USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1102 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 37 LYS NZ :NH3+ -127:sc= 0.918 (180deg=-0.559!) USER MOD Set 1.2: B 91 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: B 70 LYS NZ :NH3+ 175:sc= 1.74 (180deg=0.252) USER MOD Set 2.2: B 92 ASN : amide:sc= 0.773 K(o=2.5,f=-17!) USER MOD Set 3.1: B 26 SER OG : rot -35:sc= 1.17 USER MOD Set 3.2: B 28 GLN : amide:sc= -3.29! K(o=-2.1!,f=-0.88) USER MOD Set 4.1: A 37 LYS NZ :NH3+ -172:sc= 1.4 (180deg=1.1) USER MOD Set 4.2: A 40 THR OG1 : rot 180:sc= 0.143 USER MOD Set 5.1: A 26 SER OG : rot -122:sc= 0.273 USER MOD Set 5.2: B 24 GLN : amide:sc= 0.533 K(o=0.14,f=-4.8!) USER MOD Set 5.3: B 73 HIS : no HE2:sc= -0.669 X(o=0.14,f=0.43) USER MOD Single : A 24 GLN : amide:sc= -0.344 X(o=-0.34,f=-0.097) USER MOD Single : A 27 LYS NZ :NH3+ -170:sc=-0.00235 (180deg=-0.0807) USER MOD Single : A 28 GLN : amide:sc= 1.37 K(o=1.4,f=-8.2!) USER MOD Single : A 31 SER OG : rot 94:sc= 1.29 USER MOD Single : A 32 HIS : no HD1:sc= -2.66! K(o=-2.7!,f=-1.3) USER MOD Single : A 34 LYS NZ :NH3+ -173:sc= 1.29 (180deg=1.09) USER MOD Single : A 42 ASN : amide:sc= -1.74! K(o=-1.7!,f=-0.65) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -3.36! C(o=-3.4!,f=-15!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.311 K(o=-0.31,f=-1.1) USER MOD Single : A 51 SER OG : rot 180:sc= -0.0074 USER MOD Single : A 52 SER OG : rot 180:sc= 0.0109 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 129:sc= 1.18 (180deg=0.443) USER MOD Single : A 61 SER OG : rot 70:sc= 1.28 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -163:sc= 0.45 (180deg=0.298) USER MOD Single : A 71 TYR OH : rot 180:sc= -0.365 USER MOD Single : A 72 TYR OH : rot 88:sc= -0.922 USER MOD Single : A 73 HIS : no HE2:sc= -1.04 K(o=-1,f=-6.6!) USER MOD Single : A 80 HIS : no HD1:sc= -0.0748 X(o=-0.075,f=-0.075) USER MOD Single : A 83 ASN : amide:sc= -0.951! X(o=-0.95!,f=-1.1) USER MOD Single : A 91 TYR OH : rot 155:sc= 0.00218 USER MOD Single : A 92 ASN : amide:sc= 0.155 K(o=0.15,f=-5!) USER MOD Single : B 27 LYS NZ :NH3+ -167:sc= -0.0128 (180deg=-0.232) USER MOD Single : B 31 SER OG : rot 77:sc= 1.19 USER MOD Single : B 32 HIS : no HD1:sc= 0.986 K(o=0.99,f=-3.9!) USER MOD Single : B 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 THR OG1 : rot -67:sc= 1.25 USER MOD Single : B 42 ASN : amide:sc= -1.14 K(o=-1.1,f=-0.21) USER MOD Single : B 44 SER OG : rot 46:sc= 0.0582 USER MOD Single : B 45 GLN : amide:sc= -5.52! C(o=-5.5!,f=-3.8!) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= -2.44! K(o=-2.4!,f=-0.00065) USER MOD Single : B 51 SER OG : rot -11:sc= 0.805 USER MOD Single : B 52 SER OG : rot -46:sc= 1.21 USER MOD Single : B 54 SER OG : rot 180:sc= 0 USER MOD Single : B 59 LYS NZ :NH3+ -158:sc= 2.08 (180deg=1.68) USER MOD Single : B 61 SER OG : rot 59:sc= 1.31 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 TYR OH : rot -144:sc= 0.00838 USER MOD Single : B 80 HIS : no HD1:sc= -0.0757 X(o=-0.076,f=0) USER MOD Single : B 83 ASN : amide:sc= -3.79! C(o=-3.8!,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 22 -6.693 -5.405 -8.194 1.00 0.00 N ATOM 2 CA ALA A 22 -6.893 -4.292 -7.237 1.00 0.00 C ATOM 3 C ALA A 22 -5.562 -3.876 -6.604 1.00 0.00 C ATOM 4 O ALA A 22 -4.633 -4.680 -6.502 1.00 0.00 O ATOM 5 CB ALA A 22 -7.896 -4.696 -6.168 1.00 0.00 C ATOM 0 HA ALA A 22 -7.290 -3.433 -7.779 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.036 -3.871 -5.470 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -8.849 -4.940 -6.637 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.523 -5.567 -5.630 1.00 0.00 H new ATOM 13 N GLU A 23 -5.481 -2.622 -6.172 1.00 0.00 N ATOM 14 CA GLU A 23 -4.244 -2.068 -5.623 1.00 0.00 C ATOM 15 C GLU A 23 -4.398 -1.759 -4.135 1.00 0.00 C ATOM 16 O GLU A 23 -5.511 -1.742 -3.616 1.00 0.00 O ATOM 17 CB GLU A 23 -3.871 -0.792 -6.376 1.00 0.00 C ATOM 18 CG GLU A 23 -3.732 -0.988 -7.875 1.00 0.00 C ATOM 19 CD GLU A 23 -3.500 0.315 -8.609 1.00 0.00 C ATOM 20 OE1 GLU A 23 -2.337 0.749 -8.694 1.00 0.00 O ATOM 21 OE2 GLU A 23 -4.485 0.909 -9.099 1.00 0.00 O ATOM 0 H GLU A 23 -6.261 -1.965 -6.191 1.00 0.00 H new ATOM 0 HA GLU A 23 -3.454 -2.809 -5.742 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -4.630 -0.033 -6.186 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -2.931 -0.408 -5.980 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -2.903 -1.667 -8.074 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -4.633 -1.464 -8.261 1.00 0.00 H new ATOM 28 N GLN A 24 -3.285 -1.508 -3.454 1.00 0.00 N ATOM 29 CA GLN A 24 -3.323 -1.182 -2.032 1.00 0.00 C ATOM 30 C GLN A 24 -2.983 0.285 -1.809 1.00 0.00 C ATOM 31 O GLN A 24 -2.084 0.824 -2.456 1.00 0.00 O ATOM 32 CB GLN A 24 -2.346 -2.045 -1.228 1.00 0.00 C ATOM 33 CG GLN A 24 -2.549 -1.911 0.275 1.00 0.00 C ATOM 34 CD GLN A 24 -1.362 -2.369 1.104 1.00 0.00 C ATOM 35 OE1 GLN A 24 -1.138 -1.859 2.201 1.00 0.00 O ATOM 36 NE2 GLN A 24 -0.599 -3.324 0.597 1.00 0.00 N ATOM 0 H GLN A 24 -2.350 -1.524 -3.861 1.00 0.00 H new ATOM 0 HA GLN A 24 -4.337 -1.384 -1.686 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -2.467 -3.089 -1.516 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -1.324 -1.762 -1.480 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -2.762 -0.868 0.510 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -3.426 -2.489 0.565 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -0.819 -3.721 -0.316 1.00 0.00 H new ATOM 0 HE22 GLN A 24 0.209 -3.663 1.120 1.00 0.00 H new ATOM 45 N VAL A 25 -3.703 0.913 -0.894 1.00 0.00 N ATOM 46 CA VAL A 25 -3.439 2.293 -0.505 1.00 0.00 C ATOM 47 C VAL A 25 -3.432 2.407 1.016 1.00 0.00 C ATOM 48 O VAL A 25 -3.884 1.493 1.714 1.00 0.00 O ATOM 49 CB VAL A 25 -4.496 3.266 -1.080 1.00 0.00 C ATOM 50 CG1 VAL A 25 -4.408 3.332 -2.598 1.00 0.00 C ATOM 51 CG2 VAL A 25 -5.898 2.860 -0.646 1.00 0.00 C ATOM 0 H VAL A 25 -4.485 0.484 -0.400 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.466 2.568 -0.911 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.286 4.259 -0.683 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.162 4.023 -2.976 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.417 3.680 -2.890 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -4.582 2.340 -3.016 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -6.624 3.558 -1.062 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -6.114 1.854 -1.007 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.961 2.876 0.442 1.00 0.00 H new ATOM 61 N SER A 26 -2.922 3.511 1.536 1.00 0.00 N ATOM 62 CA SER A 26 -2.948 3.747 2.963 1.00 0.00 C ATOM 63 C SER A 26 -4.200 4.543 3.329 1.00 0.00 C ATOM 64 O SER A 26 -4.917 5.036 2.450 1.00 0.00 O ATOM 65 CB SER A 26 -1.675 4.473 3.414 1.00 0.00 C ATOM 66 OG SER A 26 -0.520 3.713 3.091 1.00 0.00 O ATOM 0 H SER A 26 -2.487 4.254 0.990 1.00 0.00 H new ATOM 0 HA SER A 26 -2.981 2.790 3.484 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.619 5.450 2.934 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.712 4.648 4.489 1.00 0.00 H new ATOM 0 HG SER A 26 -0.013 3.525 3.908 1.00 0.00 H new ATOM 72 N LYS A 27 -4.461 4.679 4.623 1.00 0.00 N ATOM 73 CA LYS A 27 -5.701 5.286 5.092 1.00 0.00 C ATOM 74 C LYS A 27 -5.731 6.775 4.755 1.00 0.00 C ATOM 75 O LYS A 27 -6.775 7.427 4.843 1.00 0.00 O ATOM 76 CB LYS A 27 -5.854 5.061 6.600 1.00 0.00 C ATOM 77 CG LYS A 27 -7.248 5.348 7.135 1.00 0.00 C ATOM 78 CD LYS A 27 -7.373 4.924 8.588 1.00 0.00 C ATOM 79 CE LYS A 27 -8.770 5.169 9.135 1.00 0.00 C ATOM 80 NZ LYS A 27 -9.117 6.615 9.157 1.00 0.00 N ATOM 0 H LYS A 27 -3.831 4.377 5.366 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.541 4.812 4.584 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -5.594 4.028 6.830 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -5.138 5.694 7.125 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -7.464 6.412 7.044 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -7.988 4.820 6.534 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -7.129 3.866 8.679 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -6.647 5.472 9.189 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -9.497 4.632 8.526 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -8.839 4.765 10.145 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -10.000 6.752 9.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -8.351 7.149 9.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -9.243 6.957 8.183 1.00 0.00 H new ATOM 94 N GLN A 28 -4.587 7.299 4.344 1.00 0.00 N ATOM 95 CA GLN A 28 -4.486 8.689 3.943 1.00 0.00 C ATOM 96 C GLN A 28 -5.060 8.880 2.544 1.00 0.00 C ATOM 97 O GLN A 28 -5.801 9.834 2.303 1.00 0.00 O ATOM 98 CB GLN A 28 -3.035 9.161 3.995 1.00 0.00 C ATOM 99 CG GLN A 28 -2.412 9.020 5.373 1.00 0.00 C ATOM 100 CD GLN A 28 -1.042 9.657 5.465 1.00 0.00 C ATOM 101 OE1 GLN A 28 -0.754 10.648 4.789 1.00 0.00 O ATOM 102 NE2 GLN A 28 -0.189 9.092 6.301 1.00 0.00 N ATOM 0 H GLN A 28 -3.713 6.778 4.280 1.00 0.00 H new ATOM 0 HA GLN A 28 -5.066 9.292 4.642 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -2.447 8.589 3.277 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -2.988 10.205 3.686 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -3.070 9.476 6.113 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -2.334 7.962 5.625 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -0.470 8.273 6.840 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.751 9.475 6.407 1.00 0.00 H new ATOM 111 N GLU A 29 -4.748 7.961 1.631 1.00 0.00 N ATOM 112 CA GLU A 29 -5.268 8.048 0.271 1.00 0.00 C ATOM 113 C GLU A 29 -6.776 7.865 0.294 1.00 0.00 C ATOM 114 O GLU A 29 -7.509 8.550 -0.418 1.00 0.00 O ATOM 115 CB GLU A 29 -4.634 7.002 -0.657 1.00 0.00 C ATOM 116 CG GLU A 29 -3.120 7.104 -0.780 1.00 0.00 C ATOM 117 CD GLU A 29 -2.394 6.226 0.217 1.00 0.00 C ATOM 118 OE1 GLU A 29 -2.463 6.514 1.426 1.00 0.00 O ATOM 119 OE2 GLU A 29 -1.771 5.227 -0.206 1.00 0.00 O ATOM 0 H GLU A 29 -4.145 7.157 1.807 1.00 0.00 H new ATOM 0 HA GLU A 29 -5.013 9.033 -0.121 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -4.890 6.007 -0.292 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -5.074 7.100 -1.649 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -2.822 6.824 -1.790 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -2.816 8.141 -0.634 1.00 0.00 H new ATOM 126 N ILE A 30 -7.226 6.951 1.144 1.00 0.00 N ATOM 127 CA ILE A 30 -8.649 6.694 1.322 1.00 0.00 C ATOM 128 C ILE A 30 -9.377 7.965 1.755 1.00 0.00 C ATOM 129 O ILE A 30 -10.434 8.302 1.223 1.00 0.00 O ATOM 130 CB ILE A 30 -8.885 5.592 2.378 1.00 0.00 C ATOM 131 CG1 ILE A 30 -8.135 4.316 1.986 1.00 0.00 C ATOM 132 CG2 ILE A 30 -10.375 5.311 2.535 1.00 0.00 C ATOM 133 CD1 ILE A 30 -8.190 3.230 3.037 1.00 0.00 C ATOM 0 H ILE A 30 -6.620 6.371 1.725 1.00 0.00 H new ATOM 0 HA ILE A 30 -9.043 6.359 0.363 1.00 0.00 H new ATOM 0 HB ILE A 30 -8.501 5.941 3.337 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -8.553 3.931 1.056 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.092 4.565 1.788 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -10.521 4.532 3.283 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -10.885 6.220 2.853 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -10.785 4.980 1.581 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -7.637 2.358 2.688 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -7.745 3.596 3.962 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.228 2.952 3.219 1.00 0.00 H new ATOM 145 N SER A 31 -8.785 8.678 2.703 1.00 0.00 N ATOM 146 CA SER A 31 -9.395 9.880 3.250 1.00 0.00 C ATOM 147 C SER A 31 -9.283 11.057 2.278 1.00 0.00 C ATOM 148 O SER A 31 -10.191 11.885 2.185 1.00 0.00 O ATOM 149 CB SER A 31 -8.733 10.236 4.582 1.00 0.00 C ATOM 150 OG SER A 31 -8.754 9.131 5.474 1.00 0.00 O ATOM 0 H SER A 31 -7.880 8.443 3.110 1.00 0.00 H new ATOM 0 HA SER A 31 -10.454 9.679 3.410 1.00 0.00 H new ATOM 0 HB2 SER A 31 -7.703 10.548 4.408 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.250 11.082 5.034 1.00 0.00 H new ATOM 0 HG SER A 31 -7.916 8.629 5.393 1.00 0.00 H new ATOM 156 N HIS A 32 -8.177 11.120 1.545 1.00 0.00 N ATOM 157 CA HIS A 32 -7.914 12.249 0.657 1.00 0.00 C ATOM 158 C HIS A 32 -8.691 12.120 -0.652 1.00 0.00 C ATOM 159 O HIS A 32 -9.251 13.094 -1.149 1.00 0.00 O ATOM 160 CB HIS A 32 -6.413 12.362 0.373 1.00 0.00 C ATOM 161 CG HIS A 32 -6.006 13.665 -0.250 1.00 0.00 C ATOM 162 ND1 HIS A 32 -5.692 14.782 0.491 1.00 0.00 N ATOM 163 CD2 HIS A 32 -5.846 14.020 -1.547 1.00 0.00 C ATOM 164 CE1 HIS A 32 -5.356 15.767 -0.320 1.00 0.00 C ATOM 165 NE2 HIS A 32 -5.440 15.332 -1.561 1.00 0.00 N ATOM 0 H HIS A 32 -7.449 10.405 1.547 1.00 0.00 H new ATOM 0 HA HIS A 32 -8.251 13.156 1.159 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -5.866 12.231 1.307 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -6.116 11.547 -0.287 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -6.007 13.390 -2.409 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -5.062 16.761 -0.018 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -5.237 15.881 -2.396 1.00 0.00 H new ATOM 174 N PHE A 33 -8.722 10.918 -1.213 1.00 0.00 N ATOM 175 CA PHE A 33 -9.416 10.693 -2.476 1.00 0.00 C ATOM 176 C PHE A 33 -10.879 10.332 -2.239 1.00 0.00 C ATOM 177 O PHE A 33 -11.678 10.328 -3.173 1.00 0.00 O ATOM 178 CB PHE A 33 -8.725 9.594 -3.288 1.00 0.00 C ATOM 179 CG PHE A 33 -7.364 9.985 -3.797 1.00 0.00 C ATOM 180 CD1 PHE A 33 -7.232 10.691 -4.983 1.00 0.00 C ATOM 181 CD2 PHE A 33 -6.219 9.649 -3.093 1.00 0.00 C ATOM 182 CE1 PHE A 33 -5.984 11.053 -5.456 1.00 0.00 C ATOM 183 CE2 PHE A 33 -4.969 10.008 -3.561 1.00 0.00 C ATOM 184 CZ PHE A 33 -4.852 10.711 -4.743 1.00 0.00 C ATOM 0 H PHE A 33 -8.278 10.089 -0.818 1.00 0.00 H new ATOM 0 HA PHE A 33 -9.379 11.621 -3.046 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -8.629 8.702 -2.669 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -9.357 9.328 -4.135 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -8.114 10.961 -5.544 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.304 9.100 -2.167 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -5.895 11.602 -6.382 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -4.085 9.739 -3.002 1.00 0.00 H new ATOM 0 HZ PHE A 33 -3.876 10.993 -5.110 1.00 0.00 H new ATOM 194 N LYS A 34 -11.212 10.043 -0.980 1.00 0.00 N ATOM 195 CA LYS A 34 -12.574 9.682 -0.586 1.00 0.00 C ATOM 196 C LYS A 34 -13.015 8.391 -1.265 1.00 0.00 C ATOM 197 O LYS A 34 -13.738 8.404 -2.263 1.00 0.00 O ATOM 198 CB LYS A 34 -13.565 10.817 -0.882 1.00 0.00 C ATOM 199 CG LYS A 34 -13.371 12.050 -0.009 1.00 0.00 C ATOM 200 CD LYS A 34 -13.563 11.725 1.466 1.00 0.00 C ATOM 201 CE LYS A 34 -13.523 12.973 2.336 1.00 0.00 C ATOM 202 NZ LYS A 34 -12.229 13.698 2.228 1.00 0.00 N ATOM 0 H LYS A 34 -10.547 10.053 -0.207 1.00 0.00 H new ATOM 0 HA LYS A 34 -12.569 9.517 0.491 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -13.469 11.106 -1.929 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -14.580 10.444 -0.746 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -12.371 12.455 -0.166 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -14.079 12.823 -0.307 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -14.518 11.218 1.604 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -12.785 11.033 1.789 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -14.335 13.640 2.047 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -13.694 12.694 3.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -12.205 14.470 2.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -11.446 13.040 2.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -12.131 14.092 1.271 1.00 0.00 H new ATOM 216 N LEU A 35 -12.554 7.275 -0.724 1.00 0.00 N ATOM 217 CA LEU A 35 -12.883 5.968 -1.269 1.00 0.00 C ATOM 218 C LEU A 35 -14.080 5.376 -0.538 1.00 0.00 C ATOM 219 O LEU A 35 -14.242 5.575 0.667 1.00 0.00 O ATOM 220 CB LEU A 35 -11.681 5.026 -1.156 1.00 0.00 C ATOM 221 CG LEU A 35 -10.395 5.522 -1.827 1.00 0.00 C ATOM 222 CD1 LEU A 35 -9.280 4.502 -1.661 1.00 0.00 C ATOM 223 CD2 LEU A 35 -10.634 5.812 -3.301 1.00 0.00 C ATOM 0 H LEU A 35 -11.948 7.248 0.096 1.00 0.00 H new ATOM 0 HA LEU A 35 -13.138 6.087 -2.322 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -11.476 4.850 -0.100 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.951 4.064 -1.592 1.00 0.00 H new ATOM 0 HG LEU A 35 -10.092 6.449 -1.340 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -8.375 4.871 -2.143 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -9.087 4.343 -0.600 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -9.578 3.559 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -9.708 6.163 -3.758 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -10.964 4.902 -3.802 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -11.401 6.580 -3.401 1.00 0.00 H new ATOM 235 N VAL A 36 -14.915 4.653 -1.268 1.00 0.00 N ATOM 236 CA VAL A 36 -16.098 4.033 -0.689 1.00 0.00 C ATOM 237 C VAL A 36 -15.825 2.565 -0.392 1.00 0.00 C ATOM 238 O VAL A 36 -15.384 1.820 -1.269 1.00 0.00 O ATOM 239 CB VAL A 36 -17.315 4.149 -1.632 1.00 0.00 C ATOM 240 CG1 VAL A 36 -18.559 3.546 -0.993 1.00 0.00 C ATOM 241 CG2 VAL A 36 -17.561 5.600 -2.015 1.00 0.00 C ATOM 0 H VAL A 36 -14.795 4.480 -2.266 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.330 4.560 0.237 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.093 3.586 -2.539 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -19.402 3.641 -1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.383 2.492 -0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -18.784 4.073 -0.066 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -18.423 5.660 -2.680 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -17.755 6.186 -1.116 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -16.682 5.996 -2.524 1.00 0.00 H new ATOM 251 N LYS A 37 -16.072 2.160 0.842 1.00 0.00 N ATOM 252 CA LYS A 37 -15.832 0.789 1.257 1.00 0.00 C ATOM 253 C LYS A 37 -16.893 -0.149 0.692 1.00 0.00 C ATOM 254 O LYS A 37 -18.091 0.131 0.758 1.00 0.00 O ATOM 255 CB LYS A 37 -15.799 0.693 2.786 1.00 0.00 C ATOM 256 CG LYS A 37 -15.611 -0.722 3.308 1.00 0.00 C ATOM 257 CD LYS A 37 -15.464 -0.743 4.818 1.00 0.00 C ATOM 258 CE LYS A 37 -15.441 -2.164 5.355 1.00 0.00 C ATOM 259 NZ LYS A 37 -15.150 -2.201 6.811 1.00 0.00 N ATOM 0 H LYS A 37 -16.440 2.764 1.577 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.863 0.482 0.863 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.991 1.320 3.163 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.729 1.097 3.186 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.464 -1.335 3.016 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.727 -1.166 2.849 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -14.545 -0.230 5.102 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.289 -0.194 5.273 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -16.403 -2.640 5.165 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.688 -2.742 4.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -15.009 -3.186 7.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.288 -1.652 7.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -15.949 -1.790 7.335 1.00 0.00 H new ATOM 273 N VAL A 38 -16.436 -1.251 0.118 1.00 0.00 N ATOM 274 CA VAL A 38 -17.325 -2.275 -0.408 1.00 0.00 C ATOM 275 C VAL A 38 -17.569 -3.342 0.653 1.00 0.00 C ATOM 276 O VAL A 38 -18.695 -3.799 0.856 1.00 0.00 O ATOM 277 CB VAL A 38 -16.731 -2.935 -1.673 1.00 0.00 C ATOM 278 CG1 VAL A 38 -17.675 -3.986 -2.238 1.00 0.00 C ATOM 279 CG2 VAL A 38 -16.409 -1.883 -2.723 1.00 0.00 C ATOM 0 H VAL A 38 -15.444 -1.460 0.004 1.00 0.00 H new ATOM 0 HA VAL A 38 -18.267 -1.798 -0.678 1.00 0.00 H new ATOM 0 HB VAL A 38 -15.805 -3.435 -1.389 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -17.231 -4.433 -3.127 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -17.848 -4.760 -1.490 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -18.624 -3.519 -2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.992 -2.366 -3.606 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -17.320 -1.351 -2.997 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.684 -1.176 -2.320 1.00 0.00 H new ATOM 289 N GLY A 39 -16.501 -3.711 1.345 1.00 0.00 N ATOM 290 CA GLY A 39 -16.582 -4.732 2.367 1.00 0.00 C ATOM 291 C GLY A 39 -15.221 -5.034 2.952 1.00 0.00 C ATOM 292 O GLY A 39 -14.259 -4.309 2.692 1.00 0.00 O ATOM 0 H GLY A 39 -15.570 -3.316 1.214 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -17.256 -4.404 3.159 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -17.007 -5.641 1.943 1.00 0.00 H new ATOM 296 N THR A 40 -15.131 -6.096 3.732 1.00 0.00 N ATOM 297 CA THR A 40 -13.872 -6.497 4.336 1.00 0.00 C ATOM 298 C THR A 40 -13.519 -7.921 3.913 1.00 0.00 C ATOM 299 O THR A 40 -14.384 -8.798 3.884 1.00 0.00 O ATOM 300 CB THR A 40 -13.950 -6.413 5.876 1.00 0.00 C ATOM 301 OG1 THR A 40 -14.450 -5.125 6.269 1.00 0.00 O ATOM 302 CG2 THR A 40 -12.585 -6.639 6.510 1.00 0.00 C ATOM 0 H THR A 40 -15.920 -6.700 3.963 1.00 0.00 H new ATOM 0 HA THR A 40 -13.095 -5.815 3.991 1.00 0.00 H new ATOM 0 HB THR A 40 -14.626 -7.195 6.222 1.00 0.00 H new ATOM 0 HG1 THR A 40 -14.499 -5.078 7.247 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.672 -6.574 7.595 1.00 0.00 H new ATOM 0 HG22 THR A 40 -12.215 -7.627 6.234 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.889 -5.879 6.156 1.00 0.00 H new ATOM 310 N ILE A 41 -12.260 -8.147 3.566 1.00 0.00 N ATOM 311 CA ILE A 41 -11.811 -9.466 3.141 1.00 0.00 C ATOM 312 C ILE A 41 -10.844 -10.068 4.151 1.00 0.00 C ATOM 313 O ILE A 41 -10.094 -9.352 4.819 1.00 0.00 O ATOM 314 CB ILE A 41 -11.138 -9.439 1.752 1.00 0.00 C ATOM 315 CG1 ILE A 41 -10.005 -8.407 1.717 1.00 0.00 C ATOM 316 CG2 ILE A 41 -12.169 -9.151 0.672 1.00 0.00 C ATOM 317 CD1 ILE A 41 -9.228 -8.395 0.420 1.00 0.00 C ATOM 0 H ILE A 41 -11.531 -7.434 3.570 1.00 0.00 H new ATOM 0 HA ILE A 41 -12.706 -10.085 3.076 1.00 0.00 H new ATOM 0 HB ILE A 41 -10.703 -10.420 1.559 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.424 -7.415 1.887 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.318 -8.608 2.539 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -11.681 -9.135 -0.302 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -12.933 -9.928 0.682 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.633 -8.183 0.861 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -8.444 -7.639 0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.778 -9.374 0.257 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.901 -8.163 -0.405 1.00 0.00 H new ATOM 329 N ASN A 42 -10.874 -11.385 4.255 1.00 0.00 N ATOM 330 CA ASN A 42 -10.019 -12.103 5.184 1.00 0.00 C ATOM 331 C ASN A 42 -9.324 -13.255 4.480 1.00 0.00 C ATOM 332 O ASN A 42 -9.979 -14.130 3.912 1.00 0.00 O ATOM 333 CB ASN A 42 -10.835 -12.650 6.364 1.00 0.00 C ATOM 334 CG ASN A 42 -11.370 -11.566 7.280 1.00 0.00 C ATOM 335 OD1 ASN A 42 -12.462 -11.035 7.071 1.00 0.00 O ATOM 336 ND2 ASN A 42 -10.615 -11.243 8.319 1.00 0.00 N ATOM 0 H ASN A 42 -11.487 -11.984 3.702 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.273 -11.404 5.561 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -11.670 -13.235 5.979 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.211 -13.330 6.944 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.932 -10.533 8.979 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.716 -11.704 8.459 1.00 0.00 H new ATOM 343 N VAL A 43 -8.002 -13.257 4.510 1.00 0.00 N ATOM 344 CA VAL A 43 -7.240 -14.369 3.967 1.00 0.00 C ATOM 345 C VAL A 43 -6.767 -15.260 5.104 1.00 0.00 C ATOM 346 O VAL A 43 -5.805 -14.932 5.799 1.00 0.00 O ATOM 347 CB VAL A 43 -6.017 -13.904 3.140 1.00 0.00 C ATOM 348 CG1 VAL A 43 -5.283 -15.097 2.546 1.00 0.00 C ATOM 349 CG2 VAL A 43 -6.433 -12.936 2.043 1.00 0.00 C ATOM 0 H VAL A 43 -7.436 -12.505 4.903 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.900 -14.917 3.295 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.339 -13.381 3.814 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.427 -14.747 1.969 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.937 -15.748 3.349 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.958 -15.652 1.894 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.554 -12.626 1.478 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.140 -13.427 1.374 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.904 -12.061 2.490 1.00 0.00 H new ATOM 359 N SER A 44 -7.467 -16.364 5.308 1.00 0.00 N ATOM 360 CA SER A 44 -7.120 -17.308 6.355 1.00 0.00 C ATOM 361 C SER A 44 -6.466 -18.536 5.745 1.00 0.00 C ATOM 362 O SER A 44 -7.081 -19.251 4.953 1.00 0.00 O ATOM 363 CB SER A 44 -8.368 -17.707 7.152 1.00 0.00 C ATOM 364 OG SER A 44 -8.056 -18.634 8.183 1.00 0.00 O ATOM 0 H SER A 44 -8.284 -16.629 4.758 1.00 0.00 H new ATOM 0 HA SER A 44 -6.415 -16.834 7.038 1.00 0.00 H new ATOM 0 HB2 SER A 44 -8.822 -16.817 7.587 1.00 0.00 H new ATOM 0 HB3 SER A 44 -9.106 -18.145 6.479 1.00 0.00 H new ATOM 0 HG SER A 44 -8.873 -18.866 8.672 1.00 0.00 H new ATOM 370 N GLN A 45 -5.220 -18.772 6.111 1.00 0.00 N ATOM 371 CA GLN A 45 -4.454 -19.875 5.555 1.00 0.00 C ATOM 372 C GLN A 45 -4.149 -20.919 6.613 1.00 0.00 C ATOM 373 O GLN A 45 -4.130 -20.613 7.804 1.00 0.00 O ATOM 374 CB GLN A 45 -3.143 -19.354 4.991 1.00 0.00 C ATOM 375 CG GLN A 45 -3.306 -18.417 3.816 1.00 0.00 C ATOM 376 CD GLN A 45 -2.077 -17.568 3.618 1.00 0.00 C ATOM 377 OE1 GLN A 45 -1.128 -17.979 2.963 1.00 0.00 O ATOM 378 NE2 GLN A 45 -2.088 -16.376 4.185 1.00 0.00 N ATOM 0 H GLN A 45 -4.713 -18.211 6.796 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.051 -20.335 4.767 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -2.600 -18.837 5.782 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -2.530 -20.201 4.684 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.501 -18.994 2.912 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.172 -17.775 3.978 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -2.901 -16.074 4.722 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -1.284 -15.757 4.086 1.00 0.00 H new ATOM 387 N SER A 46 -3.900 -22.143 6.171 1.00 0.00 N ATOM 388 CA SER A 46 -3.430 -23.192 7.061 1.00 0.00 C ATOM 389 C SER A 46 -1.908 -23.117 7.187 1.00 0.00 C ATOM 390 O SER A 46 -1.300 -23.792 8.020 1.00 0.00 O ATOM 391 CB SER A 46 -3.859 -24.560 6.531 1.00 0.00 C ATOM 392 OG SER A 46 -5.253 -24.587 6.261 1.00 0.00 O ATOM 0 H SER A 46 -4.016 -22.433 5.200 1.00 0.00 H new ATOM 0 HA SER A 46 -3.871 -23.052 8.048 1.00 0.00 H new ATOM 0 HB2 SER A 46 -3.304 -24.792 5.622 1.00 0.00 H new ATOM 0 HB3 SER A 46 -3.611 -25.331 7.261 1.00 0.00 H new ATOM 0 HG SER A 46 -5.503 -25.472 5.921 1.00 0.00 H new ATOM 398 N GLY A 47 -1.298 -22.291 6.339 1.00 0.00 N ATOM 399 CA GLY A 47 0.131 -22.067 6.416 1.00 0.00 C ATOM 400 C GLY A 47 0.861 -22.430 5.138 1.00 0.00 C ATOM 401 O GLY A 47 0.509 -23.402 4.472 1.00 0.00 O ATOM 0 H GLY A 47 -1.772 -21.773 5.599 1.00 0.00 H new ATOM 0 HA2 GLY A 47 0.316 -21.018 6.647 1.00 0.00 H new ATOM 0 HA3 GLY A 47 0.540 -22.652 7.240 1.00 0.00 H new ATOM 405 N GLY A 48 1.858 -21.623 4.784 1.00 0.00 N ATOM 406 CA GLY A 48 2.733 -21.949 3.666 1.00 0.00 C ATOM 407 C GLY A 48 2.200 -21.515 2.310 1.00 0.00 C ATOM 408 O GLY A 48 2.927 -21.555 1.319 1.00 0.00 O ATOM 0 H GLY A 48 2.078 -20.744 5.253 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.703 -21.480 3.830 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.899 -23.026 3.651 1.00 0.00 H new ATOM 412 N GLN A 49 0.943 -21.093 2.262 1.00 0.00 N ATOM 413 CA GLN A 49 0.309 -20.724 0.998 1.00 0.00 C ATOM 414 C GLN A 49 0.925 -19.448 0.423 1.00 0.00 C ATOM 415 O GLN A 49 1.459 -19.457 -0.687 1.00 0.00 O ATOM 416 CB GLN A 49 -1.201 -20.565 1.187 1.00 0.00 C ATOM 417 CG GLN A 49 -1.895 -21.866 1.565 1.00 0.00 C ATOM 418 CD GLN A 49 -3.364 -21.690 1.901 1.00 0.00 C ATOM 419 OE1 GLN A 49 -4.039 -20.798 1.384 1.00 0.00 O ATOM 420 NE2 GLN A 49 -3.869 -22.548 2.773 1.00 0.00 N ATOM 0 H GLN A 49 0.342 -20.997 3.080 1.00 0.00 H new ATOM 0 HA GLN A 49 0.485 -21.526 0.282 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -1.388 -19.822 1.962 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -1.638 -20.181 0.265 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.801 -22.572 0.740 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -1.384 -22.306 2.421 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -3.276 -23.272 3.178 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.851 -22.485 3.040 1.00 0.00 H new ATOM 429 N ILE A 50 0.850 -18.360 1.175 1.00 0.00 N ATOM 430 CA ILE A 50 1.467 -17.102 0.772 1.00 0.00 C ATOM 431 C ILE A 50 2.944 -17.095 1.145 1.00 0.00 C ATOM 432 O ILE A 50 3.313 -17.463 2.261 1.00 0.00 O ATOM 433 CB ILE A 50 0.756 -15.893 1.418 1.00 0.00 C ATOM 434 CG1 ILE A 50 -0.653 -15.746 0.838 1.00 0.00 C ATOM 435 CG2 ILE A 50 1.560 -14.613 1.224 1.00 0.00 C ATOM 436 CD1 ILE A 50 -1.438 -14.594 1.421 1.00 0.00 C ATOM 0 H ILE A 50 0.366 -18.322 2.072 1.00 0.00 H new ATOM 0 HA ILE A 50 1.368 -17.015 -0.310 1.00 0.00 H new ATOM 0 HB ILE A 50 0.678 -16.071 2.491 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.579 -15.613 -0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.204 -16.671 1.008 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.034 -13.779 1.689 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.541 -14.726 1.685 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.680 -14.417 0.159 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.425 -14.556 0.960 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.545 -14.734 2.497 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.911 -13.660 1.228 1.00 0.00 H new ATOM 448 N SER A 51 3.784 -16.686 0.207 1.00 0.00 N ATOM 449 CA SER A 51 5.221 -16.685 0.430 1.00 0.00 C ATOM 450 C SER A 51 5.805 -15.268 0.398 1.00 0.00 C ATOM 451 O SER A 51 6.406 -14.815 1.369 1.00 0.00 O ATOM 452 CB SER A 51 5.902 -17.576 -0.611 1.00 0.00 C ATOM 453 OG SER A 51 5.497 -17.225 -1.925 1.00 0.00 O ATOM 0 H SER A 51 3.497 -16.352 -0.713 1.00 0.00 H new ATOM 0 HA SER A 51 5.410 -17.083 1.427 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.984 -17.482 -0.523 1.00 0.00 H new ATOM 0 HB3 SER A 51 5.656 -18.620 -0.418 1.00 0.00 H new ATOM 0 HG SER A 51 5.947 -17.807 -2.572 1.00 0.00 H new ATOM 459 N SER A 52 5.617 -14.568 -0.710 1.00 0.00 N ATOM 460 CA SER A 52 6.226 -13.259 -0.890 1.00 0.00 C ATOM 461 C SER A 52 5.201 -12.146 -0.674 1.00 0.00 C ATOM 462 O SER A 52 3.996 -12.401 -0.682 1.00 0.00 O ATOM 463 CB SER A 52 6.829 -13.163 -2.295 1.00 0.00 C ATOM 464 OG SER A 52 5.840 -13.363 -3.291 1.00 0.00 O ATOM 0 H SER A 52 5.049 -14.883 -1.496 1.00 0.00 H new ATOM 0 HA SER A 52 7.016 -13.135 -0.149 1.00 0.00 H new ATOM 0 HB2 SER A 52 7.292 -12.185 -2.429 1.00 0.00 H new ATOM 0 HB3 SER A 52 7.618 -13.907 -2.407 1.00 0.00 H new ATOM 0 HG SER A 52 6.251 -13.295 -4.178 1.00 0.00 H new ATOM 470 N PRO A 53 5.664 -10.896 -0.468 1.00 0.00 N ATOM 471 CA PRO A 53 4.773 -9.735 -0.352 1.00 0.00 C ATOM 472 C PRO A 53 3.888 -9.578 -1.583 1.00 0.00 C ATOM 473 O PRO A 53 2.720 -9.207 -1.479 1.00 0.00 O ATOM 474 CB PRO A 53 5.734 -8.548 -0.223 1.00 0.00 C ATOM 475 CG PRO A 53 7.002 -9.138 0.286 1.00 0.00 C ATOM 476 CD PRO A 53 7.079 -10.518 -0.303 1.00 0.00 C ATOM 0 HA PRO A 53 4.087 -9.826 0.490 1.00 0.00 H new ATOM 0 HB2 PRO A 53 5.885 -8.055 -1.183 1.00 0.00 H new ATOM 0 HB3 PRO A 53 5.344 -7.796 0.463 1.00 0.00 H new ATOM 0 HG2 PRO A 53 7.861 -8.537 -0.014 1.00 0.00 H new ATOM 0 HG3 PRO A 53 7.005 -9.177 1.375 1.00 0.00 H new ATOM 0 HD2 PRO A 53 7.609 -10.520 -1.255 1.00 0.00 H new ATOM 0 HD3 PRO A 53 7.605 -11.208 0.356 1.00 0.00 H new ATOM 484 N SER A 54 4.448 -9.886 -2.748 1.00 0.00 N ATOM 485 CA SER A 54 3.701 -9.838 -3.997 1.00 0.00 C ATOM 486 C SER A 54 2.601 -10.892 -3.998 1.00 0.00 C ATOM 487 O SER A 54 1.490 -10.647 -4.469 1.00 0.00 O ATOM 488 CB SER A 54 4.644 -10.064 -5.179 1.00 0.00 C ATOM 489 OG SER A 54 5.726 -9.148 -5.143 1.00 0.00 O ATOM 0 H SER A 54 5.421 -10.173 -2.852 1.00 0.00 H new ATOM 0 HA SER A 54 3.241 -8.854 -4.092 1.00 0.00 H new ATOM 0 HB2 SER A 54 5.025 -11.085 -5.156 1.00 0.00 H new ATOM 0 HB3 SER A 54 4.096 -9.950 -6.114 1.00 0.00 H new ATOM 0 HG SER A 54 6.318 -9.311 -5.907 1.00 0.00 H new ATOM 495 N ASP A 55 2.917 -12.058 -3.447 1.00 0.00 N ATOM 496 CA ASP A 55 1.962 -13.153 -3.359 1.00 0.00 C ATOM 497 C ASP A 55 0.849 -12.795 -2.381 1.00 0.00 C ATOM 498 O ASP A 55 -0.329 -13.053 -2.632 1.00 0.00 O ATOM 499 CB ASP A 55 2.678 -14.429 -2.911 1.00 0.00 C ATOM 500 CG ASP A 55 1.843 -15.671 -3.117 1.00 0.00 C ATOM 501 OD1 ASP A 55 1.275 -15.836 -4.217 1.00 0.00 O ATOM 502 OD2 ASP A 55 1.788 -16.509 -2.195 1.00 0.00 O ATOM 0 H ASP A 55 3.834 -12.269 -3.052 1.00 0.00 H new ATOM 0 HA ASP A 55 1.520 -13.325 -4.340 1.00 0.00 H new ATOM 0 HB2 ASP A 55 3.612 -14.529 -3.463 1.00 0.00 H new ATOM 0 HB3 ASP A 55 2.939 -14.343 -1.856 1.00 0.00 H new ATOM 507 N LEU A 56 1.240 -12.175 -1.270 1.00 0.00 N ATOM 508 CA LEU A 56 0.289 -11.677 -0.282 1.00 0.00 C ATOM 509 C LEU A 56 -0.646 -10.650 -0.908 1.00 0.00 C ATOM 510 O LEU A 56 -1.868 -10.741 -0.780 1.00 0.00 O ATOM 511 CB LEU A 56 1.038 -11.049 0.901 1.00 0.00 C ATOM 512 CG LEU A 56 0.161 -10.359 1.951 1.00 0.00 C ATOM 513 CD1 LEU A 56 -0.775 -11.353 2.618 1.00 0.00 C ATOM 514 CD2 LEU A 56 1.027 -9.664 2.990 1.00 0.00 C ATOM 0 H LEU A 56 2.217 -12.005 -1.031 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.306 -12.517 0.077 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.619 -11.828 1.395 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.749 -10.320 0.512 1.00 0.00 H new ATOM 0 HG LEU A 56 -0.448 -9.610 1.445 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.386 -10.837 3.359 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -1.421 -11.805 1.866 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.190 -12.131 3.109 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.390 -9.178 3.729 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.662 -10.399 3.485 1.00 0.00 H new ATOM 0 HD23 LEU A 56 1.651 -8.916 2.502 1.00 0.00 H new ATOM 526 N ARG A 57 -0.056 -9.683 -1.601 1.00 0.00 N ATOM 527 CA ARG A 57 -0.816 -8.620 -2.240 1.00 0.00 C ATOM 528 C ARG A 57 -1.789 -9.192 -3.269 1.00 0.00 C ATOM 529 O ARG A 57 -2.900 -8.692 -3.431 1.00 0.00 O ATOM 530 CB ARG A 57 0.134 -7.635 -2.925 1.00 0.00 C ATOM 531 CG ARG A 57 -0.521 -6.315 -3.291 1.00 0.00 C ATOM 532 CD ARG A 57 0.292 -5.553 -4.323 1.00 0.00 C ATOM 533 NE ARG A 57 0.278 -6.224 -5.621 1.00 0.00 N ATOM 534 CZ ARG A 57 0.128 -5.598 -6.787 1.00 0.00 C ATOM 535 NH1 ARG A 57 0.050 -4.275 -6.834 1.00 0.00 N ATOM 536 NH2 ARG A 57 0.078 -6.302 -7.910 1.00 0.00 N ATOM 0 H ARG A 57 0.953 -9.615 -1.734 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.387 -8.099 -1.471 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.980 -7.441 -2.266 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.533 -8.096 -3.828 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.522 -6.501 -3.681 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.636 -5.705 -2.395 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.108 -4.545 -4.430 1.00 0.00 H new ATOM 0 HD3 ARG A 57 1.320 -5.453 -3.975 1.00 0.00 H new ATOM 0 HE ARG A 57 0.390 -7.238 -5.635 1.00 0.00 H new ATOM 0 HH11 ARG A 57 0.105 -3.730 -5.974 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.065 -3.802 -7.731 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.154 -7.319 -7.878 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.037 -5.827 -8.805 1.00 0.00 H new ATOM 550 N GLU A 58 -1.371 -10.255 -3.947 1.00 0.00 N ATOM 551 CA GLU A 58 -2.175 -10.841 -5.010 1.00 0.00 C ATOM 552 C GLU A 58 -3.410 -11.535 -4.443 1.00 0.00 C ATOM 553 O GLU A 58 -4.480 -11.475 -5.039 1.00 0.00 O ATOM 554 CB GLU A 58 -1.343 -11.816 -5.846 1.00 0.00 C ATOM 555 CG GLU A 58 -2.003 -12.191 -7.163 1.00 0.00 C ATOM 556 CD GLU A 58 -1.086 -12.971 -8.077 1.00 0.00 C ATOM 557 OE1 GLU A 58 -0.086 -12.390 -8.556 1.00 0.00 O ATOM 558 OE2 GLU A 58 -1.359 -14.163 -8.327 1.00 0.00 O ATOM 0 H GLU A 58 -0.482 -10.727 -3.779 1.00 0.00 H new ATOM 0 HA GLU A 58 -2.511 -10.033 -5.661 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -0.369 -11.371 -6.049 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.165 -12.721 -5.266 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -2.896 -12.782 -6.961 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.330 -11.284 -7.672 1.00 0.00 H new ATOM 565 N LYS A 59 -3.268 -12.175 -3.285 1.00 0.00 N ATOM 566 CA LYS A 59 -4.407 -12.806 -2.626 1.00 0.00 C ATOM 567 C LYS A 59 -5.415 -11.761 -2.174 1.00 0.00 C ATOM 568 O LYS A 59 -6.626 -11.963 -2.275 1.00 0.00 O ATOM 569 CB LYS A 59 -3.953 -13.654 -1.437 1.00 0.00 C ATOM 570 CG LYS A 59 -3.801 -15.124 -1.779 1.00 0.00 C ATOM 571 CD LYS A 59 -5.136 -15.726 -2.185 1.00 0.00 C ATOM 572 CE LYS A 59 -4.968 -17.110 -2.783 1.00 0.00 C ATOM 573 NZ LYS A 59 -6.265 -17.678 -3.236 1.00 0.00 N ATOM 0 H LYS A 59 -2.383 -12.270 -2.787 1.00 0.00 H new ATOM 0 HA LYS A 59 -4.889 -13.463 -3.350 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.001 -13.272 -1.069 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -4.674 -13.548 -0.626 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -3.083 -15.240 -2.591 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.401 -15.662 -0.920 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -5.790 -15.782 -1.315 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -5.625 -15.074 -2.909 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.279 -17.060 -3.626 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.519 -17.773 -2.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -6.174 -18.013 -4.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -6.529 -18.474 -2.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -7.001 -16.945 -3.187 1.00 0.00 H new ATOM 587 N LEU A 60 -4.907 -10.641 -1.684 1.00 0.00 N ATOM 588 CA LEU A 60 -5.756 -9.531 -1.290 1.00 0.00 C ATOM 589 C LEU A 60 -6.446 -8.946 -2.514 1.00 0.00 C ATOM 590 O LEU A 60 -7.645 -8.671 -2.495 1.00 0.00 O ATOM 591 CB LEU A 60 -4.925 -8.459 -0.585 1.00 0.00 C ATOM 592 CG LEU A 60 -4.195 -8.935 0.670 1.00 0.00 C ATOM 593 CD1 LEU A 60 -3.253 -7.857 1.170 1.00 0.00 C ATOM 594 CD2 LEU A 60 -5.189 -9.319 1.754 1.00 0.00 C ATOM 0 H LEU A 60 -3.909 -10.478 -1.550 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.516 -9.893 -0.598 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.190 -8.068 -1.289 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -5.580 -7.631 -0.315 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.609 -9.818 0.416 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.739 -8.209 2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.520 -7.627 0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -3.822 -6.958 1.408 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.650 -9.655 2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.802 -8.454 2.009 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.829 -10.123 1.392 1.00 0.00 H new ATOM 606 N SER A 61 -5.677 -8.771 -3.583 1.00 0.00 N ATOM 607 CA SER A 61 -6.212 -8.285 -4.843 1.00 0.00 C ATOM 608 C SER A 61 -7.269 -9.246 -5.380 1.00 0.00 C ATOM 609 O SER A 61 -8.338 -8.818 -5.799 1.00 0.00 O ATOM 610 CB SER A 61 -5.082 -8.106 -5.863 1.00 0.00 C ATOM 611 OG SER A 61 -5.578 -7.672 -7.119 1.00 0.00 O ATOM 0 H SER A 61 -4.675 -8.961 -3.598 1.00 0.00 H new ATOM 0 HA SER A 61 -6.684 -7.317 -4.672 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.361 -7.381 -5.485 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.550 -9.049 -5.987 1.00 0.00 H new ATOM 0 HG SER A 61 -5.896 -6.748 -7.044 1.00 0.00 H new ATOM 617 N GLU A 62 -6.961 -10.540 -5.343 1.00 0.00 N ATOM 618 CA GLU A 62 -7.874 -11.584 -5.805 1.00 0.00 C ATOM 619 C GLU A 62 -9.258 -11.411 -5.187 1.00 0.00 C ATOM 620 O GLU A 62 -10.261 -11.302 -5.895 1.00 0.00 O ATOM 621 CB GLU A 62 -7.311 -12.964 -5.439 1.00 0.00 C ATOM 622 CG GLU A 62 -8.207 -14.130 -5.831 1.00 0.00 C ATOM 623 CD GLU A 62 -7.670 -15.467 -5.357 1.00 0.00 C ATOM 624 OE1 GLU A 62 -7.986 -15.876 -4.220 1.00 0.00 O ATOM 625 OE2 GLU A 62 -6.932 -16.125 -6.116 1.00 0.00 O ATOM 0 H GLU A 62 -6.072 -10.895 -4.992 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.969 -11.503 -6.888 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.342 -13.088 -5.922 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.138 -12.999 -4.363 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -9.202 -13.974 -5.414 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.316 -14.151 -6.915 1.00 0.00 H new ATOM 632 N LEU A 63 -9.296 -11.363 -3.864 1.00 0.00 N ATOM 633 CA LEU A 63 -10.553 -11.279 -3.140 1.00 0.00 C ATOM 634 C LEU A 63 -11.221 -9.917 -3.334 1.00 0.00 C ATOM 635 O LEU A 63 -12.415 -9.842 -3.622 1.00 0.00 O ATOM 636 CB LEU A 63 -10.324 -11.551 -1.650 1.00 0.00 C ATOM 637 CG LEU A 63 -9.623 -12.876 -1.330 1.00 0.00 C ATOM 638 CD1 LEU A 63 -9.451 -13.040 0.171 1.00 0.00 C ATOM 639 CD2 LEU A 63 -10.396 -14.052 -1.908 1.00 0.00 C ATOM 0 H LEU A 63 -8.467 -11.381 -3.269 1.00 0.00 H new ATOM 0 HA LEU A 63 -11.223 -12.039 -3.543 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -9.732 -10.735 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -11.288 -11.536 -1.142 1.00 0.00 H new ATOM 0 HG LEU A 63 -8.636 -12.857 -1.792 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -8.952 -13.986 0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -8.849 -12.219 0.560 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -10.429 -13.033 0.652 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -9.879 -14.981 -1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -11.398 -14.074 -1.481 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -10.465 -13.945 -2.991 1.00 0.00 H new ATOM 651 N ALA A 64 -10.447 -8.845 -3.192 1.00 0.00 N ATOM 652 CA ALA A 64 -10.985 -7.488 -3.277 1.00 0.00 C ATOM 653 C ALA A 64 -11.514 -7.177 -4.673 1.00 0.00 C ATOM 654 O ALA A 64 -12.590 -6.588 -4.826 1.00 0.00 O ATOM 655 CB ALA A 64 -9.924 -6.474 -2.882 1.00 0.00 C ATOM 0 H ALA A 64 -9.443 -8.888 -3.017 1.00 0.00 H new ATOM 0 HA ALA A 64 -11.822 -7.422 -2.582 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -10.339 -5.468 -2.950 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.601 -6.665 -1.859 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -9.070 -6.561 -3.554 1.00 0.00 H new ATOM 661 N ASP A 65 -10.759 -7.584 -5.683 1.00 0.00 N ATOM 662 CA ASP A 65 -11.127 -7.332 -7.072 1.00 0.00 C ATOM 663 C ASP A 65 -12.397 -8.104 -7.414 1.00 0.00 C ATOM 664 O ASP A 65 -13.242 -7.635 -8.180 1.00 0.00 O ATOM 665 CB ASP A 65 -9.984 -7.753 -8.000 1.00 0.00 C ATOM 666 CG ASP A 65 -9.936 -6.961 -9.289 1.00 0.00 C ATOM 667 OD1 ASP A 65 -10.695 -7.285 -10.222 1.00 0.00 O ATOM 668 OD2 ASP A 65 -9.112 -6.022 -9.383 1.00 0.00 O ATOM 0 H ASP A 65 -9.883 -8.093 -5.567 1.00 0.00 H new ATOM 0 HA ASP A 65 -11.312 -6.267 -7.208 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -9.036 -7.636 -7.474 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -10.088 -8.812 -8.236 1.00 0.00 H new ATOM 673 N ALA A 66 -12.527 -9.287 -6.816 1.00 0.00 N ATOM 674 CA ALA A 66 -13.711 -10.117 -6.994 1.00 0.00 C ATOM 675 C ALA A 66 -14.931 -9.487 -6.325 1.00 0.00 C ATOM 676 O ALA A 66 -16.031 -9.514 -6.879 1.00 0.00 O ATOM 677 CB ALA A 66 -13.468 -11.514 -6.443 1.00 0.00 C ATOM 0 H ALA A 66 -11.821 -9.692 -6.201 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.912 -10.191 -8.063 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -14.362 -12.121 -6.584 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.631 -11.973 -6.970 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.236 -11.451 -5.380 1.00 0.00 H new ATOM 683 N LYS A 67 -14.731 -8.923 -5.132 1.00 0.00 N ATOM 684 CA LYS A 67 -15.816 -8.261 -4.406 1.00 0.00 C ATOM 685 C LYS A 67 -16.392 -7.122 -5.238 1.00 0.00 C ATOM 686 O LYS A 67 -17.606 -7.006 -5.401 1.00 0.00 O ATOM 687 CB LYS A 67 -15.332 -7.697 -3.064 1.00 0.00 C ATOM 688 CG LYS A 67 -14.774 -8.731 -2.100 1.00 0.00 C ATOM 689 CD LYS A 67 -15.782 -9.823 -1.780 1.00 0.00 C ATOM 690 CE LYS A 67 -15.267 -10.733 -0.677 1.00 0.00 C ATOM 691 NZ LYS A 67 -16.146 -11.909 -0.461 1.00 0.00 N ATOM 0 H LYS A 67 -13.832 -8.911 -4.650 1.00 0.00 H new ATOM 0 HA LYS A 67 -16.584 -9.011 -4.217 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -14.563 -6.949 -3.257 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -16.163 -7.183 -2.581 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -13.879 -9.180 -2.530 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.471 -8.238 -1.177 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -16.726 -9.373 -1.474 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -15.984 -10.410 -2.676 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -14.263 -11.074 -0.930 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -15.187 -10.166 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -15.754 -12.500 0.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -17.098 -11.586 -0.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -16.202 -12.466 -1.338 1.00 0.00 H new ATOM 705 N GLY A 68 -15.505 -6.296 -5.767 1.00 0.00 N ATOM 706 CA GLY A 68 -15.925 -5.153 -6.550 1.00 0.00 C ATOM 707 C GLY A 68 -15.212 -3.886 -6.131 1.00 0.00 C ATOM 708 O GLY A 68 -15.767 -2.789 -6.216 1.00 0.00 O ATOM 0 H GLY A 68 -14.495 -6.397 -5.668 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.732 -5.346 -7.605 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.001 -5.016 -6.443 1.00 0.00 H new ATOM 712 N GLY A 69 -13.979 -4.037 -5.667 1.00 0.00 N ATOM 713 CA GLY A 69 -13.202 -2.894 -5.247 1.00 0.00 C ATOM 714 C GLY A 69 -11.912 -2.784 -6.023 1.00 0.00 C ATOM 715 O GLY A 69 -11.284 -3.794 -6.338 1.00 0.00 O ATOM 0 H GLY A 69 -13.504 -4.935 -5.575 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -13.788 -1.985 -5.383 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -12.981 -2.974 -4.183 1.00 0.00 H new ATOM 719 N LYS A 70 -11.516 -1.562 -6.334 1.00 0.00 N ATOM 720 CA LYS A 70 -10.310 -1.332 -7.114 1.00 0.00 C ATOM 721 C LYS A 70 -9.108 -1.178 -6.195 1.00 0.00 C ATOM 722 O LYS A 70 -7.959 -1.335 -6.618 1.00 0.00 O ATOM 723 CB LYS A 70 -10.462 -0.077 -7.972 1.00 0.00 C ATOM 724 CG LYS A 70 -11.708 -0.073 -8.837 1.00 0.00 C ATOM 725 CD LYS A 70 -11.836 1.235 -9.593 1.00 0.00 C ATOM 726 CE LYS A 70 -13.186 1.366 -10.273 1.00 0.00 C ATOM 727 NZ LYS A 70 -13.403 2.739 -10.797 1.00 0.00 N ATOM 0 H LYS A 70 -12.011 -0.713 -6.059 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.154 -2.192 -7.765 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.481 0.797 -7.321 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.586 0.022 -8.613 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.669 -0.903 -9.542 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -12.589 -0.225 -8.214 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.694 2.068 -8.904 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -11.045 1.301 -10.340 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.253 0.649 -11.091 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.976 1.117 -9.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -14.415 2.881 -10.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -13.085 3.434 -10.092 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -12.861 2.865 -11.676 1.00 0.00 H new ATOM 741 N TYR A 71 -9.378 -0.868 -4.937 1.00 0.00 N ATOM 742 CA TYR A 71 -8.328 -0.648 -3.961 1.00 0.00 C ATOM 743 C TYR A 71 -8.663 -1.359 -2.659 1.00 0.00 C ATOM 744 O TYR A 71 -9.806 -1.754 -2.434 1.00 0.00 O ATOM 745 CB TYR A 71 -8.136 0.851 -3.704 1.00 0.00 C ATOM 746 CG TYR A 71 -7.809 1.645 -4.950 1.00 0.00 C ATOM 747 CD1 TYR A 71 -6.527 1.642 -5.483 1.00 0.00 C ATOM 748 CD2 TYR A 71 -8.788 2.390 -5.599 1.00 0.00 C ATOM 749 CE1 TYR A 71 -6.228 2.357 -6.626 1.00 0.00 C ATOM 750 CE2 TYR A 71 -8.496 3.109 -6.742 1.00 0.00 C ATOM 751 CZ TYR A 71 -7.215 3.089 -7.252 1.00 0.00 C ATOM 752 OH TYR A 71 -6.922 3.801 -8.392 1.00 0.00 O ATOM 0 H TYR A 71 -10.323 -0.763 -4.568 1.00 0.00 H new ATOM 0 HA TYR A 71 -7.399 -1.055 -4.359 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -9.045 1.253 -3.256 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -7.335 0.986 -2.977 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -5.751 1.071 -4.996 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -9.793 2.407 -5.203 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -5.226 2.343 -7.028 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -9.267 3.684 -7.234 1.00 0.00 H new ATOM 0 HH TYR A 71 -7.728 4.260 -8.707 1.00 0.00 H new ATOM 762 N TYR A 72 -7.662 -1.534 -1.817 1.00 0.00 N ATOM 763 CA TYR A 72 -7.853 -2.127 -0.506 1.00 0.00 C ATOM 764 C TYR A 72 -6.796 -1.616 0.460 1.00 0.00 C ATOM 765 O TYR A 72 -5.779 -1.057 0.044 1.00 0.00 O ATOM 766 CB TYR A 72 -7.815 -3.663 -0.578 1.00 0.00 C ATOM 767 CG TYR A 72 -6.678 -4.220 -1.406 1.00 0.00 C ATOM 768 CD1 TYR A 72 -5.389 -4.323 -0.896 1.00 0.00 C ATOM 769 CD2 TYR A 72 -6.899 -4.639 -2.709 1.00 0.00 C ATOM 770 CE1 TYR A 72 -4.357 -4.828 -1.665 1.00 0.00 C ATOM 771 CE2 TYR A 72 -5.875 -5.141 -3.481 1.00 0.00 C ATOM 772 CZ TYR A 72 -4.608 -5.234 -2.958 1.00 0.00 C ATOM 773 OH TYR A 72 -3.586 -5.724 -3.737 1.00 0.00 O ATOM 0 H TYR A 72 -6.698 -1.271 -2.021 1.00 0.00 H new ATOM 0 HA TYR A 72 -8.838 -1.833 -0.142 1.00 0.00 H new ATOM 0 HB2 TYR A 72 -7.741 -4.061 0.434 1.00 0.00 H new ATOM 0 HB3 TYR A 72 -8.758 -4.019 -0.992 1.00 0.00 H new ATOM 0 HD1 TYR A 72 -5.191 -4.004 0.116 1.00 0.00 H new ATOM 0 HD2 TYR A 72 -7.893 -4.570 -3.126 1.00 0.00 H new ATOM 0 HE1 TYR A 72 -3.361 -4.904 -1.255 1.00 0.00 H new ATOM 0 HE2 TYR A 72 -6.067 -5.461 -4.495 1.00 0.00 H new ATOM 0 HH TYR A 72 -3.503 -6.690 -3.597 1.00 0.00 H new ATOM 783 N HIS A 73 -7.045 -1.793 1.745 1.00 0.00 N ATOM 784 CA HIS A 73 -6.095 -1.383 2.767 1.00 0.00 C ATOM 785 C HIS A 73 -5.911 -2.492 3.789 1.00 0.00 C ATOM 786 O HIS A 73 -6.877 -2.943 4.404 1.00 0.00 O ATOM 787 CB HIS A 73 -6.562 -0.100 3.465 1.00 0.00 C ATOM 788 CG HIS A 73 -5.629 0.369 4.544 1.00 0.00 C ATOM 789 ND1 HIS A 73 -4.419 0.969 4.280 1.00 0.00 N ATOM 790 CD2 HIS A 73 -5.726 0.306 5.893 1.00 0.00 C ATOM 791 CE1 HIS A 73 -3.812 1.251 5.417 1.00 0.00 C ATOM 792 NE2 HIS A 73 -4.582 0.860 6.412 1.00 0.00 N ATOM 0 H HIS A 73 -7.898 -2.219 2.108 1.00 0.00 H new ATOM 0 HA HIS A 73 -5.140 -1.183 2.282 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -6.671 0.690 2.721 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.548 -0.269 3.897 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -4.049 1.165 3.350 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -6.551 -0.104 6.457 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -2.846 1.723 5.516 1.00 0.00 H new ATOM 801 N ILE A 74 -4.673 -2.933 3.957 1.00 0.00 N ATOM 802 CA ILE A 74 -4.354 -3.929 4.965 1.00 0.00 C ATOM 803 C ILE A 74 -4.436 -3.304 6.348 1.00 0.00 C ATOM 804 O ILE A 74 -3.667 -2.401 6.677 1.00 0.00 O ATOM 805 CB ILE A 74 -2.942 -4.514 4.763 1.00 0.00 C ATOM 806 CG1 ILE A 74 -2.785 -5.057 3.342 1.00 0.00 C ATOM 807 CG2 ILE A 74 -2.674 -5.610 5.785 1.00 0.00 C ATOM 808 CD1 ILE A 74 -1.402 -5.596 3.050 1.00 0.00 C ATOM 0 H ILE A 74 -3.874 -2.616 3.408 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.078 -4.738 4.869 1.00 0.00 H new ATOM 0 HB ILE A 74 -2.212 -3.717 4.908 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -3.516 -5.849 3.182 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -3.014 -4.263 2.631 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -1.674 -6.014 5.631 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -2.747 -5.196 6.791 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -3.409 -6.406 5.666 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -1.364 -5.964 2.025 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.667 -4.801 3.178 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -1.177 -6.412 3.737 1.00 0.00 H new ATOM 820 N ILE A 75 -5.382 -3.761 7.149 1.00 0.00 N ATOM 821 CA ILE A 75 -5.551 -3.220 8.486 1.00 0.00 C ATOM 822 C ILE A 75 -4.964 -4.158 9.530 1.00 0.00 C ATOM 823 O ILE A 75 -4.553 -3.721 10.605 1.00 0.00 O ATOM 824 CB ILE A 75 -7.033 -2.932 8.813 1.00 0.00 C ATOM 825 CG1 ILE A 75 -7.885 -4.196 8.655 1.00 0.00 C ATOM 826 CG2 ILE A 75 -7.553 -1.819 7.918 1.00 0.00 C ATOM 827 CD1 ILE A 75 -9.329 -4.015 9.077 1.00 0.00 C ATOM 0 H ILE A 75 -6.040 -4.499 6.900 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.012 -2.273 8.513 1.00 0.00 H new ATOM 0 HB ILE A 75 -7.104 -2.611 9.852 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -7.858 -4.514 7.613 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.441 -4.998 9.245 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -8.599 -1.621 8.154 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -6.966 -0.915 8.083 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -7.467 -2.121 6.874 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -9.869 -4.951 8.937 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -9.368 -3.728 10.128 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.790 -3.236 8.470 1.00 0.00 H new ATOM 839 N ALA A 76 -4.907 -5.446 9.205 1.00 0.00 N ATOM 840 CA ALA A 76 -4.356 -6.430 10.121 1.00 0.00 C ATOM 841 C ALA A 76 -3.945 -7.706 9.398 1.00 0.00 C ATOM 842 O ALA A 76 -4.726 -8.648 9.288 1.00 0.00 O ATOM 843 CB ALA A 76 -5.351 -6.751 11.227 1.00 0.00 C ATOM 0 H ALA A 76 -5.235 -5.828 8.318 1.00 0.00 H new ATOM 0 HA ALA A 76 -3.461 -5.994 10.565 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -4.919 -7.490 11.902 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -5.582 -5.843 11.783 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -6.265 -7.151 10.789 1.00 0.00 H new ATOM 849 N ALA A 77 -2.734 -7.715 8.869 1.00 0.00 N ATOM 850 CA ALA A 77 -2.147 -8.935 8.336 1.00 0.00 C ATOM 851 C ALA A 77 -1.330 -9.599 9.430 1.00 0.00 C ATOM 852 O ALA A 77 -0.142 -9.316 9.596 1.00 0.00 O ATOM 853 CB ALA A 77 -1.287 -8.644 7.114 1.00 0.00 C ATOM 0 H ALA A 77 -2.137 -6.891 8.796 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.942 -9.608 8.013 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.862 -9.575 6.738 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.900 -8.186 6.338 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.482 -7.963 7.390 1.00 0.00 H new ATOM 859 N ARG A 78 -1.981 -10.456 10.198 1.00 0.00 N ATOM 860 CA ARG A 78 -1.389 -10.975 11.414 1.00 0.00 C ATOM 861 C ARG A 78 -0.999 -12.438 11.266 1.00 0.00 C ATOM 862 O ARG A 78 -1.533 -13.164 10.423 1.00 0.00 O ATOM 863 CB ARG A 78 -2.353 -10.803 12.592 1.00 0.00 C ATOM 864 CG ARG A 78 -3.508 -11.796 12.610 1.00 0.00 C ATOM 865 CD ARG A 78 -4.445 -11.539 13.782 1.00 0.00 C ATOM 866 NE ARG A 78 -3.709 -11.190 14.998 1.00 0.00 N ATOM 867 CZ ARG A 78 -3.779 -11.857 16.148 1.00 0.00 C ATOM 868 NH1 ARG A 78 -4.550 -12.932 16.266 1.00 0.00 N ATOM 869 NH2 ARG A 78 -3.068 -11.440 17.186 1.00 0.00 N ATOM 0 H ARG A 78 -2.918 -10.805 9.999 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.481 -10.404 11.609 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -1.792 -10.900 13.522 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -2.759 -9.792 12.568 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.065 -11.726 11.675 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -3.116 -12.811 12.672 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -5.132 -10.732 13.528 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -5.050 -12.427 13.965 1.00 0.00 H new ATOM 0 HE ARG A 78 -3.097 -10.375 14.962 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -5.098 -13.256 15.469 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -4.594 -13.433 17.153 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -2.474 -10.615 17.099 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -3.115 -11.944 18.072 1.00 0.00 H new ATOM 883 N GLU A 79 -0.062 -12.856 12.095 1.00 0.00 N ATOM 884 CA GLU A 79 0.397 -14.230 12.111 1.00 0.00 C ATOM 885 C GLU A 79 -0.317 -14.987 13.226 1.00 0.00 C ATOM 886 O GLU A 79 -0.424 -14.491 14.352 1.00 0.00 O ATOM 887 CB GLU A 79 1.910 -14.253 12.317 1.00 0.00 C ATOM 888 CG GLU A 79 2.556 -15.607 12.100 1.00 0.00 C ATOM 889 CD GLU A 79 4.054 -15.546 12.283 1.00 0.00 C ATOM 890 OE1 GLU A 79 4.751 -15.083 11.358 1.00 0.00 O ATOM 891 OE2 GLU A 79 4.541 -15.939 13.363 1.00 0.00 O ATOM 0 H GLU A 79 0.401 -12.253 12.775 1.00 0.00 H new ATOM 0 HA GLU A 79 0.169 -14.715 11.162 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.367 -13.534 11.637 1.00 0.00 H new ATOM 0 HB3 GLU A 79 2.131 -13.918 13.331 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.133 -16.328 12.799 1.00 0.00 H new ATOM 0 HG3 GLU A 79 2.326 -15.963 11.096 1.00 0.00 H new ATOM 898 N HIS A 80 -0.816 -16.169 12.916 1.00 0.00 N ATOM 899 CA HIS A 80 -1.588 -16.945 13.874 1.00 0.00 C ATOM 900 C HIS A 80 -1.025 -18.359 13.980 1.00 0.00 C ATOM 901 O HIS A 80 -1.622 -19.321 13.499 1.00 0.00 O ATOM 902 CB HIS A 80 -3.066 -16.961 13.451 1.00 0.00 C ATOM 903 CG HIS A 80 -3.972 -17.731 14.366 1.00 0.00 C ATOM 904 ND1 HIS A 80 -4.136 -17.427 15.698 1.00 0.00 N ATOM 905 CD2 HIS A 80 -4.770 -18.796 14.125 1.00 0.00 C ATOM 906 CE1 HIS A 80 -4.994 -18.271 16.236 1.00 0.00 C ATOM 907 NE2 HIS A 80 -5.395 -19.112 15.304 1.00 0.00 N ATOM 0 H HIS A 80 -0.701 -16.615 12.006 1.00 0.00 H new ATOM 0 HA HIS A 80 -1.518 -16.485 14.859 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -3.423 -15.933 13.389 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -3.139 -17.385 12.449 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -4.892 -19.303 13.179 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.314 -18.273 17.267 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -6.061 -19.873 15.438 1.00 0.00 H new ATOM 916 N GLY A 81 0.151 -18.471 14.582 1.00 0.00 N ATOM 917 CA GLY A 81 0.811 -19.755 14.667 1.00 0.00 C ATOM 918 C GLY A 81 1.390 -20.155 13.327 1.00 0.00 C ATOM 919 O GLY A 81 2.156 -19.394 12.736 1.00 0.00 O ATOM 0 H GLY A 81 0.657 -17.697 15.012 1.00 0.00 H new ATOM 0 HA2 GLY A 81 1.605 -19.711 15.412 1.00 0.00 H new ATOM 0 HA3 GLY A 81 0.101 -20.512 15.001 1.00 0.00 H new ATOM 923 N PRO A 82 1.043 -21.344 12.823 1.00 0.00 N ATOM 924 CA PRO A 82 1.375 -21.752 11.461 1.00 0.00 C ATOM 925 C PRO A 82 0.439 -21.087 10.457 1.00 0.00 C ATOM 926 O PRO A 82 0.741 -20.975 9.268 1.00 0.00 O ATOM 927 CB PRO A 82 1.158 -23.275 11.465 1.00 0.00 C ATOM 928 CG PRO A 82 0.846 -23.644 12.883 1.00 0.00 C ATOM 929 CD PRO A 82 0.320 -22.400 13.537 1.00 0.00 C ATOM 0 HA PRO A 82 2.388 -21.469 11.175 1.00 0.00 H new ATOM 0 HB2 PRO A 82 0.341 -23.554 10.800 1.00 0.00 H new ATOM 0 HB3 PRO A 82 2.048 -23.797 11.113 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.108 -24.446 12.923 1.00 0.00 H new ATOM 0 HG3 PRO A 82 1.737 -24.005 13.396 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.760 -22.304 13.421 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.528 -22.384 14.607 1.00 0.00 H new ATOM 937 N ASN A 83 -0.697 -20.628 10.967 1.00 0.00 N ATOM 938 CA ASN A 83 -1.730 -20.016 10.150 1.00 0.00 C ATOM 939 C ASN A 83 -1.436 -18.537 9.939 1.00 0.00 C ATOM 940 O ASN A 83 -0.723 -17.914 10.725 1.00 0.00 O ATOM 941 CB ASN A 83 -3.098 -20.173 10.826 1.00 0.00 C ATOM 942 CG ASN A 83 -3.490 -21.623 11.042 1.00 0.00 C ATOM 943 OD1 ASN A 83 -3.145 -22.228 12.061 1.00 0.00 O ATOM 944 ND2 ASN A 83 -4.224 -22.186 10.098 1.00 0.00 N ATOM 0 H ASN A 83 -0.926 -20.671 11.960 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.744 -20.517 9.182 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -3.083 -19.659 11.787 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -3.857 -19.684 10.215 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.526 -23.155 10.197 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.488 -21.651 9.271 1.00 0.00 H new ATOM 951 N PHE A 84 -1.992 -17.980 8.879 1.00 0.00 N ATOM 952 CA PHE A 84 -1.825 -16.567 8.589 1.00 0.00 C ATOM 953 C PHE A 84 -3.183 -15.950 8.290 1.00 0.00 C ATOM 954 O PHE A 84 -3.943 -16.484 7.479 1.00 0.00 O ATOM 955 CB PHE A 84 -0.874 -16.372 7.401 1.00 0.00 C ATOM 956 CG PHE A 84 -0.495 -14.938 7.151 1.00 0.00 C ATOM 957 CD1 PHE A 84 0.574 -14.364 7.822 1.00 0.00 C ATOM 958 CD2 PHE A 84 -1.199 -14.171 6.239 1.00 0.00 C ATOM 959 CE1 PHE A 84 0.930 -13.050 7.587 1.00 0.00 C ATOM 960 CE2 PHE A 84 -0.848 -12.858 6.001 1.00 0.00 C ATOM 961 CZ PHE A 84 0.218 -12.296 6.675 1.00 0.00 C ATOM 0 H PHE A 84 -2.565 -18.485 8.203 1.00 0.00 H new ATOM 0 HA PHE A 84 -1.389 -16.072 9.456 1.00 0.00 H new ATOM 0 HB2 PHE A 84 0.032 -16.952 7.575 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -1.343 -16.775 6.503 1.00 0.00 H new ATOM 0 HD1 PHE A 84 1.134 -14.950 8.536 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -2.033 -14.605 5.707 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.764 -12.613 8.116 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -1.407 -12.270 5.288 1.00 0.00 H new ATOM 0 HZ PHE A 84 0.494 -11.269 6.489 1.00 0.00 H new ATOM 971 N GLU A 85 -3.487 -14.844 8.956 1.00 0.00 N ATOM 972 CA GLU A 85 -4.764 -14.168 8.774 1.00 0.00 C ATOM 973 C GLU A 85 -4.551 -12.741 8.288 1.00 0.00 C ATOM 974 O GLU A 85 -4.069 -11.884 9.031 1.00 0.00 O ATOM 975 CB GLU A 85 -5.568 -14.163 10.078 1.00 0.00 C ATOM 976 CG GLU A 85 -6.034 -15.542 10.515 1.00 0.00 C ATOM 977 CD GLU A 85 -6.866 -15.502 11.782 1.00 0.00 C ATOM 978 OE1 GLU A 85 -8.020 -15.026 11.729 1.00 0.00 O ATOM 979 OE2 GLU A 85 -6.371 -15.945 12.841 1.00 0.00 O ATOM 0 H GLU A 85 -2.865 -14.395 9.629 1.00 0.00 H new ATOM 0 HA GLU A 85 -5.329 -14.715 8.019 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -4.957 -13.728 10.869 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -6.438 -13.517 9.956 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -6.619 -15.994 9.714 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -5.166 -16.181 10.675 1.00 0.00 H new ATOM 986 N ALA A 86 -4.907 -12.492 7.040 1.00 0.00 N ATOM 987 CA ALA A 86 -4.749 -11.170 6.456 1.00 0.00 C ATOM 988 C ALA A 86 -6.097 -10.470 6.347 1.00 0.00 C ATOM 989 O ALA A 86 -6.950 -10.862 5.551 1.00 0.00 O ATOM 990 CB ALA A 86 -4.087 -11.265 5.091 1.00 0.00 C ATOM 0 H ALA A 86 -5.308 -13.188 6.411 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.106 -10.580 7.110 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -3.977 -10.266 4.670 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -3.104 -11.725 5.194 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.704 -11.872 4.429 1.00 0.00 H new ATOM 996 N VAL A 87 -6.288 -9.457 7.179 1.00 0.00 N ATOM 997 CA VAL A 87 -7.516 -8.679 7.175 1.00 0.00 C ATOM 998 C VAL A 87 -7.310 -7.367 6.422 1.00 0.00 C ATOM 999 O VAL A 87 -6.468 -6.543 6.799 1.00 0.00 O ATOM 1000 CB VAL A 87 -7.989 -8.366 8.610 1.00 0.00 C ATOM 1001 CG1 VAL A 87 -9.382 -7.753 8.597 1.00 0.00 C ATOM 1002 CG2 VAL A 87 -7.959 -9.616 9.476 1.00 0.00 C ATOM 0 H VAL A 87 -5.602 -9.154 7.870 1.00 0.00 H new ATOM 0 HA VAL A 87 -8.279 -9.277 6.677 1.00 0.00 H new ATOM 0 HB VAL A 87 -7.301 -7.639 9.041 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -9.696 -7.540 9.619 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -9.367 -6.827 8.022 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -10.083 -8.452 8.140 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -8.297 -9.369 10.483 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -8.617 -10.372 9.047 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.941 -10.004 9.520 1.00 0.00 H new ATOM 1012 N ALA A 88 -8.074 -7.181 5.357 1.00 0.00 N ATOM 1013 CA ALA A 88 -7.991 -5.972 4.555 1.00 0.00 C ATOM 1014 C ALA A 88 -9.384 -5.482 4.187 1.00 0.00 C ATOM 1015 O ALA A 88 -10.310 -6.280 4.039 1.00 0.00 O ATOM 1016 CB ALA A 88 -7.165 -6.223 3.300 1.00 0.00 C ATOM 0 H ALA A 88 -8.763 -7.857 5.027 1.00 0.00 H new ATOM 0 HA ALA A 88 -7.498 -5.199 5.144 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -7.112 -5.308 2.710 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.158 -6.531 3.583 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.632 -7.010 2.708 1.00 0.00 H new ATOM 1022 N GLU A 89 -9.535 -4.176 4.055 1.00 0.00 N ATOM 1023 CA GLU A 89 -10.818 -3.598 3.686 1.00 0.00 C ATOM 1024 C GLU A 89 -10.816 -3.218 2.211 1.00 0.00 C ATOM 1025 O GLU A 89 -9.831 -2.686 1.704 1.00 0.00 O ATOM 1026 CB GLU A 89 -11.121 -2.376 4.550 1.00 0.00 C ATOM 1027 CG GLU A 89 -11.122 -2.674 6.038 1.00 0.00 C ATOM 1028 CD GLU A 89 -11.494 -1.470 6.869 1.00 0.00 C ATOM 1029 OE1 GLU A 89 -10.624 -0.607 7.103 1.00 0.00 O ATOM 1030 OE2 GLU A 89 -12.665 -1.379 7.298 1.00 0.00 O ATOM 0 H GLU A 89 -8.788 -3.496 4.197 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.598 -4.341 3.855 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -10.382 -1.602 4.343 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.093 -1.973 4.267 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.823 -3.483 6.243 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.134 -3.025 6.335 1.00 0.00 H new ATOM 1037 N VAL A 90 -11.920 -3.496 1.536 1.00 0.00 N ATOM 1038 CA VAL A 90 -12.031 -3.267 0.101 1.00 0.00 C ATOM 1039 C VAL A 90 -12.658 -1.909 -0.183 1.00 0.00 C ATOM 1040 O VAL A 90 -13.701 -1.569 0.380 1.00 0.00 O ATOM 1041 CB VAL A 90 -12.880 -4.367 -0.568 1.00 0.00 C ATOM 1042 CG1 VAL A 90 -12.903 -4.199 -2.078 1.00 0.00 C ATOM 1043 CG2 VAL A 90 -12.362 -5.742 -0.187 1.00 0.00 C ATOM 0 H VAL A 90 -12.761 -3.885 1.963 1.00 0.00 H new ATOM 0 HA VAL A 90 -11.023 -3.292 -0.313 1.00 0.00 H new ATOM 0 HB VAL A 90 -13.904 -4.271 -0.207 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -13.509 -4.988 -2.523 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -13.330 -3.228 -2.330 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -11.886 -4.260 -2.466 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -12.972 -6.507 -0.668 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -11.327 -5.845 -0.514 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -12.414 -5.863 0.895 1.00 0.00 H new ATOM 1053 N TYR A 91 -12.030 -1.139 -1.062 1.00 0.00 N ATOM 1054 CA TYR A 91 -12.503 0.197 -1.386 1.00 0.00 C ATOM 1055 C TYR A 91 -12.654 0.392 -2.890 1.00 0.00 C ATOM 1056 O TYR A 91 -11.880 -0.136 -3.690 1.00 0.00 O ATOM 1057 CB TYR A 91 -11.550 1.254 -0.822 1.00 0.00 C ATOM 1058 CG TYR A 91 -11.552 1.328 0.687 1.00 0.00 C ATOM 1059 CD1 TYR A 91 -12.441 2.158 1.355 1.00 0.00 C ATOM 1060 CD2 TYR A 91 -10.672 0.565 1.441 1.00 0.00 C ATOM 1061 CE1 TYR A 91 -12.454 2.225 2.734 1.00 0.00 C ATOM 1062 CE2 TYR A 91 -10.678 0.627 2.819 1.00 0.00 C ATOM 1063 CZ TYR A 91 -11.571 1.458 3.460 1.00 0.00 C ATOM 1064 OH TYR A 91 -11.582 1.517 4.833 1.00 0.00 O ATOM 0 H TYR A 91 -11.188 -1.420 -1.565 1.00 0.00 H new ATOM 0 HA TYR A 91 -13.485 0.313 -0.928 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -10.538 1.039 -1.165 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -11.823 2.229 -1.225 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -13.134 2.761 0.787 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -9.971 -0.088 0.941 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -13.153 2.875 3.240 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -9.987 0.027 3.392 1.00 0.00 H new ATOM 0 HH TYR A 91 -11.229 0.679 5.199 1.00 0.00 H new ATOM 1074 N ASN A 92 -13.667 1.153 -3.257 1.00 0.00 N ATOM 1075 CA ASN A 92 -13.908 1.529 -4.640 1.00 0.00 C ATOM 1076 C ASN A 92 -14.024 3.048 -4.697 1.00 0.00 C ATOM 1077 O ASN A 92 -14.661 3.651 -3.831 1.00 0.00 O ATOM 1078 CB ASN A 92 -15.188 0.844 -5.145 1.00 0.00 C ATOM 1079 CG ASN A 92 -15.437 1.012 -6.637 1.00 0.00 C ATOM 1080 OD1 ASN A 92 -15.153 2.054 -7.224 1.00 0.00 O ATOM 1081 ND2 ASN A 92 -15.960 -0.031 -7.263 1.00 0.00 N ATOM 0 H ASN A 92 -14.351 1.531 -2.601 1.00 0.00 H new ATOM 0 HA ASN A 92 -13.090 1.208 -5.285 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.133 -0.220 -4.915 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.041 1.245 -4.598 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.140 0.014 -8.266 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -16.183 -0.879 -6.742 1.00 0.00 H new ATOM 1088 N ASP A 93 -13.397 3.673 -5.687 1.00 0.00 N ATOM 1089 CA ASP A 93 -13.321 5.132 -5.741 1.00 0.00 C ATOM 1090 C ASP A 93 -14.637 5.750 -6.218 1.00 0.00 C ATOM 1091 O ASP A 93 -14.740 6.260 -7.333 1.00 0.00 O ATOM 1092 CB ASP A 93 -12.143 5.590 -6.617 1.00 0.00 C ATOM 1093 CG ASP A 93 -12.245 5.129 -8.059 1.00 0.00 C ATOM 1094 OD1 ASP A 93 -12.247 3.908 -8.302 1.00 0.00 O ATOM 1095 OD2 ASP A 93 -12.326 5.991 -8.961 1.00 0.00 O ATOM 0 H ASP A 93 -12.935 3.196 -6.461 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.145 5.488 -4.726 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -12.086 6.678 -6.595 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -11.214 5.214 -6.188 1.00 0.00 H new ATOM 1100 N ALA A 94 -15.653 5.648 -5.358 1.00 0.00 N ATOM 1101 CA ALA A 94 -16.971 6.258 -5.574 1.00 0.00 C ATOM 1102 C ALA A 94 -17.776 5.552 -6.664 1.00 0.00 C ATOM 1103 O ALA A 94 -19.004 5.654 -6.686 1.00 0.00 O ATOM 1104 CB ALA A 94 -16.842 7.746 -5.880 1.00 0.00 C ATOM 0 H ALA A 94 -15.585 5.133 -4.480 1.00 0.00 H new ATOM 0 HA ALA A 94 -17.524 6.138 -4.642 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -17.833 8.173 -6.036 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -16.358 8.249 -5.043 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -16.243 7.882 -6.780 1.00 0.00 H new ATOM 1290 N ALA B 22 7.800 -0.429 -8.314 1.00 0.00 N ATOM 1291 CA ALA B 22 7.906 -0.567 -6.847 1.00 0.00 C ATOM 1292 C ALA B 22 6.520 -0.619 -6.219 1.00 0.00 C ATOM 1293 O ALA B 22 5.610 0.098 -6.640 1.00 0.00 O ATOM 1294 CB ALA B 22 8.719 0.581 -6.269 1.00 0.00 C ATOM 0 HA ALA B 22 8.419 -1.501 -6.617 1.00 0.00 H new ATOM 0 HB1 ALA B 22 8.790 0.468 -5.187 1.00 0.00 H new ATOM 0 HB2 ALA B 22 9.720 0.572 -6.701 1.00 0.00 H new ATOM 0 HB3 ALA B 22 8.231 1.527 -6.504 1.00 0.00 H new ATOM 1302 N GLU B 23 6.369 -1.459 -5.206 1.00 0.00 N ATOM 1303 CA GLU B 23 5.069 -1.697 -4.591 1.00 0.00 C ATOM 1304 C GLU B 23 4.963 -0.966 -3.257 1.00 0.00 C ATOM 1305 O GLU B 23 5.976 -0.619 -2.650 1.00 0.00 O ATOM 1306 CB GLU B 23 4.868 -3.197 -4.361 1.00 0.00 C ATOM 1307 CG GLU B 23 5.201 -4.062 -5.566 1.00 0.00 C ATOM 1308 CD GLU B 23 4.297 -3.801 -6.750 1.00 0.00 C ATOM 1309 OE1 GLU B 23 3.164 -4.318 -6.756 1.00 0.00 O ATOM 1310 OE2 GLU B 23 4.724 -3.099 -7.691 1.00 0.00 O ATOM 0 H GLU B 23 7.134 -1.990 -4.790 1.00 0.00 H new ATOM 0 HA GLU B 23 4.298 -1.321 -5.264 1.00 0.00 H new ATOM 0 HB2 GLU B 23 5.487 -3.511 -3.520 1.00 0.00 H new ATOM 0 HB3 GLU B 23 3.831 -3.374 -4.076 1.00 0.00 H new ATOM 0 HG2 GLU B 23 6.235 -3.883 -5.860 1.00 0.00 H new ATOM 0 HG3 GLU B 23 5.127 -5.112 -5.284 1.00 0.00 H new ATOM 1317 N GLN B 24 3.737 -0.732 -2.800 1.00 0.00 N ATOM 1318 CA GLN B 24 3.531 -0.171 -1.474 1.00 0.00 C ATOM 1319 C GLN B 24 3.091 -1.259 -0.507 1.00 0.00 C ATOM 1320 O GLN B 24 2.158 -2.012 -0.787 1.00 0.00 O ATOM 1321 CB GLN B 24 2.500 0.967 -1.472 1.00 0.00 C ATOM 1322 CG GLN B 24 2.290 1.548 -0.076 1.00 0.00 C ATOM 1323 CD GLN B 24 1.398 2.775 -0.029 1.00 0.00 C ATOM 1324 OE1 GLN B 24 1.589 3.645 0.823 1.00 0.00 O ATOM 1325 NE2 GLN B 24 0.415 2.853 -0.913 1.00 0.00 N ATOM 0 H GLN B 24 2.882 -0.920 -3.323 1.00 0.00 H new ATOM 0 HA GLN B 24 4.485 0.248 -1.154 1.00 0.00 H new ATOM 0 HB2 GLN B 24 2.831 1.756 -2.147 1.00 0.00 H new ATOM 0 HB3 GLN B 24 1.550 0.596 -1.857 1.00 0.00 H new ATOM 0 HG2 GLN B 24 1.859 0.777 0.563 1.00 0.00 H new ATOM 0 HG3 GLN B 24 3.262 1.805 0.346 1.00 0.00 H new ATOM 0 HE21 GLN B 24 0.290 2.112 -1.603 1.00 0.00 H new ATOM 0 HE22 GLN B 24 -0.217 3.654 -0.904 1.00 0.00 H new ATOM 1334 N VAL B 25 3.782 -1.338 0.618 1.00 0.00 N ATOM 1335 CA VAL B 25 3.441 -2.277 1.675 1.00 0.00 C ATOM 1336 C VAL B 25 3.169 -1.514 2.962 1.00 0.00 C ATOM 1337 O VAL B 25 3.692 -0.412 3.154 1.00 0.00 O ATOM 1338 CB VAL B 25 4.571 -3.305 1.916 1.00 0.00 C ATOM 1339 CG1 VAL B 25 4.737 -4.217 0.712 1.00 0.00 C ATOM 1340 CG2 VAL B 25 5.883 -2.601 2.236 1.00 0.00 C ATOM 0 H VAL B 25 4.593 -0.755 0.825 1.00 0.00 H new ATOM 0 HA VAL B 25 2.551 -2.823 1.363 1.00 0.00 H new ATOM 0 HB VAL B 25 4.292 -3.917 2.774 1.00 0.00 H new ATOM 0 HG11 VAL B 25 5.537 -4.932 0.904 1.00 0.00 H new ATOM 0 HG12 VAL B 25 3.806 -4.755 0.532 1.00 0.00 H new ATOM 0 HG13 VAL B 25 4.987 -3.620 -0.165 1.00 0.00 H new ATOM 0 HG21 VAL B 25 6.663 -3.344 2.402 1.00 0.00 H new ATOM 0 HG22 VAL B 25 6.164 -1.959 1.401 1.00 0.00 H new ATOM 0 HG23 VAL B 25 5.761 -1.996 3.134 1.00 0.00 H new ATOM 1350 N SER B 26 2.357 -2.073 3.840 1.00 0.00 N ATOM 1351 CA SER B 26 2.037 -1.395 5.077 1.00 0.00 C ATOM 1352 C SER B 26 2.935 -1.892 6.208 1.00 0.00 C ATOM 1353 O SER B 26 3.810 -2.741 6.000 1.00 0.00 O ATOM 1354 CB SER B 26 0.549 -1.553 5.428 1.00 0.00 C ATOM 1355 OG SER B 26 0.215 -2.882 5.781 1.00 0.00 O ATOM 0 H SER B 26 1.913 -2.983 3.720 1.00 0.00 H new ATOM 0 HA SER B 26 2.226 -0.330 4.942 1.00 0.00 H new ATOM 0 HB2 SER B 26 0.301 -0.887 6.255 1.00 0.00 H new ATOM 0 HB3 SER B 26 -0.057 -1.243 4.577 1.00 0.00 H new ATOM 0 HG SER B 26 0.751 -3.506 5.249 1.00 0.00 H new ATOM 1361 N LYS B 27 2.710 -1.358 7.403 1.00 0.00 N ATOM 1362 CA LYS B 27 3.551 -1.645 8.562 1.00 0.00 C ATOM 1363 C LYS B 27 3.596 -3.144 8.859 1.00 0.00 C ATOM 1364 O LYS B 27 4.578 -3.647 9.407 1.00 0.00 O ATOM 1365 CB LYS B 27 3.020 -0.877 9.777 1.00 0.00 C ATOM 1366 CG LYS B 27 3.853 -1.041 11.040 1.00 0.00 C ATOM 1367 CD LYS B 27 3.256 -0.246 12.191 1.00 0.00 C ATOM 1368 CE LYS B 27 4.031 -0.441 13.484 1.00 0.00 C ATOM 1369 NZ LYS B 27 4.041 -1.860 13.925 1.00 0.00 N ATOM 0 H LYS B 27 1.942 -0.715 7.597 1.00 0.00 H new ATOM 0 HA LYS B 27 4.569 -1.323 8.341 1.00 0.00 H new ATOM 0 HB2 LYS B 27 2.967 0.183 9.527 1.00 0.00 H new ATOM 0 HB3 LYS B 27 2.002 -1.207 9.983 1.00 0.00 H new ATOM 0 HG2 LYS B 27 3.907 -2.096 11.311 1.00 0.00 H new ATOM 0 HG3 LYS B 27 4.874 -0.707 10.853 1.00 0.00 H new ATOM 0 HD2 LYS B 27 3.244 0.813 11.932 1.00 0.00 H new ATOM 0 HD3 LYS B 27 2.220 -0.549 12.341 1.00 0.00 H new ATOM 0 HE2 LYS B 27 5.056 -0.098 13.346 1.00 0.00 H new ATOM 0 HE3 LYS B 27 3.591 0.177 14.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 4.382 -1.916 14.906 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 3.077 -2.247 13.871 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 4.670 -2.411 13.307 1.00 0.00 H new ATOM 1383 N GLN B 28 2.548 -3.851 8.468 1.00 0.00 N ATOM 1384 CA GLN B 28 2.432 -5.269 8.758 1.00 0.00 C ATOM 1385 C GLN B 28 3.433 -6.084 7.941 1.00 0.00 C ATOM 1386 O GLN B 28 4.035 -7.030 8.454 1.00 0.00 O ATOM 1387 CB GLN B 28 1.005 -5.763 8.499 1.00 0.00 C ATOM 1388 CG GLN B 28 -0.046 -5.176 9.441 1.00 0.00 C ATOM 1389 CD GLN B 28 -0.405 -3.734 9.125 1.00 0.00 C ATOM 1390 OE1 GLN B 28 0.180 -2.795 9.667 1.00 0.00 O ATOM 1391 NE2 GLN B 28 -1.369 -3.550 8.241 1.00 0.00 N ATOM 0 H GLN B 28 1.762 -3.463 7.946 1.00 0.00 H new ATOM 0 HA GLN B 28 2.661 -5.410 9.814 1.00 0.00 H new ATOM 0 HB2 GLN B 28 0.731 -5.522 7.472 1.00 0.00 H new ATOM 0 HB3 GLN B 28 0.988 -6.849 8.587 1.00 0.00 H new ATOM 0 HG2 GLN B 28 -0.948 -5.786 9.391 1.00 0.00 H new ATOM 0 HG3 GLN B 28 0.322 -5.234 10.465 1.00 0.00 H new ATOM 0 HE21 GLN B 28 -1.830 -4.354 7.814 1.00 0.00 H new ATOM 0 HE22 GLN B 28 -1.653 -2.604 7.985 1.00 0.00 H new ATOM 1400 N GLU B 29 3.622 -5.721 6.678 1.00 0.00 N ATOM 1401 CA GLU B 29 4.563 -6.432 5.823 1.00 0.00 C ATOM 1402 C GLU B 29 5.988 -6.082 6.217 1.00 0.00 C ATOM 1403 O GLU B 29 6.848 -6.956 6.317 1.00 0.00 O ATOM 1404 CB GLU B 29 4.348 -6.104 4.339 1.00 0.00 C ATOM 1405 CG GLU B 29 2.939 -6.371 3.832 1.00 0.00 C ATOM 1406 CD GLU B 29 2.037 -5.161 3.964 1.00 0.00 C ATOM 1407 OE1 GLU B 29 1.706 -4.785 5.103 1.00 0.00 O ATOM 1408 OE2 GLU B 29 1.669 -4.573 2.930 1.00 0.00 O ATOM 0 H GLU B 29 3.140 -4.944 6.226 1.00 0.00 H new ATOM 0 HA GLU B 29 4.389 -7.499 5.961 1.00 0.00 H new ATOM 0 HB2 GLU B 29 4.587 -5.053 4.174 1.00 0.00 H new ATOM 0 HB3 GLU B 29 5.051 -6.688 3.745 1.00 0.00 H new ATOM 0 HG2 GLU B 29 2.984 -6.675 2.786 1.00 0.00 H new ATOM 0 HG3 GLU B 29 2.508 -7.204 4.387 1.00 0.00 H new ATOM 1415 N ILE B 30 6.221 -4.799 6.462 1.00 0.00 N ATOM 1416 CA ILE B 30 7.543 -4.310 6.836 1.00 0.00 C ATOM 1417 C ILE B 30 8.054 -5.021 8.089 1.00 0.00 C ATOM 1418 O ILE B 30 9.202 -5.466 8.139 1.00 0.00 O ATOM 1419 CB ILE B 30 7.522 -2.784 7.080 1.00 0.00 C ATOM 1420 CG1 ILE B 30 6.990 -2.062 5.839 1.00 0.00 C ATOM 1421 CG2 ILE B 30 8.915 -2.278 7.438 1.00 0.00 C ATOM 1422 CD1 ILE B 30 6.780 -0.576 6.035 1.00 0.00 C ATOM 0 H ILE B 30 5.506 -4.073 6.408 1.00 0.00 H new ATOM 0 HA ILE B 30 8.217 -4.525 6.007 1.00 0.00 H new ATOM 0 HB ILE B 30 6.859 -2.574 7.919 1.00 0.00 H new ATOM 0 HG12 ILE B 30 7.687 -2.215 5.015 1.00 0.00 H new ATOM 0 HG13 ILE B 30 6.044 -2.517 5.544 1.00 0.00 H new ATOM 0 HG21 ILE B 30 8.879 -1.202 7.606 1.00 0.00 H new ATOM 0 HG22 ILE B 30 9.261 -2.775 8.344 1.00 0.00 H new ATOM 0 HG23 ILE B 30 9.602 -2.495 6.620 1.00 0.00 H new ATOM 0 HD11 ILE B 30 6.402 -0.137 5.112 1.00 0.00 H new ATOM 0 HD12 ILE B 30 6.059 -0.413 6.836 1.00 0.00 H new ATOM 0 HD13 ILE B 30 7.728 -0.106 6.299 1.00 0.00 H new ATOM 1434 N SER B 31 7.181 -5.153 9.079 1.00 0.00 N ATOM 1435 CA SER B 31 7.550 -5.763 10.348 1.00 0.00 C ATOM 1436 C SER B 31 7.742 -7.273 10.208 1.00 0.00 C ATOM 1437 O SER B 31 8.607 -7.857 10.858 1.00 0.00 O ATOM 1438 CB SER B 31 6.479 -5.466 11.399 1.00 0.00 C ATOM 1439 OG SER B 31 6.188 -4.079 11.448 1.00 0.00 O ATOM 0 H SER B 31 6.210 -4.845 9.027 1.00 0.00 H new ATOM 0 HA SER B 31 8.500 -5.333 10.665 1.00 0.00 H new ATOM 0 HB2 SER B 31 5.572 -6.024 11.167 1.00 0.00 H new ATOM 0 HB3 SER B 31 6.820 -5.805 12.377 1.00 0.00 H new ATOM 0 HG SER B 31 5.615 -3.838 10.691 1.00 0.00 H new ATOM 1445 N HIS B 32 6.947 -7.901 9.348 1.00 0.00 N ATOM 1446 CA HIS B 32 6.998 -9.352 9.191 1.00 0.00 C ATOM 1447 C HIS B 32 8.199 -9.764 8.348 1.00 0.00 C ATOM 1448 O HIS B 32 8.958 -10.660 8.721 1.00 0.00 O ATOM 1449 CB HIS B 32 5.711 -9.868 8.542 1.00 0.00 C ATOM 1450 CG HIS B 32 5.483 -11.340 8.732 1.00 0.00 C ATOM 1451 ND1 HIS B 32 6.053 -12.312 7.937 1.00 0.00 N ATOM 1452 CD2 HIS B 32 4.735 -12.003 9.647 1.00 0.00 C ATOM 1453 CE1 HIS B 32 5.664 -13.502 8.352 1.00 0.00 C ATOM 1454 NE2 HIS B 32 4.864 -13.346 9.389 1.00 0.00 N ATOM 0 H HIS B 32 6.264 -7.433 8.752 1.00 0.00 H new ATOM 0 HA HIS B 32 7.098 -9.793 10.183 1.00 0.00 H new ATOM 0 HB2 HIS B 32 4.863 -9.322 8.956 1.00 0.00 H new ATOM 0 HB3 HIS B 32 5.741 -9.649 7.475 1.00 0.00 H new ATOM 0 HD2 HIS B 32 4.146 -11.557 10.435 1.00 0.00 H new ATOM 0 HE1 HIS B 32 5.952 -14.447 7.915 1.00 0.00 H new ATOM 0 HE2 HIS B 32 4.416 -14.098 9.912 1.00 0.00 H new ATOM 1463 N PHE B 33 8.377 -9.100 7.214 1.00 0.00 N ATOM 1464 CA PHE B 33 9.432 -9.459 6.276 1.00 0.00 C ATOM 1465 C PHE B 33 10.769 -8.844 6.677 1.00 0.00 C ATOM 1466 O PHE B 33 11.804 -9.184 6.101 1.00 0.00 O ATOM 1467 CB PHE B 33 9.051 -9.041 4.853 1.00 0.00 C ATOM 1468 CG PHE B 33 7.903 -9.834 4.288 1.00 0.00 C ATOM 1469 CD1 PHE B 33 8.127 -11.057 3.674 1.00 0.00 C ATOM 1470 CD2 PHE B 33 6.603 -9.363 4.376 1.00 0.00 C ATOM 1471 CE1 PHE B 33 7.078 -11.792 3.159 1.00 0.00 C ATOM 1472 CE2 PHE B 33 5.549 -10.093 3.861 1.00 0.00 C ATOM 1473 CZ PHE B 33 5.786 -11.310 3.252 1.00 0.00 C ATOM 0 H PHE B 33 7.804 -8.309 6.921 1.00 0.00 H new ATOM 0 HA PHE B 33 9.545 -10.543 6.302 1.00 0.00 H new ATOM 0 HB2 PHE B 33 8.789 -7.983 4.850 1.00 0.00 H new ATOM 0 HB3 PHE B 33 9.918 -9.157 4.203 1.00 0.00 H new ATOM 0 HD1 PHE B 33 9.134 -11.439 3.598 1.00 0.00 H new ATOM 0 HD2 PHE B 33 6.411 -8.413 4.853 1.00 0.00 H new ATOM 0 HE1 PHE B 33 7.267 -12.743 2.684 1.00 0.00 H new ATOM 0 HE2 PHE B 33 4.541 -9.713 3.935 1.00 0.00 H new ATOM 0 HZ PHE B 33 4.964 -11.883 2.850 1.00 0.00 H new ATOM 1483 N LYS B 34 10.738 -7.950 7.669 1.00 0.00 N ATOM 1484 CA LYS B 34 11.954 -7.339 8.211 1.00 0.00 C ATOM 1485 C LYS B 34 12.676 -6.538 7.130 1.00 0.00 C ATOM 1486 O LYS B 34 13.891 -6.660 6.951 1.00 0.00 O ATOM 1487 CB LYS B 34 12.883 -8.413 8.794 1.00 0.00 C ATOM 1488 CG LYS B 34 12.244 -9.248 9.895 1.00 0.00 C ATOM 1489 CD LYS B 34 11.886 -8.400 11.102 1.00 0.00 C ATOM 1490 CE LYS B 34 11.152 -9.208 12.161 1.00 0.00 C ATOM 1491 NZ LYS B 34 10.826 -8.384 13.353 1.00 0.00 N ATOM 0 H LYS B 34 9.878 -7.632 8.115 1.00 0.00 H new ATOM 0 HA LYS B 34 11.669 -6.658 9.013 1.00 0.00 H new ATOM 0 HB2 LYS B 34 13.207 -9.075 7.991 1.00 0.00 H new ATOM 0 HB3 LYS B 34 13.777 -7.931 9.189 1.00 0.00 H new ATOM 0 HG2 LYS B 34 11.346 -9.732 9.511 1.00 0.00 H new ATOM 0 HG3 LYS B 34 12.930 -10.040 10.196 1.00 0.00 H new ATOM 0 HD2 LYS B 34 12.794 -7.977 11.532 1.00 0.00 H new ATOM 0 HD3 LYS B 34 11.263 -7.563 10.787 1.00 0.00 H new ATOM 0 HE2 LYS B 34 10.234 -9.614 11.737 1.00 0.00 H new ATOM 0 HE3 LYS B 34 11.766 -10.056 12.462 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 10.326 -8.969 14.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 11.704 -8.017 13.772 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 10.219 -7.589 13.070 1.00 0.00 H new ATOM 1505 N LEU B 35 11.915 -5.710 6.427 1.00 0.00 N ATOM 1506 CA LEU B 35 12.439 -4.934 5.310 1.00 0.00 C ATOM 1507 C LEU B 35 13.501 -3.940 5.769 1.00 0.00 C ATOM 1508 O LEU B 35 13.388 -3.334 6.838 1.00 0.00 O ATOM 1509 CB LEU B 35 11.302 -4.192 4.603 1.00 0.00 C ATOM 1510 CG LEU B 35 10.213 -5.085 4.004 1.00 0.00 C ATOM 1511 CD1 LEU B 35 9.123 -4.240 3.366 1.00 0.00 C ATOM 1512 CD2 LEU B 35 10.807 -6.045 2.982 1.00 0.00 C ATOM 0 H LEU B 35 10.924 -5.557 6.613 1.00 0.00 H new ATOM 0 HA LEU B 35 12.906 -5.629 4.613 1.00 0.00 H new ATOM 0 HB2 LEU B 35 10.838 -3.509 5.314 1.00 0.00 H new ATOM 0 HB3 LEU B 35 11.728 -3.582 3.806 1.00 0.00 H new ATOM 0 HG LEU B 35 9.771 -5.671 4.809 1.00 0.00 H new ATOM 0 HD11 LEU B 35 8.357 -4.891 2.945 1.00 0.00 H new ATOM 0 HD12 LEU B 35 8.675 -3.594 4.121 1.00 0.00 H new ATOM 0 HD13 LEU B 35 9.554 -3.628 2.574 1.00 0.00 H new ATOM 0 HD21 LEU B 35 10.016 -6.671 2.568 1.00 0.00 H new ATOM 0 HD22 LEU B 35 11.278 -5.477 2.180 1.00 0.00 H new ATOM 0 HD23 LEU B 35 11.553 -6.676 3.466 1.00 0.00 H new ATOM 1524 N VAL B 36 14.530 -3.779 4.952 1.00 0.00 N ATOM 1525 CA VAL B 36 15.610 -2.848 5.239 1.00 0.00 C ATOM 1526 C VAL B 36 15.285 -1.480 4.654 1.00 0.00 C ATOM 1527 O VAL B 36 14.822 -1.380 3.518 1.00 0.00 O ATOM 1528 CB VAL B 36 16.953 -3.350 4.661 1.00 0.00 C ATOM 1529 CG1 VAL B 36 18.084 -2.389 4.998 1.00 0.00 C ATOM 1530 CG2 VAL B 36 17.267 -4.748 5.171 1.00 0.00 C ATOM 0 H VAL B 36 14.640 -4.288 4.075 1.00 0.00 H new ATOM 0 HA VAL B 36 15.709 -2.773 6.322 1.00 0.00 H new ATOM 0 HB VAL B 36 16.859 -3.393 3.576 1.00 0.00 H new ATOM 0 HG11 VAL B 36 19.018 -2.765 4.580 1.00 0.00 H new ATOM 0 HG12 VAL B 36 17.866 -1.408 4.575 1.00 0.00 H new ATOM 0 HG13 VAL B 36 18.179 -2.304 6.081 1.00 0.00 H new ATOM 0 HG21 VAL B 36 18.216 -5.083 4.753 1.00 0.00 H new ATOM 0 HG22 VAL B 36 17.335 -4.732 6.259 1.00 0.00 H new ATOM 0 HG23 VAL B 36 16.475 -5.432 4.868 1.00 0.00 H new ATOM 1540 N LYS B 37 15.503 -0.434 5.436 1.00 0.00 N ATOM 1541 CA LYS B 37 15.220 0.920 4.989 1.00 0.00 C ATOM 1542 C LYS B 37 16.258 1.376 3.969 1.00 0.00 C ATOM 1543 O LYS B 37 17.463 1.304 4.219 1.00 0.00 O ATOM 1544 CB LYS B 37 15.201 1.881 6.177 1.00 0.00 C ATOM 1545 CG LYS B 37 14.643 3.251 5.832 1.00 0.00 C ATOM 1546 CD LYS B 37 14.741 4.209 7.007 1.00 0.00 C ATOM 1547 CE LYS B 37 13.964 5.485 6.739 1.00 0.00 C ATOM 1548 NZ LYS B 37 12.500 5.234 6.668 1.00 0.00 N ATOM 0 H LYS B 37 15.875 -0.497 6.384 1.00 0.00 H new ATOM 0 HA LYS B 37 14.238 0.924 4.516 1.00 0.00 H new ATOM 0 HB2 LYS B 37 14.605 1.445 6.979 1.00 0.00 H new ATOM 0 HB3 LYS B 37 16.215 1.995 6.560 1.00 0.00 H new ATOM 0 HG2 LYS B 37 15.187 3.662 4.981 1.00 0.00 H new ATOM 0 HG3 LYS B 37 13.601 3.154 5.528 1.00 0.00 H new ATOM 0 HD2 LYS B 37 14.356 3.727 7.906 1.00 0.00 H new ATOM 0 HD3 LYS B 37 15.787 4.450 7.197 1.00 0.00 H new ATOM 0 HE2 LYS B 37 14.171 6.209 7.527 1.00 0.00 H new ATOM 0 HE3 LYS B 37 14.303 5.927 5.802 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 12.124 5.623 5.780 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 12.321 4.210 6.700 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 12.030 5.693 7.474 1.00 0.00 H new ATOM 1562 N VAL B 38 15.785 1.834 2.821 1.00 0.00 N ATOM 1563 CA VAL B 38 16.667 2.329 1.772 1.00 0.00 C ATOM 1564 C VAL B 38 16.800 3.842 1.863 1.00 0.00 C ATOM 1565 O VAL B 38 17.896 4.391 1.742 1.00 0.00 O ATOM 1566 CB VAL B 38 16.142 1.949 0.371 1.00 0.00 C ATOM 1567 CG1 VAL B 38 17.087 2.438 -0.716 1.00 0.00 C ATOM 1568 CG2 VAL B 38 15.941 0.448 0.267 1.00 0.00 C ATOM 0 H VAL B 38 14.792 1.874 2.590 1.00 0.00 H new ATOM 0 HA VAL B 38 17.642 1.865 1.917 1.00 0.00 H new ATOM 0 HB VAL B 38 15.179 2.438 0.226 1.00 0.00 H new ATOM 0 HG11 VAL B 38 16.694 2.157 -1.693 1.00 0.00 H new ATOM 0 HG12 VAL B 38 17.177 3.523 -0.659 1.00 0.00 H new ATOM 0 HG13 VAL B 38 18.068 1.985 -0.576 1.00 0.00 H new ATOM 0 HG21 VAL B 38 15.571 0.199 -0.727 1.00 0.00 H new ATOM 0 HG22 VAL B 38 16.891 -0.059 0.438 1.00 0.00 H new ATOM 0 HG23 VAL B 38 15.217 0.125 1.015 1.00 0.00 H new ATOM 1578 N GLY B 39 15.677 4.507 2.094 1.00 0.00 N ATOM 1579 CA GLY B 39 15.671 5.950 2.169 1.00 0.00 C ATOM 1580 C GLY B 39 14.265 6.501 2.247 1.00 0.00 C ATOM 1581 O GLY B 39 13.333 5.790 2.629 1.00 0.00 O ATOM 0 H GLY B 39 14.766 4.068 2.231 1.00 0.00 H new ATOM 0 HA2 GLY B 39 16.237 6.271 3.044 1.00 0.00 H new ATOM 0 HA3 GLY B 39 16.175 6.362 1.295 1.00 0.00 H new ATOM 1585 N THR B 40 14.112 7.760 1.877 1.00 0.00 N ATOM 1586 CA THR B 40 12.823 8.428 1.929 1.00 0.00 C ATOM 1587 C THR B 40 12.611 9.259 0.668 1.00 0.00 C ATOM 1588 O THR B 40 13.483 10.037 0.275 1.00 0.00 O ATOM 1589 CB THR B 40 12.733 9.342 3.167 1.00 0.00 C ATOM 1590 OG1 THR B 40 13.074 8.594 4.343 1.00 0.00 O ATOM 1591 CG2 THR B 40 11.337 9.926 3.319 1.00 0.00 C ATOM 0 H THR B 40 14.873 8.346 1.534 1.00 0.00 H new ATOM 0 HA THR B 40 12.047 7.665 1.996 1.00 0.00 H new ATOM 0 HB THR B 40 13.435 10.166 3.036 1.00 0.00 H new ATOM 0 HG1 THR B 40 12.386 7.916 4.511 1.00 0.00 H new ATOM 0 HG21 THR B 40 11.304 10.566 4.201 1.00 0.00 H new ATOM 0 HG22 THR B 40 11.090 10.513 2.435 1.00 0.00 H new ATOM 0 HG23 THR B 40 10.615 9.117 3.431 1.00 0.00 H new ATOM 1599 N ILE B 41 11.462 9.087 0.035 1.00 0.00 N ATOM 1600 CA ILE B 41 11.159 9.806 -1.189 1.00 0.00 C ATOM 1601 C ILE B 41 10.052 10.822 -0.957 1.00 0.00 C ATOM 1602 O ILE B 41 9.108 10.572 -0.206 1.00 0.00 O ATOM 1603 CB ILE B 41 10.754 8.855 -2.334 1.00 0.00 C ATOM 1604 CG1 ILE B 41 9.593 7.950 -1.905 1.00 0.00 C ATOM 1605 CG2 ILE B 41 11.953 8.027 -2.769 1.00 0.00 C ATOM 1606 CD1 ILE B 41 9.091 7.037 -3.004 1.00 0.00 C ATOM 0 H ILE B 41 10.725 8.456 0.349 1.00 0.00 H new ATOM 0 HA ILE B 41 12.071 10.324 -1.485 1.00 0.00 H new ATOM 0 HB ILE B 41 10.416 9.452 -3.181 1.00 0.00 H new ATOM 0 HG12 ILE B 41 9.912 7.342 -1.058 1.00 0.00 H new ATOM 0 HG13 ILE B 41 8.768 8.573 -1.558 1.00 0.00 H new ATOM 0 HG21 ILE B 41 11.659 7.358 -3.578 1.00 0.00 H new ATOM 0 HG22 ILE B 41 12.746 8.689 -3.116 1.00 0.00 H new ATOM 0 HG23 ILE B 41 12.315 7.439 -1.925 1.00 0.00 H new ATOM 0 HD11 ILE B 41 8.270 6.428 -2.625 1.00 0.00 H new ATOM 0 HD12 ILE B 41 8.740 7.637 -3.843 1.00 0.00 H new ATOM 0 HD13 ILE B 41 9.901 6.388 -3.336 1.00 0.00 H new ATOM 1618 N ASN B 42 10.185 11.973 -1.588 1.00 0.00 N ATOM 1619 CA ASN B 42 9.203 13.030 -1.449 1.00 0.00 C ATOM 1620 C ASN B 42 8.855 13.621 -2.806 1.00 0.00 C ATOM 1621 O ASN B 42 9.708 14.195 -3.489 1.00 0.00 O ATOM 1622 CB ASN B 42 9.726 14.130 -0.518 1.00 0.00 C ATOM 1623 CG ASN B 42 8.718 15.247 -0.296 1.00 0.00 C ATOM 1624 OD1 ASN B 42 9.091 16.407 -0.114 1.00 0.00 O ATOM 1625 ND2 ASN B 42 7.436 14.910 -0.290 1.00 0.00 N ATOM 0 H ASN B 42 10.966 12.200 -2.204 1.00 0.00 H new ATOM 0 HA ASN B 42 8.301 12.600 -1.014 1.00 0.00 H new ATOM 0 HB2 ASN B 42 9.990 13.690 0.443 1.00 0.00 H new ATOM 0 HB3 ASN B 42 10.640 14.550 -0.938 1.00 0.00 H new ATOM 0 HD21 ASN B 42 6.722 15.621 -0.131 1.00 0.00 H new ATOM 0 HD22 ASN B 42 7.163 13.939 -0.444 1.00 0.00 H new ATOM 1632 N VAL B 43 7.604 13.463 -3.204 1.00 0.00 N ATOM 1633 CA VAL B 43 7.115 14.083 -4.419 1.00 0.00 C ATOM 1634 C VAL B 43 6.319 15.322 -4.058 1.00 0.00 C ATOM 1635 O VAL B 43 5.165 15.231 -3.632 1.00 0.00 O ATOM 1636 CB VAL B 43 6.219 13.134 -5.243 1.00 0.00 C ATOM 1637 CG1 VAL B 43 5.884 13.756 -6.593 1.00 0.00 C ATOM 1638 CG2 VAL B 43 6.878 11.777 -5.428 1.00 0.00 C ATOM 0 H VAL B 43 6.910 12.910 -2.702 1.00 0.00 H new ATOM 0 HA VAL B 43 7.981 14.337 -5.031 1.00 0.00 H new ATOM 0 HB VAL B 43 5.292 12.982 -4.690 1.00 0.00 H new ATOM 0 HG11 VAL B 43 5.252 13.074 -7.161 1.00 0.00 H new ATOM 0 HG12 VAL B 43 5.356 14.697 -6.439 1.00 0.00 H new ATOM 0 HG13 VAL B 43 6.805 13.943 -7.146 1.00 0.00 H new ATOM 0 HG21 VAL B 43 6.223 11.131 -6.012 1.00 0.00 H new ATOM 0 HG22 VAL B 43 7.826 11.901 -5.952 1.00 0.00 H new ATOM 0 HG23 VAL B 43 7.059 11.324 -4.453 1.00 0.00 H new ATOM 1648 N SER B 44 6.945 16.469 -4.201 1.00 0.00 N ATOM 1649 CA SER B 44 6.307 17.729 -3.888 1.00 0.00 C ATOM 1650 C SER B 44 6.249 18.601 -5.133 1.00 0.00 C ATOM 1651 O SER B 44 7.272 19.096 -5.606 1.00 0.00 O ATOM 1652 CB SER B 44 7.069 18.425 -2.762 1.00 0.00 C ATOM 1653 OG SER B 44 8.471 18.343 -2.973 1.00 0.00 O ATOM 0 H SER B 44 7.905 16.555 -4.535 1.00 0.00 H new ATOM 0 HA SER B 44 5.286 17.550 -3.551 1.00 0.00 H new ATOM 0 HB2 SER B 44 6.766 19.471 -2.705 1.00 0.00 H new ATOM 0 HB3 SER B 44 6.813 17.966 -1.807 1.00 0.00 H new ATOM 0 HG SER B 44 8.675 18.565 -3.906 1.00 0.00 H new ATOM 1659 N GLN B 45 5.056 18.759 -5.681 1.00 0.00 N ATOM 1660 CA GLN B 45 4.889 19.526 -6.900 1.00 0.00 C ATOM 1661 C GLN B 45 3.891 20.663 -6.708 1.00 0.00 C ATOM 1662 O GLN B 45 3.230 20.755 -5.670 1.00 0.00 O ATOM 1663 CB GLN B 45 4.496 18.625 -8.083 1.00 0.00 C ATOM 1664 CG GLN B 45 3.887 17.289 -7.707 1.00 0.00 C ATOM 1665 CD GLN B 45 2.435 17.401 -7.320 1.00 0.00 C ATOM 1666 OE1 GLN B 45 1.719 18.293 -7.771 1.00 0.00 O ATOM 1667 NE2 GLN B 45 1.986 16.478 -6.504 1.00 0.00 N ATOM 0 H GLN B 45 4.194 18.368 -5.302 1.00 0.00 H new ATOM 0 HA GLN B 45 5.853 19.974 -7.140 1.00 0.00 H new ATOM 0 HB2 GLN B 45 3.786 19.165 -8.710 1.00 0.00 H new ATOM 0 HB3 GLN B 45 5.383 18.443 -8.690 1.00 0.00 H new ATOM 0 HG2 GLN B 45 3.983 16.601 -8.547 1.00 0.00 H new ATOM 0 HG3 GLN B 45 4.448 16.859 -6.877 1.00 0.00 H new ATOM 0 HE21 GLN B 45 2.616 15.756 -6.154 1.00 0.00 H new ATOM 0 HE22 GLN B 45 1.007 16.482 -6.219 1.00 0.00 H new ATOM 1676 N SER B 46 3.792 21.523 -7.713 1.00 0.00 N ATOM 1677 CA SER B 46 3.030 22.756 -7.603 1.00 0.00 C ATOM 1678 C SER B 46 1.547 22.522 -7.874 1.00 0.00 C ATOM 1679 O SER B 46 0.691 23.244 -7.361 1.00 0.00 O ATOM 1680 CB SER B 46 3.593 23.788 -8.583 1.00 0.00 C ATOM 1681 OG SER B 46 3.042 25.076 -8.358 1.00 0.00 O ATOM 0 H SER B 46 4.235 21.385 -8.621 1.00 0.00 H new ATOM 0 HA SER B 46 3.121 23.130 -6.583 1.00 0.00 H new ATOM 0 HB2 SER B 46 4.677 23.833 -8.482 1.00 0.00 H new ATOM 0 HB3 SER B 46 3.381 23.474 -9.605 1.00 0.00 H new ATOM 0 HG SER B 46 3.423 25.712 -8.999 1.00 0.00 H new ATOM 1687 N GLY B 47 1.248 21.514 -8.673 1.00 0.00 N ATOM 1688 CA GLY B 47 -0.125 21.237 -9.029 1.00 0.00 C ATOM 1689 C GLY B 47 -0.261 20.886 -10.492 1.00 0.00 C ATOM 1690 O GLY B 47 0.594 21.252 -11.305 1.00 0.00 O ATOM 0 H GLY B 47 1.934 20.880 -9.083 1.00 0.00 H new ATOM 0 HA2 GLY B 47 -0.500 20.414 -8.421 1.00 0.00 H new ATOM 0 HA3 GLY B 47 -0.742 22.107 -8.804 1.00 0.00 H new ATOM 1694 N GLY B 48 -1.327 20.176 -10.832 1.00 0.00 N ATOM 1695 CA GLY B 48 -1.522 19.734 -12.197 1.00 0.00 C ATOM 1696 C GLY B 48 -0.521 18.667 -12.580 1.00 0.00 C ATOM 1697 O GLY B 48 -0.208 18.484 -13.758 1.00 0.00 O ATOM 0 H GLY B 48 -2.063 19.897 -10.183 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -2.533 19.345 -12.314 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -1.427 20.584 -12.873 1.00 0.00 H new ATOM 1701 N GLN B 49 -0.011 17.970 -11.574 1.00 0.00 N ATOM 1702 CA GLN B 49 0.985 16.930 -11.778 1.00 0.00 C ATOM 1703 C GLN B 49 0.456 15.596 -11.276 1.00 0.00 C ATOM 1704 O GLN B 49 0.417 14.615 -12.016 1.00 0.00 O ATOM 1705 CB GLN B 49 2.280 17.291 -11.046 1.00 0.00 C ATOM 1706 CG GLN B 49 3.480 17.495 -11.960 1.00 0.00 C ATOM 1707 CD GLN B 49 4.149 16.196 -12.392 1.00 0.00 C ATOM 1708 OE1 GLN B 49 5.358 16.162 -12.619 1.00 0.00 O ATOM 1709 NE2 GLN B 49 3.382 15.121 -12.518 1.00 0.00 N ATOM 0 H GLN B 49 -0.275 18.109 -10.599 1.00 0.00 H new ATOM 0 HA GLN B 49 1.195 16.847 -12.844 1.00 0.00 H new ATOM 0 HB2 GLN B 49 2.117 18.203 -10.471 1.00 0.00 H new ATOM 0 HB3 GLN B 49 2.512 16.501 -10.332 1.00 0.00 H new ATOM 0 HG2 GLN B 49 3.161 18.041 -12.847 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.213 18.118 -11.448 1.00 0.00 H new ATOM 0 HE21 GLN B 49 2.383 15.182 -12.322 1.00 0.00 H new ATOM 0 HE22 GLN B 49 3.791 14.234 -12.810 1.00 0.00 H new ATOM 1718 N ILE B 50 0.057 15.576 -10.014 1.00 0.00 N ATOM 1719 CA ILE B 50 -0.520 14.386 -9.413 1.00 0.00 C ATOM 1720 C ILE B 50 -1.993 14.624 -9.113 1.00 0.00 C ATOM 1721 O ILE B 50 -2.360 15.609 -8.469 1.00 0.00 O ATOM 1722 CB ILE B 50 0.237 13.973 -8.131 1.00 0.00 C ATOM 1723 CG1 ILE B 50 1.639 13.471 -8.492 1.00 0.00 C ATOM 1724 CG2 ILE B 50 -0.533 12.914 -7.351 1.00 0.00 C ATOM 1725 CD1 ILE B 50 2.463 13.045 -7.297 1.00 0.00 C ATOM 0 H ILE B 50 0.123 16.375 -9.384 1.00 0.00 H new ATOM 0 HA ILE B 50 -0.426 13.565 -10.124 1.00 0.00 H new ATOM 0 HB ILE B 50 0.330 14.849 -7.489 1.00 0.00 H new ATOM 0 HG12 ILE B 50 1.547 12.628 -9.177 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.170 14.259 -9.025 1.00 0.00 H new ATOM 0 HG21 ILE B 50 0.026 12.644 -6.455 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -1.508 13.309 -7.066 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -0.668 12.030 -7.974 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.442 12.702 -7.633 1.00 0.00 H new ATOM 0 HD12 ILE B 50 2.587 13.891 -6.621 1.00 0.00 H new ATOM 0 HD13 ILE B 50 1.955 12.234 -6.775 1.00 0.00 H new ATOM 1737 N SER B 51 -2.825 13.728 -9.604 1.00 0.00 N ATOM 1738 CA SER B 51 -4.265 13.876 -9.511 1.00 0.00 C ATOM 1739 C SER B 51 -4.950 12.564 -9.119 1.00 0.00 C ATOM 1740 O SER B 51 -6.086 12.567 -8.643 1.00 0.00 O ATOM 1741 CB SER B 51 -4.802 14.366 -10.857 1.00 0.00 C ATOM 1742 OG SER B 51 -4.509 13.447 -11.902 1.00 0.00 O ATOM 0 H SER B 51 -2.523 12.877 -10.079 1.00 0.00 H new ATOM 0 HA SER B 51 -4.486 14.602 -8.729 1.00 0.00 H new ATOM 0 HB2 SER B 51 -5.880 14.509 -10.789 1.00 0.00 H new ATOM 0 HB3 SER B 51 -4.366 15.337 -11.092 1.00 0.00 H new ATOM 0 HG SER B 51 -3.867 12.780 -11.581 1.00 0.00 H new ATOM 1748 N SER B 52 -4.259 11.446 -9.303 1.00 0.00 N ATOM 1749 CA SER B 52 -4.859 10.143 -9.098 1.00 0.00 C ATOM 1750 C SER B 52 -3.798 9.138 -8.663 1.00 0.00 C ATOM 1751 O SER B 52 -2.604 9.414 -8.756 1.00 0.00 O ATOM 1752 CB SER B 52 -5.534 9.678 -10.394 1.00 0.00 C ATOM 1753 OG SER B 52 -4.590 9.524 -11.445 1.00 0.00 O ATOM 0 H SER B 52 -3.282 11.420 -9.594 1.00 0.00 H new ATOM 0 HA SER B 52 -5.610 10.214 -8.311 1.00 0.00 H new ATOM 0 HB2 SER B 52 -6.045 8.731 -10.220 1.00 0.00 H new ATOM 0 HB3 SER B 52 -6.295 10.401 -10.689 1.00 0.00 H new ATOM 0 HG SER B 52 -3.993 10.301 -11.465 1.00 0.00 H new ATOM 1759 N PRO B 53 -4.208 7.961 -8.169 1.00 0.00 N ATOM 1760 CA PRO B 53 -3.269 6.894 -7.812 1.00 0.00 C ATOM 1761 C PRO B 53 -2.356 6.509 -8.979 1.00 0.00 C ATOM 1762 O PRO B 53 -1.238 6.059 -8.769 1.00 0.00 O ATOM 1763 CB PRO B 53 -4.181 5.728 -7.426 1.00 0.00 C ATOM 1764 CG PRO B 53 -5.454 6.374 -7.003 1.00 0.00 C ATOM 1765 CD PRO B 53 -5.605 7.580 -7.883 1.00 0.00 C ATOM 0 HA PRO B 53 -2.591 7.196 -7.014 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -4.339 5.053 -8.267 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -3.749 5.136 -6.619 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -6.297 5.694 -7.122 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -5.419 6.658 -5.951 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -6.154 7.347 -8.795 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -6.147 8.381 -7.380 1.00 0.00 H new ATOM 1773 N SER B 54 -2.833 6.710 -10.205 1.00 0.00 N ATOM 1774 CA SER B 54 -2.059 6.382 -11.399 1.00 0.00 C ATOM 1775 C SER B 54 -0.789 7.234 -11.487 1.00 0.00 C ATOM 1776 O SER B 54 0.323 6.704 -11.554 1.00 0.00 O ATOM 1777 CB SER B 54 -2.920 6.592 -12.645 1.00 0.00 C ATOM 1778 OG SER B 54 -4.189 5.975 -12.497 1.00 0.00 O ATOM 0 H SER B 54 -3.756 7.100 -10.398 1.00 0.00 H new ATOM 0 HA SER B 54 -1.758 5.336 -11.337 1.00 0.00 H new ATOM 0 HB2 SER B 54 -3.050 7.659 -12.826 1.00 0.00 H new ATOM 0 HB3 SER B 54 -2.411 6.180 -13.517 1.00 0.00 H new ATOM 0 HG SER B 54 -4.722 6.125 -13.306 1.00 0.00 H new ATOM 1784 N ASP B 55 -0.962 8.553 -11.472 1.00 0.00 N ATOM 1785 CA ASP B 55 0.168 9.480 -11.562 1.00 0.00 C ATOM 1786 C ASP B 55 0.989 9.468 -10.273 1.00 0.00 C ATOM 1787 O ASP B 55 2.220 9.580 -10.309 1.00 0.00 O ATOM 1788 CB ASP B 55 -0.313 10.906 -11.891 1.00 0.00 C ATOM 1789 CG ASP B 55 -1.587 11.284 -11.175 1.00 0.00 C ATOM 1790 OD1 ASP B 55 -1.536 11.535 -9.967 1.00 0.00 O ATOM 1791 OD2 ASP B 55 -2.655 11.344 -11.825 1.00 0.00 O ATOM 0 H ASP B 55 -1.873 9.006 -11.398 1.00 0.00 H new ATOM 0 HA ASP B 55 0.811 9.145 -12.376 1.00 0.00 H new ATOM 0 HB2 ASP B 55 0.470 11.617 -11.626 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -0.469 10.991 -12.966 1.00 0.00 H new ATOM 1796 N LEU B 56 0.310 9.313 -9.143 1.00 0.00 N ATOM 1797 CA LEU B 56 0.979 9.210 -7.851 1.00 0.00 C ATOM 1798 C LEU B 56 1.911 7.999 -7.817 1.00 0.00 C ATOM 1799 O LEU B 56 3.094 8.126 -7.501 1.00 0.00 O ATOM 1800 CB LEU B 56 -0.058 9.106 -6.727 1.00 0.00 C ATOM 1801 CG LEU B 56 0.512 9.025 -5.309 1.00 0.00 C ATOM 1802 CD1 LEU B 56 1.300 10.282 -4.971 1.00 0.00 C ATOM 1803 CD2 LEU B 56 -0.606 8.808 -4.300 1.00 0.00 C ATOM 0 H LEU B 56 -0.707 9.256 -9.095 1.00 0.00 H new ATOM 0 HA LEU B 56 1.577 10.109 -7.703 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -0.719 9.971 -6.785 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.672 8.223 -6.904 1.00 0.00 H new ATOM 0 HG LEU B 56 1.192 8.175 -5.261 1.00 0.00 H new ATOM 0 HD11 LEU B 56 1.696 10.202 -3.959 1.00 0.00 H new ATOM 0 HD12 LEU B 56 2.124 10.395 -5.675 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.645 11.151 -5.037 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -0.185 8.753 -3.296 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.310 9.639 -4.353 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -1.126 7.877 -4.527 1.00 0.00 H new ATOM 1815 N ARG B 57 1.370 6.833 -8.164 1.00 0.00 N ATOM 1816 CA ARG B 57 2.137 5.587 -8.185 1.00 0.00 C ATOM 1817 C ARG B 57 3.352 5.699 -9.100 1.00 0.00 C ATOM 1818 O ARG B 57 4.417 5.164 -8.792 1.00 0.00 O ATOM 1819 CB ARG B 57 1.231 4.431 -8.627 1.00 0.00 C ATOM 1820 CG ARG B 57 1.958 3.245 -9.242 1.00 0.00 C ATOM 1821 CD ARG B 57 0.992 2.119 -9.583 1.00 0.00 C ATOM 1822 NE ARG B 57 -0.262 2.615 -10.156 1.00 0.00 N ATOM 1823 CZ ARG B 57 -0.597 2.507 -11.443 1.00 0.00 C ATOM 1824 NH1 ARG B 57 0.244 1.971 -12.315 1.00 0.00 N ATOM 1825 NH2 ARG B 57 -1.782 2.930 -11.860 1.00 0.00 N ATOM 0 H ARG B 57 0.393 6.724 -8.437 1.00 0.00 H new ATOM 0 HA ARG B 57 2.504 5.390 -7.178 1.00 0.00 H new ATOM 0 HB2 ARG B 57 0.664 4.083 -7.764 1.00 0.00 H new ATOM 0 HB3 ARG B 57 0.509 4.811 -9.350 1.00 0.00 H new ATOM 0 HG2 ARG B 57 2.480 3.564 -10.144 1.00 0.00 H new ATOM 0 HG3 ARG B 57 2.715 2.880 -8.548 1.00 0.00 H new ATOM 0 HD2 ARG B 57 1.467 1.438 -10.289 1.00 0.00 H new ATOM 0 HD3 ARG B 57 0.775 1.545 -8.682 1.00 0.00 H new ATOM 0 HE ARG B 57 -0.923 3.074 -9.529 1.00 0.00 H new ATOM 0 HH11 ARG B 57 1.156 1.637 -12.004 1.00 0.00 H new ATOM 0 HH12 ARG B 57 -0.021 1.893 -13.297 1.00 0.00 H new ATOM 0 HH21 ARG B 57 -2.440 3.339 -11.197 1.00 0.00 H new ATOM 0 HH22 ARG B 57 -2.036 2.846 -12.844 1.00 0.00 H new ATOM 1839 N GLU B 58 3.189 6.405 -10.212 1.00 0.00 N ATOM 1840 CA GLU B 58 4.275 6.607 -11.161 1.00 0.00 C ATOM 1841 C GLU B 58 5.483 7.242 -10.478 1.00 0.00 C ATOM 1842 O GLU B 58 6.571 6.671 -10.461 1.00 0.00 O ATOM 1843 CB GLU B 58 3.813 7.502 -12.311 1.00 0.00 C ATOM 1844 CG GLU B 58 4.903 7.791 -13.329 1.00 0.00 C ATOM 1845 CD GLU B 58 4.509 8.874 -14.306 1.00 0.00 C ATOM 1846 OE1 GLU B 58 3.824 8.563 -15.304 1.00 0.00 O ATOM 1847 OE2 GLU B 58 4.883 10.044 -14.082 1.00 0.00 O ATOM 0 H GLU B 58 2.310 6.849 -10.479 1.00 0.00 H new ATOM 0 HA GLU B 58 4.565 5.632 -11.553 1.00 0.00 H new ATOM 0 HB2 GLU B 58 2.972 7.026 -12.816 1.00 0.00 H new ATOM 0 HB3 GLU B 58 3.448 8.445 -11.903 1.00 0.00 H new ATOM 0 HG2 GLU B 58 5.813 8.090 -12.808 1.00 0.00 H new ATOM 0 HG3 GLU B 58 5.135 6.878 -13.877 1.00 0.00 H new ATOM 1854 N LYS B 59 5.273 8.419 -9.901 1.00 0.00 N ATOM 1855 CA LYS B 59 6.357 9.170 -9.277 1.00 0.00 C ATOM 1856 C LYS B 59 6.905 8.462 -8.043 1.00 0.00 C ATOM 1857 O LYS B 59 8.097 8.555 -7.751 1.00 0.00 O ATOM 1858 CB LYS B 59 5.884 10.583 -8.932 1.00 0.00 C ATOM 1859 CG LYS B 59 5.840 11.500 -10.142 1.00 0.00 C ATOM 1860 CD LYS B 59 7.244 11.878 -10.590 1.00 0.00 C ATOM 1861 CE LYS B 59 7.258 12.446 -12.000 1.00 0.00 C ATOM 1862 NZ LYS B 59 7.086 11.384 -13.027 1.00 0.00 N ATOM 0 H LYS B 59 4.362 8.875 -9.852 1.00 0.00 H new ATOM 0 HA LYS B 59 7.175 9.235 -9.994 1.00 0.00 H new ATOM 0 HB2 LYS B 59 4.891 10.530 -8.485 1.00 0.00 H new ATOM 0 HB3 LYS B 59 6.549 11.011 -8.181 1.00 0.00 H new ATOM 0 HG2 LYS B 59 5.314 11.005 -10.959 1.00 0.00 H new ATOM 0 HG3 LYS B 59 5.277 12.401 -9.900 1.00 0.00 H new ATOM 0 HD2 LYS B 59 7.660 12.612 -9.899 1.00 0.00 H new ATOM 0 HD3 LYS B 59 7.887 10.999 -10.547 1.00 0.00 H new ATOM 0 HE2 LYS B 59 6.461 13.183 -12.103 1.00 0.00 H new ATOM 0 HE3 LYS B 59 8.199 12.968 -12.172 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 7.461 11.718 -13.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 7.601 10.530 -12.732 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 6.075 11.161 -13.130 1.00 0.00 H new ATOM 1876 N LEU B 60 6.044 7.752 -7.327 1.00 0.00 N ATOM 1877 CA LEU B 60 6.480 6.987 -6.164 1.00 0.00 C ATOM 1878 C LEU B 60 7.405 5.852 -6.590 1.00 0.00 C ATOM 1879 O LEU B 60 8.496 5.687 -6.042 1.00 0.00 O ATOM 1880 CB LEU B 60 5.278 6.420 -5.408 1.00 0.00 C ATOM 1881 CG LEU B 60 4.355 7.459 -4.771 1.00 0.00 C ATOM 1882 CD1 LEU B 60 3.165 6.776 -4.118 1.00 0.00 C ATOM 1883 CD2 LEU B 60 5.113 8.300 -3.753 1.00 0.00 C ATOM 0 H LEU B 60 5.046 7.689 -7.528 1.00 0.00 H new ATOM 0 HA LEU B 60 7.025 7.659 -5.501 1.00 0.00 H new ATOM 0 HB2 LEU B 60 4.692 5.811 -6.096 1.00 0.00 H new ATOM 0 HB3 LEU B 60 5.643 5.755 -4.626 1.00 0.00 H new ATOM 0 HG LEU B 60 3.989 8.122 -5.555 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.516 7.527 -3.668 1.00 0.00 H new ATOM 0 HD12 LEU B 60 2.607 6.218 -4.871 1.00 0.00 H new ATOM 0 HD13 LEU B 60 3.517 6.092 -3.346 1.00 0.00 H new ATOM 0 HD21 LEU B 60 4.438 9.033 -3.312 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.509 7.654 -2.970 1.00 0.00 H new ATOM 0 HD23 LEU B 60 5.936 8.816 -4.248 1.00 0.00 H new ATOM 1895 N SER B 61 6.969 5.084 -7.578 1.00 0.00 N ATOM 1896 CA SER B 61 7.750 3.968 -8.087 1.00 0.00 C ATOM 1897 C SER B 61 9.043 4.476 -8.728 1.00 0.00 C ATOM 1898 O SER B 61 10.106 3.870 -8.578 1.00 0.00 O ATOM 1899 CB SER B 61 6.916 3.177 -9.101 1.00 0.00 C ATOM 1900 OG SER B 61 7.560 1.977 -9.490 1.00 0.00 O ATOM 0 H SER B 61 6.072 5.216 -8.045 1.00 0.00 H new ATOM 0 HA SER B 61 8.017 3.308 -7.261 1.00 0.00 H new ATOM 0 HB2 SER B 61 5.943 2.944 -8.668 1.00 0.00 H new ATOM 0 HB3 SER B 61 6.734 3.793 -9.981 1.00 0.00 H new ATOM 0 HG SER B 61 7.716 1.419 -8.700 1.00 0.00 H new ATOM 1906 N GLU B 62 8.934 5.608 -9.419 1.00 0.00 N ATOM 1907 CA GLU B 62 10.070 6.239 -10.083 1.00 0.00 C ATOM 1908 C GLU B 62 11.194 6.527 -9.087 1.00 0.00 C ATOM 1909 O GLU B 62 12.345 6.132 -9.297 1.00 0.00 O ATOM 1910 CB GLU B 62 9.612 7.541 -10.745 1.00 0.00 C ATOM 1911 CG GLU B 62 10.660 8.208 -11.619 1.00 0.00 C ATOM 1912 CD GLU B 62 10.194 9.548 -12.152 1.00 0.00 C ATOM 1913 OE1 GLU B 62 9.100 9.611 -12.754 1.00 0.00 O ATOM 1914 OE2 GLU B 62 10.923 10.549 -11.984 1.00 0.00 O ATOM 0 H GLU B 62 8.055 6.113 -9.534 1.00 0.00 H new ATOM 0 HA GLU B 62 10.455 5.557 -10.841 1.00 0.00 H new ATOM 0 HB2 GLU B 62 8.730 7.334 -11.351 1.00 0.00 H new ATOM 0 HB3 GLU B 62 9.307 8.241 -9.967 1.00 0.00 H new ATOM 0 HG2 GLU B 62 11.575 8.346 -11.044 1.00 0.00 H new ATOM 0 HG3 GLU B 62 10.905 7.552 -12.454 1.00 0.00 H new ATOM 1921 N LEU B 63 10.843 7.197 -7.995 1.00 0.00 N ATOM 1922 CA LEU B 63 11.826 7.608 -7.001 1.00 0.00 C ATOM 1923 C LEU B 63 12.313 6.424 -6.167 1.00 0.00 C ATOM 1924 O LEU B 63 13.487 6.359 -5.804 1.00 0.00 O ATOM 1925 CB LEU B 63 11.244 8.690 -6.091 1.00 0.00 C ATOM 1926 CG LEU B 63 10.884 10.005 -6.787 1.00 0.00 C ATOM 1927 CD1 LEU B 63 10.334 11.005 -5.783 1.00 0.00 C ATOM 1928 CD2 LEU B 63 12.096 10.583 -7.501 1.00 0.00 C ATOM 0 H LEU B 63 9.884 7.467 -7.776 1.00 0.00 H new ATOM 0 HA LEU B 63 12.684 8.015 -7.536 1.00 0.00 H new ATOM 0 HB2 LEU B 63 10.349 8.295 -5.611 1.00 0.00 H new ATOM 0 HB3 LEU B 63 11.963 8.902 -5.300 1.00 0.00 H new ATOM 0 HG LEU B 63 10.113 9.799 -7.530 1.00 0.00 H new ATOM 0 HD11 LEU B 63 10.083 11.934 -6.295 1.00 0.00 H new ATOM 0 HD12 LEU B 63 9.439 10.596 -5.315 1.00 0.00 H new ATOM 0 HD13 LEU B 63 11.085 11.203 -5.018 1.00 0.00 H new ATOM 0 HD21 LEU B 63 11.819 11.517 -7.989 1.00 0.00 H new ATOM 0 HD22 LEU B 63 12.889 10.773 -6.777 1.00 0.00 H new ATOM 0 HD23 LEU B 63 12.450 9.874 -8.249 1.00 0.00 H new ATOM 1940 N ALA B 64 11.419 5.488 -5.873 1.00 0.00 N ATOM 1941 CA ALA B 64 11.781 4.312 -5.086 1.00 0.00 C ATOM 1942 C ALA B 64 12.822 3.471 -5.816 1.00 0.00 C ATOM 1943 O ALA B 64 13.781 2.979 -5.211 1.00 0.00 O ATOM 1944 CB ALA B 64 10.549 3.476 -4.774 1.00 0.00 C ATOM 0 H ALA B 64 10.442 5.518 -6.165 1.00 0.00 H new ATOM 0 HA ALA B 64 12.214 4.654 -4.146 1.00 0.00 H new ATOM 0 HB1 ALA B 64 10.840 2.605 -4.187 1.00 0.00 H new ATOM 0 HB2 ALA B 64 9.837 4.075 -4.206 1.00 0.00 H new ATOM 0 HB3 ALA B 64 10.086 3.149 -5.705 1.00 0.00 H new ATOM 1950 N ASP B 65 12.638 3.329 -7.122 1.00 0.00 N ATOM 1951 CA ASP B 65 13.584 2.598 -7.958 1.00 0.00 C ATOM 1952 C ASP B 65 14.920 3.331 -8.030 1.00 0.00 C ATOM 1953 O ASP B 65 15.981 2.708 -8.036 1.00 0.00 O ATOM 1954 CB ASP B 65 13.013 2.401 -9.365 1.00 0.00 C ATOM 1955 CG ASP B 65 14.031 1.826 -10.330 1.00 0.00 C ATOM 1956 OD1 ASP B 65 14.396 0.641 -10.188 1.00 0.00 O ATOM 1957 OD2 ASP B 65 14.478 2.565 -11.233 1.00 0.00 O ATOM 0 H ASP B 65 11.839 3.712 -7.628 1.00 0.00 H new ATOM 0 HA ASP B 65 13.751 1.620 -7.507 1.00 0.00 H new ATOM 0 HB2 ASP B 65 12.150 1.737 -9.314 1.00 0.00 H new ATOM 0 HB3 ASP B 65 12.656 3.358 -9.746 1.00 0.00 H new ATOM 1962 N ALA B 66 14.860 4.658 -8.059 1.00 0.00 N ATOM 1963 CA ALA B 66 16.061 5.483 -8.115 1.00 0.00 C ATOM 1964 C ALA B 66 16.847 5.407 -6.806 1.00 0.00 C ATOM 1965 O ALA B 66 18.067 5.561 -6.796 1.00 0.00 O ATOM 1966 CB ALA B 66 15.697 6.924 -8.432 1.00 0.00 C ATOM 0 H ALA B 66 13.988 5.187 -8.045 1.00 0.00 H new ATOM 0 HA ALA B 66 16.698 5.097 -8.911 1.00 0.00 H new ATOM 0 HB1 ALA B 66 16.603 7.528 -8.471 1.00 0.00 H new ATOM 0 HB2 ALA B 66 15.190 6.968 -9.396 1.00 0.00 H new ATOM 0 HB3 ALA B 66 15.036 7.311 -7.657 1.00 0.00 H new ATOM 1972 N LYS B 67 16.144 5.184 -5.701 1.00 0.00 N ATOM 1973 CA LYS B 67 16.794 5.004 -4.405 1.00 0.00 C ATOM 1974 C LYS B 67 17.425 3.620 -4.312 1.00 0.00 C ATOM 1975 O LYS B 67 18.441 3.430 -3.639 1.00 0.00 O ATOM 1976 CB LYS B 67 15.792 5.191 -3.262 1.00 0.00 C ATOM 1977 CG LYS B 67 15.290 6.616 -3.103 1.00 0.00 C ATOM 1978 CD LYS B 67 16.411 7.569 -2.722 1.00 0.00 C ATOM 1979 CE LYS B 67 15.887 8.977 -2.495 1.00 0.00 C ATOM 1980 NZ LYS B 67 16.974 9.926 -2.138 1.00 0.00 N ATOM 0 H LYS B 67 15.126 5.123 -5.675 1.00 0.00 H new ATOM 0 HA LYS B 67 17.575 5.759 -4.314 1.00 0.00 H new ATOM 0 HB2 LYS B 67 14.939 4.533 -3.430 1.00 0.00 H new ATOM 0 HB3 LYS B 67 16.259 4.876 -2.329 1.00 0.00 H new ATOM 0 HG2 LYS B 67 14.833 6.947 -4.036 1.00 0.00 H new ATOM 0 HG3 LYS B 67 14.513 6.645 -2.339 1.00 0.00 H new ATOM 0 HD2 LYS B 67 16.903 7.212 -1.817 1.00 0.00 H new ATOM 0 HD3 LYS B 67 17.164 7.582 -3.510 1.00 0.00 H new ATOM 0 HE2 LYS B 67 15.383 9.326 -3.396 1.00 0.00 H new ATOM 0 HE3 LYS B 67 15.143 8.963 -1.699 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 16.573 10.874 -1.992 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 17.439 9.608 -1.264 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 17.672 9.960 -2.908 1.00 0.00 H new ATOM 1994 N GLY B 68 16.816 2.659 -4.992 1.00 0.00 N ATOM 1995 CA GLY B 68 17.311 1.301 -4.967 1.00 0.00 C ATOM 1996 C GLY B 68 16.487 0.406 -4.062 1.00 0.00 C ATOM 1997 O GLY B 68 17.021 -0.497 -3.418 1.00 0.00 O ATOM 0 H GLY B 68 15.983 2.799 -5.563 1.00 0.00 H new ATOM 0 HA2 GLY B 68 17.305 0.896 -5.979 1.00 0.00 H new ATOM 0 HA3 GLY B 68 18.347 1.300 -4.629 1.00 0.00 H new ATOM 2001 N GLY B 69 15.187 0.661 -4.008 1.00 0.00 N ATOM 2002 CA GLY B 69 14.303 -0.149 -3.194 1.00 0.00 C ATOM 2003 C GLY B 69 13.189 -0.762 -4.016 1.00 0.00 C ATOM 2004 O GLY B 69 12.913 -0.307 -5.126 1.00 0.00 O ATOM 0 H GLY B 69 14.727 1.417 -4.515 1.00 0.00 H new ATOM 0 HA2 GLY B 69 14.876 -0.940 -2.711 1.00 0.00 H new ATOM 0 HA3 GLY B 69 13.875 0.464 -2.401 1.00 0.00 H new ATOM 2008 N LYS B 70 12.555 -1.800 -3.486 1.00 0.00 N ATOM 2009 CA LYS B 70 11.465 -2.458 -4.196 1.00 0.00 C ATOM 2010 C LYS B 70 10.117 -2.035 -3.628 1.00 0.00 C ATOM 2011 O LYS B 70 9.093 -2.111 -4.309 1.00 0.00 O ATOM 2012 CB LYS B 70 11.581 -3.982 -4.099 1.00 0.00 C ATOM 2013 CG LYS B 70 12.932 -4.545 -4.505 1.00 0.00 C ATOM 2014 CD LYS B 70 12.840 -6.044 -4.742 1.00 0.00 C ATOM 2015 CE LYS B 70 14.210 -6.693 -4.823 1.00 0.00 C ATOM 2016 NZ LYS B 70 14.829 -6.848 -3.481 1.00 0.00 N ATOM 0 H LYS B 70 12.774 -2.202 -2.575 1.00 0.00 H new ATOM 0 HA LYS B 70 11.535 -2.157 -5.241 1.00 0.00 H new ATOM 0 HB2 LYS B 70 11.371 -4.284 -3.073 1.00 0.00 H new ATOM 0 HB3 LYS B 70 10.812 -4.432 -4.727 1.00 0.00 H new ATOM 0 HG2 LYS B 70 13.281 -4.049 -5.411 1.00 0.00 H new ATOM 0 HG3 LYS B 70 13.666 -4.339 -3.726 1.00 0.00 H new ATOM 0 HD2 LYS B 70 12.268 -6.504 -3.936 1.00 0.00 H new ATOM 0 HD3 LYS B 70 12.295 -6.232 -5.667 1.00 0.00 H new ATOM 0 HE2 LYS B 70 14.121 -7.670 -5.297 1.00 0.00 H new ATOM 0 HE3 LYS B 70 14.861 -6.090 -5.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 70 15.724 -7.370 -3.570 1.00 0.00 H new ATOM 0 HZ2 LYS B 70 15.015 -5.909 -3.074 1.00 0.00 H new ATOM 0 HZ3 LYS B 70 14.182 -7.373 -2.859 1.00 0.00 H new ATOM 2030 N TYR B 71 10.120 -1.597 -2.379 1.00 0.00 N ATOM 2031 CA TYR B 71 8.884 -1.297 -1.678 1.00 0.00 C ATOM 2032 C TYR B 71 8.934 0.082 -1.044 1.00 0.00 C ATOM 2033 O TYR B 71 10.009 0.626 -0.799 1.00 0.00 O ATOM 2034 CB TYR B 71 8.618 -2.351 -0.597 1.00 0.00 C ATOM 2035 CG TYR B 71 8.525 -3.761 -1.135 1.00 0.00 C ATOM 2036 CD1 TYR B 71 7.392 -4.192 -1.808 1.00 0.00 C ATOM 2037 CD2 TYR B 71 9.577 -4.657 -0.978 1.00 0.00 C ATOM 2038 CE1 TYR B 71 7.305 -5.476 -2.309 1.00 0.00 C ATOM 2039 CE2 TYR B 71 9.498 -5.942 -1.479 1.00 0.00 C ATOM 2040 CZ TYR B 71 8.359 -6.346 -2.144 1.00 0.00 C ATOM 2041 OH TYR B 71 8.275 -7.625 -2.648 1.00 0.00 O ATOM 0 H TYR B 71 10.966 -1.442 -1.830 1.00 0.00 H new ATOM 0 HA TYR B 71 8.074 -1.313 -2.407 1.00 0.00 H new ATOM 0 HB2 TYR B 71 9.415 -2.306 0.146 1.00 0.00 H new ATOM 0 HB3 TYR B 71 7.689 -2.105 -0.083 1.00 0.00 H new ATOM 0 HD1 TYR B 71 6.564 -3.512 -1.943 1.00 0.00 H new ATOM 0 HD2 TYR B 71 10.469 -4.343 -0.456 1.00 0.00 H new ATOM 0 HE1 TYR B 71 6.414 -5.796 -2.828 1.00 0.00 H new ATOM 0 HE2 TYR B 71 10.323 -6.627 -1.351 1.00 0.00 H new ATOM 0 HH TYR B 71 9.102 -8.110 -2.448 1.00 0.00 H new ATOM 2051 N TYR B 72 7.766 0.640 -0.793 1.00 0.00 N ATOM 2052 CA TYR B 72 7.655 1.914 -0.108 1.00 0.00 C ATOM 2053 C TYR B 72 6.337 1.985 0.646 1.00 0.00 C ATOM 2054 O TYR B 72 5.468 1.131 0.471 1.00 0.00 O ATOM 2055 CB TYR B 72 7.769 3.086 -1.095 1.00 0.00 C ATOM 2056 CG TYR B 72 6.809 3.016 -2.266 1.00 0.00 C ATOM 2057 CD1 TYR B 72 5.485 3.424 -2.139 1.00 0.00 C ATOM 2058 CD2 TYR B 72 7.231 2.543 -3.499 1.00 0.00 C ATOM 2059 CE1 TYR B 72 4.613 3.359 -3.211 1.00 0.00 C ATOM 2060 CE2 TYR B 72 6.366 2.477 -4.573 1.00 0.00 C ATOM 2061 CZ TYR B 72 5.060 2.884 -4.425 1.00 0.00 C ATOM 2062 OH TYR B 72 4.199 2.814 -5.496 1.00 0.00 O ATOM 0 H TYR B 72 6.872 0.226 -1.056 1.00 0.00 H new ATOM 0 HA TYR B 72 8.478 1.993 0.602 1.00 0.00 H new ATOM 0 HB2 TYR B 72 7.597 4.017 -0.555 1.00 0.00 H new ATOM 0 HB3 TYR B 72 8.789 3.124 -1.479 1.00 0.00 H new ATOM 0 HD1 TYR B 72 5.133 3.797 -1.189 1.00 0.00 H new ATOM 0 HD2 TYR B 72 8.254 2.220 -3.622 1.00 0.00 H new ATOM 0 HE1 TYR B 72 3.588 3.679 -3.097 1.00 0.00 H new ATOM 0 HE2 TYR B 72 6.713 2.107 -5.526 1.00 0.00 H new ATOM 0 HH TYR B 72 4.410 2.023 -6.034 1.00 0.00 H new ATOM 2072 N HIS B 73 6.204 2.987 1.494 1.00 0.00 N ATOM 2073 CA HIS B 73 4.959 3.232 2.203 1.00 0.00 C ATOM 2074 C HIS B 73 4.779 4.725 2.415 1.00 0.00 C ATOM 2075 O HIS B 73 5.656 5.385 2.973 1.00 0.00 O ATOM 2076 CB HIS B 73 4.941 2.509 3.553 1.00 0.00 C ATOM 2077 CG HIS B 73 3.676 2.721 4.334 1.00 0.00 C ATOM 2078 ND1 HIS B 73 3.571 3.632 5.364 1.00 0.00 N ATOM 2079 CD2 HIS B 73 2.460 2.130 4.236 1.00 0.00 C ATOM 2080 CE1 HIS B 73 2.349 3.591 5.864 1.00 0.00 C ATOM 2081 NE2 HIS B 73 1.657 2.689 5.199 1.00 0.00 N ATOM 0 H HIS B 73 6.948 3.650 1.711 1.00 0.00 H new ATOM 0 HA HIS B 73 4.138 2.845 1.600 1.00 0.00 H new ATOM 0 HB2 HIS B 73 5.079 1.441 3.385 1.00 0.00 H new ATOM 0 HB3 HIS B 73 5.787 2.850 4.149 1.00 0.00 H new ATOM 0 HD1 HIS B 73 4.321 4.243 5.689 1.00 0.00 H new ATOM 0 HD2 HIS B 73 2.176 1.362 3.532 1.00 0.00 H new ATOM 0 HE1 HIS B 73 1.980 4.195 6.680 1.00 0.00 H new ATOM 2090 N ILE B 74 3.653 5.248 1.966 1.00 0.00 N ATOM 2091 CA ILE B 74 3.354 6.659 2.127 1.00 0.00 C ATOM 2092 C ILE B 74 3.090 6.977 3.594 1.00 0.00 C ATOM 2093 O ILE B 74 2.271 6.330 4.242 1.00 0.00 O ATOM 2094 CB ILE B 74 2.131 7.076 1.283 1.00 0.00 C ATOM 2095 CG1 ILE B 74 2.360 6.737 -0.193 1.00 0.00 C ATOM 2096 CG2 ILE B 74 1.852 8.563 1.449 1.00 0.00 C ATOM 2097 CD1 ILE B 74 1.165 7.032 -1.075 1.00 0.00 C ATOM 0 H ILE B 74 2.928 4.715 1.485 1.00 0.00 H new ATOM 0 HA ILE B 74 4.220 7.222 1.779 1.00 0.00 H new ATOM 0 HB ILE B 74 1.262 6.520 1.635 1.00 0.00 H new ATOM 0 HG12 ILE B 74 3.218 7.301 -0.558 1.00 0.00 H new ATOM 0 HG13 ILE B 74 2.613 5.680 -0.280 1.00 0.00 H new ATOM 0 HG21 ILE B 74 0.987 8.840 0.847 1.00 0.00 H new ATOM 0 HG22 ILE B 74 1.649 8.780 2.498 1.00 0.00 H new ATOM 0 HG23 ILE B 74 2.720 9.135 1.121 1.00 0.00 H new ATOM 0 HD11 ILE B 74 1.400 6.767 -2.106 1.00 0.00 H new ATOM 0 HD12 ILE B 74 0.310 6.448 -0.736 1.00 0.00 H new ATOM 0 HD13 ILE B 74 0.924 8.094 -1.019 1.00 0.00 H new ATOM 2109 N ILE B 75 3.812 7.952 4.122 1.00 0.00 N ATOM 2110 CA ILE B 75 3.624 8.367 5.502 1.00 0.00 C ATOM 2111 C ILE B 75 2.932 9.720 5.563 1.00 0.00 C ATOM 2112 O ILE B 75 2.370 10.094 6.592 1.00 0.00 O ATOM 2113 CB ILE B 75 4.958 8.441 6.274 1.00 0.00 C ATOM 2114 CG1 ILE B 75 5.931 9.397 5.577 1.00 0.00 C ATOM 2115 CG2 ILE B 75 5.565 7.052 6.408 1.00 0.00 C ATOM 2116 CD1 ILE B 75 7.209 9.637 6.349 1.00 0.00 C ATOM 0 H ILE B 75 4.532 8.469 3.617 1.00 0.00 H new ATOM 0 HA ILE B 75 2.999 7.611 5.977 1.00 0.00 H new ATOM 0 HB ILE B 75 4.763 8.829 7.274 1.00 0.00 H new ATOM 0 HG12 ILE B 75 6.181 8.994 4.595 1.00 0.00 H new ATOM 0 HG13 ILE B 75 5.432 10.352 5.412 1.00 0.00 H new ATOM 0 HG21 ILE B 75 6.506 7.117 6.954 1.00 0.00 H new ATOM 0 HG22 ILE B 75 4.875 6.404 6.949 1.00 0.00 H new ATOM 0 HG23 ILE B 75 5.749 6.638 5.417 1.00 0.00 H new ATOM 0 HD11 ILE B 75 7.847 10.324 5.792 1.00 0.00 H new ATOM 0 HD12 ILE B 75 6.971 10.070 7.321 1.00 0.00 H new ATOM 0 HD13 ILE B 75 7.731 8.691 6.491 1.00 0.00 H new ATOM 2128 N ALA B 76 2.969 10.449 4.456 1.00 0.00 N ATOM 2129 CA ALA B 76 2.330 11.752 4.385 1.00 0.00 C ATOM 2130 C ALA B 76 1.906 12.082 2.963 1.00 0.00 C ATOM 2131 O ALA B 76 2.714 12.531 2.153 1.00 0.00 O ATOM 2132 CB ALA B 76 3.256 12.832 4.923 1.00 0.00 C ATOM 0 H ALA B 76 3.435 10.159 3.596 1.00 0.00 H new ATOM 0 HA ALA B 76 1.434 11.717 5.005 1.00 0.00 H new ATOM 0 HB1 ALA B 76 2.760 13.801 4.861 1.00 0.00 H new ATOM 0 HB2 ALA B 76 3.502 12.616 5.963 1.00 0.00 H new ATOM 0 HB3 ALA B 76 4.171 12.855 4.331 1.00 0.00 H new ATOM 2138 N ALA B 77 0.647 11.824 2.655 1.00 0.00 N ATOM 2139 CA ALA B 77 0.071 12.228 1.381 1.00 0.00 C ATOM 2140 C ALA B 77 -0.781 13.469 1.593 1.00 0.00 C ATOM 2141 O ALA B 77 -2.008 13.430 1.480 1.00 0.00 O ATOM 2142 CB ALA B 77 -0.757 11.103 0.774 1.00 0.00 C ATOM 0 H ALA B 77 -0.000 11.334 3.272 1.00 0.00 H new ATOM 0 HA ALA B 77 0.875 12.455 0.681 1.00 0.00 H new ATOM 0 HB1 ALA B 77 -1.176 11.432 -0.177 1.00 0.00 H new ATOM 0 HB2 ALA B 77 -0.122 10.232 0.610 1.00 0.00 H new ATOM 0 HB3 ALA B 77 -1.566 10.839 1.455 1.00 0.00 H new ATOM 2148 N ARG B 78 -0.120 14.567 1.918 1.00 0.00 N ATOM 2149 CA ARG B 78 -0.813 15.766 2.352 1.00 0.00 C ATOM 2150 C ARG B 78 -0.858 16.807 1.244 1.00 0.00 C ATOM 2151 O ARG B 78 0.058 16.910 0.425 1.00 0.00 O ATOM 2152 CB ARG B 78 -0.130 16.350 3.594 1.00 0.00 C ATOM 2153 CG ARG B 78 1.264 16.902 3.326 1.00 0.00 C ATOM 2154 CD ARG B 78 1.918 17.416 4.598 1.00 0.00 C ATOM 2155 NE ARG B 78 3.136 18.173 4.318 1.00 0.00 N ATOM 2156 CZ ARG B 78 4.145 18.325 5.173 1.00 0.00 C ATOM 2157 NH1 ARG B 78 4.106 17.763 6.377 1.00 0.00 N ATOM 2158 NH2 ARG B 78 5.193 19.053 4.816 1.00 0.00 N ATOM 0 H ARG B 78 0.896 14.652 1.889 1.00 0.00 H new ATOM 0 HA ARG B 78 -1.838 15.492 2.601 1.00 0.00 H new ATOM 0 HB2 ARG B 78 -0.754 17.146 4.000 1.00 0.00 H new ATOM 0 HB3 ARG B 78 -0.063 15.576 4.358 1.00 0.00 H new ATOM 0 HG2 ARG B 78 1.886 16.122 2.886 1.00 0.00 H new ATOM 0 HG3 ARG B 78 1.202 17.710 2.597 1.00 0.00 H new ATOM 0 HD2 ARG B 78 1.214 18.049 5.138 1.00 0.00 H new ATOM 0 HD3 ARG B 78 2.155 16.575 5.249 1.00 0.00 H new ATOM 0 HE ARG B 78 3.219 18.616 3.403 1.00 0.00 H new ATOM 0 HH11 ARG B 78 3.297 17.208 6.655 1.00 0.00 H new ATOM 0 HH12 ARG B 78 4.885 17.887 7.023 1.00 0.00 H new ATOM 0 HH21 ARG B 78 5.221 19.490 3.895 1.00 0.00 H new ATOM 0 HH22 ARG B 78 5.972 19.177 5.463 1.00 0.00 H new ATOM 2172 N GLU B 79 -1.937 17.566 1.214 1.00 0.00 N ATOM 2173 CA GLU B 79 -2.060 18.665 0.280 1.00 0.00 C ATOM 2174 C GLU B 79 -1.739 19.963 1.009 1.00 0.00 C ATOM 2175 O GLU B 79 -2.430 20.345 1.959 1.00 0.00 O ATOM 2176 CB GLU B 79 -3.468 18.692 -0.311 1.00 0.00 C ATOM 2177 CG GLU B 79 -3.554 19.378 -1.663 1.00 0.00 C ATOM 2178 CD GLU B 79 -4.883 19.134 -2.342 1.00 0.00 C ATOM 2179 OE1 GLU B 79 -5.101 18.013 -2.851 1.00 0.00 O ATOM 2180 OE2 GLU B 79 -5.723 20.055 -2.368 1.00 0.00 O ATOM 0 H GLU B 79 -2.742 17.440 1.828 1.00 0.00 H new ATOM 0 HA GLU B 79 -1.359 18.541 -0.545 1.00 0.00 H new ATOM 0 HB2 GLU B 79 -3.830 17.669 -0.410 1.00 0.00 H new ATOM 0 HB3 GLU B 79 -4.135 19.200 0.386 1.00 0.00 H new ATOM 0 HG2 GLU B 79 -3.404 20.450 -1.535 1.00 0.00 H new ATOM 0 HG3 GLU B 79 -2.749 19.018 -2.303 1.00 0.00 H new ATOM 2187 N HIS B 80 -0.675 20.618 0.582 1.00 0.00 N ATOM 2188 CA HIS B 80 -0.170 21.796 1.267 1.00 0.00 C ATOM 2189 C HIS B 80 -0.514 23.043 0.464 1.00 0.00 C ATOM 2190 O HIS B 80 0.278 23.506 -0.359 1.00 0.00 O ATOM 2191 CB HIS B 80 1.344 21.675 1.459 1.00 0.00 C ATOM 2192 CG HIS B 80 1.899 22.534 2.553 1.00 0.00 C ATOM 2193 ND1 HIS B 80 3.139 23.131 2.485 1.00 0.00 N ATOM 2194 CD2 HIS B 80 1.396 22.852 3.768 1.00 0.00 C ATOM 2195 CE1 HIS B 80 3.374 23.777 3.613 1.00 0.00 C ATOM 2196 NE2 HIS B 80 2.332 23.624 4.410 1.00 0.00 N ATOM 0 H HIS B 80 -0.139 20.352 -0.244 1.00 0.00 H new ATOM 0 HA HIS B 80 -0.637 21.875 2.249 1.00 0.00 H new ATOM 0 HB2 HIS B 80 1.589 20.634 1.671 1.00 0.00 H new ATOM 0 HB3 HIS B 80 1.839 21.935 0.523 1.00 0.00 H new ATOM 0 HD2 HIS B 80 0.435 22.553 4.160 1.00 0.00 H new ATOM 0 HE1 HIS B 80 4.268 24.336 3.845 1.00 0.00 H new ATOM 0 HE2 HIS B 80 2.238 24.015 5.347 1.00 0.00 H new ATOM 2205 N GLY B 81 -1.713 23.555 0.682 1.00 0.00 N ATOM 2206 CA GLY B 81 -2.193 24.668 -0.103 1.00 0.00 C ATOM 2207 C GLY B 81 -2.567 24.217 -1.493 1.00 0.00 C ATOM 2208 O GLY B 81 -3.298 23.238 -1.648 1.00 0.00 O ATOM 0 H GLY B 81 -2.364 23.218 1.391 1.00 0.00 H new ATOM 0 HA2 GLY B 81 -3.058 25.117 0.384 1.00 0.00 H new ATOM 0 HA3 GLY B 81 -1.424 25.438 -0.160 1.00 0.00 H new ATOM 2212 N PRO B 82 -2.074 24.905 -2.527 1.00 0.00 N ATOM 2213 CA PRO B 82 -2.243 24.475 -3.910 1.00 0.00 C ATOM 2214 C PRO B 82 -1.268 23.356 -4.265 1.00 0.00 C ATOM 2215 O PRO B 82 -1.439 22.660 -5.267 1.00 0.00 O ATOM 2216 CB PRO B 82 -1.931 25.737 -4.734 1.00 0.00 C ATOM 2217 CG PRO B 82 -1.697 26.834 -3.742 1.00 0.00 C ATOM 2218 CD PRO B 82 -1.339 26.169 -2.445 1.00 0.00 C ATOM 0 HA PRO B 82 -3.240 24.078 -4.098 1.00 0.00 H new ATOM 0 HB2 PRO B 82 -1.053 25.585 -5.362 1.00 0.00 H new ATOM 0 HB3 PRO B 82 -2.759 25.983 -5.399 1.00 0.00 H new ATOM 0 HG2 PRO B 82 -0.894 27.492 -4.074 1.00 0.00 H new ATOM 0 HG3 PRO B 82 -2.589 27.450 -3.628 1.00 0.00 H new ATOM 0 HD2 PRO B 82 -0.265 26.009 -2.353 1.00 0.00 H new ATOM 0 HD3 PRO B 82 -1.647 26.763 -1.585 1.00 0.00 H new ATOM 2226 N ASN B 83 -0.257 23.185 -3.421 1.00 0.00 N ATOM 2227 CA ASN B 83 0.793 22.203 -3.653 1.00 0.00 C ATOM 2228 C ASN B 83 0.418 20.859 -3.052 1.00 0.00 C ATOM 2229 O ASN B 83 -0.369 20.784 -2.112 1.00 0.00 O ATOM 2230 CB ASN B 83 2.115 22.677 -3.039 1.00 0.00 C ATOM 2231 CG ASN B 83 2.698 23.892 -3.734 1.00 0.00 C ATOM 2232 OD1 ASN B 83 2.373 25.033 -3.403 1.00 0.00 O ATOM 2233 ND2 ASN B 83 3.584 23.659 -4.689 1.00 0.00 N ATOM 0 H ASN B 83 -0.143 23.721 -2.561 1.00 0.00 H new ATOM 0 HA ASN B 83 0.912 22.091 -4.731 1.00 0.00 H new ATOM 0 HB2 ASN B 83 1.955 22.911 -1.986 1.00 0.00 H new ATOM 0 HB3 ASN B 83 2.838 21.863 -3.078 1.00 0.00 H new ATOM 0 HD21 ASN B 83 4.023 24.439 -5.179 1.00 0.00 H new ATOM 0 HD22 ASN B 83 3.828 22.700 -4.935 1.00 0.00 H new ATOM 2240 N PHE B 84 0.989 19.799 -3.593 1.00 0.00 N ATOM 2241 CA PHE B 84 0.775 18.463 -3.064 1.00 0.00 C ATOM 2242 C PHE B 84 2.112 17.845 -2.674 1.00 0.00 C ATOM 2243 O PHE B 84 3.066 17.871 -3.457 1.00 0.00 O ATOM 2244 CB PHE B 84 0.052 17.592 -4.095 1.00 0.00 C ATOM 2245 CG PHE B 84 -0.065 16.149 -3.695 1.00 0.00 C ATOM 2246 CD1 PHE B 84 -1.037 15.736 -2.800 1.00 0.00 C ATOM 2247 CD2 PHE B 84 0.804 15.206 -4.218 1.00 0.00 C ATOM 2248 CE1 PHE B 84 -1.141 14.408 -2.433 1.00 0.00 C ATOM 2249 CE2 PHE B 84 0.707 13.877 -3.857 1.00 0.00 C ATOM 2250 CZ PHE B 84 -0.267 13.477 -2.961 1.00 0.00 C ATOM 0 H PHE B 84 1.608 19.837 -4.403 1.00 0.00 H new ATOM 0 HA PHE B 84 0.147 18.525 -2.175 1.00 0.00 H new ATOM 0 HB2 PHE B 84 -0.947 17.995 -4.261 1.00 0.00 H new ATOM 0 HB3 PHE B 84 0.583 17.654 -5.045 1.00 0.00 H new ATOM 0 HD1 PHE B 84 -1.722 16.460 -2.384 1.00 0.00 H new ATOM 0 HD2 PHE B 84 1.567 15.514 -4.917 1.00 0.00 H new ATOM 0 HE1 PHE B 84 -1.904 14.098 -1.735 1.00 0.00 H new ATOM 0 HE2 PHE B 84 1.390 13.152 -4.273 1.00 0.00 H new ATOM 0 HZ PHE B 84 -0.345 12.439 -2.674 1.00 0.00 H new ATOM 2260 N GLU B 85 2.179 17.299 -1.467 1.00 0.00 N ATOM 2261 CA GLU B 85 3.416 16.731 -0.954 1.00 0.00 C ATOM 2262 C GLU B 85 3.220 15.266 -0.582 1.00 0.00 C ATOM 2263 O GLU B 85 2.505 14.948 0.368 1.00 0.00 O ATOM 2264 CB GLU B 85 3.896 17.511 0.272 1.00 0.00 C ATOM 2265 CG GLU B 85 3.999 19.009 0.040 1.00 0.00 C ATOM 2266 CD GLU B 85 4.552 19.745 1.242 1.00 0.00 C ATOM 2267 OE1 GLU B 85 3.871 19.782 2.287 1.00 0.00 O ATOM 2268 OE2 GLU B 85 5.673 20.281 1.148 1.00 0.00 O ATOM 0 H GLU B 85 1.389 17.238 -0.825 1.00 0.00 H new ATOM 0 HA GLU B 85 4.170 16.800 -1.738 1.00 0.00 H new ATOM 0 HB2 GLU B 85 3.212 17.327 1.100 1.00 0.00 H new ATOM 0 HB3 GLU B 85 4.872 17.131 0.574 1.00 0.00 H new ATOM 0 HG2 GLU B 85 4.638 19.197 -0.823 1.00 0.00 H new ATOM 0 HG3 GLU B 85 3.013 19.405 -0.202 1.00 0.00 H new ATOM 2275 N ALA B 86 3.848 14.382 -1.338 1.00 0.00 N ATOM 2276 CA ALA B 86 3.781 12.957 -1.061 1.00 0.00 C ATOM 2277 C ALA B 86 5.087 12.470 -0.449 1.00 0.00 C ATOM 2278 O ALA B 86 6.115 12.412 -1.125 1.00 0.00 O ATOM 2279 CB ALA B 86 3.471 12.179 -2.331 1.00 0.00 C ATOM 0 H ALA B 86 4.412 14.627 -2.152 1.00 0.00 H new ATOM 0 HA ALA B 86 2.977 12.786 -0.345 1.00 0.00 H new ATOM 0 HB1 ALA B 86 3.425 11.114 -2.103 1.00 0.00 H new ATOM 0 HB2 ALA B 86 2.512 12.506 -2.733 1.00 0.00 H new ATOM 0 HB3 ALA B 86 4.254 12.359 -3.068 1.00 0.00 H new ATOM 2285 N VAL B 87 5.054 12.157 0.834 1.00 0.00 N ATOM 2286 CA VAL B 87 6.229 11.652 1.530 1.00 0.00 C ATOM 2287 C VAL B 87 6.084 10.156 1.780 1.00 0.00 C ATOM 2288 O VAL B 87 5.109 9.712 2.392 1.00 0.00 O ATOM 2289 CB VAL B 87 6.448 12.374 2.879 1.00 0.00 C ATOM 2290 CG1 VAL B 87 7.783 11.979 3.491 1.00 0.00 C ATOM 2291 CG2 VAL B 87 6.361 13.883 2.706 1.00 0.00 C ATOM 0 H VAL B 87 4.223 12.243 1.419 1.00 0.00 H new ATOM 0 HA VAL B 87 7.094 11.843 0.895 1.00 0.00 H new ATOM 0 HB VAL B 87 5.656 12.065 3.561 1.00 0.00 H new ATOM 0 HG11 VAL B 87 7.916 12.499 4.440 1.00 0.00 H new ATOM 0 HG12 VAL B 87 7.801 10.903 3.661 1.00 0.00 H new ATOM 0 HG13 VAL B 87 8.590 12.252 2.811 1.00 0.00 H new ATOM 0 HG21 VAL B 87 6.518 14.369 3.669 1.00 0.00 H new ATOM 0 HG22 VAL B 87 7.126 14.213 2.003 1.00 0.00 H new ATOM 0 HG23 VAL B 87 5.376 14.149 2.322 1.00 0.00 H new ATOM 2301 N ALA B 88 7.046 9.380 1.302 1.00 0.00 N ATOM 2302 CA ALA B 88 7.001 7.936 1.453 1.00 0.00 C ATOM 2303 C ALA B 88 8.351 7.389 1.901 1.00 0.00 C ATOM 2304 O ALA B 88 9.399 7.953 1.587 1.00 0.00 O ATOM 2305 CB ALA B 88 6.570 7.281 0.148 1.00 0.00 C ATOM 0 H ALA B 88 7.867 9.728 0.806 1.00 0.00 H new ATOM 0 HA ALA B 88 6.268 7.699 2.224 1.00 0.00 H new ATOM 0 HB1 ALA B 88 6.541 6.199 0.276 1.00 0.00 H new ATOM 0 HB2 ALA B 88 5.579 7.640 -0.130 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.281 7.534 -0.638 1.00 0.00 H new ATOM 2311 N GLU B 89 8.315 6.281 2.624 1.00 0.00 N ATOM 2312 CA GLU B 89 9.525 5.639 3.116 1.00 0.00 C ATOM 2313 C GLU B 89 9.860 4.439 2.241 1.00 0.00 C ATOM 2314 O GLU B 89 9.004 3.588 2.001 1.00 0.00 O ATOM 2315 CB GLU B 89 9.322 5.182 4.565 1.00 0.00 C ATOM 2316 CG GLU B 89 8.961 6.308 5.525 1.00 0.00 C ATOM 2317 CD GLU B 89 10.135 7.203 5.867 1.00 0.00 C ATOM 2318 OE1 GLU B 89 11.212 7.043 5.256 1.00 0.00 O ATOM 2319 OE2 GLU B 89 9.997 8.051 6.774 1.00 0.00 O ATOM 0 H GLU B 89 7.452 5.803 2.885 1.00 0.00 H new ATOM 0 HA GLU B 89 10.348 6.353 3.080 1.00 0.00 H new ATOM 0 HB2 GLU B 89 8.534 4.430 4.591 1.00 0.00 H new ATOM 0 HB3 GLU B 89 10.235 4.699 4.914 1.00 0.00 H new ATOM 0 HG2 GLU B 89 8.169 6.912 5.084 1.00 0.00 H new ATOM 0 HG3 GLU B 89 8.560 5.879 6.443 1.00 0.00 H new ATOM 2326 N VAL B 90 11.095 4.377 1.765 1.00 0.00 N ATOM 2327 CA VAL B 90 11.509 3.328 0.839 1.00 0.00 C ATOM 2328 C VAL B 90 12.167 2.170 1.583 1.00 0.00 C ATOM 2329 O VAL B 90 13.050 2.375 2.421 1.00 0.00 O ATOM 2330 CB VAL B 90 12.492 3.869 -0.222 1.00 0.00 C ATOM 2331 CG1 VAL B 90 12.843 2.795 -1.243 1.00 0.00 C ATOM 2332 CG2 VAL B 90 11.910 5.090 -0.911 1.00 0.00 C ATOM 0 H VAL B 90 11.831 5.042 2.004 1.00 0.00 H new ATOM 0 HA VAL B 90 10.608 2.972 0.339 1.00 0.00 H new ATOM 0 HB VAL B 90 13.411 4.161 0.287 1.00 0.00 H new ATOM 0 HG11 VAL B 90 13.537 3.204 -1.978 1.00 0.00 H new ATOM 0 HG12 VAL B 90 13.308 1.949 -0.736 1.00 0.00 H new ATOM 0 HG13 VAL B 90 11.936 2.462 -1.747 1.00 0.00 H new ATOM 0 HG21 VAL B 90 12.616 5.459 -1.656 1.00 0.00 H new ATOM 0 HG22 VAL B 90 10.974 4.820 -1.400 1.00 0.00 H new ATOM 0 HG23 VAL B 90 11.722 5.869 -0.173 1.00 0.00 H new ATOM 2342 N TYR B 91 11.735 0.958 1.264 1.00 0.00 N ATOM 2343 CA TYR B 91 12.267 -0.243 1.890 1.00 0.00 C ATOM 2344 C TYR B 91 12.650 -1.274 0.835 1.00 0.00 C ATOM 2345 O TYR B 91 12.168 -1.238 -0.300 1.00 0.00 O ATOM 2346 CB TYR B 91 11.243 -0.847 2.856 1.00 0.00 C ATOM 2347 CG TYR B 91 10.936 0.028 4.050 1.00 0.00 C ATOM 2348 CD1 TYR B 91 11.770 0.034 5.161 1.00 0.00 C ATOM 2349 CD2 TYR B 91 9.813 0.846 4.068 1.00 0.00 C ATOM 2350 CE1 TYR B 91 11.495 0.831 6.255 1.00 0.00 C ATOM 2351 CE2 TYR B 91 9.532 1.646 5.158 1.00 0.00 C ATOM 2352 CZ TYR B 91 10.376 1.635 6.248 1.00 0.00 C ATOM 2353 OH TYR B 91 10.099 2.433 7.335 1.00 0.00 O ATOM 0 H TYR B 91 11.010 0.780 0.568 1.00 0.00 H new ATOM 0 HA TYR B 91 13.159 0.037 2.450 1.00 0.00 H new ATOM 0 HB2 TYR B 91 10.318 -1.042 2.314 1.00 0.00 H new ATOM 0 HB3 TYR B 91 11.615 -1.809 3.209 1.00 0.00 H new ATOM 0 HD1 TYR B 91 12.648 -0.595 5.169 1.00 0.00 H new ATOM 0 HD2 TYR B 91 9.149 0.856 3.216 1.00 0.00 H new ATOM 0 HE1 TYR B 91 12.153 0.824 7.111 1.00 0.00 H new ATOM 0 HE2 TYR B 91 8.656 2.277 5.157 1.00 0.00 H new ATOM 0 HH TYR B 91 9.276 2.938 7.169 1.00 0.00 H new ATOM 2363 N ASN B 92 13.524 -2.184 1.214 1.00 0.00 N ATOM 2364 CA ASN B 92 13.952 -3.255 0.332 1.00 0.00 C ATOM 2365 C ASN B 92 14.164 -4.514 1.157 1.00 0.00 C ATOM 2366 O ASN B 92 14.597 -4.437 2.306 1.00 0.00 O ATOM 2367 CB ASN B 92 15.256 -2.866 -0.379 1.00 0.00 C ATOM 2368 CG ASN B 92 15.500 -3.644 -1.660 1.00 0.00 C ATOM 2369 OD1 ASN B 92 15.024 -4.762 -1.831 1.00 0.00 O ATOM 2370 ND2 ASN B 92 16.250 -3.053 -2.576 1.00 0.00 N ATOM 0 H ASN B 92 13.957 -2.204 2.137 1.00 0.00 H new ATOM 0 HA ASN B 92 13.188 -3.434 -0.424 1.00 0.00 H new ATOM 0 HB2 ASN B 92 15.232 -1.801 -0.609 1.00 0.00 H new ATOM 0 HB3 ASN B 92 16.093 -3.027 0.300 1.00 0.00 H new ATOM 0 HD21 ASN B 92 16.448 -3.528 -3.457 1.00 0.00 H new ATOM 0 HD22 ASN B 92 16.630 -2.123 -2.401 1.00 0.00 H new ATOM 2377 N ASP B 93 13.838 -5.663 0.593 1.00 0.00 N ATOM 2378 CA ASP B 93 14.062 -6.925 1.281 1.00 0.00 C ATOM 2379 C ASP B 93 15.548 -7.249 1.286 1.00 0.00 C ATOM 2380 O ASP B 93 16.293 -6.788 0.419 1.00 0.00 O ATOM 2381 CB ASP B 93 13.267 -8.059 0.628 1.00 0.00 C ATOM 2382 CG ASP B 93 13.625 -8.265 -0.828 1.00 0.00 C ATOM 2383 OD1 ASP B 93 13.072 -7.542 -1.685 1.00 0.00 O ATOM 2384 OD2 ASP B 93 14.454 -9.146 -1.125 1.00 0.00 O ATOM 0 H ASP B 93 13.420 -5.750 -0.333 1.00 0.00 H new ATOM 0 HA ASP B 93 13.713 -6.826 2.309 1.00 0.00 H new ATOM 0 HB2 ASP B 93 13.446 -8.984 1.176 1.00 0.00 H new ATOM 0 HB3 ASP B 93 12.202 -7.842 0.708 1.00 0.00 H new ATOM 2389 N ALA B 94 15.976 -8.028 2.266 1.00 0.00 N ATOM 2390 CA ALA B 94 17.387 -8.336 2.430 1.00 0.00 C ATOM 2391 C ALA B 94 17.880 -9.268 1.328 1.00 0.00 C ATOM 2392 O ALA B 94 17.728 -10.489 1.409 1.00 0.00 O ATOM 2393 CB ALA B 94 17.641 -8.940 3.802 1.00 0.00 C ATOM 0 H ALA B 94 15.366 -8.459 2.961 1.00 0.00 H new ATOM 0 HA ALA B 94 17.949 -7.405 2.352 1.00 0.00 H new ATOM 0 HB1 ALA B 94 18.702 -9.165 3.910 1.00 0.00 H new ATOM 0 HB2 ALA B 94 17.341 -8.231 4.573 1.00 0.00 H new ATOM 0 HB3 ALA B 94 17.063 -9.858 3.908 1.00 0.00 H new