H new ATOM 0 HE2 LYS B 694 16.711 24.390 -12.356 1.00 0.00 H new ATOM 0 HE3 LYS B 694 15.722 24.954 -11.024 1.00 0.00 H new ATOM 0 HZ1 LYS B 694 16.469 22.692 -10.665 1.00 0.00 H new ATOM 0 HZ2 LYS B 694 14.778 22.727 -10.818 1.00 0.00 H new ATOM 0 HZ3 LYS B 694 15.736 22.181 -12.109 1.00 0.00 H new ATOM 2552 N TRP B 695 12.900 27.641 -16.261 1.00 0.00 N ATOM 2553 CA TRP B 695 11.834 27.948 -17.206 1.00 0.00 C ATOM 2554 C TRP B 695 10.480 27.501 -16.665 1.00 0.00 C ATOM 2555 O TRP B 695 10.405 26.813 -15.647 1.00 0.00 O ATOM 2556 CB TRP B 695 12.105 27.274 -18.551 1.00 0.00 C ATOM 2557 CG TRP B 695 13.012 28.070 -19.442 1.00 0.00 C ATOM 2558 CD1 TRP B 695 14.167 27.640 -20.031 1.00 0.00 C ATOM 2559 CD2 TRP B 695 12.838 29.434 -19.842 1.00 0.00 C ATOM 2560 NE1 TRP B 695 14.722 28.654 -20.773 1.00 0.00 N ATOM 2561 CE2 TRP B 695 13.926 29.764 -20.675 1.00 0.00 C ATOM 2562 CE3 TRP B 695 11.870 30.406 -19.581 1.00 0.00 C ATOM 2563 CZ2 TRP B 695 14.069 31.027 -21.244 1.00 0.00 C ATOM 2564 CZ3 TRP B 695 12.014 31.659 -20.147 1.00 0.00 C ATOM 2565 CH2 TRP B 695 13.106 31.960 -20.972 1.00 0.00 C ATOM 0 H TRP B 695 13.288 26.702 -16.353 1.00 0.00 H new ATOM 0 HA TRP B 695 11.810 29.029 -17.347 1.00 0.00 H new ATOM 0 HB2 TRP B 695 12.548 26.294 -18.375 1.00 0.00 H new ATOM 0 HB3 TRP B 695 11.158 27.108 -19.064 1.00 0.00 H new ATOM 0 HD1 TRP B 695 14.583 26.649 -19.928 1.00 0.00 H new ATOM 0 HE1 TRP B 695 15.587 28.590 -21.310 1.00 0.00 H new ATOM 0 HE3 TRP B 695 11.024 30.183 -18.948 1.00 0.00 H new ATOM 0 HZ2 TRP B 695 14.911 31.262 -21.878 1.00 0.00 H new ATOM 0 HZ3 TRP B 695 11.272 32.419 -19.950 1.00 0.00 H new ATOM 0 HH2 TRP B 695 13.189 32.947 -21.401 1.00 0.00 H new ATOM 2575 N GLY B 696 9.412 27.896 -17.350 1.00 0.00 N ATOM 2576 CA GLY B 696 8.076 27.526 -16.922 1.00 0.00 C ATOM 2577 C GLY B 696 7.049 27.683 -18.026 1.00 0.00 C ATOM 2578 O GLY B 696 6.737 26.725 -18.733 1.00 0.00 O ATOM 0 H GLY B 696 9.448 28.466 -18.195 1.00 0.00 H new ATOM 0 HA2 GLY B 696 8.081 26.491 -16.579 1.00 0.00 H new ATOM 0 HA3 GLY B 696 7.787 28.142 -16.071 1.00 0.00 H new ATOM 2582 N GLY B 697 6.520 28.894 -18.172 1.00 0.00 N ATOM 2583 CA GLY B 697 5.526 29.149 -19.198 1.00 0.00 C ATOM 2584 C GLY B 697 6.122 29.792 -20.436 1.00 0.00 C ATOM 2585 O GLY B 697 6.199 29.166 -21.492 1.00 0.00 O ATOM 0 H GLY B 697 6.762 29.702 -17.599 1.00 0.00 H new ATOM 0 HA2 GLY B 697 5.045 28.211 -19.475 1.00 0.00 H new ATOM 0 HA3 GLY B 697 4.749 29.798 -18.794 1.00 0.00 H new TER 2589 GLY B 697