USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 110 THR OG1 : rot -109:sc= 0.893 USER MOD Set 1.2: A 139 TYR OH : rot 69:sc= 1.34 USER MOD Set 2.1: A 126 LYS NZ :NH3+ -153:sc= 0.201 (180deg=0) USER MOD Set 2.2: A 130 SER OG : rot 100:sc= 0.146 USER MOD Set 3.1: A 113 SER OG : rot 90:sc= 0.0255 USER MOD Set 3.2: A 116 HIS : no HE2:sc= -4.32 K(o=-5.4,f=-4.6!) USER MOD Set 3.3: A 119 LYS NZ :NH3+ -146:sc= -1.1 (180deg=0) USER MOD Set 4.1: A 77 GLN : amide:sc= 0.789 K(o=-0.34,f=-1.9) USER MOD Set 4.2: A 91 GLN : amide:sc= -1.13! C(o=-0.34!,f=-1.9!) USER MOD Set 5.1: A 72 SER OG : rot 41:sc= 1.49 USER MOD Set 5.2: A 75 THR OG1 : rot -163:sc= -0.372 USER MOD Set 6.1: A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 78 TYR OH : rot 180:sc= 0 USER MOD Set 7.1: A 59 GLN : amide:sc= -9.06! K(o=-9.1!,f=-3.5) USER MOD Set 7.2: A 61 SER OG : rot 180:sc= 0 USER MOD Set 8.1: A 52 SER OG : rot 180:sc= 0.515 USER MOD Set 8.2: A 54 GLN : amide:sc= 0.679 K(o=-2.5,f=-4.2) USER MOD Set 8.3: A 55 HIS : no HE2:sc= -3.68! C(o=-2.5!,f=-8.1!) USER MOD Set 9.1: A 32 ASN : amide:sc= -3.95! C(o=-5!,f=-9.4!) USER MOD Set 9.2: A 35 HIS : no HE2:sc= -1.03 K(o=-5,f=-9.4!) USER MOD Set10.1: A 31 SER OG : rot 180:sc= 0 USER MOD Set10.2: A 142 LYS NZ :NH3+ -166:sc= -0.0027 (180deg=-0.203) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 154:sc= -0.292 USER MOD Single : A 44 THR OG1 : rot 59:sc= 0.915 USER MOD Single : A 48 THR OG1 : rot -170:sc= -0.132 USER MOD Single : A 57 GLN : amide:sc= -1.19 K(o=-1.2,f=-3.4!) USER MOD Single : A 64 SER OG : rot 180:sc= 0.314 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot -140:sc= 0.098 USER MOD Single : A 81 MET CE :methyl 127:sc= -2.76! (180deg=-5.14!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.00862 USER MOD Single : A 88 TYR OH : rot -15:sc= 0.515 USER MOD Single : A 90 SER OG : rot -97:sc= 0.842 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0.0584 USER MOD Single : A 94 ASN : amide:sc= -0.879 K(o=-0.88,f=-4.4!) USER MOD Single : A 97 CYS SG : rot 178:sc= 0.355 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.0683 X(o=-0.068,f=-0.25) USER MOD Single : A 111 TYR OH : rot -179:sc= -0.565 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 LYS NZ :NH3+ 156:sc= -0.361 (180deg=-1.3!) USER MOD Single : A 128 ASN : amide:sc= -1.52! C(o=-1.5!,f=-5.9!) USER MOD Single : A 131 CYS SG : rot 10:sc= -1.49 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 24:sc= 1.16 USER MOD Single : A 138 HIS : no HE2:sc= 0.736 K(o=0.74,f=-3.3!) USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 152 SER OG : rot -100:sc= 0.00175 USER MOD Single : A 153 SER OG : rot 72:sc= 0.164 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 28 -4.939 9.108 0.253 1.00 0.00 N ATOM 2 CA LEU A 28 -4.218 8.460 1.372 1.00 0.00 C ATOM 3 C LEU A 28 -5.005 7.345 2.079 1.00 0.00 C ATOM 4 O LEU A 28 -4.464 6.363 2.596 1.00 0.00 O ATOM 5 CB LEU A 28 -3.847 9.570 2.361 1.00 0.00 C ATOM 6 CG LEU A 28 -2.661 9.181 3.234 1.00 0.00 C ATOM 7 CD1 LEU A 28 -1.340 9.322 2.476 1.00 0.00 C ATOM 8 CD2 LEU A 28 -2.639 10.130 4.415 1.00 0.00 C ATOM 0 HA LEU A 28 -3.341 7.954 0.967 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.610 10.481 1.812 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -4.706 9.794 2.994 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.767 8.141 3.543 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.514 9.037 3.128 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.352 8.673 1.600 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.211 10.357 2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.800 9.882 5.065 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.530 11.154 4.057 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.571 10.038 4.973 1.00 0.00 H new ATOM 9 N TYR A 29 -6.305 7.571 2.058 1.00 0.00 N ATOM 10 CA TYR A 29 -7.333 6.705 2.635 1.00 0.00 C ATOM 11 C TYR A 29 -7.721 5.559 1.688 1.00 0.00 C ATOM 12 O TYR A 29 -7.548 5.621 0.471 1.00 0.00 O ATOM 13 CB TYR A 29 -8.519 7.628 2.904 1.00 0.00 C ATOM 14 CG TYR A 29 -9.515 7.000 3.874 1.00 0.00 C ATOM 15 CD1 TYR A 29 -9.137 6.832 5.224 1.00 0.00 C ATOM 16 CD2 TYR A 29 -10.822 6.738 3.413 1.00 0.00 C ATOM 17 CE1 TYR A 29 -10.096 6.388 6.146 1.00 0.00 C ATOM 18 CE2 TYR A 29 -11.783 6.284 4.335 1.00 0.00 C ATOM 19 CZ TYR A 29 -11.405 6.117 5.685 1.00 0.00 C ATOM 20 OH TYR A 29 -12.321 5.633 6.554 1.00 0.00 O ATOM 0 H TYR A 29 -6.699 8.403 1.618 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.978 6.215 3.542 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -8.160 8.572 3.312 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.022 7.858 1.964 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -8.126 7.042 5.541 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -11.080 6.883 2.374 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -9.840 6.256 7.187 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -12.792 6.067 4.016 1.00 0.00 H new ATOM 0 HH TYR A 29 -13.173 5.498 6.090 1.00 0.00 H new ATOM 21 N CYS A 30 -8.217 4.508 2.320 1.00 0.00 N ATOM 22 CA CYS A 30 -8.755 3.315 1.640 1.00 0.00 C ATOM 23 C CYS A 30 -10.220 3.082 2.031 1.00 0.00 C ATOM 24 O CYS A 30 -10.646 3.465 3.122 1.00 0.00 O ATOM 25 CB CYS A 30 -7.934 2.082 2.081 1.00 0.00 C ATOM 26 SG CYS A 30 -8.484 0.483 1.388 1.00 0.00 S ATOM 0 H CYS A 30 -8.263 4.447 3.337 1.00 0.00 H new ATOM 0 HA CYS A 30 -8.692 3.466 0.562 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -6.893 2.241 1.800 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -7.965 2.017 3.169 1.00 0.00 H new ATOM 0 HG CYS A 30 -7.478 -0.339 1.341 1.00 0.00 H new ATOM 27 N SER A 31 -10.940 2.369 1.167 1.00 0.00 N ATOM 28 CA SER A 31 -12.208 1.700 1.531 1.00 0.00 C ATOM 29 C SER A 31 -11.825 0.417 2.286 1.00 0.00 C ATOM 30 O SER A 31 -11.453 -0.607 1.720 1.00 0.00 O ATOM 31 CB SER A 31 -13.071 1.405 0.307 1.00 0.00 C ATOM 32 OG SER A 31 -14.268 0.733 0.707 1.00 0.00 O ATOM 0 H SER A 31 -10.669 2.233 0.193 1.00 0.00 H new ATOM 0 HA SER A 31 -12.818 2.349 2.159 1.00 0.00 H new ATOM 0 HB2 SER A 31 -13.319 2.334 -0.206 1.00 0.00 H new ATOM 0 HB3 SER A 31 -12.516 0.788 -0.400 1.00 0.00 H new ATOM 0 HG SER A 31 -14.818 0.548 -0.082 1.00 0.00 H new ATOM 33 N ASN A 32 -11.500 0.757 3.526 1.00 0.00 N ATOM 34 CA ASN A 32 -10.933 -0.097 4.581 1.00 0.00 C ATOM 35 C ASN A 32 -11.898 -0.105 5.796 1.00 0.00 C ATOM 36 O ASN A 32 -13.085 0.177 5.646 1.00 0.00 O ATOM 37 CB ASN A 32 -9.583 0.562 4.926 1.00 0.00 C ATOM 38 CG ASN A 32 -8.748 -0.110 6.016 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.127 0.540 6.849 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.755 -1.412 6.069 1.00 0.00 N ATOM 0 H ASN A 32 -11.634 1.713 3.855 1.00 0.00 H new ATOM 0 HA ASN A 32 -10.797 -1.136 4.281 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -8.984 0.605 4.017 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -9.775 1.591 5.230 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -8.242 -1.895 6.806 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -9.274 -1.948 5.373 1.00 0.00 H new ATOM 41 N GLY A 33 -11.409 -0.605 6.928 1.00 0.00 N ATOM 42 CA GLY A 33 -11.910 -0.263 8.278 1.00 0.00 C ATOM 43 C GLY A 33 -11.667 1.244 8.523 1.00 0.00 C ATOM 44 O GLY A 33 -12.475 1.917 9.160 1.00 0.00 O ATOM 0 H GLY A 33 -10.638 -1.273 6.945 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.972 -0.493 8.358 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.397 -0.857 9.034 1.00 0.00 H new ATOM 45 N GLY A 34 -10.456 1.670 8.160 1.00 0.00 N ATOM 46 CA GLY A 34 -10.156 3.072 7.825 1.00 0.00 C ATOM 47 C GLY A 34 -8.901 3.664 8.479 1.00 0.00 C ATOM 48 O GLY A 34 -8.979 4.304 9.523 1.00 0.00 O ATOM 0 H GLY A 34 -9.648 1.052 8.088 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.050 3.152 6.743 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -11.012 3.684 8.108 1.00 0.00 H new ATOM 49 N HIS A 35 -7.779 3.499 7.793 1.00 0.00 N ATOM 50 CA HIS A 35 -6.479 4.067 8.202 1.00 0.00 C ATOM 51 C HIS A 35 -5.918 4.973 7.091 1.00 0.00 C ATOM 52 O HIS A 35 -6.590 5.206 6.080 1.00 0.00 O ATOM 53 CB HIS A 35 -5.504 2.913 8.531 1.00 0.00 C ATOM 54 CG HIS A 35 -6.047 1.953 9.590 1.00 0.00 C ATOM 55 ND1 HIS A 35 -6.828 0.908 9.333 1.00 0.00 N ATOM 56 CD2 HIS A 35 -6.013 2.117 10.906 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.311 0.447 10.475 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.804 1.204 11.451 1.00 0.00 N ATOM 0 H HIS A 35 -7.733 2.963 6.926 1.00 0.00 H new ATOM 0 HA HIS A 35 -6.609 4.682 9.093 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -5.290 2.355 7.619 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.559 3.331 8.878 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -7.023 0.525 8.408 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.442 2.863 11.439 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -7.988 -0.386 10.595 1.00 0.00 H new ATOM 59 N PHE A 36 -4.638 5.323 7.177 1.00 0.00 N ATOM 60 CA PHE A 36 -3.965 6.230 6.224 1.00 0.00 C ATOM 61 C PHE A 36 -2.612 5.600 5.937 1.00 0.00 C ATOM 62 O PHE A 36 -1.917 5.229 6.898 1.00 0.00 O ATOM 63 CB PHE A 36 -3.815 7.622 6.864 1.00 0.00 C ATOM 64 CG PHE A 36 -5.148 8.386 6.942 1.00 0.00 C ATOM 65 CD1 PHE A 36 -5.700 8.959 5.781 1.00 0.00 C ATOM 66 CD2 PHE A 36 -5.701 8.665 8.218 1.00 0.00 C ATOM 67 CE1 PHE A 36 -6.791 9.839 5.878 1.00 0.00 C ATOM 68 CE2 PHE A 36 -6.808 9.538 8.318 1.00 0.00 C ATOM 69 CZ PHE A 36 -7.329 10.125 7.149 1.00 0.00 C ATOM 0 H PHE A 36 -4.022 4.986 7.917 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.529 6.361 5.300 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -3.404 7.514 7.868 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -3.099 8.207 6.287 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -5.284 8.722 4.813 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -5.280 8.215 9.105 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -7.211 10.290 4.991 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.249 9.752 9.280 1.00 0.00 H new ATOM 0 HZ PHE A 36 -8.160 10.810 7.228 1.00 0.00 H new ATOM 70 N LEU A 37 -2.359 5.279 4.672 1.00 0.00 N ATOM 71 CA LEU A 37 -1.148 4.542 4.292 1.00 0.00 C ATOM 72 C LEU A 37 0.114 5.272 4.763 1.00 0.00 C ATOM 73 O LEU A 37 0.374 6.394 4.319 1.00 0.00 O ATOM 74 CB LEU A 37 -1.124 4.311 2.777 1.00 0.00 C ATOM 75 CG LEU A 37 0.127 3.564 2.294 1.00 0.00 C ATOM 76 CD1 LEU A 37 0.220 2.141 2.875 1.00 0.00 C ATOM 77 CD2 LEU A 37 0.121 3.523 0.774 1.00 0.00 C ATOM 0 H LEU A 37 -2.971 5.515 3.891 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.165 3.571 4.787 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.010 3.745 2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.182 5.274 2.269 1.00 0.00 H new ATOM 0 HG LEU A 37 1.006 4.102 2.650 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.122 1.654 2.503 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.258 2.194 3.963 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.654 1.566 2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.006 2.994 0.421 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -0.773 3.005 0.428 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.126 4.540 0.383 1.00 0.00 H new ATOM 78 N ARG A 38 0.792 4.700 5.751 1.00 0.00 N ATOM 79 CA ARG A 38 2.004 5.300 6.337 1.00 0.00 C ATOM 80 C ARG A 38 3.240 4.411 6.202 1.00 0.00 C ATOM 81 O ARG A 38 3.317 3.296 6.726 1.00 0.00 O ATOM 82 CB ARG A 38 1.765 5.735 7.787 1.00 0.00 C ATOM 83 CG ARG A 38 3.003 6.421 8.397 1.00 0.00 C ATOM 84 CD ARG A 38 2.796 7.254 9.668 1.00 0.00 C ATOM 85 NE ARG A 38 2.269 6.403 10.734 1.00 0.00 N ATOM 86 CZ ARG A 38 1.090 6.464 11.336 1.00 0.00 C ATOM 87 NH1 ARG A 38 -0.002 6.912 10.740 1.00 0.00 N ATOM 88 NH2 ARG A 38 0.943 5.711 12.412 1.00 0.00 N ATOM 0 H ARG A 38 0.526 3.811 6.173 1.00 0.00 H new ATOM 0 HA ARG A 38 2.219 6.195 5.753 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.917 6.418 7.825 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.500 4.865 8.387 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.741 5.650 8.617 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.437 7.070 7.636 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.740 7.701 9.979 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.106 8.074 9.469 1.00 0.00 H new ATOM 0 HE ARG A 38 2.892 5.663 11.058 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.040 7.231 9.772 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.886 6.938 11.248 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.714 5.127 12.735 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.058 5.714 12.920 1.00 0.00 H new ATOM 89 N ILE A 39 4.241 5.099 5.678 1.00 0.00 N ATOM 90 CA ILE A 39 5.633 4.621 5.674 1.00 0.00 C ATOM 91 C ILE A 39 6.346 5.351 6.815 1.00 0.00 C ATOM 92 O ILE A 39 6.812 6.480 6.722 1.00 0.00 O ATOM 93 CB ILE A 39 6.290 4.767 4.287 1.00 0.00 C ATOM 94 CG1 ILE A 39 7.564 3.911 4.134 1.00 0.00 C ATOM 95 CG2 ILE A 39 6.497 6.194 3.790 1.00 0.00 C ATOM 96 CD1 ILE A 39 8.741 4.199 5.089 1.00 0.00 C ATOM 0 H ILE A 39 4.120 6.011 5.238 1.00 0.00 H new ATOM 0 HA ILE A 39 5.697 3.548 5.855 1.00 0.00 H new ATOM 0 HB ILE A 39 5.533 4.362 3.616 1.00 0.00 H new ATOM 0 HG12 ILE A 39 7.282 2.865 4.256 1.00 0.00 H new ATOM 0 HG13 ILE A 39 7.925 4.027 3.112 1.00 0.00 H new ATOM 0 HG21 ILE A 39 6.966 6.172 2.806 1.00 0.00 H new ATOM 0 HG22 ILE A 39 5.533 6.699 3.722 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.140 6.732 4.486 1.00 0.00 H new ATOM 0 HD11 ILE A 39 9.565 3.522 4.865 1.00 0.00 H new ATOM 0 HD12 ILE A 39 9.072 5.229 4.958 1.00 0.00 H new ATOM 0 HD13 ILE A 39 8.418 4.049 6.119 1.00 0.00 H new ATOM 97 N LEU A 40 6.388 4.611 7.906 1.00 0.00 N ATOM 98 CA LEU A 40 7.038 5.050 9.152 1.00 0.00 C ATOM 99 C LEU A 40 8.526 5.270 8.864 1.00 0.00 C ATOM 100 O LEU A 40 9.119 4.406 8.220 1.00 0.00 O ATOM 101 CB LEU A 40 6.924 4.006 10.258 1.00 0.00 C ATOM 102 CG LEU A 40 5.568 3.891 10.961 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.282 5.207 11.682 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.423 3.556 10.016 1.00 0.00 C ATOM 0 H LEU A 40 5.973 3.681 7.966 1.00 0.00 H new ATOM 0 HA LEU A 40 6.543 5.961 9.488 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.170 3.033 9.833 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.680 4.225 11.012 1.00 0.00 H new ATOM 0 HG LEU A 40 5.631 3.061 11.665 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.319 5.143 12.189 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.066 5.398 12.415 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.257 6.021 10.957 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.493 3.490 10.580 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.334 4.337 9.261 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.621 2.601 9.529 1.00 0.00 H new ATOM 105 N PRO A 41 9.142 6.273 9.482 1.00 0.00 N ATOM 106 CA PRO A 41 10.557 6.632 9.253 1.00 0.00 C ATOM 107 C PRO A 41 11.543 5.473 9.453 1.00 0.00 C ATOM 108 O PRO A 41 12.529 5.375 8.724 1.00 0.00 O ATOM 109 CB PRO A 41 10.826 7.822 10.180 1.00 0.00 C ATOM 110 CG PRO A 41 9.788 7.663 11.286 1.00 0.00 C ATOM 111 CD PRO A 41 8.556 7.065 10.588 1.00 0.00 C ATOM 0 HA PRO A 41 10.721 6.892 8.207 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.841 7.798 10.577 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.711 8.771 9.656 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.151 7.007 12.077 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.554 8.622 11.749 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.974 6.440 11.265 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.888 7.842 10.216 1.00 0.00 H new ATOM 112 N ASP A 42 11.140 4.489 10.259 1.00 0.00 N ATOM 113 CA ASP A 42 11.893 3.245 10.521 1.00 0.00 C ATOM 114 C ASP A 42 11.588 2.141 9.474 1.00 0.00 C ATOM 115 O ASP A 42 11.395 0.983 9.822 1.00 0.00 O ATOM 116 CB ASP A 42 11.511 2.810 11.936 1.00 0.00 C ATOM 117 CG ASP A 42 12.526 1.828 12.534 1.00 0.00 C ATOM 118 OD1 ASP A 42 13.738 2.116 12.403 1.00 0.00 O ATOM 119 OD2 ASP A 42 12.065 0.862 13.174 1.00 0.00 O ATOM 0 H ASP A 42 10.256 4.530 10.766 1.00 0.00 H new ATOM 0 HA ASP A 42 12.966 3.418 10.438 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.437 3.689 12.577 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.525 2.345 11.918 1.00 0.00 H new ATOM 120 N GLY A 43 11.407 2.557 8.228 1.00 0.00 N ATOM 121 CA GLY A 43 11.093 1.697 7.068 1.00 0.00 C ATOM 122 C GLY A 43 9.952 0.694 7.311 1.00 0.00 C ATOM 123 O GLY A 43 9.944 -0.387 6.728 1.00 0.00 O ATOM 0 H GLY A 43 11.475 3.543 7.975 1.00 0.00 H new ATOM 0 HA2 GLY A 43 10.829 2.331 6.222 1.00 0.00 H new ATOM 0 HA3 GLY A 43 11.990 1.146 6.786 1.00 0.00 H new ATOM 124 N THR A 44 8.933 1.115 8.064 1.00 0.00 N ATOM 125 CA THR A 44 7.847 0.218 8.502 1.00 0.00 C ATOM 126 C THR A 44 6.527 0.710 7.898 1.00 0.00 C ATOM 127 O THR A 44 6.262 1.914 7.911 1.00 0.00 O ATOM 128 CB THR A 44 7.802 0.229 10.045 1.00 0.00 C ATOM 129 OG1 THR A 44 8.993 -0.341 10.582 1.00 0.00 O ATOM 130 CG2 THR A 44 6.600 -0.520 10.644 1.00 0.00 C ATOM 0 H THR A 44 8.832 2.077 8.388 1.00 0.00 H new ATOM 0 HA THR A 44 8.015 -0.805 8.165 1.00 0.00 H new ATOM 0 HB THR A 44 7.704 1.279 10.319 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.769 0.171 10.272 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.642 -0.465 11.732 1.00 0.00 H new ATOM 0 HG22 THR A 44 5.675 -0.063 10.293 1.00 0.00 H new ATOM 0 HG23 THR A 44 6.630 -1.564 10.332 1.00 0.00 H new ATOM 131 N VAL A 45 5.684 -0.205 7.436 1.00 0.00 N ATOM 132 CA VAL A 45 4.423 0.214 6.803 1.00 0.00 C ATOM 133 C VAL A 45 3.197 -0.199 7.631 1.00 0.00 C ATOM 134 O VAL A 45 2.798 -1.362 7.739 1.00 0.00 O ATOM 135 CB VAL A 45 4.387 -0.158 5.308 1.00 0.00 C ATOM 136 CG1 VAL A 45 3.069 0.221 4.640 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.482 0.620 4.573 1.00 0.00 C ATOM 0 H VAL A 45 5.835 -1.213 7.481 1.00 0.00 H new ATOM 0 HA VAL A 45 4.375 1.303 6.804 1.00 0.00 H new ATOM 0 HB VAL A 45 4.523 -1.238 5.251 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.099 -0.064 3.588 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.248 -0.299 5.134 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.917 1.297 4.720 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.463 0.362 3.514 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.309 1.690 4.689 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.455 0.363 4.992 1.00 0.00 H new ATOM 138 N ASP A 46 2.644 0.861 8.226 1.00 0.00 N ATOM 139 CA ASP A 46 1.480 0.784 9.122 1.00 0.00 C ATOM 140 C ASP A 46 0.418 1.821 8.741 1.00 0.00 C ATOM 141 O ASP A 46 0.653 2.663 7.878 1.00 0.00 O ATOM 142 CB ASP A 46 1.853 1.037 10.588 1.00 0.00 C ATOM 143 CG ASP A 46 2.717 -0.079 11.184 1.00 0.00 C ATOM 144 OD1 ASP A 46 2.283 -1.250 11.050 1.00 0.00 O ATOM 145 OD2 ASP A 46 3.765 0.268 11.773 1.00 0.00 O ATOM 0 H ASP A 46 2.994 1.811 8.099 1.00 0.00 H new ATOM 0 HA ASP A 46 1.093 -0.229 9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.388 1.984 10.663 1.00 0.00 H new ATOM 0 HB3 ASP A 46 0.942 1.138 11.177 1.00 0.00 H new ATOM 146 N GLY A 47 -0.798 1.561 9.194 1.00 0.00 N ATOM 147 CA GLY A 47 -1.890 2.541 9.176 1.00 0.00 C ATOM 148 C GLY A 47 -1.934 3.332 10.490 1.00 0.00 C ATOM 149 O GLY A 47 -0.939 3.416 11.220 1.00 0.00 O ATOM 0 H GLY A 47 -1.064 0.659 9.589 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -1.756 3.226 8.338 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.841 2.030 9.022 1.00 0.00 H new ATOM 150 N THR A 48 -3.149 3.651 10.885 1.00 0.00 N ATOM 151 CA THR A 48 -3.350 4.552 12.038 1.00 0.00 C ATOM 152 C THR A 48 -4.372 4.175 13.122 1.00 0.00 C ATOM 153 O THR A 48 -5.542 4.528 13.073 1.00 0.00 O ATOM 154 CB THR A 48 -3.486 6.028 11.621 1.00 0.00 C ATOM 155 OG1 THR A 48 -3.824 6.833 12.761 1.00 0.00 O ATOM 156 CG2 THR A 48 -4.552 6.266 10.556 1.00 0.00 C ATOM 0 H THR A 48 -4.007 3.316 10.446 1.00 0.00 H new ATOM 0 HA THR A 48 -2.409 4.395 12.565 1.00 0.00 H new ATOM 0 HB THR A 48 -2.519 6.305 11.202 1.00 0.00 H new ATOM 0 HG1 THR A 48 -4.063 7.736 12.465 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.592 7.328 10.312 1.00 0.00 H new ATOM 0 HG22 THR A 48 -4.305 5.696 9.660 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.522 5.944 10.934 1.00 0.00 H new ATOM 157 N ARG A 49 -3.828 3.477 14.102 1.00 0.00 N ATOM 158 CA ARG A 49 -4.329 3.545 15.486 1.00 0.00 C ATOM 159 C ARG A 49 -3.912 4.864 16.180 1.00 0.00 C ATOM 160 O ARG A 49 -4.492 5.265 17.179 1.00 0.00 O ATOM 161 CB ARG A 49 -3.905 2.316 16.290 1.00 0.00 C ATOM 162 CG ARG A 49 -2.417 1.938 16.119 1.00 0.00 C ATOM 163 CD ARG A 49 -2.054 0.701 16.926 1.00 0.00 C ATOM 164 NE ARG A 49 -2.849 -0.476 16.520 1.00 0.00 N ATOM 165 CZ ARG A 49 -2.376 -1.591 15.971 1.00 0.00 C ATOM 166 NH1 ARG A 49 -1.097 -1.718 15.653 1.00 0.00 N ATOM 167 NH2 ARG A 49 -3.203 -2.596 15.685 1.00 0.00 N ATOM 0 H ARG A 49 -3.034 2.849 13.976 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.418 3.542 15.443 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -4.104 2.499 17.346 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -4.522 1.468 15.991 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -2.206 1.759 15.065 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -1.791 2.773 16.432 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.993 0.484 16.799 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -2.214 0.899 17.986 1.00 0.00 H new ATOM 0 HE ARG A 49 -3.856 -0.429 16.675 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -0.449 -0.950 15.828 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -0.759 -2.584 15.233 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -4.199 -2.510 15.887 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -2.840 -3.451 15.264 1.00 0.00 H new ATOM 168 N ASP A 50 -2.927 5.533 15.571 1.00 0.00 N ATOM 169 CA ASP A 50 -2.382 6.851 15.958 1.00 0.00 C ATOM 170 C ASP A 50 -1.424 7.342 14.861 1.00 0.00 C ATOM 171 O ASP A 50 -0.376 6.743 14.641 1.00 0.00 O ATOM 172 CB ASP A 50 -1.609 6.717 17.267 1.00 0.00 C ATOM 173 CG ASP A 50 -1.279 8.092 17.864 1.00 0.00 C ATOM 174 OD1 ASP A 50 -2.226 8.738 18.344 1.00 0.00 O ATOM 175 OD2 ASP A 50 -0.098 8.499 17.747 1.00 0.00 O ATOM 0 H ASP A 50 -2.459 5.153 14.748 1.00 0.00 H new ATOM 0 HA ASP A 50 -3.200 7.560 16.085 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.196 6.140 17.981 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.686 6.163 17.092 1.00 0.00 H new ATOM 176 N ARG A 51 -1.854 8.359 14.125 1.00 0.00 N ATOM 177 CA ARG A 51 -1.059 8.974 13.032 1.00 0.00 C ATOM 178 C ARG A 51 0.244 9.635 13.510 1.00 0.00 C ATOM 179 O ARG A 51 0.238 10.571 14.306 1.00 0.00 O ATOM 180 CB ARG A 51 -1.911 9.982 12.265 1.00 0.00 C ATOM 181 CG ARG A 51 -2.184 9.495 10.833 1.00 0.00 C ATOM 182 CD ARG A 51 -2.869 10.550 9.963 1.00 0.00 C ATOM 183 NE ARG A 51 -1.937 11.643 9.626 1.00 0.00 N ATOM 184 CZ ARG A 51 -2.100 12.926 9.929 1.00 0.00 C ATOM 185 NH1 ARG A 51 -3.155 13.342 10.596 1.00 0.00 N ATOM 186 NH2 ARG A 51 -1.226 13.836 9.528 1.00 0.00 N ATOM 0 H ARG A 51 -2.767 8.794 14.258 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.762 8.157 12.374 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.855 10.137 12.787 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.402 10.945 12.235 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -1.242 9.205 10.368 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.809 8.603 10.872 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -3.239 10.088 9.048 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -3.734 10.954 10.488 1.00 0.00 H new ATOM 0 HE ARG A 51 -1.091 11.391 9.114 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -3.868 12.675 10.891 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -3.260 14.332 10.818 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -0.414 13.556 8.978 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -1.365 14.817 9.769 1.00 0.00 H new ATOM 187 N SER A 52 1.356 9.109 12.999 1.00 0.00 N ATOM 188 CA SER A 52 2.673 9.759 13.101 1.00 0.00 C ATOM 189 C SER A 52 2.850 10.749 11.943 1.00 0.00 C ATOM 190 O SER A 52 3.499 10.537 10.922 1.00 0.00 O ATOM 191 CB SER A 52 3.779 8.716 13.179 1.00 0.00 C ATOM 192 OG SER A 52 5.079 9.227 12.850 1.00 0.00 O ATOM 0 H SER A 52 1.375 8.219 12.501 1.00 0.00 H new ATOM 0 HA SER A 52 2.736 10.334 14.025 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.806 8.302 14.187 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.540 7.895 12.504 1.00 0.00 H new ATOM 0 HG SER A 52 5.741 8.508 12.921 1.00 0.00 H new ATOM 193 N ASP A 53 2.004 11.746 12.138 1.00 0.00 N ATOM 194 CA ASP A 53 1.733 12.944 11.314 1.00 0.00 C ATOM 195 C ASP A 53 2.294 13.057 9.882 1.00 0.00 C ATOM 196 O ASP A 53 1.528 13.187 8.926 1.00 0.00 O ATOM 197 CB ASP A 53 2.084 14.167 12.166 1.00 0.00 C ATOM 198 CG ASP A 53 1.360 15.432 11.703 1.00 0.00 C ATOM 199 OD1 ASP A 53 0.196 15.599 12.120 1.00 0.00 O ATOM 200 OD2 ASP A 53 2.018 16.214 10.972 1.00 0.00 O ATOM 0 H ASP A 53 1.415 11.749 12.971 1.00 0.00 H new ATOM 0 HA ASP A 53 0.676 12.860 11.062 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.828 13.966 13.206 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.160 14.334 12.129 1.00 0.00 H new ATOM 201 N GLN A 54 3.611 13.070 9.758 1.00 0.00 N ATOM 202 CA GLN A 54 4.324 13.299 8.490 1.00 0.00 C ATOM 203 C GLN A 54 4.348 12.071 7.558 1.00 0.00 C ATOM 204 O GLN A 54 3.922 12.151 6.419 1.00 0.00 O ATOM 205 CB GLN A 54 5.748 13.749 8.818 1.00 0.00 C ATOM 206 CG GLN A 54 6.663 13.920 7.603 1.00 0.00 C ATOM 207 CD GLN A 54 8.137 13.964 7.995 1.00 0.00 C ATOM 208 OE1 GLN A 54 8.540 13.950 9.158 1.00 0.00 O ATOM 209 NE2 GLN A 54 9.011 13.832 7.033 1.00 0.00 N ATOM 0 H GLN A 54 4.238 12.919 10.548 1.00 0.00 H new ATOM 0 HA GLN A 54 3.783 14.068 7.939 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.700 14.696 9.355 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.197 13.022 9.494 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.498 13.097 6.907 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.400 14.839 7.079 1.00 0.00 H new ATOM 0 HE21 GLN A 54 8.704 13.840 6.060 1.00 0.00 H new ATOM 0 HE22 GLN A 54 10.000 13.721 7.255 1.00 0.00 H new ATOM 210 N HIS A 55 4.725 10.929 8.135 1.00 0.00 N ATOM 211 CA HIS A 55 5.154 9.737 7.381 1.00 0.00 C ATOM 212 C HIS A 55 4.101 9.039 6.504 1.00 0.00 C ATOM 213 O HIS A 55 4.414 8.095 5.774 1.00 0.00 O ATOM 214 CB HIS A 55 5.861 8.804 8.382 1.00 0.00 C ATOM 215 CG HIS A 55 6.900 9.565 9.222 1.00 0.00 C ATOM 216 ND1 HIS A 55 6.756 9.866 10.510 1.00 0.00 N ATOM 217 CD2 HIS A 55 7.904 10.295 8.750 1.00 0.00 C ATOM 218 CE1 HIS A 55 7.653 10.786 10.830 1.00 0.00 C ATOM 219 NE2 HIS A 55 8.349 11.064 9.739 1.00 0.00 N ATOM 0 H HIS A 55 4.743 10.798 9.146 1.00 0.00 H new ATOM 0 HA HIS A 55 5.837 10.069 6.599 1.00 0.00 H new ATOM 0 HB2 HIS A 55 5.122 8.348 9.041 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.351 7.993 7.842 1.00 0.00 H new ATOM 0 HD1 HIS A 55 6.070 9.457 11.144 1.00 0.00 H new ATOM 0 HD2 HIS A 55 8.290 10.269 7.742 1.00 0.00 H new ATOM 0 HE1 HIS A 55 7.792 11.229 11.805 1.00 0.00 H new ATOM 220 N ILE A 56 2.836 9.435 6.673 1.00 0.00 N ATOM 221 CA ILE A 56 1.728 9.104 5.747 1.00 0.00 C ATOM 222 C ILE A 56 2.106 9.375 4.282 1.00 0.00 C ATOM 223 O ILE A 56 2.330 10.503 3.841 1.00 0.00 O ATOM 224 CB ILE A 56 0.379 9.636 6.273 1.00 0.00 C ATOM 225 CG1 ILE A 56 0.376 11.113 6.690 1.00 0.00 C ATOM 226 CG2 ILE A 56 -0.140 8.785 7.433 1.00 0.00 C ATOM 227 CD1 ILE A 56 0.348 12.103 5.530 1.00 0.00 C ATOM 0 H ILE A 56 2.540 10.003 7.466 1.00 0.00 H new ATOM 0 HA ILE A 56 1.556 8.028 5.728 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.286 9.560 5.413 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.490 11.295 7.326 1.00 0.00 H new ATOM 0 HG13 ILE A 56 1.262 11.308 7.295 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.092 9.186 7.781 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.280 7.758 7.096 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.582 8.804 8.250 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.348 13.121 5.920 1.00 0.00 H new ATOM 0 HD12 ILE A 56 1.228 11.955 4.904 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.552 11.942 4.936 1.00 0.00 H new ATOM 228 N GLN A 57 2.100 8.269 3.556 1.00 0.00 N ATOM 229 CA GLN A 57 2.846 8.044 2.304 1.00 0.00 C ATOM 230 C GLN A 57 2.230 8.483 0.958 1.00 0.00 C ATOM 231 O GLN A 57 2.716 9.393 0.293 1.00 0.00 O ATOM 232 CB GLN A 57 3.164 6.535 2.344 1.00 0.00 C ATOM 233 CG GLN A 57 3.764 5.890 1.091 1.00 0.00 C ATOM 234 CD GLN A 57 4.216 4.461 1.380 1.00 0.00 C ATOM 235 OE1 GLN A 57 3.532 3.630 1.970 1.00 0.00 O ATOM 236 NE2 GLN A 57 5.442 4.151 1.035 1.00 0.00 N ATOM 0 H GLN A 57 1.550 7.455 3.828 1.00 0.00 H new ATOM 0 HA GLN A 57 3.708 8.712 2.300 1.00 0.00 H new ATOM 0 HB2 GLN A 57 3.853 6.361 3.171 1.00 0.00 H new ATOM 0 HB3 GLN A 57 2.241 6.006 2.582 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.026 5.887 0.289 1.00 0.00 H new ATOM 0 HG3 GLN A 57 4.611 6.481 0.743 1.00 0.00 H new ATOM 0 HE21 GLN A 57 6.021 4.832 0.544 1.00 0.00 H new ATOM 0 HE22 GLN A 57 5.817 3.229 1.257 1.00 0.00 H new ATOM 237 N LEU A 58 1.068 7.912 0.699 1.00 0.00 N ATOM 238 CA LEU A 58 0.507 7.637 -0.634 1.00 0.00 C ATOM 239 C LEU A 58 0.499 8.685 -1.747 1.00 0.00 C ATOM 240 O LEU A 58 -0.373 9.547 -1.898 1.00 0.00 O ATOM 241 CB LEU A 58 -0.824 6.968 -0.325 1.00 0.00 C ATOM 242 CG LEU A 58 -1.718 6.589 -1.521 1.00 0.00 C ATOM 243 CD1 LEU A 58 -0.989 5.759 -2.584 1.00 0.00 C ATOM 244 CD2 LEU A 58 -2.925 5.829 -1.002 1.00 0.00 C ATOM 0 H LEU A 58 0.447 7.606 1.448 1.00 0.00 H new ATOM 0 HA LEU A 58 1.221 7.018 -1.178 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.622 6.062 0.246 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -1.393 7.633 0.324 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.020 7.513 -2.014 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.676 5.526 -3.398 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.144 6.327 -2.973 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.628 4.832 -2.138 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.568 5.553 -1.838 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.593 4.928 -0.487 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.481 6.460 -0.308 1.00 0.00 H new ATOM 245 N GLN A 59 1.524 8.475 -2.566 1.00 0.00 N ATOM 246 CA GLN A 59 1.715 9.062 -3.893 1.00 0.00 C ATOM 247 C GLN A 59 2.277 7.993 -4.832 1.00 0.00 C ATOM 248 O GLN A 59 2.873 7.008 -4.377 1.00 0.00 O ATOM 249 CB GLN A 59 2.717 10.204 -3.694 1.00 0.00 C ATOM 250 CG GLN A 59 2.998 11.070 -4.942 1.00 0.00 C ATOM 251 CD GLN A 59 4.397 10.812 -5.510 1.00 0.00 C ATOM 252 OE1 GLN A 59 4.647 9.890 -6.264 1.00 0.00 O ATOM 253 NE2 GLN A 59 5.350 11.612 -5.080 1.00 0.00 N ATOM 0 H GLN A 59 2.291 7.854 -2.308 1.00 0.00 H new ATOM 0 HA GLN A 59 0.788 9.431 -4.333 1.00 0.00 H new ATOM 0 HB2 GLN A 59 2.348 10.853 -2.899 1.00 0.00 H new ATOM 0 HB3 GLN A 59 3.660 9.780 -3.348 1.00 0.00 H new ATOM 0 HG2 GLN A 59 2.251 10.859 -5.707 1.00 0.00 H new ATOM 0 HG3 GLN A 59 2.900 12.124 -4.683 1.00 0.00 H new ATOM 0 HE21 GLN A 59 5.124 12.380 -4.448 1.00 0.00 H new ATOM 0 HE22 GLN A 59 6.314 11.463 -5.379 1.00 0.00 H new ATOM 254 N LEU A 60 1.978 8.106 -6.113 1.00 0.00 N ATOM 255 CA LEU A 60 2.515 7.123 -7.064 1.00 0.00 C ATOM 256 C LEU A 60 3.186 7.646 -8.321 1.00 0.00 C ATOM 257 O LEU A 60 2.591 8.285 -9.184 1.00 0.00 O ATOM 258 CB LEU A 60 1.633 5.884 -7.348 1.00 0.00 C ATOM 259 CG LEU A 60 0.129 6.074 -7.580 1.00 0.00 C ATOM 260 CD1 LEU A 60 -0.538 6.224 -6.223 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.266 7.180 -8.569 1.00 0.00 C ATOM 0 H LEU A 60 1.390 8.835 -6.518 1.00 0.00 H new ATOM 0 HA LEU A 60 3.343 6.766 -6.452 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.040 5.386 -8.228 1.00 0.00 H new ATOM 0 HB3 LEU A 60 1.752 5.198 -6.510 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.235 5.184 -8.093 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.611 6.361 -6.358 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.359 5.328 -5.628 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.124 7.091 -5.708 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.352 7.222 -8.653 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.108 8.139 -8.211 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.165 6.965 -9.547 1.00 0.00 H new ATOM 262 N SER A 61 4.268 6.918 -8.542 1.00 0.00 N ATOM 263 CA SER A 61 5.229 7.175 -9.620 1.00 0.00 C ATOM 264 C SER A 61 5.251 6.008 -10.571 1.00 0.00 C ATOM 265 O SER A 61 5.776 4.921 -10.298 1.00 0.00 O ATOM 266 CB SER A 61 6.618 7.422 -9.059 1.00 0.00 C ATOM 267 OG SER A 61 6.717 8.824 -8.841 1.00 0.00 O ATOM 0 H SER A 61 4.515 6.112 -7.968 1.00 0.00 H new ATOM 0 HA SER A 61 4.917 8.070 -10.158 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.765 6.873 -8.129 1.00 0.00 H new ATOM 0 HB3 SER A 61 7.385 7.082 -9.755 1.00 0.00 H new ATOM 0 HG SER A 61 7.601 9.037 -8.475 1.00 0.00 H new ATOM 268 N ALA A 62 4.231 6.130 -11.396 1.00 0.00 N ATOM 269 CA ALA A 62 4.074 5.259 -12.576 1.00 0.00 C ATOM 270 C ALA A 62 5.299 5.294 -13.471 1.00 0.00 C ATOM 271 O ALA A 62 5.745 6.316 -13.978 1.00 0.00 O ATOM 272 CB ALA A 62 2.816 5.633 -13.360 1.00 0.00 C ATOM 0 H ALA A 62 3.489 6.821 -11.283 1.00 0.00 H new ATOM 0 HA ALA A 62 3.966 4.236 -12.215 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.719 4.978 -14.226 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.941 5.520 -12.720 1.00 0.00 H new ATOM 0 HB3 ALA A 62 2.890 6.668 -13.694 1.00 0.00 H new ATOM 273 N GLU A 63 5.920 4.121 -13.454 1.00 0.00 N ATOM 274 CA GLU A 63 7.099 3.790 -14.260 1.00 0.00 C ATOM 275 C GLU A 63 6.681 3.403 -15.687 1.00 0.00 C ATOM 276 O GLU A 63 7.365 3.696 -16.661 1.00 0.00 O ATOM 277 CB GLU A 63 7.769 2.570 -13.637 1.00 0.00 C ATOM 278 CG GLU A 63 9.112 2.270 -14.330 1.00 0.00 C ATOM 279 CD GLU A 63 10.246 3.079 -13.697 1.00 0.00 C ATOM 280 OE1 GLU A 63 10.167 3.264 -12.485 1.00 0.00 O ATOM 281 OE2 GLU A 63 11.309 3.264 -14.320 1.00 0.00 O ATOM 0 H GLU A 63 5.612 3.348 -12.864 1.00 0.00 H new ATOM 0 HA GLU A 63 7.764 4.653 -14.291 1.00 0.00 H new ATOM 0 HB2 GLU A 63 7.934 2.743 -12.574 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.110 1.705 -13.720 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.334 1.205 -14.256 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.039 2.507 -15.391 1.00 0.00 H new ATOM 282 N SER A 64 5.632 2.590 -15.724 1.00 0.00 N ATOM 283 CA SER A 64 5.158 1.933 -16.944 1.00 0.00 C ATOM 284 C SER A 64 3.631 1.778 -16.864 1.00 0.00 C ATOM 285 O SER A 64 3.013 2.236 -15.903 1.00 0.00 O ATOM 286 CB SER A 64 5.886 0.594 -17.079 1.00 0.00 C ATOM 287 OG SER A 64 5.608 0.030 -18.357 1.00 0.00 O ATOM 0 H SER A 64 5.077 2.363 -14.899 1.00 0.00 H new ATOM 0 HA SER A 64 5.375 2.523 -17.835 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.960 0.738 -16.959 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.565 -0.088 -16.291 1.00 0.00 H new ATOM 0 HG SER A 64 6.075 -0.827 -18.445 1.00 0.00 H new ATOM 288 N VAL A 65 3.082 1.019 -17.805 1.00 0.00 N ATOM 289 CA VAL A 65 1.642 0.728 -18.003 1.00 0.00 C ATOM 290 C VAL A 65 0.967 0.186 -16.723 1.00 0.00 C ATOM 291 O VAL A 65 1.224 -0.926 -16.277 1.00 0.00 O ATOM 292 CB VAL A 65 1.557 -0.219 -19.216 1.00 0.00 C ATOM 293 CG1 VAL A 65 2.274 -1.558 -18.984 1.00 0.00 C ATOM 294 CG2 VAL A 65 0.109 -0.432 -19.653 1.00 0.00 C ATOM 0 H VAL A 65 3.659 0.552 -18.505 1.00 0.00 H new ATOM 0 HA VAL A 65 1.076 1.636 -18.210 1.00 0.00 H new ATOM 0 HB VAL A 65 2.089 0.275 -20.029 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.179 -2.181 -19.873 1.00 0.00 H new ATOM 0 HG12 VAL A 65 3.329 -1.375 -18.780 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.824 -2.069 -18.133 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.083 -1.104 -20.510 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.458 -0.869 -18.831 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.332 0.526 -19.929 1.00 0.00 H new ATOM 295 N GLY A 66 0.288 1.099 -16.050 1.00 0.00 N ATOM 296 CA GLY A 66 -0.389 0.842 -14.750 1.00 0.00 C ATOM 297 C GLY A 66 0.557 0.558 -13.582 1.00 0.00 C ATOM 298 O GLY A 66 0.142 0.492 -12.431 1.00 0.00 O ATOM 0 H GLY A 66 0.178 2.058 -16.379 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.005 1.706 -14.499 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.063 -0.006 -14.868 1.00 0.00 H new ATOM 299 N GLU A 67 1.844 0.451 -13.865 1.00 0.00 N ATOM 300 CA GLU A 67 2.882 0.084 -12.900 1.00 0.00 C ATOM 301 C GLU A 67 3.426 1.308 -12.154 1.00 0.00 C ATOM 302 O GLU A 67 4.176 2.106 -12.705 1.00 0.00 O ATOM 303 CB GLU A 67 4.014 -0.574 -13.668 1.00 0.00 C ATOM 304 CG GLU A 67 3.640 -1.940 -14.244 1.00 0.00 C ATOM 305 CD GLU A 67 4.720 -2.439 -15.204 1.00 0.00 C ATOM 306 OE1 GLU A 67 5.880 -2.577 -14.758 1.00 0.00 O ATOM 307 OE2 GLU A 67 4.374 -2.580 -16.399 1.00 0.00 O ATOM 0 H GLU A 67 2.213 0.621 -14.800 1.00 0.00 H new ATOM 0 HA GLU A 67 2.454 -0.589 -12.158 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.322 0.083 -14.481 1.00 0.00 H new ATOM 0 HB3 GLU A 67 4.873 -0.689 -13.007 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.508 -2.657 -13.434 1.00 0.00 H new ATOM 0 HG3 GLU A 67 2.686 -1.870 -14.767 1.00 0.00 H new ATOM 308 N VAL A 68 3.277 1.212 -10.842 1.00 0.00 N ATOM 309 CA VAL A 68 3.395 2.351 -9.929 1.00 0.00 C ATOM 310 C VAL A 68 4.181 2.070 -8.651 1.00 0.00 C ATOM 311 O VAL A 68 3.876 1.189 -7.864 1.00 0.00 O ATOM 312 CB VAL A 68 1.966 2.781 -9.655 1.00 0.00 C ATOM 313 CG1 VAL A 68 1.135 2.267 -8.481 1.00 0.00 C ATOM 314 CG2 VAL A 68 1.293 3.782 -10.546 1.00 0.00 C ATOM 0 H VAL A 68 3.068 0.332 -10.370 1.00 0.00 H new ATOM 0 HA VAL A 68 3.987 3.142 -10.389 1.00 0.00 H new ATOM 0 HB VAL A 68 2.760 2.040 -9.559 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.147 2.726 -8.506 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.034 1.184 -8.553 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.630 2.524 -7.545 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.278 3.961 -10.191 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.853 4.717 -10.531 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.258 3.396 -11.565 1.00 0.00 H new ATOM 315 N TYR A 69 5.297 2.769 -8.588 1.00 0.00 N ATOM 316 CA TYR A 69 6.144 2.791 -7.384 1.00 0.00 C ATOM 317 C TYR A 69 5.519 3.771 -6.399 1.00 0.00 C ATOM 318 O TYR A 69 5.398 4.961 -6.706 1.00 0.00 O ATOM 319 CB TYR A 69 7.533 3.315 -7.703 1.00 0.00 C ATOM 320 CG TYR A 69 8.433 2.337 -8.448 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.711 1.039 -7.935 1.00 0.00 C ATOM 322 CD2 TYR A 69 9.108 2.852 -9.566 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.667 0.235 -8.594 1.00 0.00 C ATOM 324 CE2 TYR A 69 10.094 2.044 -10.153 1.00 0.00 C ATOM 325 CZ TYR A 69 10.345 0.739 -9.721 1.00 0.00 C ATOM 326 OH TYR A 69 11.172 -0.031 -10.472 1.00 0.00 O ATOM 0 H TYR A 69 5.651 3.338 -9.357 1.00 0.00 H new ATOM 0 HA TYR A 69 6.218 1.778 -6.987 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.435 4.222 -8.299 1.00 0.00 H new ATOM 0 HB3 TYR A 69 8.022 3.598 -6.771 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.199 0.675 -7.056 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.878 3.831 -9.959 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.877 -0.762 -8.235 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.679 2.445 -10.967 1.00 0.00 H new ATOM 0 HH TYR A 69 11.541 0.504 -11.205 1.00 0.00 H new ATOM 327 N ILE A 70 5.004 3.213 -5.318 1.00 0.00 N ATOM 328 CA ILE A 70 4.323 4.052 -4.321 1.00 0.00 C ATOM 329 C ILE A 70 5.338 4.788 -3.446 1.00 0.00 C ATOM 330 O ILE A 70 5.790 4.344 -2.397 1.00 0.00 O ATOM 331 CB ILE A 70 3.167 3.358 -3.593 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.158 2.983 -4.679 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.513 4.264 -2.535 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.108 1.945 -4.250 1.00 0.00 C ATOM 0 H ILE A 70 5.036 2.217 -5.102 1.00 0.00 H new ATOM 0 HA ILE A 70 3.785 4.835 -4.855 1.00 0.00 H new ATOM 0 HB ILE A 70 3.529 2.486 -3.048 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.643 3.887 -5.005 1.00 0.00 H new ATOM 0 HG13 ILE A 70 2.700 2.596 -5.542 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.700 3.726 -2.048 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.256 4.550 -1.791 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.119 5.159 -3.016 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.436 1.741 -5.084 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.608 1.023 -3.953 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.535 2.334 -3.409 1.00 0.00 H new ATOM 335 N LYS A 71 5.414 6.039 -3.864 1.00 0.00 N ATOM 336 CA LYS A 71 6.363 7.014 -3.344 1.00 0.00 C ATOM 337 C LYS A 71 5.613 7.848 -2.303 1.00 0.00 C ATOM 338 O LYS A 71 4.382 7.879 -2.197 1.00 0.00 O ATOM 339 CB LYS A 71 6.823 7.887 -4.514 1.00 0.00 C ATOM 340 CG LYS A 71 8.028 8.739 -4.109 1.00 0.00 C ATOM 341 CD LYS A 71 8.224 9.935 -5.034 1.00 0.00 C ATOM 342 CE LYS A 71 9.093 11.001 -4.374 1.00 0.00 C ATOM 343 NZ LYS A 71 10.488 10.545 -4.244 1.00 0.00 N ATOM 0 H LYS A 71 4.805 6.416 -4.590 1.00 0.00 H new ATOM 0 HA LYS A 71 7.237 6.551 -2.886 1.00 0.00 H new ATOM 0 HB2 LYS A 71 7.085 7.257 -5.364 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.006 8.533 -4.836 1.00 0.00 H new ATOM 0 HG2 LYS A 71 7.895 9.091 -3.086 1.00 0.00 H new ATOM 0 HG3 LYS A 71 8.927 8.122 -4.119 1.00 0.00 H new ATOM 0 HD2 LYS A 71 8.688 9.607 -5.964 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.255 10.361 -5.294 1.00 0.00 H new ATOM 0 HE2 LYS A 71 9.060 11.917 -4.964 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.693 11.242 -3.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 11.056 11.290 -3.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 10.519 9.684 -3.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 10.875 10.339 -5.187 1.00 0.00 H new ATOM 344 N SER A 72 6.430 8.368 -1.412 1.00 0.00 N ATOM 345 CA SER A 72 5.951 9.260 -0.365 1.00 0.00 C ATOM 346 C SER A 72 6.509 10.665 -0.557 1.00 0.00 C ATOM 347 O SER A 72 7.703 10.886 -0.679 1.00 0.00 O ATOM 348 CB SER A 72 6.305 8.648 0.983 1.00 0.00 C ATOM 349 OG SER A 72 6.247 9.660 1.991 1.00 0.00 O ATOM 0 H SER A 72 7.434 8.190 -1.388 1.00 0.00 H new ATOM 0 HA SER A 72 4.867 9.368 -0.413 1.00 0.00 H new ATOM 0 HB2 SER A 72 5.613 7.841 1.222 1.00 0.00 H new ATOM 0 HB3 SER A 72 7.303 8.212 0.946 1.00 0.00 H new ATOM 0 HG SER A 72 5.472 10.238 1.830 1.00 0.00 H new ATOM 350 N THR A 73 5.584 11.610 -0.644 1.00 0.00 N ATOM 351 CA THR A 73 5.897 13.057 -0.684 1.00 0.00 C ATOM 352 C THR A 73 6.181 13.663 0.705 1.00 0.00 C ATOM 353 O THR A 73 6.001 14.855 0.943 1.00 0.00 O ATOM 354 CB THR A 73 4.743 13.810 -1.359 1.00 0.00 C ATOM 355 OG1 THR A 73 3.500 13.143 -1.107 1.00 0.00 O ATOM 356 CG2 THR A 73 5.032 13.976 -2.845 1.00 0.00 C ATOM 0 H THR A 73 4.585 11.408 -0.690 1.00 0.00 H new ATOM 0 HA THR A 73 6.816 13.167 -1.260 1.00 0.00 H new ATOM 0 HB THR A 73 4.655 14.810 -0.934 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.950 13.159 -1.918 1.00 0.00 H new ATOM 0 HG21 THR A 73 4.209 14.511 -3.318 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.955 14.541 -2.975 1.00 0.00 H new ATOM 0 HG23 THR A 73 5.139 12.994 -3.307 1.00 0.00 H new ATOM 357 N GLU A 74 6.592 12.796 1.616 1.00 0.00 N ATOM 358 CA GLU A 74 6.783 13.095 3.052 1.00 0.00 C ATOM 359 C GLU A 74 8.024 12.383 3.620 1.00 0.00 C ATOM 360 O GLU A 74 8.826 12.994 4.313 1.00 0.00 O ATOM 361 CB GLU A 74 5.554 12.682 3.867 1.00 0.00 C ATOM 362 CG GLU A 74 4.221 13.334 3.451 1.00 0.00 C ATOM 363 CD GLU A 74 3.420 12.601 2.345 1.00 0.00 C ATOM 364 OE1 GLU A 74 3.918 11.594 1.807 1.00 0.00 O ATOM 365 OE2 GLU A 74 2.316 13.108 2.030 1.00 0.00 O ATOM 0 H GLU A 74 6.813 11.828 1.382 1.00 0.00 H new ATOM 0 HA GLU A 74 6.928 14.172 3.132 1.00 0.00 H new ATOM 0 HB2 GLU A 74 5.444 11.600 3.799 1.00 0.00 H new ATOM 0 HB3 GLU A 74 5.740 12.918 4.915 1.00 0.00 H new ATOM 0 HG2 GLU A 74 3.589 13.417 4.335 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.427 14.349 3.110 1.00 0.00 H new ATOM 366 N THR A 75 8.115 11.085 3.339 1.00 0.00 N ATOM 367 CA THR A 75 9.217 10.214 3.788 1.00 0.00 C ATOM 368 C THR A 75 10.060 9.676 2.612 1.00 0.00 C ATOM 369 O THR A 75 11.114 9.075 2.835 1.00 0.00 O ATOM 370 CB THR A 75 8.667 9.014 4.558 1.00 0.00 C ATOM 371 OG1 THR A 75 7.303 9.200 4.949 1.00 0.00 O ATOM 372 CG2 THR A 75 9.531 8.758 5.804 1.00 0.00 C ATOM 0 H THR A 75 7.416 10.593 2.783 1.00 0.00 H new ATOM 0 HA THR A 75 9.853 10.829 4.425 1.00 0.00 H new ATOM 0 HB THR A 75 8.703 8.153 3.891 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.073 8.556 5.651 1.00 0.00 H new ATOM 0 HG21 THR A 75 9.136 7.902 6.351 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.557 8.552 5.499 1.00 0.00 H new ATOM 0 HG23 THR A 75 9.513 9.638 6.446 1.00 0.00 H new ATOM 373 N GLY A 76 9.438 9.641 1.433 1.00 0.00 N ATOM 374 CA GLY A 76 10.078 9.222 0.162 1.00 0.00 C ATOM 375 C GLY A 76 9.929 7.727 -0.081 1.00 0.00 C ATOM 376 O GLY A 76 9.205 7.310 -0.983 1.00 0.00 O ATOM 0 H GLY A 76 8.459 9.905 1.321 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.632 9.771 -0.667 1.00 0.00 H new ATOM 0 HA3 GLY A 76 11.136 9.483 0.185 1.00 0.00 H new ATOM 377 N GLN A 77 10.560 7.000 0.833 1.00 0.00 N ATOM 378 CA GLN A 77 10.614 5.523 0.905 1.00 0.00 C ATOM 379 C GLN A 77 9.352 4.833 0.384 1.00 0.00 C ATOM 380 O GLN A 77 8.223 5.105 0.794 1.00 0.00 O ATOM 381 CB GLN A 77 10.894 5.071 2.342 1.00 0.00 C ATOM 382 CG GLN A 77 12.284 5.500 2.813 1.00 0.00 C ATOM 383 CD GLN A 77 12.510 5.171 4.286 1.00 0.00 C ATOM 384 OE1 GLN A 77 12.818 4.058 4.678 1.00 0.00 O ATOM 385 NE2 GLN A 77 12.473 6.185 5.125 1.00 0.00 N ATOM 0 H GLN A 77 11.081 7.439 1.592 1.00 0.00 H new ATOM 0 HA GLN A 77 11.428 5.221 0.247 1.00 0.00 H new ATOM 0 HB2 GLN A 77 10.140 5.490 3.008 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.808 3.986 2.405 1.00 0.00 H new ATOM 0 HG2 GLN A 77 13.042 5.002 2.209 1.00 0.00 H new ATOM 0 HG3 GLN A 77 12.406 6.572 2.657 1.00 0.00 H new ATOM 0 HE21 GLN A 77 12.215 7.114 4.792 1.00 0.00 H new ATOM 0 HE22 GLN A 77 12.703 6.042 6.108 1.00 0.00 H new ATOM 386 N TYR A 78 9.628 3.893 -0.513 1.00 0.00 N ATOM 387 CA TYR A 78 8.628 3.216 -1.353 1.00 0.00 C ATOM 388 C TYR A 78 7.871 2.117 -0.611 1.00 0.00 C ATOM 389 O TYR A 78 8.454 1.345 0.161 1.00 0.00 O ATOM 390 CB TYR A 78 9.312 2.606 -2.579 1.00 0.00 C ATOM 391 CG TYR A 78 9.945 3.664 -3.492 1.00 0.00 C ATOM 392 CD1 TYR A 78 11.230 4.152 -3.149 1.00 0.00 C ATOM 393 CD2 TYR A 78 9.166 4.276 -4.491 1.00 0.00 C ATOM 394 CE1 TYR A 78 11.719 5.306 -3.775 1.00 0.00 C ATOM 395 CE2 TYR A 78 9.663 5.428 -5.134 1.00 0.00 C ATOM 396 CZ TYR A 78 10.920 5.942 -4.752 1.00 0.00 C ATOM 397 OH TYR A 78 11.325 7.147 -5.223 1.00 0.00 O ATOM 0 H TYR A 78 10.579 3.567 -0.686 1.00 0.00 H new ATOM 0 HA TYR A 78 7.902 3.974 -1.648 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.082 1.908 -2.250 1.00 0.00 H new ATOM 0 HB3 TYR A 78 8.582 2.031 -3.148 1.00 0.00 H new ATOM 0 HD1 TYR A 78 11.828 3.638 -2.411 1.00 0.00 H new ATOM 0 HD2 TYR A 78 8.202 3.870 -4.761 1.00 0.00 H new ATOM 0 HE1 TYR A 78 12.689 5.703 -3.516 1.00 0.00 H new ATOM 0 HE2 TYR A 78 9.088 5.911 -5.910 1.00 0.00 H new ATOM 0 HH TYR A 78 10.684 7.470 -5.890 1.00 0.00 H new ATOM 398 N LEU A 79 6.557 2.117 -0.814 1.00 0.00 N ATOM 399 CA LEU A 79 5.712 0.987 -0.394 1.00 0.00 C ATOM 400 C LEU A 79 6.126 -0.283 -1.147 1.00 0.00 C ATOM 401 O LEU A 79 6.101 -0.325 -2.372 1.00 0.00 O ATOM 402 CB LEU A 79 4.227 1.275 -0.628 1.00 0.00 C ATOM 403 CG LEU A 79 3.275 0.191 -0.077 1.00 0.00 C ATOM 404 CD1 LEU A 79 3.513 -0.080 1.395 1.00 0.00 C ATOM 405 CD2 LEU A 79 1.851 0.670 -0.337 1.00 0.00 C ATOM 0 H LEU A 79 6.050 2.879 -1.264 1.00 0.00 H new ATOM 0 HA LEU A 79 5.857 0.840 0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 79 3.977 2.230 -0.166 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.054 1.384 -1.699 1.00 0.00 H new ATOM 0 HG LEU A 79 3.457 -0.758 -0.580 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.821 -0.849 1.740 1.00 0.00 H new ATOM 0 HD12 LEU A 79 4.538 -0.422 1.541 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.351 0.835 1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.144 -0.070 0.038 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.688 1.619 0.173 1.00 0.00 H new ATOM 0 HD23 LEU A 79 1.702 0.803 -1.409 1.00 0.00 H new ATOM 406 N ALA A 80 6.614 -1.239 -0.367 1.00 0.00 N ATOM 407 CA ALA A 80 7.165 -2.511 -0.880 1.00 0.00 C ATOM 408 C ALA A 80 6.515 -3.713 -0.184 1.00 0.00 C ATOM 409 O ALA A 80 6.205 -3.617 1.000 1.00 0.00 O ATOM 410 CB ALA A 80 8.649 -2.563 -0.585 1.00 0.00 C ATOM 0 H ALA A 80 6.644 -1.164 0.650 1.00 0.00 H new ATOM 0 HA ALA A 80 6.968 -2.557 -1.951 1.00 0.00 H new ATOM 0 HB1 ALA A 80 9.062 -3.499 -0.961 1.00 0.00 H new ATOM 0 HB2 ALA A 80 9.147 -1.725 -1.073 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.808 -2.503 0.492 1.00 0.00 H new ATOM 411 N MET A 81 6.528 -4.862 -0.850 1.00 0.00 N ATOM 412 CA MET A 81 5.921 -6.065 -0.255 1.00 0.00 C ATOM 413 C MET A 81 6.905 -7.248 -0.234 1.00 0.00 C ATOM 414 O MET A 81 7.824 -7.324 -1.045 1.00 0.00 O ATOM 415 CB MET A 81 4.606 -6.432 -0.955 1.00 0.00 C ATOM 416 CG MET A 81 3.830 -7.433 -0.099 1.00 0.00 C ATOM 417 SD MET A 81 2.164 -7.933 -0.679 1.00 0.00 S ATOM 418 CE MET A 81 1.463 -6.485 -1.424 1.00 0.00 C ATOM 0 H MET A 81 6.937 -4.994 -1.775 1.00 0.00 H new ATOM 0 HA MET A 81 5.683 -5.831 0.782 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.007 -5.536 -1.118 1.00 0.00 H new ATOM 0 HB3 MET A 81 4.812 -6.860 -1.936 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.436 -8.334 -0.002 1.00 0.00 H new ATOM 0 HG3 MET A 81 3.725 -7.010 0.900 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.122 -6.723 -2.432 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.619 -6.141 -0.827 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.217 -5.699 -1.472 1.00 0.00 H new ATOM 419 N ASP A 82 6.833 -7.984 0.879 1.00 0.00 N ATOM 420 CA ASP A 82 7.649 -9.190 1.123 1.00 0.00 C ATOM 421 C ASP A 82 6.816 -10.465 1.036 1.00 0.00 C ATOM 422 O ASP A 82 5.684 -10.527 1.508 1.00 0.00 O ATOM 423 CB ASP A 82 8.268 -9.058 2.513 1.00 0.00 C ATOM 424 CG ASP A 82 9.341 -10.088 2.854 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.470 -9.955 2.327 1.00 0.00 O ATOM 426 OD2 ASP A 82 8.940 -11.076 3.504 1.00 0.00 O ATOM 0 H ASP A 82 6.201 -7.762 1.648 1.00 0.00 H new ATOM 0 HA ASP A 82 8.421 -9.265 0.357 1.00 0.00 H new ATOM 0 HB2 ASP A 82 8.702 -8.062 2.605 1.00 0.00 H new ATOM 0 HB3 ASP A 82 7.472 -9.129 3.254 1.00 0.00 H new ATOM 427 N THR A 83 7.594 -11.491 0.743 1.00 0.00 N ATOM 428 CA THR A 83 7.205 -12.907 0.548 1.00 0.00 C ATOM 429 C THR A 83 6.433 -13.535 1.722 1.00 0.00 C ATOM 430 O THR A 83 5.722 -14.520 1.549 1.00 0.00 O ATOM 431 CB THR A 83 8.428 -13.777 0.270 1.00 0.00 C ATOM 432 OG1 THR A 83 9.459 -13.440 1.213 1.00 0.00 O ATOM 433 CG2 THR A 83 8.899 -13.636 -1.178 1.00 0.00 C ATOM 0 H THR A 83 8.599 -11.363 0.622 1.00 0.00 H new ATOM 0 HA THR A 83 6.530 -12.880 -0.307 1.00 0.00 H new ATOM 0 HB THR A 83 8.166 -14.827 0.397 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.250 -13.994 1.045 1.00 0.00 H new ATOM 0 HG21 THR A 83 9.771 -14.269 -1.340 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.099 -13.941 -1.852 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.163 -12.597 -1.375 1.00 0.00 H new ATOM 434 N ASP A 84 6.744 -13.041 2.913 1.00 0.00 N ATOM 435 CA ASP A 84 6.023 -13.330 4.173 1.00 0.00 C ATOM 436 C ASP A 84 4.553 -12.876 4.230 1.00 0.00 C ATOM 437 O ASP A 84 3.851 -13.165 5.196 1.00 0.00 O ATOM 438 CB ASP A 84 6.811 -12.686 5.316 1.00 0.00 C ATOM 439 CG ASP A 84 8.075 -13.489 5.636 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.080 -13.254 4.944 1.00 0.00 O ATOM 441 OD2 ASP A 84 7.994 -14.330 6.555 1.00 0.00 O ATOM 0 H ASP A 84 7.530 -12.405 3.047 1.00 0.00 H new ATOM 0 HA ASP A 84 5.967 -14.416 4.253 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.084 -11.666 5.044 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.182 -12.622 6.204 1.00 0.00 H new ATOM 442 N GLY A 85 4.217 -11.973 3.319 1.00 0.00 N ATOM 443 CA GLY A 85 2.870 -11.394 3.187 1.00 0.00 C ATOM 444 C GLY A 85 2.685 -10.196 4.109 1.00 0.00 C ATOM 445 O GLY A 85 1.804 -10.177 4.958 1.00 0.00 O ATOM 0 H GLY A 85 4.880 -11.610 2.634 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.704 -11.089 2.154 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.122 -12.152 3.419 1.00 0.00 H new ATOM 446 N LEU A 86 3.472 -9.164 3.808 1.00 0.00 N ATOM 447 CA LEU A 86 3.545 -7.898 4.570 1.00 0.00 C ATOM 448 C LEU A 86 4.224 -6.785 3.764 1.00 0.00 C ATOM 449 O LEU A 86 5.082 -7.055 2.912 1.00 0.00 O ATOM 450 CB LEU A 86 4.149 -8.140 5.965 1.00 0.00 C ATOM 451 CG LEU A 86 5.516 -8.819 5.894 1.00 0.00 C ATOM 452 CD1 LEU A 86 6.591 -7.749 5.778 1.00 0.00 C ATOM 453 CD2 LEU A 86 5.746 -9.705 7.121 1.00 0.00 C ATOM 0 H LEU A 86 4.100 -9.177 3.004 1.00 0.00 H new ATOM 0 HA LEU A 86 2.534 -7.529 4.743 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.245 -7.188 6.487 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.469 -8.758 6.551 1.00 0.00 H new ATOM 0 HG LEU A 86 5.559 -9.465 5.017 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.571 -8.222 5.727 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.424 -7.162 4.875 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.549 -7.095 6.649 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.725 -10.179 7.049 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.703 -9.095 8.023 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.974 -10.473 7.165 1.00 0.00 H new ATOM 454 N LEU A 87 3.904 -5.552 4.152 1.00 0.00 N ATOM 455 CA LEU A 87 4.370 -4.333 3.461 1.00 0.00 C ATOM 456 C LEU A 87 5.448 -3.651 4.308 1.00 0.00 C ATOM 457 O LEU A 87 5.286 -3.400 5.503 1.00 0.00 O ATOM 458 CB LEU A 87 3.231 -3.308 3.223 1.00 0.00 C ATOM 459 CG LEU A 87 1.917 -3.905 2.743 1.00 0.00 C ATOM 460 CD1 LEU A 87 0.807 -2.869 2.845 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.045 -4.461 1.331 1.00 0.00 C ATOM 0 H LEU A 87 3.311 -5.360 4.959 1.00 0.00 H new ATOM 0 HA LEU A 87 4.757 -4.647 2.491 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.049 -2.768 4.152 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.569 -2.576 2.490 1.00 0.00 H new ATOM 0 HG LEU A 87 1.658 -4.744 3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -0.130 -3.305 2.499 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.699 -2.552 3.882 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.056 -2.007 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.089 -4.880 1.017 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.331 -3.660 0.649 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.806 -5.241 1.315 1.00 0.00 H new ATOM 462 N TYR A 88 6.545 -3.321 3.628 1.00 0.00 N ATOM 463 CA TYR A 88 7.701 -2.609 4.206 1.00 0.00 C ATOM 464 C TYR A 88 8.060 -1.362 3.402 1.00 0.00 C ATOM 465 O TYR A 88 7.716 -1.237 2.232 1.00 0.00 O ATOM 466 CB TYR A 88 8.948 -3.483 4.402 1.00 0.00 C ATOM 467 CG TYR A 88 9.500 -4.209 3.191 1.00 0.00 C ATOM 468 CD1 TYR A 88 8.718 -5.200 2.543 1.00 0.00 C ATOM 469 CD2 TYR A 88 10.804 -3.895 2.764 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.255 -5.850 1.428 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.344 -4.576 1.655 1.00 0.00 C ATOM 472 CZ TYR A 88 10.550 -5.534 0.997 1.00 0.00 C ATOM 473 OH TYR A 88 10.997 -6.116 -0.138 1.00 0.00 O ATOM 0 H TYR A 88 6.665 -3.542 2.640 1.00 0.00 H new ATOM 0 HA TYR A 88 7.369 -2.313 5.201 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.740 -2.851 4.803 1.00 0.00 H new ATOM 0 HB3 TYR A 88 8.718 -4.228 5.163 1.00 0.00 H new ATOM 0 HD1 TYR A 88 7.730 -5.447 2.903 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.383 -3.143 3.279 1.00 0.00 H new ATOM 0 HE1 TYR A 88 8.674 -6.593 0.901 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.348 -4.367 1.316 1.00 0.00 H new ATOM 0 HH TYR A 88 10.416 -6.870 -0.370 1.00 0.00 H new ATOM 474 N GLY A 89 8.766 -0.457 4.077 1.00 0.00 N ATOM 475 CA GLY A 89 9.176 0.816 3.488 1.00 0.00 C ATOM 476 C GLY A 89 10.570 0.691 2.889 1.00 0.00 C ATOM 477 O GLY A 89 11.549 1.082 3.518 1.00 0.00 O ATOM 0 H GLY A 89 9.069 -0.584 5.043 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.466 1.114 2.717 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.167 1.597 4.248 1.00 0.00 H new ATOM 478 N SER A 90 10.639 0.001 1.757 1.00 0.00 N ATOM 479 CA SER A 90 11.911 -0.174 1.024 1.00 0.00 C ATOM 480 C SER A 90 12.302 1.098 0.256 1.00 0.00 C ATOM 481 O SER A 90 11.588 1.566 -0.636 1.00 0.00 O ATOM 482 CB SER A 90 11.887 -1.393 0.100 1.00 0.00 C ATOM 483 OG SER A 90 13.049 -1.416 -0.741 1.00 0.00 O ATOM 0 H SER A 90 9.837 -0.450 1.318 1.00 0.00 H new ATOM 0 HA SER A 90 12.679 -0.359 1.775 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.845 -2.305 0.695 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.987 -1.371 -0.515 1.00 0.00 H new ATOM 0 HG SER A 90 12.829 -1.029 -1.614 1.00 0.00 H new ATOM 484 N GLN A 91 13.493 1.573 0.576 1.00 0.00 N ATOM 485 CA GLN A 91 14.117 2.773 -0.010 1.00 0.00 C ATOM 486 C GLN A 91 14.310 2.631 -1.529 1.00 0.00 C ATOM 487 O GLN A 91 14.172 3.559 -2.309 1.00 0.00 O ATOM 488 CB GLN A 91 15.512 2.959 0.584 1.00 0.00 C ATOM 489 CG GLN A 91 15.578 3.163 2.114 1.00 0.00 C ATOM 490 CD GLN A 91 15.386 1.861 2.885 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.994 0.828 2.608 1.00 0.00 O ATOM 492 NE2 GLN A 91 14.496 1.864 3.855 1.00 0.00 N ATOM 0 H GLN A 91 14.084 1.125 1.276 1.00 0.00 H new ATOM 0 HA GLN A 91 13.458 3.614 0.206 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.113 2.086 0.328 1.00 0.00 H new ATOM 0 HB3 GLN A 91 15.978 3.819 0.103 1.00 0.00 H new ATOM 0 HG2 GLN A 91 16.541 3.599 2.378 1.00 0.00 H new ATOM 0 HG3 GLN A 91 14.811 3.877 2.416 1.00 0.00 H new ATOM 0 HE21 GLN A 91 13.993 2.722 4.083 1.00 0.00 H new ATOM 0 HE22 GLN A 91 14.309 1.009 4.379 1.00 0.00 H new ATOM 493 N THR A 92 14.722 1.411 -1.849 1.00 0.00 N ATOM 494 CA THR A 92 15.118 0.927 -3.180 1.00 0.00 C ATOM 495 C THR A 92 13.863 0.446 -3.903 1.00 0.00 C ATOM 496 O THR A 92 13.159 -0.424 -3.376 1.00 0.00 O ATOM 497 CB THR A 92 16.008 -0.305 -3.019 1.00 0.00 C ATOM 498 OG1 THR A 92 16.631 -0.319 -1.732 1.00 0.00 O ATOM 499 CG2 THR A 92 17.086 -0.358 -4.102 1.00 0.00 C ATOM 0 H THR A 92 14.796 0.678 -1.143 1.00 0.00 H new ATOM 0 HA THR A 92 15.630 1.724 -3.720 1.00 0.00 H new ATOM 0 HB THR A 92 15.366 -1.180 -3.118 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.194 -1.117 -1.650 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.702 -1.246 -3.959 1.00 0.00 H new ATOM 0 HG22 THR A 92 16.614 -0.398 -5.084 1.00 0.00 H new ATOM 0 HG23 THR A 92 17.712 0.532 -4.036 1.00 0.00 H new ATOM 500 N PRO A 93 13.596 0.982 -5.095 1.00 0.00 N ATOM 501 CA PRO A 93 12.488 0.500 -5.902 1.00 0.00 C ATOM 502 C PRO A 93 12.859 -0.633 -6.850 1.00 0.00 C ATOM 503 O PRO A 93 13.875 -0.624 -7.532 1.00 0.00 O ATOM 504 CB PRO A 93 11.948 1.723 -6.617 1.00 0.00 C ATOM 505 CG PRO A 93 13.196 2.584 -6.833 1.00 0.00 C ATOM 506 CD PRO A 93 14.093 2.259 -5.630 1.00 0.00 C ATOM 0 HA PRO A 93 11.728 0.038 -5.272 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.473 1.459 -7.562 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.200 2.242 -6.018 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.689 2.341 -7.774 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.947 3.644 -6.868 1.00 0.00 H new ATOM 0 HD2 PRO A 93 15.137 2.177 -5.931 1.00 0.00 H new ATOM 0 HD3 PRO A 93 14.039 3.046 -4.878 1.00 0.00 H new ATOM 507 N ASN A 94 12.196 -1.728 -6.501 1.00 0.00 N ATOM 508 CA ASN A 94 12.208 -3.001 -7.253 1.00 0.00 C ATOM 509 C ASN A 94 10.741 -3.351 -7.593 1.00 0.00 C ATOM 510 O ASN A 94 9.819 -2.630 -7.200 1.00 0.00 O ATOM 511 CB ASN A 94 12.875 -4.030 -6.317 1.00 0.00 C ATOM 512 CG ASN A 94 13.113 -5.415 -6.908 1.00 0.00 C ATOM 513 OD1 ASN A 94 12.264 -6.297 -6.870 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.251 -5.592 -7.540 1.00 0.00 N ATOM 0 H ASN A 94 11.614 -1.768 -5.664 1.00 0.00 H new ATOM 0 HA ASN A 94 12.759 -2.967 -8.193 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.833 -3.627 -5.990 1.00 0.00 H new ATOM 0 HB3 ASN A 94 12.255 -4.138 -5.427 1.00 0.00 H new ATOM 0 HD21 ASN A 94 14.441 -6.477 -8.011 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.945 -4.845 -7.560 1.00 0.00 H new ATOM 515 N GLU A 95 10.528 -4.504 -8.203 1.00 0.00 N ATOM 516 CA GLU A 95 9.183 -5.081 -8.487 1.00 0.00 C ATOM 517 C GLU A 95 8.334 -5.172 -7.215 1.00 0.00 C ATOM 518 O GLU A 95 7.112 -5.013 -7.232 1.00 0.00 O ATOM 519 CB GLU A 95 9.313 -6.544 -8.942 1.00 0.00 C ATOM 520 CG GLU A 95 10.104 -6.799 -10.225 1.00 0.00 C ATOM 521 CD GLU A 95 11.624 -6.819 -10.028 1.00 0.00 C ATOM 522 OE1 GLU A 95 12.212 -5.714 -10.101 1.00 0.00 O ATOM 523 OE2 GLU A 95 12.161 -7.908 -9.736 1.00 0.00 O ATOM 0 H GLU A 95 11.291 -5.096 -8.531 1.00 0.00 H new ATOM 0 HA GLU A 95 8.734 -4.433 -9.240 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.781 -7.110 -8.136 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.310 -6.949 -9.075 1.00 0.00 H new ATOM 0 HG2 GLU A 95 9.791 -7.753 -10.649 1.00 0.00 H new ATOM 0 HG3 GLU A 95 9.853 -6.028 -10.954 1.00 0.00 H new ATOM 524 N GLU A 96 9.030 -5.479 -6.126 1.00 0.00 N ATOM 525 CA GLU A 96 8.507 -5.479 -4.745 1.00 0.00 C ATOM 526 C GLU A 96 7.746 -4.200 -4.395 1.00 0.00 C ATOM 527 O GLU A 96 6.641 -4.276 -3.851 1.00 0.00 O ATOM 528 CB GLU A 96 9.698 -5.602 -3.789 1.00 0.00 C ATOM 529 CG GLU A 96 10.264 -7.022 -3.950 1.00 0.00 C ATOM 530 CD GLU A 96 11.188 -7.445 -2.811 1.00 0.00 C ATOM 531 OE1 GLU A 96 12.399 -7.187 -2.951 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.647 -8.082 -1.880 1.00 0.00 O ATOM 0 H GLU A 96 10.013 -5.747 -6.172 1.00 0.00 H new ATOM 0 HA GLU A 96 7.809 -6.312 -4.654 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.458 -4.856 -4.023 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.385 -5.427 -2.760 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.437 -7.728 -4.017 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.811 -7.082 -4.891 1.00 0.00 H new ATOM 533 N CYS A 97 8.271 -3.101 -4.916 1.00 0.00 N ATOM 534 CA CYS A 97 7.853 -1.727 -4.595 1.00 0.00 C ATOM 535 C CYS A 97 6.996 -1.124 -5.734 1.00 0.00 C ATOM 536 O CYS A 97 6.406 -0.057 -5.587 1.00 0.00 O ATOM 537 CB CYS A 97 9.144 -0.918 -4.412 1.00 0.00 C ATOM 538 SG CYS A 97 10.439 -1.692 -3.381 1.00 0.00 S ATOM 0 H CYS A 97 9.028 -3.133 -5.599 1.00 0.00 H new ATOM 0 HA CYS A 97 7.237 -1.709 -3.696 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.565 -0.716 -5.397 1.00 0.00 H new ATOM 0 HB3 CYS A 97 8.886 0.045 -3.972 1.00 0.00 H new ATOM 0 HG CYS A 97 11.485 -0.920 -3.346 1.00 0.00 H new ATOM 539 N LEU A 98 6.845 -1.913 -6.808 1.00 0.00 N ATOM 540 CA LEU A 98 6.101 -1.527 -8.020 1.00 0.00 C ATOM 541 C LEU A 98 4.776 -2.284 -7.991 1.00 0.00 C ATOM 542 O LEU A 98 4.687 -3.441 -7.579 1.00 0.00 O ATOM 543 CB LEU A 98 6.883 -1.851 -9.288 1.00 0.00 C ATOM 544 CG LEU A 98 6.286 -1.117 -10.502 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.423 0.377 -10.388 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.120 -1.451 -11.719 1.00 0.00 C ATOM 0 H LEU A 98 7.241 -2.851 -6.862 1.00 0.00 H new ATOM 0 HA LEU A 98 5.935 -0.450 -8.031 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.926 -1.563 -9.160 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.868 -2.927 -9.465 1.00 0.00 H new ATOM 0 HG LEU A 98 5.240 -1.417 -10.563 1.00 0.00 H new ATOM 0 HD11 LEU A 98 5.987 0.851 -11.268 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.903 0.723 -9.495 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.478 0.641 -10.319 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.712 -0.940 -12.591 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.148 -1.127 -11.556 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.102 -2.528 -11.888 1.00 0.00 H new ATOM 547 N PHE A 99 3.759 -1.499 -8.285 1.00 0.00 N ATOM 548 CA PHE A 99 2.390 -1.961 -8.200 1.00 0.00 C ATOM 549 C PHE A 99 1.506 -1.711 -9.411 1.00 0.00 C ATOM 550 O PHE A 99 1.440 -0.608 -9.939 1.00 0.00 O ATOM 551 CB PHE A 99 1.695 -1.318 -6.984 1.00 0.00 C ATOM 552 CG PHE A 99 2.307 -1.757 -5.651 1.00 0.00 C ATOM 553 CD1 PHE A 99 1.914 -2.993 -5.103 1.00 0.00 C ATOM 554 CD2 PHE A 99 3.266 -0.954 -5.015 1.00 0.00 C ATOM 555 CE1 PHE A 99 2.490 -3.438 -3.900 1.00 0.00 C ATOM 556 CE2 PHE A 99 3.834 -1.397 -3.795 1.00 0.00 C ATOM 557 CZ PHE A 99 3.436 -2.631 -3.238 1.00 0.00 C ATOM 0 H PHE A 99 3.858 -0.530 -8.587 1.00 0.00 H new ATOM 0 HA PHE A 99 2.494 -3.043 -8.120 1.00 0.00 H new ATOM 0 HB2 PHE A 99 1.757 -0.233 -7.067 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.637 -1.579 -6.996 1.00 0.00 H new ATOM 0 HD1 PHE A 99 1.173 -3.597 -5.605 1.00 0.00 H new ATOM 0 HD2 PHE A 99 3.567 -0.012 -5.449 1.00 0.00 H new ATOM 0 HE1 PHE A 99 2.208 -4.395 -3.485 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.572 -0.790 -3.291 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.859 -2.958 -2.300 1.00 0.00 H new ATOM 558 N LEU A 100 0.779 -2.747 -9.766 1.00 0.00 N ATOM 559 CA LEU A 100 -0.186 -2.693 -10.869 1.00 0.00 C ATOM 560 C LEU A 100 -1.471 -1.981 -10.422 1.00 0.00 C ATOM 561 O LEU A 100 -2.064 -2.362 -9.414 1.00 0.00 O ATOM 562 CB LEU A 100 -0.530 -4.122 -11.264 1.00 0.00 C ATOM 563 CG LEU A 100 -0.594 -4.295 -12.787 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.824 -4.271 -13.357 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.231 -5.634 -13.115 1.00 0.00 C ATOM 0 H LEU A 100 0.832 -3.656 -9.305 1.00 0.00 H new ATOM 0 HA LEU A 100 0.247 -2.146 -11.707 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.216 -4.802 -10.852 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.489 -4.399 -10.827 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.184 -3.487 -13.220 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.783 -4.394 -14.439 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.296 -3.318 -13.117 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.405 -5.084 -12.921 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.278 -5.759 -14.197 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.634 -6.437 -12.682 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.239 -5.668 -12.702 1.00 0.00 H new ATOM 566 N GLU A 101 -1.762 -0.899 -11.118 1.00 0.00 N ATOM 567 CA GLU A 101 -3.039 -0.174 -10.962 1.00 0.00 C ATOM 568 C GLU A 101 -4.168 -1.005 -11.590 1.00 0.00 C ATOM 569 O GLU A 101 -4.190 -1.261 -12.788 1.00 0.00 O ATOM 570 CB GLU A 101 -2.991 1.199 -11.612 1.00 0.00 C ATOM 571 CG GLU A 101 -2.168 2.206 -10.798 1.00 0.00 C ATOM 572 CD GLU A 101 -2.268 3.589 -11.423 1.00 0.00 C ATOM 573 OE1 GLU A 101 -1.643 3.779 -12.494 1.00 0.00 O ATOM 574 OE2 GLU A 101 -2.981 4.435 -10.838 1.00 0.00 O ATOM 0 H GLU A 101 -1.133 -0.488 -11.808 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.221 -0.029 -9.897 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.565 1.110 -12.611 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.006 1.577 -11.731 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.529 2.236 -9.770 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -1.126 1.890 -10.761 1.00 0.00 H new ATOM 575 N ARG A 102 -4.809 -1.705 -10.669 1.00 0.00 N ATOM 576 CA ARG A 102 -5.922 -2.633 -10.928 1.00 0.00 C ATOM 577 C ARG A 102 -7.303 -1.943 -10.978 1.00 0.00 C ATOM 578 O ARG A 102 -8.244 -2.503 -11.521 1.00 0.00 O ATOM 579 CB ARG A 102 -5.898 -3.643 -9.789 1.00 0.00 C ATOM 580 CG ARG A 102 -4.787 -4.680 -9.891 1.00 0.00 C ATOM 581 CD ARG A 102 -4.870 -5.617 -11.104 1.00 0.00 C ATOM 582 NE ARG A 102 -6.053 -6.504 -11.065 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.963 -6.621 -12.030 1.00 0.00 C ATOM 584 NH1 ARG A 102 -7.173 -5.629 -12.888 1.00 0.00 N ATOM 585 NH2 ARG A 102 -7.912 -7.543 -11.948 1.00 0.00 N ATOM 0 H ARG A 102 -4.567 -1.648 -9.680 1.00 0.00 H new ATOM 0 HA ARG A 102 -5.787 -3.088 -11.909 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.792 -3.107 -8.846 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.858 -4.159 -9.756 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.829 -4.160 -9.920 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.794 -5.285 -8.985 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -4.899 -5.021 -12.016 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -3.967 -6.226 -11.149 1.00 0.00 H new ATOM 0 HE ARG A 102 -6.183 -7.074 -10.229 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.634 -4.766 -12.812 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.873 -5.730 -13.623 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -7.948 -8.168 -11.142 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -8.606 -7.628 -12.690 1.00 0.00 H new ATOM 586 N LEU A 103 -7.406 -0.936 -10.126 1.00 0.00 N ATOM 587 CA LEU A 103 -8.517 0.030 -9.983 1.00 0.00 C ATOM 588 C LEU A 103 -9.954 -0.515 -10.103 1.00 0.00 C ATOM 589 O LEU A 103 -10.478 -0.832 -11.175 1.00 0.00 O ATOM 590 CB LEU A 103 -8.267 1.173 -10.964 1.00 0.00 C ATOM 591 CG LEU A 103 -9.248 2.357 -10.883 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.153 3.111 -9.562 1.00 0.00 C ATOM 593 CD2 LEU A 103 -8.991 3.311 -12.053 1.00 0.00 C ATOM 0 H LEU A 103 -6.661 -0.746 -9.456 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.495 0.358 -8.944 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.258 1.551 -10.801 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -8.297 0.770 -11.976 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.258 1.951 -10.941 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.867 3.935 -9.561 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.380 2.433 -8.739 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.144 3.505 -9.440 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.685 4.150 -11.997 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -7.967 3.682 -12.002 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -9.138 2.781 -12.994 1.00 0.00 H new ATOM 594 N GLU A 104 -10.635 -0.183 -9.022 1.00 0.00 N ATOM 595 CA GLU A 104 -12.105 -0.207 -8.918 1.00 0.00 C ATOM 596 C GLU A 104 -12.493 1.217 -9.309 1.00 0.00 C ATOM 597 O GLU A 104 -12.081 2.180 -8.643 1.00 0.00 O ATOM 598 CB GLU A 104 -12.576 -0.399 -7.464 1.00 0.00 C ATOM 599 CG GLU A 104 -12.028 -1.655 -6.775 1.00 0.00 C ATOM 600 CD GLU A 104 -12.933 -2.867 -6.985 1.00 0.00 C ATOM 601 OE1 GLU A 104 -12.827 -3.503 -8.060 1.00 0.00 O ATOM 602 OE2 GLU A 104 -13.705 -3.164 -6.043 1.00 0.00 O ATOM 0 H GLU A 104 -10.180 0.121 -8.161 1.00 0.00 H new ATOM 0 HA GLU A 104 -12.531 -1.010 -9.519 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.283 0.475 -6.883 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.665 -0.440 -7.451 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.033 -1.875 -7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -11.920 -1.464 -5.707 1.00 0.00 H new ATOM 603 N GLU A 105 -12.978 1.316 -10.548 1.00 0.00 N ATOM 604 CA GLU A 105 -13.441 2.567 -11.182 1.00 0.00 C ATOM 605 C GLU A 105 -13.698 3.828 -10.361 1.00 0.00 C ATOM 606 O GLU A 105 -13.294 4.923 -10.740 1.00 0.00 O ATOM 607 CB GLU A 105 -14.659 2.258 -12.065 1.00 0.00 C ATOM 608 CG GLU A 105 -14.229 1.827 -13.464 1.00 0.00 C ATOM 609 CD GLU A 105 -13.516 2.986 -14.168 1.00 0.00 C ATOM 610 OE1 GLU A 105 -14.246 3.863 -14.689 1.00 0.00 O ATOM 611 OE2 GLU A 105 -12.268 3.006 -14.114 1.00 0.00 O ATOM 0 H GLU A 105 -13.065 0.507 -11.163 1.00 0.00 H new ATOM 0 HA GLU A 105 -12.546 2.874 -11.724 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.254 1.469 -11.605 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.296 3.140 -12.133 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -13.566 0.964 -13.401 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -15.099 1.518 -14.043 1.00 0.00 H new ATOM 612 N ASN A 106 -14.386 3.621 -9.241 1.00 0.00 N ATOM 613 CA ASN A 106 -14.670 4.607 -8.185 1.00 0.00 C ATOM 614 C ASN A 106 -13.477 5.193 -7.415 1.00 0.00 C ATOM 615 O ASN A 106 -13.574 5.513 -6.230 1.00 0.00 O ATOM 616 CB ASN A 106 -15.584 3.839 -7.224 1.00 0.00 C ATOM 617 CG ASN A 106 -16.968 3.681 -7.827 1.00 0.00 C ATOM 618 OD1 ASN A 106 -17.245 2.791 -8.614 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.861 4.529 -7.401 1.00 0.00 N ATOM 0 H ASN A 106 -14.787 2.708 -9.027 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.091 5.499 -8.649 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.158 2.858 -7.012 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.652 4.369 -6.274 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.825 4.460 -7.726 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.596 5.262 -6.743 1.00 0.00 H new ATOM 620 N HIS A 107 -12.387 5.391 -8.150 1.00 0.00 N ATOM 621 CA HIS A 107 -11.094 5.951 -7.688 1.00 0.00 C ATOM 622 C HIS A 107 -10.370 5.086 -6.630 1.00 0.00 C ATOM 623 O HIS A 107 -9.281 5.442 -6.179 1.00 0.00 O ATOM 624 CB HIS A 107 -11.250 7.399 -7.187 1.00 0.00 C ATOM 625 CG HIS A 107 -12.077 8.286 -8.131 1.00 0.00 C ATOM 626 ND1 HIS A 107 -13.393 8.435 -8.060 1.00 0.00 N ATOM 627 CD2 HIS A 107 -11.657 8.914 -9.223 1.00 0.00 C ATOM 628 CE1 HIS A 107 -13.797 9.124 -9.114 1.00 0.00 C ATOM 629 NE2 HIS A 107 -12.723 9.427 -9.825 1.00 0.00 N ATOM 0 H HIS A 107 -12.368 5.156 -9.142 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.455 5.947 -8.571 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.723 7.387 -6.205 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -10.261 7.840 -7.059 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -10.634 8.993 -9.560 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.816 9.390 -9.351 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -12.715 9.965 -10.691 1.00 0.00 H new ATOM 630 N TYR A 108 -10.793 3.826 -6.556 1.00 0.00 N ATOM 631 CA TYR A 108 -10.281 2.849 -5.569 1.00 0.00 C ATOM 632 C TYR A 108 -9.231 1.945 -6.203 1.00 0.00 C ATOM 633 O TYR A 108 -9.482 0.882 -6.753 1.00 0.00 O ATOM 634 CB TYR A 108 -11.416 2.015 -4.994 1.00 0.00 C ATOM 635 CG TYR A 108 -12.280 2.798 -4.016 1.00 0.00 C ATOM 636 CD1 TYR A 108 -11.686 3.539 -2.971 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.683 2.764 -4.215 1.00 0.00 C ATOM 638 CE1 TYR A 108 -12.522 4.273 -2.108 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.506 3.496 -3.356 1.00 0.00 C ATOM 640 CZ TYR A 108 -13.910 4.247 -2.311 1.00 0.00 C ATOM 641 OH TYR A 108 -14.718 4.934 -1.473 1.00 0.00 O ATOM 0 H TYR A 108 -11.504 3.442 -7.178 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.816 3.405 -4.755 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.039 1.645 -5.808 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -11.001 1.143 -4.489 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -10.614 3.543 -2.837 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -14.109 2.181 -5.018 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -12.099 4.850 -1.299 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.578 3.490 -3.485 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.651 4.816 -1.748 1.00 0.00 H new ATOM 642 N ASN A 109 -8.021 2.453 -6.080 1.00 0.00 N ATOM 643 CA ASN A 109 -6.827 1.848 -6.687 1.00 0.00 C ATOM 644 C ASN A 109 -6.273 0.675 -5.892 1.00 0.00 C ATOM 645 O ASN A 109 -5.832 0.806 -4.750 1.00 0.00 O ATOM 646 CB ASN A 109 -5.773 2.920 -6.893 1.00 0.00 C ATOM 647 CG ASN A 109 -5.474 3.043 -8.391 1.00 0.00 C ATOM 648 OD1 ASN A 109 -5.193 2.075 -9.090 1.00 0.00 O ATOM 649 ND2 ASN A 109 -5.558 4.241 -8.917 1.00 0.00 N ATOM 0 H ASN A 109 -7.825 3.304 -5.554 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.123 1.430 -7.649 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -6.124 3.874 -6.499 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -4.865 2.665 -6.347 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -5.389 4.373 -9.914 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -5.792 5.041 -8.329 1.00 0.00 H new ATOM 650 N THR A 110 -6.626 -0.470 -6.428 1.00 0.00 N ATOM 651 CA THR A 110 -6.165 -1.795 -5.989 1.00 0.00 C ATOM 652 C THR A 110 -4.821 -2.065 -6.674 1.00 0.00 C ATOM 653 O THR A 110 -4.592 -1.666 -7.813 1.00 0.00 O ATOM 654 CB THR A 110 -7.273 -2.777 -6.341 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.774 -2.462 -7.647 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.413 -2.694 -5.327 1.00 0.00 C ATOM 0 H THR A 110 -7.270 -0.521 -7.217 1.00 0.00 H new ATOM 0 HA THR A 110 -5.984 -1.883 -4.918 1.00 0.00 H new ATOM 0 HB THR A 110 -6.869 -3.789 -6.323 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.674 -2.082 -7.569 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.194 -3.405 -5.598 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.034 -2.933 -4.333 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.825 -1.685 -5.325 1.00 0.00 H new ATOM 657 N TYR A 111 -3.912 -2.687 -5.924 1.00 0.00 N ATOM 658 CA TYR A 111 -2.485 -2.670 -6.275 1.00 0.00 C ATOM 659 C TYR A 111 -1.724 -4.000 -6.145 1.00 0.00 C ATOM 660 O TYR A 111 -1.154 -4.284 -5.090 1.00 0.00 O ATOM 661 CB TYR A 111 -1.762 -1.593 -5.465 1.00 0.00 C ATOM 662 CG TYR A 111 -2.240 -0.179 -5.754 1.00 0.00 C ATOM 663 CD1 TYR A 111 -2.018 0.381 -7.040 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.641 0.607 -4.655 1.00 0.00 C ATOM 665 CE1 TYR A 111 -2.169 1.774 -7.196 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.790 1.989 -4.819 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.544 2.555 -6.082 1.00 0.00 C ATOM 668 OH TYR A 111 -2.675 3.894 -6.187 1.00 0.00 O ATOM 0 H TYR A 111 -4.132 -3.207 -5.074 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.481 -2.454 -7.343 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.895 -1.801 -4.403 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.693 -1.654 -5.671 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.741 -0.244 -7.876 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.831 0.148 -3.696 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -2.000 2.238 -8.157 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.089 2.611 -3.988 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.924 4.268 -5.316 1.00 0.00 H new ATOM 669 N ILE A 112 -1.610 -4.720 -7.263 1.00 0.00 N ATOM 670 CA ILE A 112 -0.786 -5.954 -7.305 1.00 0.00 C ATOM 671 C ILE A 112 0.688 -5.569 -7.181 1.00 0.00 C ATOM 672 O ILE A 112 1.248 -4.903 -8.049 1.00 0.00 O ATOM 673 CB ILE A 112 -0.927 -6.800 -8.593 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.358 -7.257 -8.867 1.00 0.00 C ATOM 675 CG2 ILE A 112 0.021 -8.008 -8.665 1.00 0.00 C ATOM 676 CD1 ILE A 112 -2.974 -8.194 -7.813 1.00 0.00 C ATOM 0 H ILE A 112 -2.066 -4.484 -8.144 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.149 -6.566 -6.480 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.630 -6.103 -9.377 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -2.991 -6.374 -8.955 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.380 -7.763 -9.832 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.144 -8.545 -9.599 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.054 -7.663 -8.623 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.174 -8.674 -7.824 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.990 -8.455 -8.108 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.374 -9.101 -7.737 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -2.995 -7.691 -6.846 1.00 0.00 H new ATOM 677 N SER A 113 1.292 -6.238 -6.218 1.00 0.00 N ATOM 678 CA SER A 113 2.755 -6.320 -6.066 1.00 0.00 C ATOM 679 C SER A 113 3.318 -7.079 -7.267 1.00 0.00 C ATOM 680 O SER A 113 3.021 -8.258 -7.466 1.00 0.00 O ATOM 681 CB SER A 113 3.112 -7.066 -4.791 1.00 0.00 C ATOM 682 OG SER A 113 4.510 -6.939 -4.550 1.00 0.00 O ATOM 0 H SER A 113 0.782 -6.753 -5.500 1.00 0.00 H new ATOM 0 HA SER A 113 3.175 -5.316 -6.012 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.548 -6.663 -3.950 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.841 -8.118 -4.883 1.00 0.00 H new ATOM 0 HG SER A 113 4.677 -6.142 -4.004 1.00 0.00 H new ATOM 683 N LYS A 114 4.025 -6.339 -8.126 1.00 0.00 N ATOM 684 CA LYS A 114 4.666 -6.910 -9.322 1.00 0.00 C ATOM 685 C LYS A 114 5.428 -8.227 -9.081 1.00 0.00 C ATOM 686 O LYS A 114 5.176 -9.192 -9.790 1.00 0.00 O ATOM 687 CB LYS A 114 5.574 -5.869 -9.981 1.00 0.00 C ATOM 688 CG LYS A 114 4.750 -4.731 -10.581 1.00 0.00 C ATOM 689 CD LYS A 114 3.923 -5.185 -11.779 1.00 0.00 C ATOM 690 CE LYS A 114 4.808 -5.355 -13.013 1.00 0.00 C ATOM 691 NZ LYS A 114 4.077 -6.140 -14.009 1.00 0.00 N ATOM 0 H LYS A 114 4.171 -5.335 -8.017 1.00 0.00 H new ATOM 0 HA LYS A 114 3.851 -7.176 -9.995 1.00 0.00 H new ATOM 0 HB2 LYS A 114 6.271 -5.470 -9.244 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.171 -6.342 -10.761 1.00 0.00 H new ATOM 0 HG2 LYS A 114 4.087 -4.324 -9.818 1.00 0.00 H new ATOM 0 HG3 LYS A 114 5.417 -3.925 -10.887 1.00 0.00 H new ATOM 0 HD2 LYS A 114 3.427 -6.128 -11.548 1.00 0.00 H new ATOM 0 HD3 LYS A 114 3.140 -4.455 -11.985 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.077 -4.381 -13.422 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.738 -5.856 -12.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 4.668 -6.264 -14.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 3.842 -7.072 -13.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 3.201 -5.643 -14.268 1.00 0.00 H new ATOM 692 N LYS A 115 6.136 -8.312 -7.957 1.00 0.00 N ATOM 693 CA LYS A 115 6.828 -9.562 -7.602 1.00 0.00 C ATOM 694 C LYS A 115 5.856 -10.687 -7.179 1.00 0.00 C ATOM 695 O LYS A 115 5.873 -11.763 -7.762 1.00 0.00 O ATOM 696 CB LYS A 115 7.984 -9.331 -6.628 1.00 0.00 C ATOM 697 CG LYS A 115 7.656 -9.387 -5.118 1.00 0.00 C ATOM 698 CD LYS A 115 8.543 -10.382 -4.368 1.00 0.00 C ATOM 699 CE LYS A 115 8.181 -11.826 -4.691 1.00 0.00 C ATOM 700 NZ LYS A 115 9.377 -12.610 -5.039 1.00 0.00 N ATOM 0 H LYS A 115 6.249 -7.552 -7.286 1.00 0.00 H new ATOM 0 HA LYS A 115 7.295 -9.933 -8.514 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.754 -10.075 -6.835 1.00 0.00 H new ATOM 0 HB3 LYS A 115 8.418 -8.355 -6.844 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.780 -8.395 -4.684 1.00 0.00 H new ATOM 0 HG3 LYS A 115 6.610 -9.664 -4.986 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.587 -10.203 -4.626 1.00 0.00 H new ATOM 0 HD3 LYS A 115 8.447 -10.216 -3.295 1.00 0.00 H new ATOM 0 HE2 LYS A 115 7.683 -12.279 -3.834 1.00 0.00 H new ATOM 0 HE3 LYS A 115 7.474 -11.850 -5.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.100 -13.589 -5.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 9.838 -12.190 -5.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.040 -12.606 -4.238 1.00 0.00 H new ATOM 701 N HIS A 116 4.882 -10.334 -6.339 1.00 0.00 N ATOM 702 CA HIS A 116 3.853 -11.283 -5.877 1.00 0.00 C ATOM 703 C HIS A 116 2.669 -11.407 -6.845 1.00 0.00 C ATOM 704 O HIS A 116 1.617 -11.925 -6.469 1.00 0.00 O ATOM 705 CB HIS A 116 3.365 -10.872 -4.483 1.00 0.00 C ATOM 706 CG HIS A 116 4.500 -10.768 -3.470 1.00 0.00 C ATOM 707 ND1 HIS A 116 4.880 -9.647 -2.884 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.240 -11.760 -2.986 1.00 0.00 C ATOM 709 CE1 HIS A 116 5.834 -9.939 -2.016 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.062 -11.240 -2.081 1.00 0.00 N ATOM 0 H HIS A 116 4.779 -9.393 -5.959 1.00 0.00 H new ATOM 0 HA HIS A 116 4.318 -12.268 -5.835 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.854 -9.912 -4.550 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.633 -11.599 -4.130 1.00 0.00 H new ATOM 0 HD1 HIS A 116 4.503 -8.717 -3.069 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.184 -12.799 -3.275 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.338 -9.238 -1.368 1.00 0.00 H new ATOM 711 N ALA A 117 2.937 -11.192 -8.144 1.00 0.00 N ATOM 712 CA ALA A 117 1.952 -11.398 -9.215 1.00 0.00 C ATOM 713 C ALA A 117 1.512 -12.872 -9.270 1.00 0.00 C ATOM 714 O ALA A 117 0.326 -13.160 -9.340 1.00 0.00 O ATOM 715 CB ALA A 117 2.517 -10.978 -10.570 1.00 0.00 C ATOM 0 H ALA A 117 3.845 -10.870 -8.480 1.00 0.00 H new ATOM 0 HA ALA A 117 1.086 -10.775 -8.992 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.767 -11.141 -11.344 1.00 0.00 H new ATOM 0 HB2 ALA A 117 2.784 -9.922 -10.541 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.404 -11.571 -10.794 1.00 0.00 H new ATOM 716 N GLU A 118 2.452 -13.764 -8.934 1.00 0.00 N ATOM 717 CA GLU A 118 2.167 -15.205 -8.836 1.00 0.00 C ATOM 718 C GLU A 118 1.354 -15.670 -7.613 1.00 0.00 C ATOM 719 O GLU A 118 1.089 -16.858 -7.444 1.00 0.00 O ATOM 720 CB GLU A 118 3.474 -15.986 -8.981 1.00 0.00 C ATOM 721 CG GLU A 118 4.462 -15.556 -7.902 1.00 0.00 C ATOM 722 CD GLU A 118 5.903 -15.818 -8.313 1.00 0.00 C ATOM 723 OE1 GLU A 118 6.297 -15.246 -9.356 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.573 -16.546 -7.559 1.00 0.00 O ATOM 0 H GLU A 118 3.419 -13.515 -8.725 1.00 0.00 H new ATOM 0 HA GLU A 118 1.488 -15.422 -9.661 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.279 -17.055 -8.901 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.903 -15.813 -9.968 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.332 -14.494 -7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.245 -16.091 -6.978 1.00 0.00 H new ATOM 725 N LYS A 119 1.079 -14.720 -6.717 1.00 0.00 N ATOM 726 CA LYS A 119 0.219 -14.871 -5.533 1.00 0.00 C ATOM 727 C LYS A 119 -0.997 -13.918 -5.521 1.00 0.00 C ATOM 728 O LYS A 119 -1.879 -14.093 -4.695 1.00 0.00 O ATOM 729 CB LYS A 119 1.092 -14.619 -4.299 1.00 0.00 C ATOM 730 CG LYS A 119 1.864 -15.875 -3.902 1.00 0.00 C ATOM 731 CD LYS A 119 3.238 -15.522 -3.340 1.00 0.00 C ATOM 732 CE LYS A 119 4.191 -15.102 -4.453 1.00 0.00 C ATOM 733 NZ LYS A 119 5.532 -14.845 -3.907 1.00 0.00 N ATOM 0 H LYS A 119 1.466 -13.780 -6.797 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.199 -15.878 -5.542 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.792 -13.809 -4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.466 -14.296 -3.467 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.296 -16.434 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 119 1.979 -16.524 -4.770 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.142 -14.714 -2.615 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.649 -16.380 -2.809 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.243 -15.884 -5.211 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.814 -14.206 -4.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.982 -14.073 -4.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.453 -14.575 -2.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.111 -15.705 -3.989 1.00 0.00 H new ATOM 734 N ASN A 120 -1.008 -12.936 -6.434 1.00 0.00 N ATOM 735 CA ASN A 120 -2.021 -11.862 -6.570 1.00 0.00 C ATOM 736 C ASN A 120 -2.143 -10.905 -5.373 1.00 0.00 C ATOM 737 O ASN A 120 -3.173 -10.259 -5.172 1.00 0.00 O ATOM 738 CB ASN A 120 -3.399 -12.454 -6.903 1.00 0.00 C ATOM 739 CG ASN A 120 -3.482 -13.039 -8.317 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.939 -12.429 -9.276 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.199 -14.321 -8.458 1.00 0.00 N ATOM 0 H ASN A 120 -0.274 -12.859 -7.138 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.652 -11.249 -7.392 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.636 -13.235 -6.180 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -4.156 -11.678 -6.793 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.362 -14.784 -9.352 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -2.818 -14.848 -7.673 1.00 0.00 H new ATOM 742 N TRP A 121 -1.025 -10.703 -4.685 1.00 0.00 N ATOM 743 CA TRP A 121 -1.007 -9.845 -3.484 1.00 0.00 C ATOM 744 C TRP A 121 -1.087 -8.346 -3.740 1.00 0.00 C ATOM 745 O TRP A 121 -0.164 -7.735 -4.294 1.00 0.00 O ATOM 746 CB TRP A 121 0.217 -10.128 -2.604 1.00 0.00 C ATOM 747 CG TRP A 121 0.198 -11.518 -1.972 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.802 -12.380 -1.945 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.270 -12.082 -1.293 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.412 -13.494 -1.319 1.00 0.00 N ATOM 751 CE2 TRP A 121 0.840 -13.354 -0.883 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.542 -11.591 -0.946 1.00 0.00 C ATOM 753 CZ2 TRP A 121 1.675 -14.164 -0.080 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.402 -12.418 -0.196 1.00 0.00 C ATOM 755 CH2 TRP A 121 2.951 -13.675 0.258 1.00 0.00 C ATOM 0 H TRP A 121 -0.123 -11.113 -4.927 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.929 -10.120 -2.971 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.120 -10.022 -3.205 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.270 -9.378 -1.815 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.783 -12.211 -2.364 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -0.987 -14.327 -1.193 1.00 0.00 H new ATOM 0 HE3 TRP A 121 2.853 -10.602 -1.248 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.343 -15.132 0.265 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.406 -12.090 0.031 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.599 -14.276 0.879 1.00 0.00 H new ATOM 756 N PHE A 122 -2.197 -7.790 -3.264 1.00 0.00 N ATOM 757 CA PHE A 122 -2.409 -6.342 -3.265 1.00 0.00 C ATOM 758 C PHE A 122 -2.008 -5.770 -1.914 1.00 0.00 C ATOM 759 O PHE A 122 -2.008 -6.472 -0.905 1.00 0.00 O ATOM 760 CB PHE A 122 -3.875 -5.935 -3.471 1.00 0.00 C ATOM 761 CG PHE A 122 -4.588 -6.574 -4.667 1.00 0.00 C ATOM 762 CD1 PHE A 122 -5.060 -7.896 -4.588 1.00 0.00 C ATOM 763 CD2 PHE A 122 -4.905 -5.750 -5.773 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.874 -8.410 -5.614 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.741 -6.260 -6.799 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.217 -7.581 -6.711 1.00 0.00 C ATOM 0 H PHE A 122 -2.971 -8.324 -2.869 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.810 -5.960 -4.092 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.431 -6.184 -2.567 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -3.918 -4.852 -3.584 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.799 -8.515 -3.742 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.515 -4.745 -5.835 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.234 -9.427 -5.566 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.010 -5.639 -7.641 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.854 -7.969 -7.492 1.00 0.00 H new ATOM 767 N VAL A 123 -1.624 -4.490 -1.932 1.00 0.00 N ATOM 768 CA VAL A 123 -1.449 -3.733 -0.673 1.00 0.00 C ATOM 769 C VAL A 123 -2.793 -3.574 0.060 1.00 0.00 C ATOM 770 O VAL A 123 -3.838 -3.423 -0.578 1.00 0.00 O ATOM 771 CB VAL A 123 -0.776 -2.359 -0.792 1.00 0.00 C ATOM 772 CG1 VAL A 123 0.664 -2.540 -1.214 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.445 -1.371 -1.735 1.00 0.00 C ATOM 0 H VAL A 123 -1.430 -3.959 -2.781 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.752 -4.347 -0.103 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.866 -1.918 0.201 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.144 -1.565 -1.299 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.189 -3.139 -0.470 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.700 -3.047 -2.178 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.885 -0.436 -1.740 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.466 -1.787 -2.742 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -2.465 -1.181 -1.400 1.00 0.00 H new ATOM 774 N GLY A 124 -2.688 -3.373 1.363 1.00 0.00 N ATOM 775 CA GLY A 124 -3.869 -3.284 2.242 1.00 0.00 C ATOM 776 C GLY A 124 -3.561 -2.674 3.586 1.00 0.00 C ATOM 777 O GLY A 124 -2.413 -2.525 4.003 1.00 0.00 O ATOM 0 H GLY A 124 -1.797 -3.266 1.849 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.638 -2.691 1.748 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -4.282 -4.282 2.389 1.00 0.00 H new ATOM 778 N LEU A 125 -4.624 -2.017 4.006 1.00 0.00 N ATOM 779 CA LEU A 125 -4.724 -1.398 5.323 1.00 0.00 C ATOM 780 C LEU A 125 -5.355 -2.395 6.275 1.00 0.00 C ATOM 781 O LEU A 125 -6.457 -2.895 6.059 1.00 0.00 O ATOM 782 CB LEU A 125 -5.515 -0.103 5.194 1.00 0.00 C ATOM 783 CG LEU A 125 -4.575 1.096 5.073 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.562 0.964 3.956 1.00 0.00 C ATOM 785 CD2 LEU A 125 -5.385 2.383 4.890 1.00 0.00 C ATOM 0 H LEU A 125 -5.460 -1.893 3.435 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.747 -1.137 5.728 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -6.163 -0.153 4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.161 0.022 6.063 1.00 0.00 H new ATOM 0 HG LEU A 125 -4.008 1.134 6.003 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.930 1.852 3.931 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.944 0.083 4.128 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -4.082 0.862 3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.706 3.231 4.805 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.987 2.308 3.985 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -6.039 2.527 5.750 1.00 0.00 H new ATOM 786 N LYS A 126 -4.478 -2.896 7.129 1.00 0.00 N ATOM 787 CA LYS A 126 -4.868 -3.920 8.092 1.00 0.00 C ATOM 788 C LYS A 126 -5.826 -3.300 9.145 1.00 0.00 C ATOM 789 O LYS A 126 -5.417 -2.456 9.948 1.00 0.00 O ATOM 790 CB LYS A 126 -3.610 -4.490 8.765 1.00 0.00 C ATOM 791 CG LYS A 126 -3.634 -5.997 9.082 1.00 0.00 C ATOM 792 CD LYS A 126 -4.725 -6.433 10.082 1.00 0.00 C ATOM 793 CE LYS A 126 -4.696 -5.646 11.388 1.00 0.00 C ATOM 794 NZ LYS A 126 -3.499 -5.937 12.187 1.00 0.00 N ATOM 0 H LYS A 126 -3.499 -2.615 7.178 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.390 -4.732 7.585 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.755 -4.289 8.120 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -3.442 -3.947 9.695 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -3.774 -6.547 8.151 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.661 -6.285 9.480 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -5.703 -6.314 9.616 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -4.603 -7.494 10.302 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -4.733 -4.579 11.168 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -5.586 -5.882 11.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -3.707 -5.779 13.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -3.218 -6.928 12.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -2.723 -5.311 11.891 1.00 0.00 H new ATOM 795 N LYS A 127 -7.041 -3.845 9.148 1.00 0.00 N ATOM 796 CA LYS A 127 -8.268 -3.314 9.793 1.00 0.00 C ATOM 797 C LYS A 127 -8.338 -3.104 11.322 1.00 0.00 C ATOM 798 O LYS A 127 -9.412 -2.931 11.896 1.00 0.00 O ATOM 799 CB LYS A 127 -9.476 -4.175 9.388 1.00 0.00 C ATOM 800 CG LYS A 127 -10.034 -3.840 8.005 1.00 0.00 C ATOM 801 CD LYS A 127 -9.305 -4.559 6.871 1.00 0.00 C ATOM 802 CE LYS A 127 -9.682 -6.035 6.826 1.00 0.00 C ATOM 803 NZ LYS A 127 -8.918 -6.708 5.773 1.00 0.00 N ATOM 0 H LYS A 127 -7.220 -4.729 8.671 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.262 -2.293 9.412 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -9.185 -5.225 9.408 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -10.266 -4.049 10.129 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -11.091 -4.104 7.973 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -9.969 -2.764 7.845 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -9.552 -4.088 5.919 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -8.228 -4.459 7.006 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.480 -6.501 7.790 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -10.750 -6.142 6.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -8.850 -7.723 5.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -9.398 -6.579 4.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -7.963 -6.300 5.723 1.00 0.00 H new ATOM 804 N ASN A 128 -7.182 -2.902 11.916 1.00 0.00 N ATOM 805 CA ASN A 128 -7.002 -2.702 13.358 1.00 0.00 C ATOM 806 C ASN A 128 -6.095 -1.518 13.685 1.00 0.00 C ATOM 807 O ASN A 128 -6.189 -0.956 14.776 1.00 0.00 O ATOM 808 CB ASN A 128 -6.370 -3.956 13.955 1.00 0.00 C ATOM 809 CG ASN A 128 -7.351 -5.117 13.993 1.00 0.00 C ATOM 810 OD1 ASN A 128 -7.379 -5.997 13.151 1.00 0.00 O ATOM 811 ND2 ASN A 128 -8.213 -5.130 14.990 1.00 0.00 N ATOM 0 H ASN A 128 -6.303 -2.869 11.399 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.987 -2.499 13.778 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.496 -4.237 13.368 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -6.020 -3.742 14.965 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -8.904 -5.877 15.057 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.189 -4.393 15.695 1.00 0.00 H new ATOM 812 N GLY A 129 -5.160 -1.243 12.772 1.00 0.00 N ATOM 813 CA GLY A 129 -4.147 -0.224 13.037 1.00 0.00 C ATOM 814 C GLY A 129 -2.954 -0.215 12.084 1.00 0.00 C ATOM 815 O GLY A 129 -2.408 0.844 11.814 1.00 0.00 O ATOM 0 H GLY A 129 -5.085 -1.701 11.864 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.625 0.755 13.002 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.776 -0.361 14.053 1.00 0.00 H new ATOM 816 N SER A 130 -2.582 -1.380 11.557 1.00 0.00 N ATOM 817 CA SER A 130 -1.398 -1.480 10.691 1.00 0.00 C ATOM 818 C SER A 130 -1.738 -1.567 9.200 1.00 0.00 C ATOM 819 O SER A 130 -2.806 -1.121 8.774 1.00 0.00 O ATOM 820 CB SER A 130 -0.570 -2.672 11.176 1.00 0.00 C ATOM 821 OG SER A 130 -1.350 -3.867 11.062 1.00 0.00 O ATOM 0 H SER A 130 -3.073 -2.261 11.709 1.00 0.00 H new ATOM 0 HA SER A 130 -0.816 -0.562 10.772 1.00 0.00 H new ATOM 0 HB2 SER A 130 0.341 -2.761 10.585 1.00 0.00 H new ATOM 0 HB3 SER A 130 -0.265 -2.520 12.211 1.00 0.00 H new ATOM 0 HG SER A 130 -1.092 -4.350 10.249 1.00 0.00 H new ATOM 822 N CYS A 131 -0.726 -1.845 8.381 1.00 0.00 N ATOM 823 CA CYS A 131 -0.941 -2.058 6.934 1.00 0.00 C ATOM 824 C CYS A 131 -0.508 -3.478 6.548 1.00 0.00 C ATOM 825 O CYS A 131 -1.336 -4.291 6.160 1.00 0.00 O ATOM 826 CB CYS A 131 -0.222 -1.026 6.068 1.00 0.00 C ATOM 827 SG CYS A 131 -1.031 0.612 6.091 1.00 0.00 S ATOM 0 H CYS A 131 0.245 -1.929 8.681 1.00 0.00 H new ATOM 0 HA CYS A 131 -2.007 -1.932 6.744 1.00 0.00 H new ATOM 0 HB2 CYS A 131 0.806 -0.922 6.414 1.00 0.00 H new ATOM 0 HB3 CYS A 131 -0.178 -1.389 5.041 1.00 0.00 H new ATOM 0 HG CYS A 131 -1.944 0.632 7.017 1.00 0.00 H new ATOM 828 N LYS A 132 0.779 -3.726 6.801 1.00 0.00 N ATOM 829 CA LYS A 132 1.486 -5.011 6.639 1.00 0.00 C ATOM 830 C LYS A 132 0.690 -6.278 6.311 1.00 0.00 C ATOM 831 O LYS A 132 0.404 -7.131 7.160 1.00 0.00 O ATOM 832 CB LYS A 132 2.443 -5.195 7.822 1.00 0.00 C ATOM 833 CG LYS A 132 1.727 -5.085 9.171 1.00 0.00 C ATOM 834 CD LYS A 132 1.969 -6.307 10.039 1.00 0.00 C ATOM 835 CE LYS A 132 1.127 -6.155 11.297 1.00 0.00 C ATOM 836 NZ LYS A 132 1.363 -7.315 12.155 1.00 0.00 N ATOM 0 H LYS A 132 1.399 -2.993 7.146 1.00 0.00 H new ATOM 0 HA LYS A 132 2.017 -4.903 5.693 1.00 0.00 H new ATOM 0 HB2 LYS A 132 2.926 -6.169 7.748 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.231 -4.444 7.769 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.072 -4.193 9.694 1.00 0.00 H new ATOM 0 HG3 LYS A 132 0.657 -4.963 9.006 1.00 0.00 H new ATOM 0 HD2 LYS A 132 1.696 -7.216 9.504 1.00 0.00 H new ATOM 0 HD3 LYS A 132 3.025 -6.392 10.294 1.00 0.00 H new ATOM 0 HE2 LYS A 132 1.391 -5.236 11.821 1.00 0.00 H new ATOM 0 HE3 LYS A 132 0.070 -6.083 11.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 0.794 -7.228 13.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 1.092 -8.182 11.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.371 -7.362 12.406 1.00 0.00 H new ATOM 837 N ARG A 133 0.422 -6.406 5.018 1.00 0.00 N ATOM 838 CA ARG A 133 -0.241 -7.591 4.488 1.00 0.00 C ATOM 839 C ARG A 133 0.097 -7.985 3.039 1.00 0.00 C ATOM 840 O ARG A 133 0.953 -7.373 2.394 1.00 0.00 O ATOM 841 CB ARG A 133 -1.752 -7.401 4.681 1.00 0.00 C ATOM 842 CG ARG A 133 -2.503 -8.716 4.945 1.00 0.00 C ATOM 843 CD ARG A 133 -2.321 -9.272 6.357 1.00 0.00 C ATOM 844 NE ARG A 133 -1.143 -10.166 6.396 1.00 0.00 N ATOM 845 CZ ARG A 133 -1.155 -11.485 6.561 1.00 0.00 C ATOM 846 NH1 ARG A 133 -2.253 -12.148 6.931 1.00 0.00 N ATOM 847 NH2 ARG A 133 -0.024 -12.159 6.483 1.00 0.00 N ATOM 0 H ARG A 133 0.654 -5.703 4.316 1.00 0.00 H new ATOM 0 HA ARG A 133 0.145 -8.440 5.052 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.922 -6.720 5.515 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.168 -6.926 3.792 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.566 -8.556 4.764 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -2.166 -9.464 4.227 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -2.192 -8.454 7.066 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -3.214 -9.819 6.660 1.00 0.00 H new ATOM 0 HE ARG A 133 -0.229 -9.726 6.285 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -3.123 -11.642 7.097 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -2.222 -13.161 7.047 1.00 0.00 H new ATOM 0 HH21 ARG A 133 0.851 -11.668 6.297 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -0.024 -13.171 6.608 1.00 0.00 H new ATOM 848 N GLY A 134 -0.314 -9.215 2.754 1.00 0.00 N ATOM 849 CA GLY A 134 -0.156 -9.906 1.453 1.00 0.00 C ATOM 850 C GLY A 134 -1.259 -10.948 1.201 1.00 0.00 C ATOM 851 O GLY A 134 -2.204 -10.645 0.472 1.00 0.00 O ATOM 0 H GLY A 134 -0.789 -9.795 3.446 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.167 -9.169 0.650 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.817 -10.397 1.422 1.00 0.00 H new ATOM 852 N PRO A 135 -1.198 -12.140 1.816 1.00 0.00 N ATOM 853 CA PRO A 135 -2.051 -13.285 1.422 1.00 0.00 C ATOM 854 C PRO A 135 -3.541 -13.188 1.716 1.00 0.00 C ATOM 855 O PRO A 135 -4.357 -13.756 1.000 1.00 0.00 O ATOM 856 CB PRO A 135 -1.328 -14.495 2.014 1.00 0.00 C ATOM 857 CG PRO A 135 -0.747 -13.960 3.314 1.00 0.00 C ATOM 858 CD PRO A 135 -0.383 -12.510 2.984 1.00 0.00 C ATOM 0 HA PRO A 135 -2.140 -13.343 0.337 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.013 -15.324 2.192 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.548 -14.863 1.347 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.470 -14.015 4.128 1.00 0.00 H new ATOM 0 HG3 PRO A 135 0.128 -14.531 3.626 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.592 -11.854 3.829 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.680 -12.416 2.763 1.00 0.00 H new ATOM 859 N ARG A 136 -3.873 -12.408 2.727 1.00 0.00 N ATOM 860 CA ARG A 136 -5.261 -12.066 3.065 1.00 0.00 C ATOM 861 C ARG A 136 -5.844 -11.055 2.051 1.00 0.00 C ATOM 862 O ARG A 136 -6.990 -11.195 1.611 1.00 0.00 O ATOM 863 CB ARG A 136 -5.181 -11.430 4.438 1.00 0.00 C ATOM 864 CG ARG A 136 -6.561 -11.236 5.057 1.00 0.00 C ATOM 865 CD ARG A 136 -6.447 -10.066 6.011 1.00 0.00 C ATOM 866 NE ARG A 136 -7.716 -9.881 6.721 1.00 0.00 N ATOM 867 CZ ARG A 136 -7.816 -9.387 7.952 1.00 0.00 C ATOM 868 NH1 ARG A 136 -6.756 -8.949 8.616 1.00 0.00 N ATOM 869 NH2 ARG A 136 -8.996 -9.172 8.524 1.00 0.00 N ATOM 0 H ARG A 136 -3.186 -11.984 3.350 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.908 -12.943 3.044 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -4.574 -12.055 5.093 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.678 -10.466 4.363 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -7.306 -11.037 4.287 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.879 -12.136 5.584 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -5.643 -10.244 6.725 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -6.191 -9.160 5.461 1.00 0.00 H new ATOM 0 HE ARG A 136 -8.576 -10.148 6.241 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -5.833 -8.986 8.184 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -6.863 -8.575 9.559 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -9.855 -9.387 8.018 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -9.043 -8.792 9.470 1.00 0.00 H new ATOM 870 N THR A 137 -5.005 -10.118 1.640 1.00 0.00 N ATOM 871 CA THR A 137 -5.391 -8.948 0.829 1.00 0.00 C ATOM 872 C THR A 137 -5.504 -9.254 -0.668 1.00 0.00 C ATOM 873 O THR A 137 -4.582 -9.055 -1.454 1.00 0.00 O ATOM 874 CB THR A 137 -4.450 -7.762 1.071 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.091 -8.192 1.146 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.900 -6.964 2.291 1.00 0.00 C ATOM 0 H THR A 137 -4.009 -10.140 1.860 1.00 0.00 H new ATOM 0 HA THR A 137 -6.391 -8.674 1.165 1.00 0.00 H new ATOM 0 HB THR A 137 -4.503 -7.085 0.219 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.988 -9.037 0.661 1.00 0.00 H new ATOM 0 HG21 THR A 137 -4.221 -6.126 2.448 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.910 -6.587 2.127 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.891 -7.608 3.170 1.00 0.00 H new ATOM 877 N HIS A 138 -6.686 -9.771 -0.978 1.00 0.00 N ATOM 878 CA HIS A 138 -7.119 -10.001 -2.364 1.00 0.00 C ATOM 879 C HIS A 138 -8.398 -9.206 -2.702 1.00 0.00 C ATOM 880 O HIS A 138 -9.067 -8.667 -1.810 1.00 0.00 O ATOM 881 CB HIS A 138 -7.340 -11.493 -2.645 1.00 0.00 C ATOM 882 CG HIS A 138 -8.447 -12.112 -1.788 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.754 -11.908 -1.888 1.00 0.00 N ATOM 884 CD2 HIS A 138 -8.242 -12.957 -0.781 1.00 0.00 C ATOM 885 CE1 HIS A 138 -10.368 -12.633 -0.961 1.00 0.00 C ATOM 886 NE2 HIS A 138 -9.427 -13.283 -0.282 1.00 0.00 N ATOM 0 H HIS A 138 -7.377 -10.045 -0.280 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.314 -9.644 -3.006 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.589 -11.625 -3.698 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.409 -12.031 -2.468 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -10.211 -11.296 -2.564 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -7.284 -13.313 -0.433 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.433 -12.685 -0.790 1.00 0.00 H new ATOM 887 N TYR A 139 -8.629 -9.076 -3.996 1.00 0.00 N ATOM 888 CA TYR A 139 -9.877 -8.536 -4.569 1.00 0.00 C ATOM 889 C TYR A 139 -11.140 -9.057 -3.860 1.00 0.00 C ATOM 890 O TYR A 139 -11.316 -10.263 -3.713 1.00 0.00 O ATOM 891 CB TYR A 139 -9.965 -8.785 -6.072 1.00 0.00 C ATOM 892 CG TYR A 139 -10.026 -7.497 -6.913 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.413 -6.266 -6.334 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.569 -7.555 -8.253 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.291 -5.083 -7.081 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.447 -6.371 -9.000 1.00 0.00 C ATOM 897 CZ TYR A 139 -9.789 -5.139 -8.398 1.00 0.00 C ATOM 898 OH TYR A 139 -9.473 -3.981 -9.021 1.00 0.00 O ATOM 0 H TYR A 139 -7.947 -9.345 -4.705 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.837 -7.460 -4.400 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.101 -9.371 -6.385 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.850 -9.386 -6.280 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.799 -6.236 -5.326 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -9.315 -8.506 -8.699 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -10.580 -4.136 -6.650 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -9.096 -6.402 -10.021 1.00 0.00 H new ATOM 0 HH TYR A 139 -8.683 -3.586 -8.597 1.00 0.00 H new ATOM 899 N GLY A 140 -11.657 -8.122 -3.074 1.00 0.00 N ATOM 900 CA GLY A 140 -12.862 -8.346 -2.259 1.00 0.00 C ATOM 901 C GLY A 140 -12.698 -7.767 -0.848 1.00 0.00 C ATOM 902 O GLY A 140 -13.640 -7.182 -0.314 1.00 0.00 O ATOM 0 H GLY A 140 -11.261 -7.187 -2.978 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.723 -7.886 -2.745 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.066 -9.415 -2.194 1.00 0.00 H new ATOM 903 N GLN A 141 -11.499 -7.879 -0.273 1.00 0.00 N ATOM 904 CA GLN A 141 -11.175 -7.283 1.036 1.00 0.00 C ATOM 905 C GLN A 141 -11.300 -5.770 1.003 1.00 0.00 C ATOM 906 O GLN A 141 -10.641 -5.081 0.216 1.00 0.00 O ATOM 907 CB GLN A 141 -9.728 -7.590 1.423 1.00 0.00 C ATOM 908 CG GLN A 141 -9.385 -9.083 1.529 1.00 0.00 C ATOM 909 CD GLN A 141 -10.077 -9.840 2.658 1.00 0.00 C ATOM 910 OE1 GLN A 141 -10.546 -9.317 3.664 1.00 0.00 O ATOM 911 NE2 GLN A 141 -10.018 -11.148 2.564 1.00 0.00 N ATOM 0 H GLN A 141 -10.721 -8.384 -0.697 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.878 -7.710 1.752 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.067 -7.132 0.687 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.516 -7.115 2.381 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -9.639 -9.564 0.584 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.307 -9.182 1.657 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -9.628 -11.582 1.727 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -10.362 -11.730 3.328 1.00 0.00 H new ATOM 912 N LYS A 142 -11.987 -5.307 2.031 1.00 0.00 N ATOM 913 CA LYS A 142 -12.079 -3.874 2.363 1.00 0.00 C ATOM 914 C LYS A 142 -10.842 -3.388 3.122 1.00 0.00 C ATOM 915 O LYS A 142 -10.794 -3.229 4.344 1.00 0.00 O ATOM 916 CB LYS A 142 -13.393 -3.590 3.062 1.00 0.00 C ATOM 917 CG LYS A 142 -14.499 -3.618 2.021 1.00 0.00 C ATOM 918 CD LYS A 142 -15.724 -2.896 2.575 1.00 0.00 C ATOM 919 CE LYS A 142 -16.831 -2.771 1.526 1.00 0.00 C ATOM 920 NZ LYS A 142 -16.418 -1.877 0.432 1.00 0.00 N ATOM 0 H LYS A 142 -12.505 -5.909 2.671 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.083 -3.287 1.444 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -13.581 -4.334 3.836 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.359 -2.618 3.555 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.163 -3.138 1.102 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.752 -4.648 1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -16.104 -3.437 3.442 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -15.436 -1.903 2.920 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -17.071 -3.756 1.125 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -17.738 -2.387 1.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -17.249 -1.618 -0.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -15.989 -1.017 0.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -15.724 -2.364 -0.171 1.00 0.00 H new ATOM 921 N ALA A 143 -9.788 -3.582 2.360 1.00 0.00 N ATOM 922 CA ALA A 143 -8.382 -3.312 2.701 1.00 0.00 C ATOM 923 C ALA A 143 -7.557 -2.786 1.521 1.00 0.00 C ATOM 924 O ALA A 143 -6.717 -1.908 1.716 1.00 0.00 O ATOM 925 CB ALA A 143 -7.721 -4.593 3.213 1.00 0.00 C ATOM 0 H ALA A 143 -9.883 -3.959 1.417 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.399 -2.535 3.465 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.680 -4.390 3.465 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.247 -4.944 4.101 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.764 -5.359 2.439 1.00 0.00 H new ATOM 926 N ILE A 144 -7.887 -3.287 0.321 1.00 0.00 N ATOM 927 CA ILE A 144 -7.067 -3.088 -0.900 1.00 0.00 C ATOM 928 C ILE A 144 -7.484 -1.925 -1.827 1.00 0.00 C ATOM 929 O ILE A 144 -6.801 -1.663 -2.810 1.00 0.00 O ATOM 930 CB ILE A 144 -6.983 -4.396 -1.713 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.324 -4.838 -2.282 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.277 -5.466 -0.888 1.00 0.00 C ATOM 933 CD1 ILE A 144 -8.082 -5.657 -3.548 1.00 0.00 C ATOM 0 H ILE A 144 -8.728 -3.842 0.162 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.091 -2.797 -0.513 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.379 -4.212 -2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.867 -5.432 -1.547 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.942 -3.969 -2.508 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.218 -6.390 -1.464 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.271 -5.129 -0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.836 -5.646 0.030 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -9.038 -5.978 -3.962 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.555 -5.046 -4.281 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.480 -6.532 -3.305 1.00 0.00 H new ATOM 934 N LEU A 145 -8.482 -1.148 -1.423 1.00 0.00 N ATOM 935 CA LEU A 145 -9.129 -0.132 -2.291 1.00 0.00 C ATOM 936 C LEU A 145 -8.656 1.281 -1.930 1.00 0.00 C ATOM 937 O LEU A 145 -9.309 2.007 -1.176 1.00 0.00 O ATOM 938 CB LEU A 145 -10.657 -0.215 -2.141 1.00 0.00 C ATOM 939 CG LEU A 145 -11.308 -1.503 -2.619 1.00 0.00 C ATOM 940 CD1 LEU A 145 -11.308 -2.570 -1.520 1.00 0.00 C ATOM 941 CD2 LEU A 145 -12.780 -1.199 -2.938 1.00 0.00 C ATOM 0 H LEU A 145 -8.877 -1.194 -0.484 1.00 0.00 H new ATOM 0 HA LEU A 145 -8.848 -0.338 -3.324 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -10.906 -0.075 -1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.101 0.617 -2.688 1.00 0.00 H new ATOM 0 HG LEU A 145 -10.753 -1.868 -3.483 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -11.781 -3.478 -1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -10.282 -2.790 -1.226 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -11.862 -2.203 -0.656 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -13.272 -2.108 -3.284 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -13.279 -0.835 -2.040 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -12.834 -0.438 -3.717 1.00 0.00 H new ATOM 942 N PHE A 146 -7.509 1.665 -2.490 1.00 0.00 N ATOM 943 CA PHE A 146 -6.832 2.936 -2.132 1.00 0.00 C ATOM 944 C PHE A 146 -7.201 4.163 -2.953 1.00 0.00 C ATOM 945 O PHE A 146 -7.354 4.096 -4.161 1.00 0.00 O ATOM 946 CB PHE A 146 -5.309 2.766 -2.209 1.00 0.00 C ATOM 947 CG PHE A 146 -4.699 1.853 -1.147 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.181 0.535 -0.960 1.00 0.00 C ATOM 949 CD2 PHE A 146 -3.584 2.321 -0.425 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.543 -0.315 -0.038 1.00 0.00 C ATOM 951 CE2 PHE A 146 -2.933 1.468 0.493 1.00 0.00 C ATOM 952 CZ PHE A 146 -3.421 0.162 0.675 1.00 0.00 C ATOM 0 H PHE A 146 -7.018 1.119 -3.198 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.189 3.132 -1.121 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.053 2.373 -3.193 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.846 3.749 -2.129 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -6.034 0.184 -1.522 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -3.228 3.330 -0.573 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.907 -1.319 0.122 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -2.073 1.814 1.047 1.00 0.00 H new ATOM 0 HZ PHE A 146 -2.926 -0.492 1.377 1.00 0.00 H new ATOM 953 N LEU A 147 -7.222 5.313 -2.291 1.00 0.00 N ATOM 954 CA LEU A 147 -7.353 6.609 -2.977 1.00 0.00 C ATOM 955 C LEU A 147 -5.976 7.294 -3.063 1.00 0.00 C ATOM 956 O LEU A 147 -5.379 7.545 -2.024 1.00 0.00 O ATOM 957 CB LEU A 147 -8.323 7.510 -2.213 1.00 0.00 C ATOM 958 CG LEU A 147 -9.719 6.897 -2.282 1.00 0.00 C ATOM 959 CD1 LEU A 147 -10.424 7.217 -0.987 1.00 0.00 C ATOM 960 CD2 LEU A 147 -10.512 7.374 -3.497 1.00 0.00 C ATOM 0 H LEU A 147 -7.150 5.383 -1.276 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.738 6.439 -3.983 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.006 7.612 -1.175 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.328 8.511 -2.644 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.635 5.818 -2.408 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -11.427 6.792 -1.004 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -9.864 6.793 -0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -10.490 8.298 -0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -11.497 6.906 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -10.625 8.457 -3.455 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -9.981 7.099 -4.409 1.00 0.00 H new ATOM 961 N PRO A 148 -5.411 7.452 -4.272 1.00 0.00 N ATOM 962 CA PRO A 148 -4.104 8.096 -4.501 1.00 0.00 C ATOM 963 C PRO A 148 -4.076 9.607 -4.174 1.00 0.00 C ATOM 964 O PRO A 148 -4.034 10.466 -5.057 1.00 0.00 O ATOM 965 CB PRO A 148 -3.787 7.870 -5.981 1.00 0.00 C ATOM 966 CG PRO A 148 -4.621 6.660 -6.369 1.00 0.00 C ATOM 967 CD PRO A 148 -5.882 6.764 -5.487 1.00 0.00 C ATOM 0 HA PRO A 148 -3.366 7.657 -3.830 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.049 8.742 -6.581 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -2.724 7.685 -6.135 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.875 6.676 -7.429 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -4.082 5.731 -6.184 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.672 7.328 -5.984 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.290 5.780 -5.256 1.00 0.00 H new ATOM 968 N LEU A 149 -3.945 9.894 -2.891 1.00 0.00 N ATOM 969 CA LEU A 149 -3.944 11.281 -2.383 1.00 0.00 C ATOM 970 C LEU A 149 -2.785 11.552 -1.423 1.00 0.00 C ATOM 971 O LEU A 149 -2.680 10.870 -0.408 1.00 0.00 O ATOM 972 CB LEU A 149 -5.268 11.629 -1.686 1.00 0.00 C ATOM 973 CG LEU A 149 -6.400 11.861 -2.693 1.00 0.00 C ATOM 974 CD1 LEU A 149 -7.749 11.786 -1.968 1.00 0.00 C ATOM 975 CD2 LEU A 149 -6.206 13.204 -3.412 1.00 0.00 C ATOM 0 H LEU A 149 -3.836 9.186 -2.164 1.00 0.00 H new ATOM 0 HA LEU A 149 -3.820 11.917 -3.259 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -5.545 10.821 -1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -5.134 12.524 -1.078 1.00 0.00 H new ATOM 0 HG LEU A 149 -6.383 11.083 -3.456 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -8.556 11.951 -2.682 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -7.863 10.802 -1.512 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -7.789 12.552 -1.193 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -7.017 13.356 -4.124 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -6.209 14.012 -2.681 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -5.254 13.199 -3.942 1.00 0.00 H new ATOM 976 N PRO A 150 -1.910 12.494 -1.771 1.00 0.00 N ATOM 977 CA PRO A 150 -0.905 13.019 -0.819 1.00 0.00 C ATOM 978 C PRO A 150 -1.639 13.759 0.309 1.00 0.00 C ATOM 979 O PRO A 150 -2.602 14.474 0.062 1.00 0.00 O ATOM 980 CB PRO A 150 -0.043 13.974 -1.637 1.00 0.00 C ATOM 981 CG PRO A 150 -0.165 13.427 -3.052 1.00 0.00 C ATOM 982 CD PRO A 150 -1.614 12.956 -3.143 1.00 0.00 C ATOM 0 HA PRO A 150 -0.295 12.241 -0.360 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -0.404 15.000 -1.570 1.00 0.00 H new ATOM 0 HB3 PRO A 150 0.992 13.977 -1.294 1.00 0.00 H new ATOM 0 HG2 PRO A 150 0.053 14.193 -3.796 1.00 0.00 H new ATOM 0 HG3 PRO A 150 0.533 12.607 -3.224 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -2.280 13.763 -3.448 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -1.731 12.154 -3.871 1.00 0.00 H new ATOM 983 N VAL A 151 -1.125 13.531 1.511 1.00 0.00 N ATOM 984 CA VAL A 151 -1.594 14.079 2.808 1.00 0.00 C ATOM 985 C VAL A 151 -3.078 13.891 3.184 1.00 0.00 C ATOM 986 O VAL A 151 -4.000 13.954 2.371 1.00 0.00 O ATOM 987 CB VAL A 151 -1.084 15.495 3.164 1.00 0.00 C ATOM 988 CG1 VAL A 151 0.421 15.449 3.424 1.00 0.00 C ATOM 989 CG2 VAL A 151 -1.439 16.594 2.163 1.00 0.00 C ATOM 0 H VAL A 151 -0.316 12.921 1.630 1.00 0.00 H new ATOM 0 HA VAL A 151 -1.074 13.382 3.465 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.619 15.782 4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.778 16.448 3.675 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.626 14.772 4.253 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.934 15.094 2.530 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -1.034 17.545 2.508 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -1.014 16.351 1.189 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -2.523 16.671 2.076 1.00 0.00 H new ATOM 990 N SER A 152 -3.241 13.676 4.480 1.00 0.00 N ATOM 991 CA SER A 152 -4.515 13.423 5.197 1.00 0.00 C ATOM 992 C SER A 152 -5.642 14.381 4.825 1.00 0.00 C ATOM 993 O SER A 152 -6.748 13.970 4.474 1.00 0.00 O ATOM 994 CB SER A 152 -4.263 13.528 6.709 1.00 0.00 C ATOM 995 OG SER A 152 -3.060 12.839 7.052 1.00 0.00 O ATOM 0 H SER A 152 -2.443 13.670 5.116 1.00 0.00 H new ATOM 0 HA SER A 152 -4.841 12.426 4.902 1.00 0.00 H new ATOM 0 HB2 SER A 152 -4.188 14.575 7.002 1.00 0.00 H new ATOM 0 HB3 SER A 152 -5.104 13.103 7.257 1.00 0.00 H new ATOM 0 HG SER A 152 -3.281 11.957 7.418 1.00 0.00 H new ATOM 996 N SER A 153 -5.290 15.656 4.759 1.00 0.00 N ATOM 997 CA SER A 153 -6.223 16.772 4.467 1.00 0.00 C ATOM 998 C SER A 153 -6.451 16.998 2.960 1.00 0.00 C ATOM 999 O SER A 153 -7.145 17.932 2.563 1.00 0.00 O ATOM 1000 CB SER A 153 -5.622 18.023 5.092 1.00 0.00 C ATOM 1001 OG SER A 153 -4.227 18.046 4.759 1.00 0.00 O ATOM 0 H SER A 153 -4.330 15.967 4.908 1.00 0.00 H new ATOM 0 HA SER A 153 -7.202 16.530 4.881 1.00 0.00 H new ATOM 0 HB2 SER A 153 -6.120 18.916 4.716 1.00 0.00 H new ATOM 0 HB3 SER A 153 -5.758 18.014 6.173 1.00 0.00 H new ATOM 0 HG SER A 153 -4.121 18.253 3.807 1.00 0.00 H new ATOM 1002 N ASP A 154 -5.844 16.147 2.142 1.00 0.00 N ATOM 1003 CA ASP A 154 -5.907 16.261 0.675 1.00 0.00 C ATOM 1004 C ASP A 154 -6.237 14.964 -0.067 1.00 0.00 C ATOM 1005 O ASP A 154 -6.271 13.894 0.575 1.00 0.00 O ATOM 1006 CB ASP A 154 -4.611 16.870 0.130 1.00 0.00 C ATOM 1007 CG ASP A 154 -4.537 18.361 0.426 1.00 0.00 C ATOM 1008 OD1 ASP A 154 -4.036 18.704 1.529 1.00 0.00 O ATOM 1009 OD2 ASP A 154 -4.973 19.131 -0.452 1.00 0.00 O ATOM 1010 OXT ASP A 154 -6.657 15.145 -1.226 1.00 0.00 O ATOM 0 H ASP A 154 -5.291 15.355 2.469 1.00 0.00 H new ATOM 0 HA ASP A 154 -6.751 16.923 0.480 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -3.754 16.365 0.575 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -4.554 16.707 -0.946 1.00 0.00 H new TER 1011 ASP A 154