USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=35 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 106 ASN : amide:sc= -2.2! C(o=-2.8!,f=-6.6!) USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= -0.574 USER MOD Set 2.1: A 115 LYS NZ :NH3+ -178:sc= -0.0801 (180deg=-0.0925) USER MOD Set 2.2: A 116 HIS : no HE2:sc= 0.0265 K(o=-0.054,f=-1.5) USER MOD Set 3.1: A 109 ASN : amide:sc= 0.498 K(o=0.5,f=-1.4) USER MOD Set 3.2: A 111 TYR OH : rot 15:sc= 0 USER MOD Set 4.1: A 29 TYR OH : rot -161:sc= 0.405 USER MOD Set 4.2: A 31 SER OG : rot 45:sc= 2.71 USER MOD Set 4.3: A 108 TYR OH : rot -31:sc= 0.988 USER MOD Set 5.1: A 90 SER OG : rot 180:sc= 0.00718 USER MOD Set 5.2: A 92 THR OG1 : rot 37:sc= 0.763 USER MOD Set 6.1: A 81 MET CE :methyl -144:sc= -0.295 (180deg=-2.88!) USER MOD Set 6.2: A 113 SER OG : rot 95:sc= 0.415 USER MOD Set 7.1: A 72 SER OG : rot 80:sc= 0.764 USER MOD Set 7.2: A 75 THR OG1 : rot -71:sc= 0.972 USER MOD Single : A 30 CYS SG : rot -93:sc= 0.174 USER MOD Single : A 32 ASN : amide:sc= -0.432! C(o=-0.43!,f=-6.2!) USER MOD Single : A 35 HIS : no HE2:sc= 0.683 K(o=0.68,f=-2.3!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0331 USER MOD Single : A 48 THR OG1 : rot -129:sc= 0.673 USER MOD Single : A 52 SER OG : rot -9:sc= 1.34 USER MOD Single : A 54 GLN : amide:sc= 0.0751 X(o=0.075,f=0) USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= 0.16 X(o=0.16,f=0) USER MOD Single : A 59 GLN : amide:sc= -0.0418 K(o=-0.042,f=-7!) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= -0.227 USER MOD Single : A 69 TYR OH : rot 157:sc= 1.27 USER MOD Single : A 71 LYS NZ :NH3+ -160:sc= -0.046 (180deg=-0.751) USER MOD Single : A 73 THR OG1 : rot -125:sc= -0.174 USER MOD Single : A 77 GLN : amide:sc= 0.592 K(o=0.59,f=-0.18) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.034 USER MOD Single : A 88 TYR OH : rot -152:sc= 0.254 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= -0.181 K(o=-0.18,f=-1.9) USER MOD Single : A 97 CYS SG : rot -149:sc= 0.0703 USER MOD Single : A 107 HIS : no HE2:sc= -0.571 K(o=-0.57,f=-4!) USER MOD Single : A 110 THR OG1 : rot -55:sc= 0.221 USER MOD Single : A 114 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0362) USER MOD Single : A 119 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.051) USER MOD Single : A 120 ASN : amide:sc= -0.0288 K(o=-0.029,f=-1.2) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 CYS SG : rot 98:sc= -1.63 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 141:sc= 1.3 USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 141 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 142 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00445) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 26 3.242 -4.405 12.178 1.00 0.00 N ATOM 12 CA ALA A 26 3.431 -4.884 10.790 1.00 0.00 C ATOM 13 C ALA A 26 4.102 -3.829 9.907 1.00 0.00 C ATOM 14 O ALA A 26 3.732 -2.662 9.933 1.00 0.00 O ATOM 15 CB ALA A 26 2.101 -5.305 10.166 1.00 0.00 C ATOM 0 HA ALA A 26 4.089 -5.751 10.846 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.271 -5.652 9.147 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.661 -6.110 10.755 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.421 -4.454 10.151 1.00 0.00 H new ATOM 16 N LEU A 27 4.936 -4.342 9.007 1.00 0.00 N ATOM 17 CA LEU A 27 5.739 -3.496 8.095 1.00 0.00 C ATOM 18 C LEU A 27 5.558 -3.837 6.623 1.00 0.00 C ATOM 19 O LEU A 27 5.512 -4.998 6.233 1.00 0.00 O ATOM 20 CB LEU A 27 7.226 -3.593 8.472 1.00 0.00 C ATOM 21 CG LEU A 27 7.546 -2.751 9.705 1.00 0.00 C ATOM 22 CD1 LEU A 27 8.833 -3.270 10.359 1.00 0.00 C ATOM 23 CD2 LEU A 27 7.678 -1.280 9.316 1.00 0.00 C ATOM 0 H LEU A 27 5.082 -5.344 8.881 1.00 0.00 H new ATOM 0 HA LEU A 27 5.375 -2.476 8.221 1.00 0.00 H new ATOM 0 HB2 LEU A 27 7.487 -4.634 8.663 1.00 0.00 H new ATOM 0 HB3 LEU A 27 7.838 -3.260 7.634 1.00 0.00 H new ATOM 0 HG LEU A 27 6.733 -2.834 10.427 1.00 0.00 H new ATOM 0 HD11 LEU A 27 9.062 -2.669 11.239 1.00 0.00 H new ATOM 0 HD12 LEU A 27 8.697 -4.310 10.655 1.00 0.00 H new ATOM 0 HD13 LEU A 27 9.656 -3.200 9.648 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.906 -0.688 10.203 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.481 -1.167 8.588 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.741 -0.934 8.880 1.00 0.00 H new ATOM 24 N LEU A 28 5.518 -2.778 5.833 1.00 0.00 N ATOM 25 CA LEU A 28 5.335 -2.890 4.381 1.00 0.00 C ATOM 26 C LEU A 28 6.558 -2.260 3.694 1.00 0.00 C ATOM 27 O LEU A 28 6.737 -1.038 3.716 1.00 0.00 O ATOM 28 CB LEU A 28 4.093 -2.090 3.977 1.00 0.00 C ATOM 29 CG LEU A 28 3.250 -2.667 2.818 1.00 0.00 C ATOM 30 CD1 LEU A 28 4.087 -3.010 1.577 1.00 0.00 C ATOM 31 CD2 LEU A 28 2.445 -3.883 3.269 1.00 0.00 C ATOM 0 H LEU A 28 5.610 -1.819 6.169 1.00 0.00 H new ATOM 0 HA LEU A 28 5.222 -3.935 4.092 1.00 0.00 H new ATOM 0 HB2 LEU A 28 3.450 -1.993 4.852 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.410 -1.084 3.701 1.00 0.00 H new ATOM 0 HG LEU A 28 2.560 -1.875 2.527 1.00 0.00 H new ATOM 0 HD11 LEU A 28 3.437 -3.411 0.799 1.00 0.00 H new ATOM 0 HD12 LEU A 28 4.580 -2.110 1.210 1.00 0.00 H new ATOM 0 HD13 LEU A 28 4.839 -3.754 1.840 1.00 0.00 H new ATOM 0 HD21 LEU A 28 1.863 -4.265 2.431 1.00 0.00 H new ATOM 0 HD22 LEU A 28 3.125 -4.659 3.622 1.00 0.00 H new ATOM 0 HD23 LEU A 28 1.772 -3.595 4.077 1.00 0.00 H new ATOM 32 N TYR A 29 7.420 -3.133 3.203 1.00 0.00 N ATOM 33 CA TYR A 29 8.645 -2.733 2.497 1.00 0.00 C ATOM 34 C TYR A 29 8.371 -2.716 0.994 1.00 0.00 C ATOM 35 O TYR A 29 7.502 -3.413 0.484 1.00 0.00 O ATOM 36 CB TYR A 29 9.748 -3.704 2.929 1.00 0.00 C ATOM 37 CG TYR A 29 11.008 -3.704 2.053 1.00 0.00 C ATOM 38 CD1 TYR A 29 11.820 -2.547 1.922 1.00 0.00 C ATOM 39 CD2 TYR A 29 11.176 -4.833 1.235 1.00 0.00 C ATOM 40 CE1 TYR A 29 12.771 -2.500 0.892 1.00 0.00 C ATOM 41 CE2 TYR A 29 12.137 -4.795 0.215 1.00 0.00 C ATOM 42 CZ TYR A 29 12.900 -3.619 0.033 1.00 0.00 C ATOM 43 OH TYR A 29 13.641 -3.523 -1.099 1.00 0.00 O ATOM 0 H TYR A 29 7.299 -4.143 3.278 1.00 0.00 H new ATOM 0 HA TYR A 29 8.975 -1.725 2.746 1.00 0.00 H new ATOM 0 HB2 TYR A 29 10.038 -3.465 3.952 1.00 0.00 H new ATOM 0 HB3 TYR A 29 9.335 -4.713 2.942 1.00 0.00 H new ATOM 0 HD1 TYR A 29 11.707 -1.717 2.604 1.00 0.00 H new ATOM 0 HD2 TYR A 29 10.574 -5.717 1.389 1.00 0.00 H new ATOM 0 HE1 TYR A 29 13.393 -1.627 0.756 1.00 0.00 H new ATOM 0 HE2 TYR A 29 12.292 -5.652 -0.423 1.00 0.00 H new ATOM 0 HH TYR A 29 13.393 -4.244 -1.715 1.00 0.00 H new ATOM 44 N CYS A 30 9.112 -1.850 0.322 1.00 0.00 N ATOM 45 CA CYS A 30 8.895 -1.572 -1.101 1.00 0.00 C ATOM 46 C CYS A 30 10.205 -1.741 -1.866 1.00 0.00 C ATOM 47 O CYS A 30 11.097 -0.894 -1.767 1.00 0.00 O ATOM 48 CB CYS A 30 8.394 -0.126 -1.206 1.00 0.00 C ATOM 49 SG CYS A 30 7.067 0.324 -0.011 1.00 0.00 S ATOM 0 H CYS A 30 9.878 -1.320 0.738 1.00 0.00 H new ATOM 0 HA CYS A 30 8.167 -2.260 -1.531 1.00 0.00 H new ATOM 0 HB2 CYS A 30 9.239 0.547 -1.059 1.00 0.00 H new ATOM 0 HB3 CYS A 30 8.024 0.042 -2.217 1.00 0.00 H new ATOM 0 HG CYS A 30 5.905 0.139 -0.563 1.00 0.00 H new ATOM 50 N SER A 31 10.322 -2.880 -2.545 1.00 0.00 N ATOM 51 CA SER A 31 11.444 -3.171 -3.463 1.00 0.00 C ATOM 52 C SER A 31 11.422 -2.372 -4.783 1.00 0.00 C ATOM 53 O SER A 31 12.273 -2.545 -5.654 1.00 0.00 O ATOM 54 CB SER A 31 11.630 -4.660 -3.781 1.00 0.00 C ATOM 55 OG SER A 31 12.193 -5.325 -2.654 1.00 0.00 O ATOM 0 H SER A 31 9.642 -3.638 -2.480 1.00 0.00 H new ATOM 0 HA SER A 31 12.302 -2.834 -2.881 1.00 0.00 H new ATOM 0 HB2 SER A 31 10.671 -5.109 -4.039 1.00 0.00 H new ATOM 0 HB3 SER A 31 12.281 -4.778 -4.648 1.00 0.00 H new ATOM 0 HG SER A 31 11.726 -5.042 -1.840 1.00 0.00 H new ATOM 56 N ASN A 32 10.436 -1.480 -4.874 1.00 0.00 N ATOM 57 CA ASN A 32 10.416 -0.320 -5.785 1.00 0.00 C ATOM 58 C ASN A 32 11.739 0.481 -5.720 1.00 0.00 C ATOM 59 O ASN A 32 12.134 1.134 -6.686 1.00 0.00 O ATOM 60 CB ASN A 32 9.244 0.540 -5.297 1.00 0.00 C ATOM 61 CG ASN A 32 8.745 1.646 -6.223 1.00 0.00 C ATOM 62 OD1 ASN A 32 7.610 2.087 -6.116 1.00 0.00 O ATOM 63 ND2 ASN A 32 9.570 2.183 -7.104 1.00 0.00 N ATOM 0 H ASN A 32 9.596 -1.541 -4.298 1.00 0.00 H new ATOM 0 HA ASN A 32 10.306 -0.630 -6.824 1.00 0.00 H new ATOM 0 HB2 ASN A 32 8.406 -0.124 -5.085 1.00 0.00 H new ATOM 0 HB3 ASN A 32 9.535 0.999 -4.352 1.00 0.00 H new ATOM 0 HD21 ASN A 32 9.258 2.959 -7.688 1.00 0.00 H new ATOM 0 HD22 ASN A 32 10.519 1.822 -7.200 1.00 0.00 H new ATOM 64 N GLY A 33 12.306 0.496 -4.514 1.00 0.00 N ATOM 65 CA GLY A 33 13.648 1.017 -4.199 1.00 0.00 C ATOM 66 C GLY A 33 14.059 0.400 -2.854 1.00 0.00 C ATOM 67 O GLY A 33 13.906 -0.801 -2.616 1.00 0.00 O ATOM 0 H GLY A 33 11.827 0.131 -3.691 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.360 0.750 -4.980 1.00 0.00 H new ATOM 0 HA3 GLY A 33 13.636 2.105 -4.137 1.00 0.00 H new ATOM 68 N GLY A 34 14.431 1.303 -1.960 1.00 0.00 N ATOM 69 CA GLY A 34 14.739 0.976 -0.557 1.00 0.00 C ATOM 70 C GLY A 34 13.882 1.839 0.364 1.00 0.00 C ATOM 71 O GLY A 34 14.387 2.774 0.989 1.00 0.00 O ATOM 0 H GLY A 34 14.531 2.294 -2.179 1.00 0.00 H new ATOM 0 HA2 GLY A 34 14.546 -0.080 -0.367 1.00 0.00 H new ATOM 0 HA3 GLY A 34 15.796 1.148 -0.355 1.00 0.00 H new ATOM 72 N HIS A 35 12.574 1.639 0.239 1.00 0.00 N ATOM 73 CA HIS A 35 11.619 2.361 1.089 1.00 0.00 C ATOM 74 C HIS A 35 10.629 1.423 1.768 1.00 0.00 C ATOM 75 O HIS A 35 10.503 0.252 1.407 1.00 0.00 O ATOM 76 CB HIS A 35 10.789 3.414 0.350 1.00 0.00 C ATOM 77 CG HIS A 35 11.577 4.541 -0.342 1.00 0.00 C ATOM 78 ND1 HIS A 35 12.832 4.901 -0.098 1.00 0.00 N ATOM 79 CD2 HIS A 35 11.069 5.416 -1.208 1.00 0.00 C ATOM 80 CE1 HIS A 35 13.110 5.993 -0.805 1.00 0.00 C ATOM 81 NE2 HIS A 35 12.015 6.304 -1.487 1.00 0.00 N ATOM 0 H HIS A 35 12.151 0.995 -0.429 1.00 0.00 H new ATOM 0 HA HIS A 35 12.260 2.857 1.818 1.00 0.00 H new ATOM 0 HB2 HIS A 35 10.185 2.907 -0.402 1.00 0.00 H new ATOM 0 HB3 HIS A 35 10.098 3.866 1.062 1.00 0.00 H new ATOM 0 HD1 HIS A 35 13.477 4.419 0.529 1.00 0.00 H new ATOM 0 HD2 HIS A 35 10.067 5.405 -1.611 1.00 0.00 H new ATOM 0 HE1 HIS A 35 14.049 6.526 -0.821 1.00 0.00 H new ATOM 82 N PHE A 36 10.113 1.919 2.862 1.00 0.00 N ATOM 83 CA PHE A 36 8.880 1.419 3.479 1.00 0.00 C ATOM 84 C PHE A 36 7.736 2.390 3.176 1.00 0.00 C ATOM 85 O PHE A 36 7.943 3.471 2.608 1.00 0.00 O ATOM 86 CB PHE A 36 9.114 1.361 4.992 1.00 0.00 C ATOM 87 CG PHE A 36 9.969 0.168 5.401 1.00 0.00 C ATOM 88 CD1 PHE A 36 11.380 0.240 5.277 1.00 0.00 C ATOM 89 CD2 PHE A 36 9.344 -1.007 5.884 1.00 0.00 C ATOM 90 CE1 PHE A 36 12.176 -0.874 5.616 1.00 0.00 C ATOM 91 CE2 PHE A 36 10.139 -2.130 6.233 1.00 0.00 C ATOM 92 CZ PHE A 36 11.540 -2.049 6.089 1.00 0.00 C ATOM 0 H PHE A 36 10.534 2.697 3.370 1.00 0.00 H new ATOM 0 HA PHE A 36 8.621 0.434 3.091 1.00 0.00 H new ATOM 0 HB2 PHE A 36 9.599 2.281 5.318 1.00 0.00 H new ATOM 0 HB3 PHE A 36 8.153 1.309 5.504 1.00 0.00 H new ATOM 0 HD1 PHE A 36 11.845 1.148 4.923 1.00 0.00 H new ATOM 0 HD2 PHE A 36 8.270 -1.049 5.986 1.00 0.00 H new ATOM 0 HE1 PHE A 36 13.251 -0.832 5.517 1.00 0.00 H new ATOM 0 HE2 PHE A 36 9.678 -3.034 6.604 1.00 0.00 H new ATOM 0 HZ PHE A 36 12.145 -2.906 6.346 1.00 0.00 H new ATOM 93 N LEU A 37 6.547 1.880 3.403 1.00 0.00 N ATOM 94 CA LEU A 37 5.301 2.660 3.410 1.00 0.00 C ATOM 95 C LEU A 37 5.140 3.309 4.798 1.00 0.00 C ATOM 96 O LEU A 37 5.673 2.794 5.784 1.00 0.00 O ATOM 97 CB LEU A 37 4.191 1.651 3.157 1.00 0.00 C ATOM 98 CG LEU A 37 3.036 2.231 2.345 1.00 0.00 C ATOM 99 CD1 LEU A 37 2.374 1.106 1.537 1.00 0.00 C ATOM 100 CD2 LEU A 37 2.010 2.953 3.223 1.00 0.00 C ATOM 0 H LEU A 37 6.401 0.889 3.594 1.00 0.00 H new ATOM 0 HA LEU A 37 5.287 3.452 2.662 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.603 0.790 2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.811 1.289 4.112 1.00 0.00 H new ATOM 0 HG LEU A 37 3.440 2.982 1.666 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.548 1.514 0.955 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.107 0.661 0.864 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.996 0.343 2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.209 3.347 2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 37 1.594 2.253 3.947 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.496 3.774 3.750 1.00 0.00 H new ATOM 101 N ARG A 38 4.650 4.545 4.822 1.00 0.00 N ATOM 102 CA ARG A 38 4.220 5.242 6.058 1.00 0.00 C ATOM 103 C ARG A 38 2.906 6.011 5.853 1.00 0.00 C ATOM 104 O ARG A 38 2.779 6.840 4.952 1.00 0.00 O ATOM 105 CB ARG A 38 5.246 6.230 6.609 1.00 0.00 C ATOM 106 CG ARG A 38 6.313 5.529 7.451 1.00 0.00 C ATOM 107 CD ARG A 38 7.045 6.435 8.439 1.00 0.00 C ATOM 108 NE ARG A 38 7.643 7.580 7.725 1.00 0.00 N ATOM 109 CZ ARG A 38 8.450 8.527 8.234 1.00 0.00 C ATOM 110 NH1 ARG A 38 8.866 8.520 9.498 1.00 0.00 N ATOM 111 NH2 ARG A 38 8.931 9.471 7.449 1.00 0.00 N ATOM 0 H ARG A 38 4.534 5.109 3.980 1.00 0.00 H new ATOM 0 HA ARG A 38 4.093 4.435 6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 38 5.723 6.757 5.783 1.00 0.00 H new ATOM 0 HB3 ARG A 38 4.739 6.980 7.216 1.00 0.00 H new ATOM 0 HG2 ARG A 38 5.843 4.716 8.004 1.00 0.00 H new ATOM 0 HG3 ARG A 38 7.046 5.078 6.782 1.00 0.00 H new ATOM 0 HD2 ARG A 38 6.352 6.792 9.200 1.00 0.00 H new ATOM 0 HD3 ARG A 38 7.822 5.871 8.955 1.00 0.00 H new ATOM 0 HE ARG A 38 7.419 7.662 6.733 1.00 0.00 H new ATOM 0 HH11 ARG A 38 8.573 7.773 10.127 1.00 0.00 H new ATOM 0 HH12 ARG A 38 9.478 9.262 9.837 1.00 0.00 H new ATOM 0 HH21 ARG A 38 8.691 9.482 6.458 1.00 0.00 H new ATOM 0 HH22 ARG A 38 9.543 10.191 7.833 1.00 0.00 H new ATOM 112 N ILE A 39 1.988 5.754 6.773 1.00 0.00 N ATOM 113 CA ILE A 39 0.662 6.393 6.808 1.00 0.00 C ATOM 114 C ILE A 39 0.612 7.573 7.788 1.00 0.00 C ATOM 115 O ILE A 39 0.600 7.413 9.008 1.00 0.00 O ATOM 116 CB ILE A 39 -0.481 5.364 6.996 1.00 0.00 C ATOM 117 CG1 ILE A 39 -1.858 6.043 7.111 1.00 0.00 C ATOM 118 CG2 ILE A 39 -0.206 4.396 8.159 1.00 0.00 C ATOM 119 CD1 ILE A 39 -3.037 5.093 6.818 1.00 0.00 C ATOM 0 H ILE A 39 2.136 5.088 7.531 1.00 0.00 H new ATOM 0 HA ILE A 39 0.488 6.832 5.826 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.509 4.757 6.091 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.971 6.451 8.116 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.899 6.884 6.419 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.035 3.694 8.252 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.715 3.847 7.965 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.103 4.961 9.086 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.976 5.637 6.917 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.948 4.705 5.803 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -3.021 4.264 7.526 1.00 0.00 H new ATOM 120 N LEU A 40 0.599 8.763 7.198 1.00 0.00 N ATOM 121 CA LEU A 40 0.241 9.990 7.924 1.00 0.00 C ATOM 122 C LEU A 40 -1.243 9.918 8.357 1.00 0.00 C ATOM 123 O LEU A 40 -2.092 9.601 7.518 1.00 0.00 O ATOM 124 CB LEU A 40 0.520 11.232 7.076 1.00 0.00 C ATOM 125 CG LEU A 40 2.039 11.484 7.003 1.00 0.00 C ATOM 126 CD1 LEU A 40 2.353 12.467 5.876 1.00 0.00 C ATOM 127 CD2 LEU A 40 2.590 11.999 8.349 1.00 0.00 C ATOM 0 H LEU A 40 0.832 8.911 6.216 1.00 0.00 H new ATOM 0 HA LEU A 40 0.860 10.070 8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.116 11.097 6.073 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.019 12.098 7.508 1.00 0.00 H new ATOM 0 HG LEU A 40 2.532 10.535 6.791 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.428 12.639 5.832 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.013 12.053 4.927 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.842 13.411 6.064 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.664 12.166 8.263 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.097 12.935 8.610 1.00 0.00 H new ATOM 0 HD23 LEU A 40 2.400 11.260 9.127 1.00 0.00 H new ATOM 128 N PRO A 41 -1.519 10.096 9.654 1.00 0.00 N ATOM 129 CA PRO A 41 -2.865 9.945 10.250 1.00 0.00 C ATOM 130 C PRO A 41 -4.020 10.496 9.397 1.00 0.00 C ATOM 131 O PRO A 41 -4.910 9.748 9.007 1.00 0.00 O ATOM 132 CB PRO A 41 -2.765 10.646 11.601 1.00 0.00 C ATOM 133 CG PRO A 41 -1.327 10.368 12.017 1.00 0.00 C ATOM 134 CD PRO A 41 -0.544 10.464 10.715 1.00 0.00 C ATOM 0 HA PRO A 41 -3.122 8.889 10.332 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -2.963 11.715 11.518 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.479 10.244 12.320 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -0.975 11.095 12.749 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -1.226 9.383 12.472 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.154 11.470 10.562 1.00 0.00 H new ATOM 0 HD3 PRO A 41 0.311 9.788 10.717 1.00 0.00 H new ATOM 135 N ASP A 42 -3.906 11.766 9.048 1.00 0.00 N ATOM 136 CA ASP A 42 -4.913 12.468 8.217 1.00 0.00 C ATOM 137 C ASP A 42 -4.390 12.742 6.812 1.00 0.00 C ATOM 138 O ASP A 42 -3.574 13.639 6.581 1.00 0.00 O ATOM 139 CB ASP A 42 -5.351 13.785 8.872 1.00 0.00 C ATOM 140 CG ASP A 42 -6.024 13.520 10.215 1.00 0.00 C ATOM 141 OD1 ASP A 42 -5.272 13.276 11.183 1.00 0.00 O ATOM 142 OD2 ASP A 42 -7.274 13.559 10.231 1.00 0.00 O ATOM 0 H ASP A 42 -3.119 12.353 9.324 1.00 0.00 H new ATOM 0 HA ASP A 42 -5.776 11.807 8.140 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.485 14.432 9.014 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -6.039 14.314 8.213 1.00 0.00 H new ATOM 143 N GLY A 43 -4.703 11.769 5.979 1.00 0.00 N ATOM 144 CA GLY A 43 -4.568 11.900 4.530 1.00 0.00 C ATOM 145 C GLY A 43 -3.365 11.130 3.974 1.00 0.00 C ATOM 146 O GLY A 43 -3.110 9.992 4.347 1.00 0.00 O ATOM 0 H GLY A 43 -5.059 10.862 6.282 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.478 11.539 4.051 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -4.469 12.955 4.273 1.00 0.00 H new ATOM 147 N THR A 44 -2.711 11.805 3.041 1.00 0.00 N ATOM 148 CA THR A 44 -1.617 11.314 2.173 1.00 0.00 C ATOM 149 C THR A 44 -0.597 10.402 2.874 1.00 0.00 C ATOM 150 O THR A 44 0.069 10.808 3.831 1.00 0.00 O ATOM 151 CB THR A 44 -0.921 12.559 1.600 1.00 0.00 C ATOM 152 OG1 THR A 44 -1.921 13.391 1.009 1.00 0.00 O ATOM 153 CG2 THR A 44 0.173 12.238 0.572 1.00 0.00 C ATOM 0 H THR A 44 -2.936 12.780 2.846 1.00 0.00 H new ATOM 0 HA THR A 44 -2.053 10.681 1.400 1.00 0.00 H new ATOM 0 HB THR A 44 -0.412 13.064 2.421 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.500 14.194 0.637 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.618 13.166 0.213 1.00 0.00 H new ATOM 0 HG22 THR A 44 0.942 11.623 1.039 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.264 11.697 -0.267 1.00 0.00 H new ATOM 154 N VAL A 45 -0.371 9.254 2.257 1.00 0.00 N ATOM 155 CA VAL A 45 0.642 8.292 2.728 1.00 0.00 C ATOM 156 C VAL A 45 1.921 8.382 1.872 1.00 0.00 C ATOM 157 O VAL A 45 1.892 8.572 0.651 1.00 0.00 O ATOM 158 CB VAL A 45 0.082 6.868 2.852 1.00 0.00 C ATOM 159 CG1 VAL A 45 -1.276 6.837 3.577 1.00 0.00 C ATOM 160 CG2 VAL A 45 -0.088 6.126 1.530 1.00 0.00 C ATOM 0 H VAL A 45 -0.874 8.954 1.422 1.00 0.00 H new ATOM 0 HA VAL A 45 0.926 8.569 3.743 1.00 0.00 H new ATOM 0 HB VAL A 45 0.848 6.355 3.433 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -1.631 5.808 3.640 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -1.161 7.244 4.582 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -1.998 7.437 3.023 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.489 5.130 1.720 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.776 6.677 0.889 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.879 6.039 1.034 1.00 0.00 H new ATOM 161 N ASP A 46 3.035 8.142 2.554 1.00 0.00 N ATOM 162 CA ASP A 46 4.379 8.382 2.019 1.00 0.00 C ATOM 163 C ASP A 46 5.260 7.130 1.949 1.00 0.00 C ATOM 164 O ASP A 46 4.942 6.087 2.525 1.00 0.00 O ATOM 165 CB ASP A 46 5.041 9.478 2.866 1.00 0.00 C ATOM 166 CG ASP A 46 5.288 9.130 4.339 1.00 0.00 C ATOM 167 OD1 ASP A 46 6.379 8.579 4.621 1.00 0.00 O ATOM 168 OD2 ASP A 46 4.376 9.403 5.149 1.00 0.00 O ATOM 0 H ASP A 46 3.035 7.771 3.504 1.00 0.00 H new ATOM 0 HA ASP A 46 4.272 8.700 0.982 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.996 9.736 2.409 1.00 0.00 H new ATOM 0 HB3 ASP A 46 4.416 10.370 2.824 1.00 0.00 H new ATOM 169 N GLY A 47 6.337 7.288 1.190 1.00 0.00 N ATOM 170 CA GLY A 47 7.476 6.357 1.143 1.00 0.00 C ATOM 171 C GLY A 47 8.581 6.907 2.055 1.00 0.00 C ATOM 172 O GLY A 47 8.740 8.118 2.197 1.00 0.00 O ATOM 0 H GLY A 47 6.453 8.089 0.569 1.00 0.00 H new ATOM 0 HA2 GLY A 47 7.170 5.364 1.473 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.842 6.255 0.121 1.00 0.00 H new ATOM 173 N THR A 48 9.363 5.973 2.604 1.00 0.00 N ATOM 174 CA THR A 48 10.399 6.292 3.615 1.00 0.00 C ATOM 175 C THR A 48 11.627 5.382 3.579 1.00 0.00 C ATOM 176 O THR A 48 11.516 4.161 3.718 1.00 0.00 O ATOM 177 CB THR A 48 9.783 6.357 5.018 1.00 0.00 C ATOM 178 OG1 THR A 48 10.780 6.805 5.939 1.00 0.00 O ATOM 179 CG2 THR A 48 9.169 5.042 5.502 1.00 0.00 C ATOM 0 H THR A 48 9.305 4.982 2.370 1.00 0.00 H new ATOM 0 HA THR A 48 10.780 7.277 3.347 1.00 0.00 H new ATOM 0 HB THR A 48 8.951 7.059 4.963 1.00 0.00 H new ATOM 0 HG1 THR A 48 10.823 6.189 6.700 1.00 0.00 H new ATOM 0 HG21 THR A 48 8.757 5.179 6.502 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.374 4.739 4.821 1.00 0.00 H new ATOM 0 HG23 THR A 48 9.938 4.270 5.529 1.00 0.00 H new ATOM 180 N ARG A 49 12.782 6.021 3.561 1.00 0.00 N ATOM 181 CA ARG A 49 14.097 5.352 3.676 1.00 0.00 C ATOM 182 C ARG A 49 14.376 4.794 5.089 1.00 0.00 C ATOM 183 O ARG A 49 15.300 4.002 5.289 1.00 0.00 O ATOM 184 CB ARG A 49 15.255 6.221 3.168 1.00 0.00 C ATOM 185 CG ARG A 49 15.706 7.415 4.033 1.00 0.00 C ATOM 186 CD ARG A 49 14.685 8.557 4.172 1.00 0.00 C ATOM 187 NE ARG A 49 14.296 9.053 2.848 1.00 0.00 N ATOM 188 CZ ARG A 49 13.049 9.193 2.394 1.00 0.00 C ATOM 189 NH1 ARG A 49 12.001 9.125 3.192 1.00 0.00 N ATOM 190 NH2 ARG A 49 12.849 9.611 1.152 1.00 0.00 N ATOM 0 H ARG A 49 12.851 7.034 3.465 1.00 0.00 H new ATOM 0 HA ARG A 49 14.036 4.490 3.012 1.00 0.00 H new ATOM 0 HB2 ARG A 49 16.118 5.572 3.021 1.00 0.00 H new ATOM 0 HB3 ARG A 49 14.976 6.607 2.188 1.00 0.00 H new ATOM 0 HG2 ARG A 49 15.951 7.047 5.029 1.00 0.00 H new ATOM 0 HG3 ARG A 49 16.624 7.822 3.609 1.00 0.00 H new ATOM 0 HD2 ARG A 49 13.805 8.204 4.709 1.00 0.00 H new ATOM 0 HD3 ARG A 49 15.114 9.368 4.761 1.00 0.00 H new ATOM 0 HE ARG A 49 15.050 9.316 2.214 1.00 0.00 H new ATOM 0 HH11 ARG A 49 12.130 8.961 4.190 1.00 0.00 H new ATOM 0 HH12 ARG A 49 11.062 9.237 2.811 1.00 0.00 H new ATOM 0 HH21 ARG A 49 13.645 9.823 0.551 1.00 0.00 H new ATOM 0 HH22 ARG A 49 11.899 9.721 0.798 1.00 0.00 H new ATOM 191 N ASP A 50 13.561 5.218 6.060 1.00 0.00 N ATOM 192 CA ASP A 50 13.631 4.699 7.441 1.00 0.00 C ATOM 193 C ASP A 50 12.237 4.417 7.986 1.00 0.00 C ATOM 194 O ASP A 50 11.475 5.321 8.347 1.00 0.00 O ATOM 195 CB ASP A 50 14.362 5.645 8.389 1.00 0.00 C ATOM 196 CG ASP A 50 15.825 5.827 7.995 1.00 0.00 C ATOM 197 OD1 ASP A 50 16.086 6.769 7.218 1.00 0.00 O ATOM 198 OD2 ASP A 50 16.646 5.044 8.514 1.00 0.00 O ATOM 0 H ASP A 50 12.838 5.924 5.919 1.00 0.00 H new ATOM 0 HA ASP A 50 14.201 3.772 7.389 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.863 6.614 8.391 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.305 5.256 9.405 1.00 0.00 H new ATOM 199 N ARG A 51 11.956 3.125 8.083 1.00 0.00 N ATOM 200 CA ARG A 51 10.704 2.575 8.649 1.00 0.00 C ATOM 201 C ARG A 51 10.075 3.360 9.812 1.00 0.00 C ATOM 202 O ARG A 51 8.963 3.851 9.670 1.00 0.00 O ATOM 203 CB ARG A 51 10.863 1.086 8.991 1.00 0.00 C ATOM 204 CG ARG A 51 12.055 0.796 9.894 1.00 0.00 C ATOM 205 CD ARG A 51 12.063 -0.684 10.245 1.00 0.00 C ATOM 206 NE ARG A 51 13.206 -0.904 11.137 1.00 0.00 N ATOM 207 CZ ARG A 51 13.143 -1.144 12.447 1.00 0.00 C ATOM 208 NH1 ARG A 51 11.996 -1.184 13.114 1.00 0.00 N ATOM 209 NH2 ARG A 51 14.288 -1.345 13.089 1.00 0.00 N ATOM 0 H ARG A 51 12.601 2.401 7.766 1.00 0.00 H new ATOM 0 HA ARG A 51 9.976 2.692 7.846 1.00 0.00 H new ATOM 0 HB2 ARG A 51 9.954 0.734 9.478 1.00 0.00 H new ATOM 0 HB3 ARG A 51 10.970 0.518 8.067 1.00 0.00 H new ATOM 0 HG2 ARG A 51 12.983 1.069 9.391 1.00 0.00 H new ATOM 0 HG3 ARG A 51 11.995 1.398 10.801 1.00 0.00 H new ATOM 0 HD2 ARG A 51 11.131 -0.970 10.733 1.00 0.00 H new ATOM 0 HD3 ARG A 51 12.152 -1.294 9.346 1.00 0.00 H new ATOM 0 HE ARG A 51 14.135 -0.870 10.717 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.115 -1.028 12.624 1.00 0.00 H new ATOM 0 HH12 ARG A 51 11.995 -1.371 14.117 1.00 0.00 H new ATOM 0 HH21 ARG A 51 15.171 -1.312 12.579 1.00 0.00 H new ATOM 0 HH22 ARG A 51 14.284 -1.532 14.092 1.00 0.00 H new ATOM 210 N SER A 52 10.802 3.476 10.940 1.00 0.00 N ATOM 211 CA SER A 52 10.442 4.204 12.186 1.00 0.00 C ATOM 212 C SER A 52 9.258 3.634 12.983 1.00 0.00 C ATOM 213 O SER A 52 9.183 3.824 14.203 1.00 0.00 O ATOM 214 CB SER A 52 10.252 5.712 11.984 1.00 0.00 C ATOM 215 OG SER A 52 9.058 5.982 11.231 1.00 0.00 O ATOM 0 H SER A 52 11.719 3.036 11.017 1.00 0.00 H new ATOM 0 HA SER A 52 11.328 4.037 12.798 1.00 0.00 H new ATOM 0 HB2 SER A 52 10.196 6.209 12.953 1.00 0.00 H new ATOM 0 HB3 SER A 52 11.116 6.125 11.464 1.00 0.00 H new ATOM 0 HG SER A 52 8.695 5.142 10.881 1.00 0.00 H new ATOM 216 N ASP A 53 8.290 3.056 12.273 1.00 0.00 N ATOM 217 CA ASP A 53 7.009 2.496 12.779 1.00 0.00 C ATOM 218 C ASP A 53 6.004 3.428 13.448 1.00 0.00 C ATOM 219 O ASP A 53 4.816 3.118 13.515 1.00 0.00 O ATOM 220 CB ASP A 53 7.230 1.238 13.641 1.00 0.00 C ATOM 221 CG ASP A 53 7.470 -0.011 12.784 1.00 0.00 C ATOM 222 OD1 ASP A 53 8.517 -0.042 12.106 1.00 0.00 O ATOM 223 OD2 ASP A 53 6.606 -0.918 12.865 1.00 0.00 O ATOM 0 H ASP A 53 8.372 2.953 11.262 1.00 0.00 H new ATOM 0 HA ASP A 53 6.514 2.251 11.839 1.00 0.00 H new ATOM 0 HB2 ASP A 53 8.084 1.395 14.300 1.00 0.00 H new ATOM 0 HB3 ASP A 53 6.361 1.078 14.279 1.00 0.00 H new ATOM 224 N GLN A 54 6.502 4.632 13.703 1.00 0.00 N ATOM 225 CA GLN A 54 5.747 5.796 14.195 1.00 0.00 C ATOM 226 C GLN A 54 4.514 6.076 13.331 1.00 0.00 C ATOM 227 O GLN A 54 3.455 6.397 13.860 1.00 0.00 O ATOM 228 CB GLN A 54 6.718 6.964 14.155 1.00 0.00 C ATOM 229 CG GLN A 54 6.517 7.892 15.353 1.00 0.00 C ATOM 230 CD GLN A 54 5.581 9.065 15.043 1.00 0.00 C ATOM 231 OE1 GLN A 54 6.005 10.158 14.717 1.00 0.00 O ATOM 232 NE2 GLN A 54 4.282 8.854 15.068 1.00 0.00 N ATOM 0 H GLN A 54 7.491 4.841 13.568 1.00 0.00 H new ATOM 0 HA GLN A 54 5.369 5.621 15.202 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.742 6.589 14.150 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.579 7.524 13.230 1.00 0.00 H new ATOM 0 HG2 GLN A 54 6.111 7.319 16.187 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.484 8.279 15.673 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.919 7.941 15.340 1.00 0.00 H new ATOM 0 HE22 GLN A 54 3.639 9.604 14.815 1.00 0.00 H new ATOM 233 N HIS A 55 4.660 5.867 12.023 1.00 0.00 N ATOM 234 CA HIS A 55 3.560 5.957 11.041 1.00 0.00 C ATOM 235 C HIS A 55 3.359 4.666 10.228 1.00 0.00 C ATOM 236 O HIS A 55 2.600 4.629 9.260 1.00 0.00 O ATOM 237 CB HIS A 55 3.831 7.110 10.073 1.00 0.00 C ATOM 238 CG HIS A 55 4.053 8.452 10.766 1.00 0.00 C ATOM 239 ND1 HIS A 55 5.137 9.200 10.688 1.00 0.00 N ATOM 240 CD2 HIS A 55 3.209 9.035 11.596 1.00 0.00 C ATOM 241 CE1 HIS A 55 4.970 10.269 11.466 1.00 0.00 C ATOM 242 NE2 HIS A 55 3.775 10.160 12.023 1.00 0.00 N ATOM 0 H HIS A 55 5.557 5.626 11.601 1.00 0.00 H new ATOM 0 HA HIS A 55 2.648 6.125 11.613 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.709 6.871 9.473 1.00 0.00 H new ATOM 0 HB3 HIS A 55 2.990 7.201 9.385 1.00 0.00 H new ATOM 0 HD2 HIS A 55 2.234 8.665 11.878 1.00 0.00 H new ATOM 0 HE1 HIS A 55 5.677 11.072 11.614 1.00 0.00 H new ATOM 0 HE2 HIS A 55 3.358 10.827 12.672 1.00 0.00 H new ATOM 243 N ILE A 56 3.963 3.561 10.685 1.00 0.00 N ATOM 244 CA ILE A 56 3.882 2.300 9.944 1.00 0.00 C ATOM 245 C ILE A 56 3.742 1.079 10.853 1.00 0.00 C ATOM 246 O ILE A 56 4.700 0.557 11.404 1.00 0.00 O ATOM 247 CB ILE A 56 4.946 2.118 8.826 1.00 0.00 C ATOM 248 CG1 ILE A 56 4.654 0.846 8.053 1.00 0.00 C ATOM 249 CG2 ILE A 56 6.411 2.200 9.232 1.00 0.00 C ATOM 250 CD1 ILE A 56 3.371 1.065 7.239 1.00 0.00 C ATOM 0 H ILE A 56 4.503 3.516 11.549 1.00 0.00 H new ATOM 0 HA ILE A 56 2.945 2.380 9.393 1.00 0.00 H new ATOM 0 HB ILE A 56 4.833 3.000 8.196 1.00 0.00 H new ATOM 0 HG12 ILE A 56 5.486 0.603 7.393 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.532 0.005 8.736 1.00 0.00 H new ATOM 0 HG21 ILE A 56 7.041 2.055 8.354 1.00 0.00 H new ATOM 0 HG22 ILE A 56 6.614 3.179 9.667 1.00 0.00 H new ATOM 0 HG23 ILE A 56 6.629 1.425 9.966 1.00 0.00 H new ATOM 0 HD11 ILE A 56 3.140 0.162 6.674 1.00 0.00 H new ATOM 0 HD12 ILE A 56 2.546 1.291 7.914 1.00 0.00 H new ATOM 0 HD13 ILE A 56 3.515 1.898 6.550 1.00 0.00 H new ATOM 251 N GLN A 57 2.461 0.808 11.109 1.00 0.00 N ATOM 252 CA GLN A 57 1.945 -0.436 11.694 1.00 0.00 C ATOM 253 C GLN A 57 0.584 -0.717 11.059 1.00 0.00 C ATOM 254 O GLN A 57 -0.273 0.166 11.049 1.00 0.00 O ATOM 255 CB GLN A 57 1.817 -0.347 13.222 1.00 0.00 C ATOM 256 CG GLN A 57 3.200 -0.395 13.877 1.00 0.00 C ATOM 257 CD GLN A 57 3.151 -0.045 15.367 1.00 0.00 C ATOM 258 OE1 GLN A 57 2.909 -0.877 16.224 1.00 0.00 O ATOM 259 NE2 GLN A 57 3.538 1.178 15.661 1.00 0.00 N ATOM 0 H GLN A 57 1.720 1.478 10.906 1.00 0.00 H new ATOM 0 HA GLN A 57 2.645 -1.247 11.491 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.309 0.577 13.498 1.00 0.00 H new ATOM 0 HB3 GLN A 57 1.204 -1.170 13.591 1.00 0.00 H new ATOM 0 HG2 GLN A 57 3.623 -1.392 13.754 1.00 0.00 H new ATOM 0 HG3 GLN A 57 3.866 0.299 13.365 1.00 0.00 H new ATOM 0 HE21 GLN A 57 3.731 1.845 14.914 1.00 0.00 H new ATOM 0 HE22 GLN A 57 3.645 1.459 16.636 1.00 0.00 H new ATOM 260 N LEU A 58 0.581 -1.757 10.239 1.00 0.00 N ATOM 261 CA LEU A 58 -0.607 -2.127 9.446 1.00 0.00 C ATOM 262 C LEU A 58 -1.230 -3.492 9.799 1.00 0.00 C ATOM 263 O LEU A 58 -0.774 -4.198 10.704 1.00 0.00 O ATOM 264 CB LEU A 58 -0.222 -2.034 7.960 1.00 0.00 C ATOM 265 CG LEU A 58 0.792 -3.116 7.561 1.00 0.00 C ATOM 266 CD1 LEU A 58 0.110 -4.132 6.653 1.00 0.00 C ATOM 267 CD2 LEU A 58 1.994 -2.496 6.864 1.00 0.00 C ATOM 0 H LEU A 58 1.385 -2.368 10.097 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.404 -1.424 9.690 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.118 -2.132 7.346 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.199 -1.049 7.755 1.00 0.00 H new ATOM 0 HG LEU A 58 1.151 -3.619 8.459 1.00 0.00 H new ATOM 0 HD11 LEU A 58 0.826 -4.902 6.367 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.725 -4.591 7.183 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.260 -3.630 5.759 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.700 -3.280 6.590 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.664 -1.974 5.966 1.00 0.00 H new ATOM 0 HD23 LEU A 58 2.480 -1.789 7.537 1.00 0.00 H new ATOM 268 N GLN A 59 -2.422 -3.702 9.236 1.00 0.00 N ATOM 269 CA GLN A 59 -3.101 -5.007 9.218 1.00 0.00 C ATOM 270 C GLN A 59 -3.614 -5.312 7.803 1.00 0.00 C ATOM 271 O GLN A 59 -4.163 -4.447 7.137 1.00 0.00 O ATOM 272 CB GLN A 59 -4.263 -4.997 10.226 1.00 0.00 C ATOM 273 CG GLN A 59 -5.033 -6.323 10.347 1.00 0.00 C ATOM 274 CD GLN A 59 -4.167 -7.546 10.657 1.00 0.00 C ATOM 275 OE1 GLN A 59 -3.285 -7.959 9.917 1.00 0.00 O ATOM 276 NE2 GLN A 59 -4.512 -8.289 11.693 1.00 0.00 N ATOM 0 H GLN A 59 -2.952 -2.964 8.773 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.396 -5.788 9.503 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -3.870 -4.732 11.208 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -4.964 -4.212 9.941 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -5.784 -6.220 11.130 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.568 -6.502 9.414 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -5.244 -7.971 12.328 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -4.046 -9.181 11.858 1.00 0.00 H new ATOM 277 N LEU A 60 -3.469 -6.571 7.404 1.00 0.00 N ATOM 278 CA LEU A 60 -3.961 -7.065 6.109 1.00 0.00 C ATOM 279 C LEU A 60 -5.277 -7.836 6.305 1.00 0.00 C ATOM 280 O LEU A 60 -5.376 -9.067 6.224 1.00 0.00 O ATOM 281 CB LEU A 60 -2.906 -7.957 5.431 1.00 0.00 C ATOM 282 CG LEU A 60 -1.550 -7.246 5.295 1.00 0.00 C ATOM 283 CD1 LEU A 60 -0.459 -8.287 5.048 1.00 0.00 C ATOM 284 CD2 LEU A 60 -1.557 -6.176 4.205 1.00 0.00 C ATOM 0 H LEU A 60 -3.006 -7.285 7.966 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.149 -6.211 5.459 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.779 -8.872 6.010 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -3.261 -8.252 4.444 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.345 -6.720 6.228 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.505 -7.788 4.951 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.424 -8.983 5.886 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.679 -8.834 4.131 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -0.575 -5.705 4.151 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.792 -6.636 3.245 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.309 -5.422 4.440 1.00 0.00 H new ATOM 285 N SER A 61 -6.324 -7.034 6.333 1.00 0.00 N ATOM 286 CA SER A 61 -7.656 -7.445 6.819 1.00 0.00 C ATOM 287 C SER A 61 -8.580 -7.773 5.638 1.00 0.00 C ATOM 288 O SER A 61 -9.352 -6.939 5.160 1.00 0.00 O ATOM 289 CB SER A 61 -8.145 -6.279 7.663 1.00 0.00 C ATOM 290 OG SER A 61 -9.310 -6.598 8.420 1.00 0.00 O ATOM 0 H SER A 61 -6.288 -6.064 6.018 1.00 0.00 H new ATOM 0 HA SER A 61 -7.633 -8.357 7.415 1.00 0.00 H new ATOM 0 HB2 SER A 61 -7.350 -5.968 8.341 1.00 0.00 H new ATOM 0 HB3 SER A 61 -8.360 -5.431 7.013 1.00 0.00 H new ATOM 0 HG SER A 61 -9.583 -5.817 8.946 1.00 0.00 H new ATOM 291 N ALA A 62 -8.234 -8.880 4.982 1.00 0.00 N ATOM 292 CA ALA A 62 -9.068 -9.487 3.933 1.00 0.00 C ATOM 293 C ALA A 62 -10.551 -9.599 4.277 1.00 0.00 C ATOM 294 O ALA A 62 -10.947 -10.172 5.293 1.00 0.00 O ATOM 295 CB ALA A 62 -8.522 -10.863 3.539 1.00 0.00 C ATOM 0 H ALA A 62 -7.366 -9.386 5.160 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.008 -8.797 3.092 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.152 -11.296 2.762 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.504 -10.757 3.163 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.520 -11.517 4.411 1.00 0.00 H new ATOM 296 N GLU A 63 -11.280 -8.725 3.599 1.00 0.00 N ATOM 297 CA GLU A 63 -12.738 -8.807 3.483 1.00 0.00 C ATOM 298 C GLU A 63 -13.129 -10.041 2.658 1.00 0.00 C ATOM 299 O GLU A 63 -14.117 -10.719 2.938 1.00 0.00 O ATOM 300 CB GLU A 63 -13.231 -7.541 2.777 1.00 0.00 C ATOM 301 CG GLU A 63 -14.762 -7.404 2.760 1.00 0.00 C ATOM 302 CD GLU A 63 -15.222 -6.218 1.905 1.00 0.00 C ATOM 303 OE1 GLU A 63 -15.068 -6.317 0.677 1.00 0.00 O ATOM 304 OE2 GLU A 63 -15.667 -5.211 2.510 1.00 0.00 O ATOM 0 H GLU A 63 -10.876 -7.928 3.107 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.188 -8.892 4.472 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -12.802 -6.669 3.270 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.863 -7.540 1.751 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -15.204 -8.322 2.374 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -15.126 -7.279 3.780 1.00 0.00 H new ATOM 305 N SER A 64 -12.276 -10.334 1.688 1.00 0.00 N ATOM 306 CA SER A 64 -12.467 -11.396 0.686 1.00 0.00 C ATOM 307 C SER A 64 -11.166 -11.705 -0.070 1.00 0.00 C ATOM 308 O SER A 64 -10.124 -11.127 0.231 1.00 0.00 O ATOM 309 CB SER A 64 -13.580 -10.955 -0.267 1.00 0.00 C ATOM 310 OG SER A 64 -13.942 -12.038 -1.130 1.00 0.00 O ATOM 0 H SER A 64 -11.399 -9.828 1.564 1.00 0.00 H new ATOM 0 HA SER A 64 -12.753 -12.322 1.184 1.00 0.00 H new ATOM 0 HB2 SER A 64 -14.449 -10.627 0.303 1.00 0.00 H new ATOM 0 HB3 SER A 64 -13.247 -10.103 -0.859 1.00 0.00 H new ATOM 0 HG SER A 64 -14.656 -11.749 -1.736 1.00 0.00 H new ATOM 311 N VAL A 65 -11.258 -12.726 -0.921 1.00 0.00 N ATOM 312 CA VAL A 65 -10.263 -13.268 -1.860 1.00 0.00 C ATOM 313 C VAL A 65 -9.315 -12.221 -2.470 1.00 0.00 C ATOM 314 O VAL A 65 -9.693 -11.404 -3.304 1.00 0.00 O ATOM 315 CB VAL A 65 -10.954 -14.124 -2.948 1.00 0.00 C ATOM 316 CG1 VAL A 65 -11.541 -15.409 -2.354 1.00 0.00 C ATOM 317 CG2 VAL A 65 -12.022 -13.383 -3.759 1.00 0.00 C ATOM 0 H VAL A 65 -12.127 -13.256 -0.979 1.00 0.00 H new ATOM 0 HA VAL A 65 -9.610 -13.907 -1.265 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.160 -14.373 -3.652 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -12.020 -15.989 -3.143 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -10.743 -15.999 -1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -12.278 -15.154 -1.593 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -12.453 -14.059 -4.497 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -12.806 -13.029 -3.090 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -11.568 -12.533 -4.267 1.00 0.00 H new ATOM 318 N GLY A 66 -8.285 -12.012 -1.668 1.00 0.00 N ATOM 319 CA GLY A 66 -7.179 -11.103 -2.006 1.00 0.00 C ATOM 320 C GLY A 66 -7.357 -9.694 -1.428 1.00 0.00 C ATOM 321 O GLY A 66 -6.468 -9.167 -0.769 1.00 0.00 O ATOM 0 H GLY A 66 -8.183 -12.464 -0.760 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.245 -11.525 -1.636 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -7.091 -11.035 -3.090 1.00 0.00 H new ATOM 322 N GLU A 67 -8.478 -9.074 -1.801 1.00 0.00 N ATOM 323 CA GLU A 67 -8.844 -7.696 -1.375 1.00 0.00 C ATOM 324 C GLU A 67 -8.852 -7.506 0.145 1.00 0.00 C ATOM 325 O GLU A 67 -9.747 -7.933 0.885 1.00 0.00 O ATOM 326 CB GLU A 67 -10.130 -7.217 -2.079 1.00 0.00 C ATOM 327 CG GLU A 67 -11.387 -8.037 -1.773 1.00 0.00 C ATOM 328 CD GLU A 67 -11.947 -8.882 -2.929 1.00 0.00 C ATOM 329 OE1 GLU A 67 -11.185 -9.156 -3.881 1.00 0.00 O ATOM 330 OE2 GLU A 67 -13.126 -9.252 -2.812 1.00 0.00 O ATOM 0 H GLU A 67 -9.171 -9.506 -2.412 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.046 -7.034 -1.711 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.315 -6.180 -1.797 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.961 -7.229 -3.156 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -11.167 -8.702 -0.938 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -12.168 -7.354 -1.439 1.00 0.00 H new ATOM 331 N VAL A 68 -7.741 -6.907 0.567 1.00 0.00 N ATOM 332 CA VAL A 68 -7.429 -6.634 1.991 1.00 0.00 C ATOM 333 C VAL A 68 -7.655 -5.156 2.308 1.00 0.00 C ATOM 334 O VAL A 68 -7.204 -4.252 1.603 1.00 0.00 O ATOM 335 CB VAL A 68 -6.011 -7.043 2.436 1.00 0.00 C ATOM 336 CG1 VAL A 68 -5.798 -8.551 2.379 1.00 0.00 C ATOM 337 CG2 VAL A 68 -4.858 -6.343 1.719 1.00 0.00 C ATOM 0 H VAL A 68 -7.013 -6.588 -0.072 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.114 -7.265 2.557 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.978 -6.698 3.469 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.784 -8.788 2.702 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -6.513 -9.045 3.037 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.944 -8.901 1.357 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.909 -6.708 2.113 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.913 -6.553 0.651 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -4.928 -5.267 1.881 1.00 0.00 H new ATOM 338 N TYR A 69 -8.388 -4.952 3.390 1.00 0.00 N ATOM 339 CA TYR A 69 -8.417 -3.642 4.070 1.00 0.00 C ATOM 340 C TYR A 69 -7.096 -3.491 4.814 1.00 0.00 C ATOM 341 O TYR A 69 -6.758 -4.338 5.648 1.00 0.00 O ATOM 342 CB TYR A 69 -9.559 -3.571 5.097 1.00 0.00 C ATOM 343 CG TYR A 69 -10.934 -3.352 4.472 1.00 0.00 C ATOM 344 CD1 TYR A 69 -11.103 -2.284 3.580 1.00 0.00 C ATOM 345 CD2 TYR A 69 -12.001 -4.211 4.830 1.00 0.00 C ATOM 346 CE1 TYR A 69 -12.368 -2.064 3.006 1.00 0.00 C ATOM 347 CE2 TYR A 69 -13.266 -3.991 4.256 1.00 0.00 C ATOM 348 CZ TYR A 69 -13.425 -2.923 3.345 1.00 0.00 C ATOM 349 OH TYR A 69 -14.630 -2.703 2.751 1.00 0.00 O ATOM 0 H TYR A 69 -8.973 -5.666 3.825 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.570 -2.855 3.332 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.575 -4.496 5.674 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.355 -2.762 5.798 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.272 -1.638 3.337 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.847 -5.019 5.530 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -12.523 -1.248 2.316 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.101 -4.628 4.507 1.00 0.00 H new ATOM 0 HH TYR A 69 -15.156 -3.530 2.762 1.00 0.00 H new ATOM 350 N ILE A 70 -6.237 -2.614 4.313 1.00 0.00 N ATOM 351 CA ILE A 70 -5.018 -2.304 5.087 1.00 0.00 C ATOM 352 C ILE A 70 -5.339 -1.276 6.163 1.00 0.00 C ATOM 353 O ILE A 70 -5.227 -0.065 6.014 1.00 0.00 O ATOM 354 CB ILE A 70 -3.822 -1.914 4.190 1.00 0.00 C ATOM 355 CG1 ILE A 70 -3.521 -3.072 3.213 1.00 0.00 C ATOM 356 CG2 ILE A 70 -2.584 -1.534 5.024 1.00 0.00 C ATOM 357 CD1 ILE A 70 -2.452 -2.793 2.145 1.00 0.00 C ATOM 0 H ILE A 70 -6.339 -2.122 3.425 1.00 0.00 H new ATOM 0 HA ILE A 70 -4.686 -3.212 5.590 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.086 -1.026 3.615 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.207 -3.939 3.794 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.448 -3.345 2.708 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.764 -1.266 4.357 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.823 -0.685 5.664 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.287 -2.382 5.641 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.325 -3.675 1.518 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.765 -1.951 1.528 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.506 -2.554 2.631 1.00 0.00 H new ATOM 358 N LYS A 71 -5.716 -1.869 7.279 1.00 0.00 N ATOM 359 CA LYS A 71 -6.075 -1.142 8.505 1.00 0.00 C ATOM 360 C LYS A 71 -4.765 -0.841 9.210 1.00 0.00 C ATOM 361 O LYS A 71 -4.115 -1.706 9.787 1.00 0.00 O ATOM 362 CB LYS A 71 -6.917 -2.088 9.346 1.00 0.00 C ATOM 363 CG LYS A 71 -7.665 -1.334 10.448 1.00 0.00 C ATOM 364 CD LYS A 71 -6.870 -1.238 11.747 1.00 0.00 C ATOM 365 CE LYS A 71 -7.618 -0.303 12.699 1.00 0.00 C ATOM 366 NZ LYS A 71 -6.863 -0.207 13.957 1.00 0.00 N ATOM 0 H LYS A 71 -5.786 -2.882 7.372 1.00 0.00 H new ATOM 0 HA LYS A 71 -6.629 -0.222 8.321 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -7.632 -2.607 8.708 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.277 -2.849 9.793 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -7.901 -0.329 10.098 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -8.613 -1.834 10.644 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -6.755 -2.225 12.196 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -5.867 -0.858 11.551 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -7.730 0.684 12.249 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.622 -0.682 12.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.492 0.128 14.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.487 -1.143 14.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -6.076 0.462 13.839 1.00 0.00 H new ATOM 367 N SER A 72 -4.466 0.432 9.253 1.00 0.00 N ATOM 368 CA SER A 72 -3.268 0.941 9.936 1.00 0.00 C ATOM 369 C SER A 72 -3.535 0.980 11.433 1.00 0.00 C ATOM 370 O SER A 72 -4.247 1.844 11.945 1.00 0.00 O ATOM 371 CB SER A 72 -2.863 2.305 9.390 1.00 0.00 C ATOM 372 OG SER A 72 -1.988 2.962 10.320 1.00 0.00 O ATOM 0 H SER A 72 -5.036 1.159 8.820 1.00 0.00 H new ATOM 0 HA SER A 72 -2.426 0.274 9.749 1.00 0.00 H new ATOM 0 HB2 SER A 72 -2.364 2.188 8.428 1.00 0.00 H new ATOM 0 HB3 SER A 72 -3.749 2.915 9.217 1.00 0.00 H new ATOM 0 HG SER A 72 -1.080 2.607 10.222 1.00 0.00 H new ATOM 373 N THR A 73 -3.281 -0.198 11.976 1.00 0.00 N ATOM 374 CA THR A 73 -3.135 -0.467 13.428 1.00 0.00 C ATOM 375 C THR A 73 -2.332 0.580 14.227 1.00 0.00 C ATOM 376 O THR A 73 -2.436 0.619 15.456 1.00 0.00 O ATOM 377 CB THR A 73 -2.536 -1.862 13.655 1.00 0.00 C ATOM 378 OG1 THR A 73 -1.287 -1.982 12.968 1.00 0.00 O ATOM 379 CG2 THR A 73 -3.482 -2.960 13.174 1.00 0.00 C ATOM 0 H THR A 73 -3.163 -1.038 11.410 1.00 0.00 H new ATOM 0 HA THR A 73 -4.151 -0.406 13.819 1.00 0.00 H new ATOM 0 HB THR A 73 -2.381 -1.982 14.727 1.00 0.00 H new ATOM 0 HG1 THR A 73 -1.311 -2.765 12.380 1.00 0.00 H new ATOM 0 HG21 THR A 73 -3.027 -3.935 13.350 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.423 -2.895 13.721 1.00 0.00 H new ATOM 0 HG23 THR A 73 -3.672 -2.835 12.108 1.00 0.00 H new ATOM 380 N GLU A 74 -1.692 1.505 13.524 1.00 0.00 N ATOM 381 CA GLU A 74 -0.937 2.631 14.122 1.00 0.00 C ATOM 382 C GLU A 74 -1.840 3.844 14.352 1.00 0.00 C ATOM 383 O GLU A 74 -1.837 4.454 15.422 1.00 0.00 O ATOM 384 CB GLU A 74 0.200 3.010 13.194 1.00 0.00 C ATOM 385 CG GLU A 74 1.387 3.550 14.017 1.00 0.00 C ATOM 386 CD GLU A 74 1.189 4.969 14.565 1.00 0.00 C ATOM 387 OE1 GLU A 74 0.590 5.794 13.828 1.00 0.00 O ATOM 388 OE2 GLU A 74 1.705 5.213 15.671 1.00 0.00 O ATOM 0 H GLU A 74 -1.674 1.506 12.504 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.546 2.315 15.089 1.00 0.00 H new ATOM 0 HB2 GLU A 74 0.513 2.142 12.614 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -0.135 3.765 12.483 1.00 0.00 H new ATOM 0 HG2 GLU A 74 1.571 2.874 14.852 1.00 0.00 H new ATOM 0 HG3 GLU A 74 2.281 3.537 13.393 1.00 0.00 H new ATOM 389 N THR A 75 -2.571 4.188 13.304 1.00 0.00 N ATOM 390 CA THR A 75 -3.340 5.442 13.195 1.00 0.00 C ATOM 391 C THR A 75 -4.841 5.239 13.439 1.00 0.00 C ATOM 392 O THR A 75 -5.591 6.203 13.610 1.00 0.00 O ATOM 393 CB THR A 75 -3.140 6.073 11.817 1.00 0.00 C ATOM 394 OG1 THR A 75 -3.582 5.199 10.772 1.00 0.00 O ATOM 395 CG2 THR A 75 -1.671 6.475 11.573 1.00 0.00 C ATOM 0 H THR A 75 -2.656 3.595 12.478 1.00 0.00 H new ATOM 0 HA THR A 75 -2.961 6.105 13.973 1.00 0.00 H new ATOM 0 HB THR A 75 -3.748 6.977 11.801 1.00 0.00 H new ATOM 0 HG1 THR A 75 -2.959 4.447 10.689 1.00 0.00 H new ATOM 0 HG21 THR A 75 -1.575 6.919 10.582 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.362 7.199 12.327 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.036 5.591 11.638 1.00 0.00 H new ATOM 396 N GLY A 76 -5.250 3.986 13.314 1.00 0.00 N ATOM 397 CA GLY A 76 -6.647 3.535 13.369 1.00 0.00 C ATOM 398 C GLY A 76 -7.437 3.998 12.130 1.00 0.00 C ATOM 399 O GLY A 76 -8.553 4.499 12.238 1.00 0.00 O ATOM 0 H GLY A 76 -4.596 3.217 13.165 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.677 2.447 13.436 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.121 3.923 14.270 1.00 0.00 H new ATOM 400 N GLN A 77 -6.734 3.964 10.998 1.00 0.00 N ATOM 401 CA GLN A 77 -7.243 4.389 9.672 1.00 0.00 C ATOM 402 C GLN A 77 -6.933 3.321 8.615 1.00 0.00 C ATOM 403 O GLN A 77 -5.918 2.650 8.687 1.00 0.00 O ATOM 404 CB GLN A 77 -6.559 5.695 9.219 1.00 0.00 C ATOM 405 CG GLN A 77 -6.849 6.923 10.096 1.00 0.00 C ATOM 406 CD GLN A 77 -8.292 7.411 10.000 1.00 0.00 C ATOM 407 OE1 GLN A 77 -8.678 8.138 9.086 1.00 0.00 O ATOM 408 NE2 GLN A 77 -9.138 6.974 10.901 1.00 0.00 N ATOM 0 H GLN A 77 -5.770 3.634 10.965 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.319 4.537 9.768 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -5.481 5.532 9.194 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.872 5.915 8.198 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -6.624 6.680 11.134 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.180 7.733 9.806 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -8.812 6.371 11.657 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -10.122 7.237 10.846 1.00 0.00 H new ATOM 409 N TYR A 78 -7.792 3.244 7.616 1.00 0.00 N ATOM 410 CA TYR A 78 -7.632 2.365 6.448 1.00 0.00 C ATOM 411 C TYR A 78 -6.815 3.072 5.367 1.00 0.00 C ATOM 412 O TYR A 78 -7.061 4.240 5.044 1.00 0.00 O ATOM 413 CB TYR A 78 -9.002 2.014 5.853 1.00 0.00 C ATOM 414 CG TYR A 78 -9.846 1.157 6.814 1.00 0.00 C ATOM 415 CD1 TYR A 78 -10.533 1.782 7.866 1.00 0.00 C ATOM 416 CD2 TYR A 78 -9.733 -0.242 6.715 1.00 0.00 C ATOM 417 CE1 TYR A 78 -11.087 0.988 8.890 1.00 0.00 C ATOM 418 CE2 TYR A 78 -10.298 -1.036 7.729 1.00 0.00 C ATOM 419 CZ TYR A 78 -10.955 -0.411 8.812 1.00 0.00 C ATOM 420 OH TYR A 78 -11.460 -1.175 9.806 1.00 0.00 O ATOM 0 H TYR A 78 -8.646 3.801 7.583 1.00 0.00 H new ATOM 0 HA TYR A 78 -7.123 1.459 6.776 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -9.541 2.932 5.618 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.863 1.476 4.915 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.636 2.857 7.891 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -9.223 -0.696 5.878 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -11.604 1.445 9.721 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -10.230 -2.113 7.680 1.00 0.00 H new ATOM 0 HH TYR A 78 -11.292 -2.120 9.610 1.00 0.00 H new ATOM 421 N LEU A 79 -5.824 2.350 4.868 1.00 0.00 N ATOM 422 CA LEU A 79 -5.173 2.695 3.595 1.00 0.00 C ATOM 423 C LEU A 79 -6.220 2.596 2.493 1.00 0.00 C ATOM 424 O LEU A 79 -7.042 1.679 2.484 1.00 0.00 O ATOM 425 CB LEU A 79 -4.032 1.674 3.427 1.00 0.00 C ATOM 426 CG LEU A 79 -2.975 2.112 2.399 1.00 0.00 C ATOM 427 CD1 LEU A 79 -2.180 3.299 2.937 1.00 0.00 C ATOM 428 CD2 LEU A 79 -2.002 0.960 2.149 1.00 0.00 C ATOM 0 H LEU A 79 -5.446 1.518 5.320 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.765 3.705 3.560 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.549 1.517 4.391 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.452 0.716 3.121 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.481 2.393 1.476 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.434 3.601 2.201 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.856 4.132 3.131 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.681 3.013 3.863 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.252 1.269 1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.510 0.690 3.084 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.549 0.099 1.764 1.00 0.00 H new ATOM 429 N ALA A 80 -6.382 3.745 1.851 1.00 0.00 N ATOM 430 CA ALA A 80 -7.525 4.005 0.958 1.00 0.00 C ATOM 431 C ALA A 80 -7.139 4.868 -0.237 1.00 0.00 C ATOM 432 O ALA A 80 -6.478 5.894 -0.090 1.00 0.00 O ATOM 433 CB ALA A 80 -8.590 4.697 1.807 1.00 0.00 C ATOM 0 H ALA A 80 -5.732 4.527 1.928 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.894 3.069 0.539 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.463 4.913 1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.880 4.044 2.630 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.188 5.628 2.206 1.00 0.00 H new ATOM 434 N MET A 81 -7.612 4.434 -1.403 1.00 0.00 N ATOM 435 CA MET A 81 -7.283 5.057 -2.699 1.00 0.00 C ATOM 436 C MET A 81 -8.256 6.129 -3.200 1.00 0.00 C ATOM 437 O MET A 81 -9.477 6.029 -3.103 1.00 0.00 O ATOM 438 CB MET A 81 -7.163 3.877 -3.678 1.00 0.00 C ATOM 439 CG MET A 81 -6.780 4.270 -5.104 1.00 0.00 C ATOM 440 SD MET A 81 -8.209 4.428 -6.230 1.00 0.00 S ATOM 441 CE MET A 81 -7.976 2.980 -7.237 1.00 0.00 C ATOM 0 H MET A 81 -8.240 3.634 -1.484 1.00 0.00 H new ATOM 0 HA MET A 81 -6.364 5.634 -2.599 1.00 0.00 H new ATOM 0 HB2 MET A 81 -6.419 3.179 -3.295 1.00 0.00 H new ATOM 0 HB3 MET A 81 -8.114 3.346 -3.705 1.00 0.00 H new ATOM 0 HG2 MET A 81 -6.242 5.218 -5.078 1.00 0.00 H new ATOM 0 HG3 MET A 81 -6.093 3.525 -5.505 1.00 0.00 H new ATOM 0 HE1 MET A 81 -8.271 3.199 -8.263 1.00 0.00 H new ATOM 0 HE2 MET A 81 -6.926 2.687 -7.215 1.00 0.00 H new ATOM 0 HE3 MET A 81 -8.588 2.165 -6.850 1.00 0.00 H new ATOM 442 N ASP A 82 -7.620 7.204 -3.653 1.00 0.00 N ATOM 443 CA ASP A 82 -8.190 8.289 -4.480 1.00 0.00 C ATOM 444 C ASP A 82 -7.742 8.042 -5.925 1.00 0.00 C ATOM 445 O ASP A 82 -6.597 7.662 -6.132 1.00 0.00 O ATOM 446 CB ASP A 82 -7.637 9.604 -3.924 1.00 0.00 C ATOM 447 CG ASP A 82 -7.927 10.831 -4.787 1.00 0.00 C ATOM 448 OD1 ASP A 82 -9.043 11.372 -4.669 1.00 0.00 O ATOM 449 OD2 ASP A 82 -7.060 11.098 -5.648 1.00 0.00 O ATOM 0 H ASP A 82 -6.634 7.361 -3.447 1.00 0.00 H new ATOM 0 HA ASP A 82 -9.279 8.327 -4.459 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -8.055 9.768 -2.931 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -6.558 9.507 -3.804 1.00 0.00 H new ATOM 450 N THR A 83 -8.526 8.566 -6.863 1.00 0.00 N ATOM 451 CA THR A 83 -8.359 8.417 -8.332 1.00 0.00 C ATOM 452 C THR A 83 -7.227 9.166 -9.039 1.00 0.00 C ATOM 453 O THR A 83 -7.195 9.296 -10.259 1.00 0.00 O ATOM 454 CB THR A 83 -9.683 8.706 -9.036 1.00 0.00 C ATOM 455 OG1 THR A 83 -10.259 9.901 -8.503 1.00 0.00 O ATOM 456 CG2 THR A 83 -10.615 7.508 -8.886 1.00 0.00 C ATOM 0 H THR A 83 -9.338 9.136 -6.623 1.00 0.00 H new ATOM 0 HA THR A 83 -8.039 7.379 -8.420 1.00 0.00 H new ATOM 0 HB THR A 83 -9.515 8.865 -10.101 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.108 10.086 -8.957 1.00 0.00 H new ATOM 0 HG21 THR A 83 -11.559 7.716 -9.389 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.152 6.628 -9.333 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.801 7.322 -7.828 1.00 0.00 H new ATOM 457 N ASP A 84 -6.228 9.484 -8.238 1.00 0.00 N ATOM 458 CA ASP A 84 -4.855 9.735 -8.713 1.00 0.00 C ATOM 459 C ASP A 84 -3.891 8.623 -8.233 1.00 0.00 C ATOM 460 O ASP A 84 -2.680 8.723 -8.399 1.00 0.00 O ATOM 461 CB ASP A 84 -4.412 11.099 -8.179 1.00 0.00 C ATOM 462 CG ASP A 84 -3.010 11.540 -8.623 1.00 0.00 C ATOM 463 OD1 ASP A 84 -2.839 11.782 -9.842 1.00 0.00 O ATOM 464 OD2 ASP A 84 -2.151 11.668 -7.724 1.00 0.00 O ATOM 0 H ASP A 84 -6.334 9.580 -7.228 1.00 0.00 H new ATOM 0 HA ASP A 84 -4.834 9.732 -9.803 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -5.133 11.851 -8.500 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.442 11.074 -7.090 1.00 0.00 H new ATOM 465 N GLY A 85 -4.485 7.478 -7.899 1.00 0.00 N ATOM 466 CA GLY A 85 -3.885 6.373 -7.112 1.00 0.00 C ATOM 467 C GLY A 85 -3.354 6.798 -5.736 1.00 0.00 C ATOM 468 O GLY A 85 -2.835 5.952 -5.011 1.00 0.00 O ATOM 0 H GLY A 85 -5.445 7.274 -8.178 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.633 5.592 -6.975 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -3.068 5.935 -7.685 1.00 0.00 H new ATOM 469 N LEU A 86 -3.898 7.904 -5.242 1.00 0.00 N ATOM 470 CA LEU A 86 -3.336 8.569 -4.066 1.00 0.00 C ATOM 471 C LEU A 86 -3.914 7.874 -2.843 1.00 0.00 C ATOM 472 O LEU A 86 -5.127 7.894 -2.606 1.00 0.00 O ATOM 473 CB LEU A 86 -3.678 10.056 -4.060 1.00 0.00 C ATOM 474 CG LEU A 86 -2.745 10.834 -3.130 1.00 0.00 C ATOM 475 CD1 LEU A 86 -2.611 12.265 -3.629 1.00 0.00 C ATOM 476 CD2 LEU A 86 -3.201 10.800 -1.665 1.00 0.00 C ATOM 0 H LEU A 86 -4.723 8.359 -5.633 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.248 8.500 -4.071 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.602 10.454 -5.072 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.711 10.193 -3.741 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.770 10.346 -3.152 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.946 12.820 -2.967 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -2.198 12.261 -4.638 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.592 12.740 -3.640 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.501 11.368 -1.053 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.195 11.240 -1.583 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.232 9.767 -1.317 1.00 0.00 H new ATOM 477 N LEU A 87 -3.026 7.161 -2.173 1.00 0.00 N ATOM 478 CA LEU A 87 -3.414 6.468 -0.937 1.00 0.00 C ATOM 479 C LEU A 87 -3.284 7.410 0.245 1.00 0.00 C ATOM 480 O LEU A 87 -2.342 8.177 0.425 1.00 0.00 O ATOM 481 CB LEU A 87 -2.626 5.195 -0.658 1.00 0.00 C ATOM 482 CG LEU A 87 -2.375 4.297 -1.875 1.00 0.00 C ATOM 483 CD1 LEU A 87 -1.450 3.144 -1.465 1.00 0.00 C ATOM 484 CD2 LEU A 87 -3.675 3.746 -2.459 1.00 0.00 C ATOM 0 H LEU A 87 -2.051 7.042 -2.448 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.450 6.161 -1.082 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.664 5.471 -0.227 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.159 4.616 0.096 1.00 0.00 H new ATOM 0 HG LEU A 87 -1.904 4.899 -2.652 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.267 2.501 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.503 3.547 -1.105 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.922 2.564 -0.672 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.449 3.116 -3.319 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.192 3.156 -1.702 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.312 4.573 -2.773 1.00 0.00 H new ATOM 485 N TYR A 88 -4.432 7.450 0.882 1.00 0.00 N ATOM 486 CA TYR A 88 -4.691 8.259 2.079 1.00 0.00 C ATOM 487 C TYR A 88 -5.188 7.415 3.264 1.00 0.00 C ATOM 488 O TYR A 88 -5.476 6.222 3.111 1.00 0.00 O ATOM 489 CB TYR A 88 -5.648 9.431 1.769 1.00 0.00 C ATOM 490 CG TYR A 88 -6.998 9.010 1.204 1.00 0.00 C ATOM 491 CD1 TYR A 88 -8.065 8.661 2.062 1.00 0.00 C ATOM 492 CD2 TYR A 88 -7.112 8.899 -0.198 1.00 0.00 C ATOM 493 CE1 TYR A 88 -9.244 8.141 1.499 1.00 0.00 C ATOM 494 CE2 TYR A 88 -8.292 8.369 -0.741 1.00 0.00 C ATOM 495 CZ TYR A 88 -9.338 7.970 0.108 1.00 0.00 C ATOM 496 OH TYR A 88 -10.397 7.312 -0.433 1.00 0.00 O ATOM 0 H TYR A 88 -5.243 6.909 0.583 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.735 8.685 2.385 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -5.813 10.001 2.683 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -5.164 10.101 1.059 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -7.977 8.791 3.130 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.305 9.216 -0.842 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -10.075 7.874 2.135 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -8.396 8.268 -1.811 1.00 0.00 H new ATOM 0 HH TYR A 88 -10.127 6.896 -1.278 1.00 0.00 H new ATOM 497 N GLY A 89 -5.065 8.026 4.425 1.00 0.00 N ATOM 498 CA GLY A 89 -5.606 7.552 5.709 1.00 0.00 C ATOM 499 C GLY A 89 -7.089 7.890 5.793 1.00 0.00 C ATOM 500 O GLY A 89 -7.467 9.057 5.659 1.00 0.00 O ATOM 0 H GLY A 89 -4.563 8.909 4.517 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.462 6.475 5.801 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.069 8.017 6.536 1.00 0.00 H new ATOM 501 N SER A 90 -7.900 6.833 5.744 1.00 0.00 N ATOM 502 CA SER A 90 -9.363 6.981 5.868 1.00 0.00 C ATOM 503 C SER A 90 -10.009 6.216 7.011 1.00 0.00 C ATOM 504 O SER A 90 -9.832 5.018 7.223 1.00 0.00 O ATOM 505 CB SER A 90 -10.076 6.665 4.550 1.00 0.00 C ATOM 506 OG SER A 90 -11.440 7.104 4.615 1.00 0.00 O ATOM 0 H SER A 90 -7.580 5.872 5.621 1.00 0.00 H new ATOM 0 HA SER A 90 -9.494 8.034 6.118 1.00 0.00 H new ATOM 0 HB2 SER A 90 -9.565 7.158 3.723 1.00 0.00 H new ATOM 0 HB3 SER A 90 -10.039 5.593 4.354 1.00 0.00 H new ATOM 0 HG SER A 90 -11.890 6.900 3.769 1.00 0.00 H new ATOM 507 N GLN A 91 -11.020 6.938 7.440 1.00 0.00 N ATOM 508 CA GLN A 91 -11.989 6.600 8.500 1.00 0.00 C ATOM 509 C GLN A 91 -13.046 5.562 8.078 1.00 0.00 C ATOM 510 O GLN A 91 -13.741 4.996 8.921 1.00 0.00 O ATOM 511 CB GLN A 91 -12.585 7.946 8.923 1.00 0.00 C ATOM 512 CG GLN A 91 -13.457 8.518 7.813 1.00 0.00 C ATOM 513 CD GLN A 91 -14.012 9.914 8.117 1.00 0.00 C ATOM 514 OE1 GLN A 91 -15.109 10.115 8.605 1.00 0.00 O ATOM 515 NE2 GLN A 91 -13.246 10.910 7.745 1.00 0.00 N ATOM 0 H GLN A 91 -11.216 7.853 7.034 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.502 6.095 9.334 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -13.177 7.819 9.829 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.784 8.646 9.161 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -12.875 8.562 6.893 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -14.290 7.838 7.631 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -12.329 10.724 7.338 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -13.566 11.871 7.863 1.00 0.00 H new ATOM 516 N THR A 92 -13.200 5.410 6.756 1.00 0.00 N ATOM 517 CA THR A 92 -14.267 4.591 6.155 1.00 0.00 C ATOM 518 C THR A 92 -13.718 3.486 5.241 1.00 0.00 C ATOM 519 O THR A 92 -13.159 3.800 4.177 1.00 0.00 O ATOM 520 CB THR A 92 -15.235 5.443 5.334 1.00 0.00 C ATOM 521 OG1 THR A 92 -14.510 6.159 4.332 1.00 0.00 O ATOM 522 CG2 THR A 92 -16.082 6.397 6.195 1.00 0.00 C ATOM 0 H THR A 92 -12.588 5.851 6.070 1.00 0.00 H new ATOM 0 HA THR A 92 -14.788 4.134 6.996 1.00 0.00 H new ATOM 0 HB THR A 92 -15.944 4.766 4.859 1.00 0.00 H new ATOM 0 HG1 THR A 92 -13.782 5.598 3.991 1.00 0.00 H new ATOM 0 HG21 THR A 92 -16.748 6.973 5.552 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.673 5.818 6.905 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.425 7.076 6.739 1.00 0.00 H new ATOM 523 N PRO A 93 -13.902 2.224 5.619 1.00 0.00 N ATOM 524 CA PRO A 93 -13.603 1.086 4.732 1.00 0.00 C ATOM 525 C PRO A 93 -14.610 1.008 3.571 1.00 0.00 C ATOM 526 O PRO A 93 -15.794 1.308 3.718 1.00 0.00 O ATOM 527 CB PRO A 93 -13.593 -0.133 5.643 1.00 0.00 C ATOM 528 CG PRO A 93 -14.489 0.249 6.813 1.00 0.00 C ATOM 529 CD PRO A 93 -14.283 1.761 6.965 1.00 0.00 C ATOM 0 HA PRO A 93 -12.641 1.176 4.228 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -13.971 -1.016 5.127 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -12.583 -0.368 5.978 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -15.533 0.007 6.611 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.208 -0.285 7.721 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -15.193 2.252 7.310 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -13.505 1.983 7.695 1.00 0.00 H new ATOM 530 N ASN A 94 -14.016 0.883 2.398 1.00 0.00 N ATOM 531 CA ASN A 94 -14.732 0.876 1.110 1.00 0.00 C ATOM 532 C ASN A 94 -13.993 -0.018 0.098 1.00 0.00 C ATOM 533 O ASN A 94 -12.813 -0.328 0.291 1.00 0.00 O ATOM 534 CB ASN A 94 -14.728 2.336 0.620 1.00 0.00 C ATOM 535 CG ASN A 94 -15.951 2.626 -0.244 1.00 0.00 C ATOM 536 OD1 ASN A 94 -15.956 2.426 -1.454 1.00 0.00 O ATOM 537 ND2 ASN A 94 -17.060 2.887 0.404 1.00 0.00 N ATOM 0 H ASN A 94 -13.006 0.781 2.299 1.00 0.00 H new ATOM 0 HA ASN A 94 -15.745 0.487 1.216 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -14.715 3.011 1.476 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -13.820 2.529 0.048 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -17.947 2.926 -0.098 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -17.036 3.051 1.411 1.00 0.00 H new ATOM 538 N GLU A 95 -14.589 -0.093 -1.089 1.00 0.00 N ATOM 539 CA GLU A 95 -14.061 -0.659 -2.353 1.00 0.00 C ATOM 540 C GLU A 95 -12.631 -0.197 -2.717 1.00 0.00 C ATOM 541 O GLU A 95 -11.858 -0.911 -3.359 1.00 0.00 O ATOM 542 CB GLU A 95 -14.973 -0.146 -3.473 1.00 0.00 C ATOM 543 CG GLU A 95 -15.766 -1.253 -4.192 1.00 0.00 C ATOM 544 CD GLU A 95 -16.951 -1.793 -3.375 1.00 0.00 C ATOM 545 OE1 GLU A 95 -16.782 -2.051 -2.163 1.00 0.00 O ATOM 546 OE2 GLU A 95 -18.023 -1.951 -3.996 1.00 0.00 O ATOM 0 H GLU A 95 -15.535 0.268 -1.215 1.00 0.00 H new ATOM 0 HA GLU A 95 -14.033 -1.742 -2.232 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -15.674 0.576 -3.054 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -14.367 0.387 -4.206 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -16.137 -0.865 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -15.092 -2.077 -4.426 1.00 0.00 H new ATOM 547 N GLU A 96 -12.336 0.995 -2.224 1.00 0.00 N ATOM 548 CA GLU A 96 -11.109 1.775 -2.491 1.00 0.00 C ATOM 549 C GLU A 96 -9.934 1.305 -1.638 1.00 0.00 C ATOM 550 O GLU A 96 -8.770 1.344 -2.025 1.00 0.00 O ATOM 551 CB GLU A 96 -11.375 3.223 -2.084 1.00 0.00 C ATOM 552 CG GLU A 96 -12.381 3.925 -2.995 1.00 0.00 C ATOM 553 CD GLU A 96 -12.788 5.302 -2.450 1.00 0.00 C ATOM 554 OE1 GLU A 96 -13.192 5.339 -1.254 1.00 0.00 O ATOM 555 OE2 GLU A 96 -12.747 6.262 -3.239 1.00 0.00 O ATOM 0 H GLU A 96 -12.971 1.482 -1.592 1.00 0.00 H new ATOM 0 HA GLU A 96 -10.863 1.657 -3.546 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.745 3.244 -1.059 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -10.436 3.776 -2.095 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -11.950 4.042 -3.989 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -13.268 3.301 -3.104 1.00 0.00 H new ATOM 556 N CYS A 97 -10.336 1.022 -0.412 1.00 0.00 N ATOM 557 CA CYS A 97 -9.504 0.589 0.707 1.00 0.00 C ATOM 558 C CYS A 97 -9.111 -0.898 0.632 1.00 0.00 C ATOM 559 O CYS A 97 -8.396 -1.422 1.469 1.00 0.00 O ATOM 560 CB CYS A 97 -10.330 0.792 1.978 1.00 0.00 C ATOM 561 SG CYS A 97 -11.175 2.416 2.129 1.00 0.00 S ATOM 0 H CYS A 97 -11.319 1.092 -0.149 1.00 0.00 H new ATOM 0 HA CYS A 97 -8.581 1.168 0.690 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -11.083 0.005 2.029 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -9.675 0.663 2.839 1.00 0.00 H new ATOM 0 HG CYS A 97 -11.266 2.743 3.384 1.00 0.00 H new ATOM 562 N LEU A 98 -9.745 -1.573 -0.325 1.00 0.00 N ATOM 563 CA LEU A 98 -9.510 -2.991 -0.633 1.00 0.00 C ATOM 564 C LEU A 98 -8.368 -3.152 -1.630 1.00 0.00 C ATOM 565 O LEU A 98 -8.370 -2.643 -2.740 1.00 0.00 O ATOM 566 CB LEU A 98 -10.810 -3.592 -1.147 1.00 0.00 C ATOM 567 CG LEU A 98 -11.701 -3.859 0.063 1.00 0.00 C ATOM 568 CD1 LEU A 98 -13.166 -3.911 -0.353 1.00 0.00 C ATOM 569 CD2 LEU A 98 -11.300 -5.086 0.878 1.00 0.00 C ATOM 0 H LEU A 98 -10.452 -1.145 -0.923 1.00 0.00 H new ATOM 0 HA LEU A 98 -9.205 -3.525 0.267 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.300 -2.909 -1.841 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.616 -4.516 -1.692 1.00 0.00 H new ATOM 0 HG LEU A 98 -11.555 -3.017 0.739 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -13.786 -4.102 0.523 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -13.452 -2.958 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.309 -4.710 -1.081 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -11.984 -5.204 1.719 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -11.345 -5.973 0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.284 -4.958 1.252 1.00 0.00 H new ATOM 570 N PHE A 99 -7.359 -3.794 -1.079 1.00 0.00 N ATOM 571 CA PHE A 99 -6.089 -4.004 -1.775 1.00 0.00 C ATOM 572 C PHE A 99 -5.834 -5.482 -2.062 1.00 0.00 C ATOM 573 O PHE A 99 -5.647 -6.320 -1.190 1.00 0.00 O ATOM 574 CB PHE A 99 -4.922 -3.414 -1.002 1.00 0.00 C ATOM 575 CG PHE A 99 -4.986 -1.885 -0.903 1.00 0.00 C ATOM 576 CD1 PHE A 99 -4.600 -1.122 -2.039 1.00 0.00 C ATOM 577 CD2 PHE A 99 -5.504 -1.249 0.241 1.00 0.00 C ATOM 578 CE1 PHE A 99 -4.741 0.277 -2.031 1.00 0.00 C ATOM 579 CE2 PHE A 99 -5.645 0.150 0.249 1.00 0.00 C ATOM 580 CZ PHE A 99 -5.269 0.903 -0.877 1.00 0.00 C ATOM 0 H PHE A 99 -7.387 -4.187 -0.138 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.170 -3.482 -2.729 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.906 -3.838 0.002 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -3.989 -3.703 -1.485 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -4.198 -1.618 -2.910 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -5.791 -1.830 1.105 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.451 0.863 -2.890 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.043 0.647 1.122 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.385 1.977 -0.861 1.00 0.00 H new ATOM 581 N LEU A 100 -6.128 -5.765 -3.315 1.00 0.00 N ATOM 582 CA LEU A 100 -6.021 -7.094 -3.904 1.00 0.00 C ATOM 583 C LEU A 100 -4.616 -7.672 -3.899 1.00 0.00 C ATOM 584 O LEU A 100 -3.722 -7.185 -4.599 1.00 0.00 O ATOM 585 CB LEU A 100 -6.585 -7.129 -5.320 1.00 0.00 C ATOM 586 CG LEU A 100 -7.717 -8.138 -5.273 1.00 0.00 C ATOM 587 CD1 LEU A 100 -8.861 -7.737 -6.205 1.00 0.00 C ATOM 588 CD2 LEU A 100 -7.282 -9.585 -5.568 1.00 0.00 C ATOM 0 H LEU A 100 -6.458 -5.060 -3.974 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.622 -7.729 -3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -6.946 -6.147 -5.624 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.823 -7.426 -6.040 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.065 -8.122 -4.240 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.655 -8.481 -6.147 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.252 -6.765 -5.904 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -8.492 -7.679 -7.229 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.149 -10.244 -5.515 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.847 -9.638 -6.566 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.542 -9.900 -4.832 1.00 0.00 H new ATOM 589 N GLU A 101 -4.459 -8.551 -2.927 1.00 0.00 N ATOM 590 CA GLU A 101 -3.274 -9.411 -2.814 1.00 0.00 C ATOM 591 C GLU A 101 -3.063 -10.270 -4.061 1.00 0.00 C ATOM 592 O GLU A 101 -3.642 -11.345 -4.238 1.00 0.00 O ATOM 593 CB GLU A 101 -3.339 -10.332 -1.604 1.00 0.00 C ATOM 594 CG GLU A 101 -3.340 -9.621 -0.254 1.00 0.00 C ATOM 595 CD GLU A 101 -3.224 -10.640 0.877 1.00 0.00 C ATOM 596 OE1 GLU A 101 -4.273 -11.239 1.216 1.00 0.00 O ATOM 597 OE2 GLU A 101 -2.078 -10.821 1.340 1.00 0.00 O ATOM 0 H GLU A 101 -5.146 -8.697 -2.187 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.435 -8.725 -2.699 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -4.240 -10.942 -1.678 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.489 -11.014 -1.639 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.510 -8.916 -0.205 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -4.257 -9.042 -0.140 1.00 0.00 H new ATOM 598 N ARG A 102 -2.238 -9.723 -4.942 1.00 0.00 N ATOM 599 CA ARG A 102 -1.669 -10.439 -6.086 1.00 0.00 C ATOM 600 C ARG A 102 -0.191 -10.647 -5.740 1.00 0.00 C ATOM 601 O ARG A 102 0.664 -9.780 -5.891 1.00 0.00 O ATOM 602 CB ARG A 102 -1.832 -9.610 -7.368 1.00 0.00 C ATOM 603 CG ARG A 102 -1.213 -10.356 -8.551 1.00 0.00 C ATOM 604 CD ARG A 102 -1.145 -9.525 -9.841 1.00 0.00 C ATOM 605 NE ARG A 102 -2.469 -9.476 -10.495 1.00 0.00 N ATOM 606 CZ ARG A 102 -2.730 -8.939 -11.688 1.00 0.00 C ATOM 607 NH1 ARG A 102 -1.848 -8.202 -12.369 1.00 0.00 N ATOM 608 NH2 ARG A 102 -3.954 -9.049 -12.192 1.00 0.00 N ATOM 0 H ARG A 102 -1.936 -8.750 -4.885 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.169 -11.390 -6.269 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -2.889 -9.422 -7.558 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -1.352 -8.639 -7.247 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -0.206 -10.674 -8.281 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -1.792 -11.259 -8.742 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -0.808 -8.514 -9.612 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -0.412 -9.958 -10.522 1.00 0.00 H new ATOM 0 HE ARG A 102 -3.253 -9.889 -9.990 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -0.922 -8.026 -11.980 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -2.101 -7.815 -13.278 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.679 -9.539 -11.668 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.169 -8.644 -13.103 1.00 0.00 H new ATOM 609 N LEU A 103 -0.042 -11.675 -4.918 1.00 0.00 N ATOM 610 CA LEU A 103 1.279 -12.215 -4.584 1.00 0.00 C ATOM 611 C LEU A 103 1.799 -12.941 -5.828 1.00 0.00 C ATOM 612 O LEU A 103 1.212 -13.876 -6.364 1.00 0.00 O ATOM 613 CB LEU A 103 1.222 -13.075 -3.324 1.00 0.00 C ATOM 614 CG LEU A 103 2.611 -13.534 -2.849 1.00 0.00 C ATOM 615 CD1 LEU A 103 2.625 -13.593 -1.318 1.00 0.00 C ATOM 616 CD2 LEU A 103 3.029 -14.880 -3.454 1.00 0.00 C ATOM 0 H LEU A 103 -0.819 -12.157 -4.466 1.00 0.00 H new ATOM 0 HA LEU A 103 1.986 -11.425 -4.330 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.739 -12.510 -2.526 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.601 -13.950 -3.516 1.00 0.00 H new ATOM 0 HG LEU A 103 3.343 -12.806 -3.198 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.607 -13.918 -0.975 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.408 -12.604 -0.914 1.00 0.00 H new ATOM 0 HD13 LEU A 103 1.869 -14.299 -0.974 1.00 0.00 H new ATOM 0 HD21 LEU A 103 4.017 -15.154 -3.084 1.00 0.00 H new ATOM 0 HD22 LEU A 103 2.309 -15.647 -3.168 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.059 -14.797 -4.540 1.00 0.00 H new ATOM 617 N GLU A 104 2.789 -12.253 -6.367 1.00 0.00 N ATOM 618 CA GLU A 104 3.326 -12.439 -7.731 1.00 0.00 C ATOM 619 C GLU A 104 4.149 -13.712 -8.012 1.00 0.00 C ATOM 620 O GLU A 104 4.989 -13.705 -8.913 1.00 0.00 O ATOM 621 CB GLU A 104 4.119 -11.162 -8.033 1.00 0.00 C ATOM 622 CG GLU A 104 3.259 -9.889 -8.142 1.00 0.00 C ATOM 623 CD GLU A 104 2.482 -9.706 -9.451 1.00 0.00 C ATOM 624 OE1 GLU A 104 2.117 -10.719 -10.095 1.00 0.00 O ATOM 625 OE2 GLU A 104 2.297 -8.537 -9.823 1.00 0.00 O ATOM 0 H GLU A 104 3.271 -11.514 -5.856 1.00 0.00 H new ATOM 0 HA GLU A 104 2.481 -12.603 -8.400 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.863 -11.017 -7.250 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.663 -11.299 -8.968 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.546 -9.886 -7.317 1.00 0.00 H new ATOM 0 HG3 GLU A 104 3.908 -9.024 -8.006 1.00 0.00 H new ATOM 626 N GLU A 105 3.772 -14.845 -7.416 1.00 0.00 N ATOM 627 CA GLU A 105 4.513 -16.139 -7.448 1.00 0.00 C ATOM 628 C GLU A 105 5.905 -16.078 -6.783 1.00 0.00 C ATOM 629 O GLU A 105 6.356 -17.034 -6.157 1.00 0.00 O ATOM 630 CB GLU A 105 4.673 -16.748 -8.856 1.00 0.00 C ATOM 631 CG GLU A 105 3.364 -17.279 -9.460 1.00 0.00 C ATOM 632 CD GLU A 105 2.369 -16.167 -9.842 1.00 0.00 C ATOM 633 OE1 GLU A 105 2.732 -15.344 -10.708 1.00 0.00 O ATOM 634 OE2 GLU A 105 1.273 -16.176 -9.244 1.00 0.00 O ATOM 0 H GLU A 105 2.911 -14.904 -6.873 1.00 0.00 H new ATOM 0 HA GLU A 105 3.866 -16.791 -6.862 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.088 -15.992 -9.523 1.00 0.00 H new ATOM 0 HB3 GLU A 105 5.396 -17.563 -8.808 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.595 -17.869 -10.347 1.00 0.00 H new ATOM 0 HG3 GLU A 105 2.889 -17.951 -8.745 1.00 0.00 H new ATOM 635 N ASN A 106 6.620 -14.992 -7.075 1.00 0.00 N ATOM 636 CA ASN A 106 7.747 -14.522 -6.262 1.00 0.00 C ATOM 637 C ASN A 106 7.198 -13.977 -4.938 1.00 0.00 C ATOM 638 O ASN A 106 6.004 -13.706 -4.802 1.00 0.00 O ATOM 639 CB ASN A 106 8.567 -13.476 -7.034 1.00 0.00 C ATOM 640 CG ASN A 106 7.753 -12.283 -7.553 1.00 0.00 C ATOM 641 OD1 ASN A 106 7.248 -11.466 -6.808 1.00 0.00 O ATOM 642 ND2 ASN A 106 7.587 -12.214 -8.865 1.00 0.00 N ATOM 0 H ASN A 106 6.434 -14.407 -7.889 1.00 0.00 H new ATOM 0 HA ASN A 106 8.428 -15.344 -6.040 1.00 0.00 H new ATOM 0 HB2 ASN A 106 9.360 -13.104 -6.385 1.00 0.00 H new ATOM 0 HB3 ASN A 106 9.051 -13.965 -7.880 1.00 0.00 H new ATOM 0 HD21 ASN A 106 7.026 -11.464 -9.269 1.00 0.00 H new ATOM 0 HD22 ASN A 106 8.020 -12.911 -9.471 1.00 0.00 H new ATOM 643 N HIS A 107 8.096 -13.869 -3.969 1.00 0.00 N ATOM 644 CA HIS A 107 7.808 -13.421 -2.592 1.00 0.00 C ATOM 645 C HIS A 107 6.886 -12.189 -2.492 1.00 0.00 C ATOM 646 O HIS A 107 6.026 -12.105 -1.611 1.00 0.00 O ATOM 647 CB HIS A 107 9.128 -13.090 -1.907 1.00 0.00 C ATOM 648 CG HIS A 107 9.002 -13.261 -0.388 1.00 0.00 C ATOM 649 ND1 HIS A 107 7.922 -13.000 0.360 1.00 0.00 N ATOM 650 CD2 HIS A 107 9.908 -13.834 0.392 1.00 0.00 C ATOM 651 CE1 HIS A 107 8.162 -13.398 1.592 1.00 0.00 C ATOM 652 NE2 HIS A 107 9.386 -13.918 1.616 1.00 0.00 N ATOM 0 H HIS A 107 9.080 -14.095 -4.113 1.00 0.00 H new ATOM 0 HA HIS A 107 7.275 -14.241 -2.111 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.915 -13.740 -2.288 1.00 0.00 H new ATOM 0 HB3 HIS A 107 9.419 -12.066 -2.141 1.00 0.00 H new ATOM 0 HD1 HIS A 107 7.059 -12.566 0.031 1.00 0.00 H new ATOM 0 HD2 HIS A 107 10.889 -14.171 0.091 1.00 0.00 H new ATOM 0 HE1 HIS A 107 7.487 -13.317 2.431 1.00 0.00 H new ATOM 653 N TYR A 108 7.070 -11.287 -3.450 1.00 0.00 N ATOM 654 CA TYR A 108 6.390 -9.993 -3.538 1.00 0.00 C ATOM 655 C TYR A 108 4.871 -10.115 -3.574 1.00 0.00 C ATOM 656 O TYR A 108 4.235 -10.541 -4.541 1.00 0.00 O ATOM 657 CB TYR A 108 6.917 -9.189 -4.722 1.00 0.00 C ATOM 658 CG TYR A 108 8.360 -8.767 -4.446 1.00 0.00 C ATOM 659 CD1 TYR A 108 8.551 -7.755 -3.484 1.00 0.00 C ATOM 660 CD2 TYR A 108 9.422 -9.608 -4.864 1.00 0.00 C ATOM 661 CE1 TYR A 108 9.804 -7.615 -2.880 1.00 0.00 C ATOM 662 CE2 TYR A 108 10.684 -9.468 -4.251 1.00 0.00 C ATOM 663 CZ TYR A 108 10.855 -8.466 -3.269 1.00 0.00 C ATOM 664 OH TYR A 108 12.098 -8.146 -2.845 1.00 0.00 O ATOM 0 H TYR A 108 7.722 -11.440 -4.219 1.00 0.00 H new ATOM 0 HA TYR A 108 6.621 -9.452 -2.621 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.869 -9.787 -5.632 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.294 -8.310 -4.885 1.00 0.00 H new ATOM 0 HD1 TYR A 108 7.739 -7.095 -3.216 1.00 0.00 H new ATOM 0 HD2 TYR A 108 9.267 -10.344 -5.639 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.964 -6.862 -2.123 1.00 0.00 H new ATOM 0 HE2 TYR A 108 11.504 -10.114 -4.527 1.00 0.00 H new ATOM 0 HH TYR A 108 12.175 -7.173 -2.761 1.00 0.00 H new ATOM 665 N ASN A 109 4.375 -9.379 -2.600 1.00 0.00 N ATOM 666 CA ASN A 109 2.941 -9.331 -2.305 1.00 0.00 C ATOM 667 C ASN A 109 2.472 -7.914 -2.601 1.00 0.00 C ATOM 668 O ASN A 109 2.827 -6.931 -1.947 1.00 0.00 O ATOM 669 CB ASN A 109 2.618 -9.693 -0.859 1.00 0.00 C ATOM 670 CG ASN A 109 1.127 -9.945 -0.605 1.00 0.00 C ATOM 671 OD1 ASN A 109 0.233 -9.623 -1.385 1.00 0.00 O ATOM 672 ND2 ASN A 109 0.829 -10.477 0.552 1.00 0.00 N ATOM 0 H ASN A 109 4.945 -8.796 -1.987 1.00 0.00 H new ATOM 0 HA ASN A 109 2.428 -10.069 -2.922 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.180 -10.585 -0.583 1.00 0.00 H new ATOM 0 HB3 ASN A 109 2.957 -8.888 -0.208 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -0.147 -10.626 0.809 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.572 -10.743 1.197 1.00 0.00 H new ATOM 673 N THR A 110 1.694 -7.891 -3.659 1.00 0.00 N ATOM 674 CA THR A 110 1.442 -6.643 -4.382 1.00 0.00 C ATOM 675 C THR A 110 -0.059 -6.395 -4.499 1.00 0.00 C ATOM 676 O THR A 110 -0.851 -7.322 -4.607 1.00 0.00 O ATOM 677 CB THR A 110 2.136 -6.588 -5.755 1.00 0.00 C ATOM 678 OG1 THR A 110 1.463 -7.403 -6.712 1.00 0.00 O ATOM 679 CG2 THR A 110 3.619 -6.976 -5.688 1.00 0.00 C ATOM 0 H THR A 110 1.223 -8.710 -4.044 1.00 0.00 H new ATOM 0 HA THR A 110 1.886 -5.837 -3.797 1.00 0.00 H new ATOM 0 HB THR A 110 2.083 -5.547 -6.075 1.00 0.00 H new ATOM 0 HG1 THR A 110 1.386 -8.317 -6.367 1.00 0.00 H new ATOM 0 HG21 THR A 110 4.055 -6.919 -6.685 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.144 -6.291 -5.022 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.712 -7.994 -5.309 1.00 0.00 H new ATOM 680 N TYR A 111 -0.390 -5.118 -4.453 1.00 0.00 N ATOM 681 CA TYR A 111 -1.767 -4.679 -4.168 1.00 0.00 C ATOM 682 C TYR A 111 -2.362 -3.844 -5.294 1.00 0.00 C ATOM 683 O TYR A 111 -1.764 -2.879 -5.758 1.00 0.00 O ATOM 684 CB TYR A 111 -1.788 -3.879 -2.848 1.00 0.00 C ATOM 685 CG TYR A 111 -1.334 -4.715 -1.653 1.00 0.00 C ATOM 686 CD1 TYR A 111 -1.998 -5.931 -1.350 1.00 0.00 C ATOM 687 CD2 TYR A 111 -0.185 -4.306 -0.940 1.00 0.00 C ATOM 688 CE1 TYR A 111 -1.492 -6.756 -0.344 1.00 0.00 C ATOM 689 CE2 TYR A 111 0.320 -5.131 0.085 1.00 0.00 C ATOM 690 CZ TYR A 111 -0.343 -6.347 0.368 1.00 0.00 C ATOM 691 OH TYR A 111 0.194 -7.212 1.264 1.00 0.00 O ATOM 0 H TYR A 111 0.269 -4.355 -4.608 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.384 -5.573 -4.078 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.141 -3.007 -2.945 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -2.797 -3.509 -2.667 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -2.887 -6.216 -1.893 1.00 0.00 H new ATOM 0 HD2 TYR A 111 0.301 -3.371 -1.178 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -1.973 -7.695 -0.113 1.00 0.00 H new ATOM 0 HE2 TYR A 111 1.197 -4.840 0.644 1.00 0.00 H new ATOM 0 HH TYR A 111 -0.173 -8.108 1.114 1.00 0.00 H new ATOM 692 N ILE A 112 -3.431 -4.413 -5.826 1.00 0.00 N ATOM 693 CA ILE A 112 -4.286 -3.720 -6.816 1.00 0.00 C ATOM 694 C ILE A 112 -5.509 -3.230 -6.039 1.00 0.00 C ATOM 695 O ILE A 112 -6.209 -4.016 -5.397 1.00 0.00 O ATOM 696 CB ILE A 112 -4.806 -4.625 -7.941 1.00 0.00 C ATOM 697 CG1 ILE A 112 -3.743 -5.586 -8.470 1.00 0.00 C ATOM 698 CG2 ILE A 112 -5.311 -3.719 -9.077 1.00 0.00 C ATOM 699 CD1 ILE A 112 -4.314 -6.761 -9.266 1.00 0.00 C ATOM 0 H ILE A 112 -3.741 -5.357 -5.597 1.00 0.00 H new ATOM 0 HA ILE A 112 -3.691 -2.937 -7.287 1.00 0.00 H new ATOM 0 HB ILE A 112 -5.607 -5.248 -7.542 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.050 -5.033 -9.104 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -3.167 -5.974 -7.630 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -5.688 -4.335 -9.893 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -6.112 -3.081 -8.704 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -4.491 -3.099 -9.439 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.499 -7.399 -9.608 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -4.985 -7.339 -8.631 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -4.865 -6.383 -10.127 1.00 0.00 H new ATOM 700 N SER A 113 -5.729 -1.932 -6.082 1.00 0.00 N ATOM 701 CA SER A 113 -6.931 -1.361 -5.445 1.00 0.00 C ATOM 702 C SER A 113 -8.189 -1.822 -6.189 1.00 0.00 C ATOM 703 O SER A 113 -8.439 -1.464 -7.342 1.00 0.00 O ATOM 704 CB SER A 113 -6.874 0.169 -5.374 1.00 0.00 C ATOM 705 OG SER A 113 -8.065 0.650 -4.747 1.00 0.00 O ATOM 0 H SER A 113 -5.117 -1.254 -6.536 1.00 0.00 H new ATOM 0 HA SER A 113 -6.968 -1.727 -4.419 1.00 0.00 H new ATOM 0 HB2 SER A 113 -5.997 0.487 -4.811 1.00 0.00 H new ATOM 0 HB3 SER A 113 -6.779 0.589 -6.375 1.00 0.00 H new ATOM 0 HG SER A 113 -7.901 0.781 -3.790 1.00 0.00 H new ATOM 706 N LYS A 114 -8.869 -2.747 -5.506 1.00 0.00 N ATOM 707 CA LYS A 114 -10.048 -3.497 -5.979 1.00 0.00 C ATOM 708 C LYS A 114 -10.994 -2.685 -6.879 1.00 0.00 C ATOM 709 O LYS A 114 -11.299 -3.097 -7.993 1.00 0.00 O ATOM 710 CB LYS A 114 -10.817 -4.013 -4.757 1.00 0.00 C ATOM 711 CG LYS A 114 -11.945 -4.972 -5.100 1.00 0.00 C ATOM 712 CD LYS A 114 -13.138 -4.692 -4.173 1.00 0.00 C ATOM 713 CE LYS A 114 -14.219 -5.761 -4.234 1.00 0.00 C ATOM 714 NZ LYS A 114 -14.773 -5.835 -5.600 1.00 0.00 N ATOM 0 H LYS A 114 -8.602 -3.011 -4.558 1.00 0.00 H new ATOM 0 HA LYS A 114 -9.678 -4.313 -6.600 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -10.119 -4.513 -4.085 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.229 -3.163 -4.213 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -12.241 -4.849 -6.142 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -11.611 -6.003 -4.983 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -12.779 -4.608 -3.147 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -13.575 -3.729 -4.437 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -13.804 -6.727 -3.947 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -15.012 -5.530 -3.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -15.589 -6.480 -5.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -15.077 -4.888 -5.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -14.044 -6.190 -6.252 1.00 0.00 H new ATOM 715 N LYS A 115 -11.330 -1.477 -6.403 1.00 0.00 N ATOM 716 CA LYS A 115 -12.140 -0.464 -7.112 1.00 0.00 C ATOM 717 C LYS A 115 -11.785 -0.331 -8.618 1.00 0.00 C ATOM 718 O LYS A 115 -12.666 -0.229 -9.468 1.00 0.00 O ATOM 719 CB LYS A 115 -11.919 0.858 -6.380 1.00 0.00 C ATOM 720 CG LYS A 115 -12.692 2.022 -7.009 1.00 0.00 C ATOM 721 CD LYS A 115 -12.077 3.337 -6.562 1.00 0.00 C ATOM 722 CE LYS A 115 -12.497 4.493 -7.467 1.00 0.00 C ATOM 723 NZ LYS A 115 -11.722 4.429 -8.708 1.00 0.00 N ATOM 0 H LYS A 115 -11.036 -1.163 -5.478 1.00 0.00 H new ATOM 0 HA LYS A 115 -13.187 -0.766 -7.100 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -12.223 0.747 -5.339 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -10.855 1.093 -6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -12.664 1.946 -8.096 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -13.740 1.979 -6.713 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -12.378 3.550 -5.536 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -10.990 3.250 -6.563 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -13.563 4.433 -7.685 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -12.327 5.446 -6.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -11.976 5.232 -9.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -10.707 4.471 -8.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -11.932 3.539 -9.203 1.00 0.00 H new ATOM 724 N HIS A 116 -10.492 -0.281 -8.904 1.00 0.00 N ATOM 725 CA HIS A 116 -9.967 -0.267 -10.289 1.00 0.00 C ATOM 726 C HIS A 116 -9.033 -1.429 -10.658 1.00 0.00 C ATOM 727 O HIS A 116 -8.115 -1.282 -11.478 1.00 0.00 O ATOM 728 CB HIS A 116 -9.334 1.098 -10.582 1.00 0.00 C ATOM 729 CG HIS A 116 -10.379 2.140 -10.993 1.00 0.00 C ATOM 730 ND1 HIS A 116 -11.664 1.929 -11.247 1.00 0.00 N ATOM 731 CD2 HIS A 116 -10.084 3.372 -11.380 1.00 0.00 C ATOM 732 CE1 HIS A 116 -12.167 3.025 -11.823 1.00 0.00 C ATOM 733 NE2 HIS A 116 -11.183 3.913 -11.892 1.00 0.00 N ATOM 0 H HIS A 116 -9.764 -0.249 -8.190 1.00 0.00 H new ATOM 0 HA HIS A 116 -10.827 -0.428 -10.939 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -8.802 1.448 -9.697 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -8.596 0.992 -11.377 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -12.181 1.075 -11.038 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -9.120 3.852 -11.294 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -13.182 3.162 -12.167 1.00 0.00 H new ATOM 734 N ALA A 117 -9.438 -2.633 -10.243 1.00 0.00 N ATOM 735 CA ALA A 117 -8.744 -3.907 -10.575 1.00 0.00 C ATOM 736 C ALA A 117 -9.064 -4.460 -11.988 1.00 0.00 C ATOM 737 O ALA A 117 -9.151 -5.661 -12.229 1.00 0.00 O ATOM 738 CB ALA A 117 -9.058 -4.920 -9.478 1.00 0.00 C ATOM 0 H ALA A 117 -10.265 -2.765 -9.660 1.00 0.00 H new ATOM 0 HA ALA A 117 -7.673 -3.707 -10.613 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -8.559 -5.863 -9.700 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -8.705 -4.540 -8.520 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -10.135 -5.082 -9.429 1.00 0.00 H new ATOM 739 N GLU A 118 -9.201 -3.521 -12.920 1.00 0.00 N ATOM 740 CA GLU A 118 -9.464 -3.734 -14.353 1.00 0.00 C ATOM 741 C GLU A 118 -8.652 -2.777 -15.234 1.00 0.00 C ATOM 742 O GLU A 118 -8.247 -3.094 -16.350 1.00 0.00 O ATOM 743 CB GLU A 118 -10.962 -3.576 -14.659 1.00 0.00 C ATOM 744 CG GLU A 118 -11.799 -4.713 -14.078 1.00 0.00 C ATOM 745 CD GLU A 118 -13.278 -4.505 -14.365 1.00 0.00 C ATOM 746 OE1 GLU A 118 -13.722 -4.969 -15.440 1.00 0.00 O ATOM 747 OE2 GLU A 118 -13.932 -3.850 -13.522 1.00 0.00 O ATOM 0 H GLU A 118 -9.128 -2.530 -12.689 1.00 0.00 H new ATOM 0 HA GLU A 118 -9.153 -4.752 -14.586 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -11.314 -2.627 -14.255 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -11.107 -3.537 -15.739 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -11.473 -5.663 -14.502 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -11.639 -4.773 -13.001 1.00 0.00 H new ATOM 748 N LYS A 119 -8.567 -1.556 -14.723 1.00 0.00 N ATOM 749 CA LYS A 119 -7.552 -0.538 -15.072 1.00 0.00 C ATOM 750 C LYS A 119 -6.228 -0.807 -14.318 1.00 0.00 C ATOM 751 O LYS A 119 -5.262 -0.079 -14.497 1.00 0.00 O ATOM 752 CB LYS A 119 -8.227 0.776 -14.680 1.00 0.00 C ATOM 753 CG LYS A 119 -7.718 1.970 -15.474 1.00 0.00 C ATOM 754 CD LYS A 119 -8.503 3.224 -15.063 1.00 0.00 C ATOM 755 CE LYS A 119 -7.965 4.498 -15.737 1.00 0.00 C ATOM 756 NZ LYS A 119 -8.129 4.417 -17.199 1.00 0.00 N ATOM 0 H LYS A 119 -9.227 -1.221 -14.022 1.00 0.00 H new ATOM 0 HA LYS A 119 -7.260 -0.536 -16.122 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -9.303 0.682 -14.826 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -8.064 0.958 -13.618 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -6.654 2.117 -15.290 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.835 1.788 -16.542 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -9.553 3.094 -15.324 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -8.455 3.341 -13.980 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -8.494 5.370 -15.354 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.912 4.630 -15.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -7.872 5.329 -17.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.512 3.670 -17.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.119 4.195 -17.425 1.00 0.00 H new ATOM 757 N ASN A 120 -6.103 -2.056 -13.846 1.00 0.00 N ATOM 758 CA ASN A 120 -5.150 -2.538 -12.826 1.00 0.00 C ATOM 759 C ASN A 120 -4.317 -1.491 -12.067 1.00 0.00 C ATOM 760 O ASN A 120 -3.096 -1.511 -12.063 1.00 0.00 O ATOM 761 CB ASN A 120 -4.314 -3.672 -13.436 1.00 0.00 C ATOM 762 CG ASN A 120 -5.133 -4.958 -13.505 1.00 0.00 C ATOM 763 OD1 ASN A 120 -6.165 -5.047 -14.157 1.00 0.00 O ATOM 764 ND2 ASN A 120 -4.743 -5.945 -12.731 1.00 0.00 N ATOM 0 H ASN A 120 -6.702 -2.808 -14.186 1.00 0.00 H new ATOM 0 HA ASN A 120 -5.760 -2.910 -12.003 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.982 -3.391 -14.435 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -3.418 -3.835 -12.837 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -5.302 -6.796 -12.669 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -3.881 -5.860 -12.192 1.00 0.00 H new ATOM 765 N TRP A 121 -5.062 -0.717 -11.285 1.00 0.00 N ATOM 766 CA TRP A 121 -4.500 0.338 -10.429 1.00 0.00 C ATOM 767 C TRP A 121 -3.829 -0.227 -9.171 1.00 0.00 C ATOM 768 O TRP A 121 -4.427 -0.541 -8.148 1.00 0.00 O ATOM 769 CB TRP A 121 -5.561 1.389 -10.130 1.00 0.00 C ATOM 770 CG TRP A 121 -5.707 2.398 -11.272 1.00 0.00 C ATOM 771 CD1 TRP A 121 -5.422 2.260 -12.579 1.00 0.00 C ATOM 772 CD2 TRP A 121 -5.940 3.746 -11.065 1.00 0.00 C ATOM 773 NE1 TRP A 121 -5.435 3.439 -13.189 1.00 0.00 N ATOM 774 CE2 TRP A 121 -5.762 4.377 -12.313 1.00 0.00 C ATOM 775 CE3 TRP A 121 -6.159 4.504 -9.897 1.00 0.00 C ATOM 776 CZ2 TRP A 121 -5.802 5.777 -12.414 1.00 0.00 C ATOM 777 CZ3 TRP A 121 -6.250 5.894 -10.008 1.00 0.00 C ATOM 778 CH2 TRP A 121 -6.091 6.535 -11.257 1.00 0.00 C ATOM 0 H TRP A 121 -6.077 -0.799 -11.222 1.00 0.00 H new ATOM 0 HA TRP A 121 -3.696 0.834 -10.973 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -6.518 0.898 -9.955 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -5.301 1.916 -9.212 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -5.211 1.319 -13.066 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -5.226 3.597 -14.175 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -6.255 4.020 -8.936 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -5.615 6.266 -13.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -6.445 6.487 -9.126 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -6.191 7.608 -11.328 1.00 0.00 H new ATOM 779 N PHE A 122 -2.535 -0.366 -9.387 1.00 0.00 N ATOM 780 CA PHE A 122 -1.589 -1.068 -8.506 1.00 0.00 C ATOM 781 C PHE A 122 -0.756 -0.121 -7.637 1.00 0.00 C ATOM 782 O PHE A 122 -0.703 1.079 -7.887 1.00 0.00 O ATOM 783 CB PHE A 122 -0.603 -1.841 -9.386 1.00 0.00 C ATOM 784 CG PHE A 122 -0.800 -3.352 -9.468 1.00 0.00 C ATOM 785 CD1 PHE A 122 -0.305 -4.138 -8.402 1.00 0.00 C ATOM 786 CD2 PHE A 122 -1.071 -3.925 -10.731 1.00 0.00 C ATOM 787 CE1 PHE A 122 -0.041 -5.506 -8.619 1.00 0.00 C ATOM 788 CE2 PHE A 122 -0.808 -5.293 -10.948 1.00 0.00 C ATOM 789 CZ PHE A 122 -0.283 -6.068 -9.892 1.00 0.00 C ATOM 0 H PHE A 122 -2.083 0.021 -10.216 1.00 0.00 H new ATOM 0 HA PHE A 122 -2.179 -1.708 -7.849 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -0.657 -1.435 -10.396 1.00 0.00 H new ATOM 0 HB3 PHE A 122 0.405 -1.648 -9.019 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.131 -3.695 -7.432 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -1.478 -3.318 -11.526 1.00 0.00 H new ATOM 0 HE1 PHE A 122 0.343 -6.120 -7.818 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -1.006 -5.742 -11.910 1.00 0.00 H new ATOM 0 HZ PHE A 122 -0.062 -7.112 -10.061 1.00 0.00 H new ATOM 790 N VAL A 123 -0.092 -0.686 -6.630 1.00 0.00 N ATOM 791 CA VAL A 123 0.872 0.042 -5.779 1.00 0.00 C ATOM 792 C VAL A 123 2.226 0.403 -6.385 1.00 0.00 C ATOM 793 O VAL A 123 2.712 -0.273 -7.289 1.00 0.00 O ATOM 794 CB VAL A 123 1.073 -0.636 -4.407 1.00 0.00 C ATOM 795 CG1 VAL A 123 -0.110 -0.355 -3.470 1.00 0.00 C ATOM 796 CG2 VAL A 123 1.426 -2.123 -4.493 1.00 0.00 C ATOM 0 H VAL A 123 -0.202 -1.667 -6.373 1.00 0.00 H new ATOM 0 HA VAL A 123 0.369 1.002 -5.663 1.00 0.00 H new ATOM 0 HB VAL A 123 1.957 -0.176 -3.966 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.060 -0.846 -2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -0.205 0.720 -3.316 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -1.027 -0.740 -3.916 1.00 0.00 H new ATOM 0 HG21 VAL A 123 1.551 -2.526 -3.488 1.00 0.00 H new ATOM 0 HG22 VAL A 123 0.624 -2.658 -5.002 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.355 -2.245 -5.051 1.00 0.00 H new ATOM 797 N GLY A 124 2.682 1.587 -5.990 1.00 0.00 N ATOM 798 CA GLY A 124 4.002 2.118 -6.385 1.00 0.00 C ATOM 799 C GLY A 124 4.265 3.530 -5.862 1.00 0.00 C ATOM 800 O GLY A 124 3.367 4.353 -5.692 1.00 0.00 O ATOM 0 H GLY A 124 2.153 2.215 -5.385 1.00 0.00 H new ATOM 0 HA2 GLY A 124 4.780 1.450 -6.016 1.00 0.00 H new ATOM 0 HA3 GLY A 124 4.074 2.121 -7.473 1.00 0.00 H new ATOM 801 N LEU A 125 5.541 3.760 -5.628 1.00 0.00 N ATOM 802 CA LEU A 125 6.044 5.025 -5.063 1.00 0.00 C ATOM 803 C LEU A 125 6.608 6.009 -6.087 1.00 0.00 C ATOM 804 O LEU A 125 7.449 5.706 -6.928 1.00 0.00 O ATOM 805 CB LEU A 125 7.136 4.724 -4.021 1.00 0.00 C ATOM 806 CG LEU A 125 6.579 3.929 -2.837 1.00 0.00 C ATOM 807 CD1 LEU A 125 7.735 3.359 -2.024 1.00 0.00 C ATOM 808 CD2 LEU A 125 5.682 4.792 -1.967 1.00 0.00 C ATOM 0 H LEU A 125 6.275 3.078 -5.821 1.00 0.00 H new ATOM 0 HA LEU A 125 5.174 5.509 -4.619 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.943 4.162 -4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.566 5.659 -3.662 1.00 0.00 H new ATOM 0 HG LEU A 125 5.969 3.110 -3.219 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.342 2.792 -1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.334 2.702 -2.655 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.357 4.174 -1.655 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.302 4.199 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.253 5.636 -1.580 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.846 5.162 -2.561 1.00 0.00 H new ATOM 809 N LYS A 126 6.115 7.225 -5.883 1.00 0.00 N ATOM 810 CA LYS A 126 6.722 8.440 -6.426 1.00 0.00 C ATOM 811 C LYS A 126 8.001 8.641 -5.612 1.00 0.00 C ATOM 812 O LYS A 126 7.967 8.710 -4.382 1.00 0.00 O ATOM 813 CB LYS A 126 5.770 9.622 -6.227 1.00 0.00 C ATOM 814 CG LYS A 126 6.376 10.887 -6.820 1.00 0.00 C ATOM 815 CD LYS A 126 5.749 12.132 -6.197 1.00 0.00 C ATOM 816 CE LYS A 126 6.544 13.359 -6.649 1.00 0.00 C ATOM 817 NZ LYS A 126 6.096 14.505 -5.864 1.00 0.00 N ATOM 0 H LYS A 126 5.275 7.400 -5.331 1.00 0.00 H new ATOM 0 HA LYS A 126 6.929 8.365 -7.493 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.812 9.411 -6.702 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.574 9.767 -5.165 1.00 0.00 H new ATOM 0 HG2 LYS A 126 7.453 10.893 -6.651 1.00 0.00 H new ATOM 0 HG3 LYS A 126 6.222 10.898 -7.899 1.00 0.00 H new ATOM 0 HD2 LYS A 126 4.707 12.223 -6.502 1.00 0.00 H new ATOM 0 HD3 LYS A 126 5.757 12.056 -5.110 1.00 0.00 H new ATOM 0 HE2 LYS A 126 7.612 13.194 -6.506 1.00 0.00 H new ATOM 0 HE3 LYS A 126 6.389 13.542 -7.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 6.624 15.353 -6.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 5.080 14.659 -6.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 6.265 14.321 -4.854 1.00 0.00 H new ATOM 818 N LYS A 127 9.099 8.749 -6.360 1.00 0.00 N ATOM 819 CA LYS A 127 10.492 8.851 -5.855 1.00 0.00 C ATOM 820 C LYS A 127 10.672 9.713 -4.603 1.00 0.00 C ATOM 821 O LYS A 127 11.224 9.257 -3.607 1.00 0.00 O ATOM 822 CB LYS A 127 11.430 9.408 -6.934 1.00 0.00 C ATOM 823 CG LYS A 127 11.611 8.509 -8.162 1.00 0.00 C ATOM 824 CD LYS A 127 10.431 8.550 -9.146 1.00 0.00 C ATOM 825 CE LYS A 127 10.328 9.889 -9.877 1.00 0.00 C ATOM 826 NZ LYS A 127 9.148 9.809 -10.740 1.00 0.00 N ATOM 0 H LYS A 127 9.054 8.770 -7.379 1.00 0.00 H new ATOM 0 HA LYS A 127 10.742 7.825 -5.585 1.00 0.00 H new ATOM 0 HB2 LYS A 127 11.048 10.374 -7.263 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.408 9.588 -6.487 1.00 0.00 H new ATOM 0 HG2 LYS A 127 12.519 8.807 -8.687 1.00 0.00 H new ATOM 0 HG3 LYS A 127 11.758 7.482 -7.829 1.00 0.00 H new ATOM 0 HD2 LYS A 127 10.542 7.748 -9.876 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.504 8.362 -8.605 1.00 0.00 H new ATOM 0 HE2 LYS A 127 10.233 10.711 -9.167 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.226 10.078 -10.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 9.037 10.703 -11.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 9.265 9.027 -11.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 8.303 9.640 -10.158 1.00 0.00 H new ATOM 827 N ASN A 128 9.983 10.837 -4.640 1.00 0.00 N ATOM 828 CA ASN A 128 9.993 11.907 -3.620 1.00 0.00 C ATOM 829 C ASN A 128 9.092 11.600 -2.410 1.00 0.00 C ATOM 830 O ASN A 128 8.488 12.475 -1.787 1.00 0.00 O ATOM 831 CB ASN A 128 9.570 13.184 -4.345 1.00 0.00 C ATOM 832 CG ASN A 128 10.608 13.632 -5.364 1.00 0.00 C ATOM 833 OD1 ASN A 128 10.544 13.321 -6.545 1.00 0.00 O ATOM 834 ND2 ASN A 128 11.597 14.380 -4.913 1.00 0.00 N ATOM 0 H ASN A 128 9.362 11.055 -5.419 1.00 0.00 H new ATOM 0 HA ASN A 128 10.988 12.007 -3.187 1.00 0.00 H new ATOM 0 HB2 ASN A 128 8.617 13.017 -4.848 1.00 0.00 H new ATOM 0 HB3 ASN A 128 9.411 13.979 -3.616 1.00 0.00 H new ATOM 0 HD21 ASN A 128 12.322 14.707 -5.552 1.00 0.00 H new ATOM 0 HD22 ASN A 128 11.637 14.631 -3.925 1.00 0.00 H new ATOM 835 N GLY A 129 9.139 10.311 -2.059 1.00 0.00 N ATOM 836 CA GLY A 129 8.382 9.655 -0.968 1.00 0.00 C ATOM 837 C GLY A 129 6.870 9.912 -0.974 1.00 0.00 C ATOM 838 O GLY A 129 6.335 10.338 0.050 1.00 0.00 O ATOM 0 H GLY A 129 9.740 9.651 -2.553 1.00 0.00 H new ATOM 0 HA2 GLY A 129 8.552 8.580 -1.026 1.00 0.00 H new ATOM 0 HA3 GLY A 129 8.787 9.991 -0.014 1.00 0.00 H new ATOM 839 N SER A 130 6.175 9.506 -2.032 1.00 0.00 N ATOM 840 CA SER A 130 4.704 9.634 -2.068 1.00 0.00 C ATOM 841 C SER A 130 4.071 8.419 -2.745 1.00 0.00 C ATOM 842 O SER A 130 4.476 8.022 -3.840 1.00 0.00 O ATOM 843 CB SER A 130 4.292 10.891 -2.843 1.00 0.00 C ATOM 844 OG SER A 130 3.033 11.331 -2.327 1.00 0.00 O ATOM 0 H SER A 130 6.588 9.091 -2.867 1.00 0.00 H new ATOM 0 HA SER A 130 4.355 9.703 -1.038 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.044 11.672 -2.732 1.00 0.00 H new ATOM 0 HB3 SER A 130 4.213 10.674 -3.908 1.00 0.00 H new ATOM 0 HG SER A 130 2.747 12.137 -2.806 1.00 0.00 H new ATOM 845 N CYS A 131 3.069 7.841 -2.086 1.00 0.00 N ATOM 846 CA CYS A 131 2.284 6.724 -2.654 1.00 0.00 C ATOM 847 C CYS A 131 1.250 7.236 -3.656 1.00 0.00 C ATOM 848 O CYS A 131 0.056 7.406 -3.389 1.00 0.00 O ATOM 849 CB CYS A 131 1.578 5.929 -1.562 1.00 0.00 C ATOM 850 SG CYS A 131 2.645 4.908 -0.490 1.00 0.00 S ATOM 0 H CYS A 131 2.773 8.123 -1.152 1.00 0.00 H new ATOM 0 HA CYS A 131 2.987 6.068 -3.167 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.027 6.627 -0.932 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.843 5.277 -2.034 1.00 0.00 H new ATOM 0 HG CYS A 131 2.891 5.549 0.614 1.00 0.00 H new ATOM 851 N LYS A 132 1.860 7.581 -4.779 1.00 0.00 N ATOM 852 CA LYS A 132 1.227 8.235 -5.936 1.00 0.00 C ATOM 853 C LYS A 132 0.455 7.229 -6.805 1.00 0.00 C ATOM 854 O LYS A 132 -0.775 7.279 -6.868 1.00 0.00 O ATOM 855 CB LYS A 132 2.260 9.004 -6.755 1.00 0.00 C ATOM 856 CG LYS A 132 1.627 9.738 -7.942 1.00 0.00 C ATOM 857 CD LYS A 132 2.641 10.486 -8.791 1.00 0.00 C ATOM 858 CE LYS A 132 3.724 9.565 -9.359 1.00 0.00 C ATOM 859 NZ LYS A 132 4.489 10.311 -10.361 1.00 0.00 N ATOM 0 H LYS A 132 2.855 7.409 -4.925 1.00 0.00 H new ATOM 0 HA LYS A 132 0.499 8.951 -5.555 1.00 0.00 H new ATOM 0 HB2 LYS A 132 2.767 9.724 -6.113 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.019 8.313 -7.120 1.00 0.00 H new ATOM 0 HG2 LYS A 132 1.100 9.018 -8.567 1.00 0.00 H new ATOM 0 HG3 LYS A 132 0.883 10.443 -7.571 1.00 0.00 H new ATOM 0 HD2 LYS A 132 2.125 10.984 -9.612 1.00 0.00 H new ATOM 0 HD3 LYS A 132 3.110 11.265 -8.189 1.00 0.00 H new ATOM 0 HE2 LYS A 132 4.381 9.217 -8.562 1.00 0.00 H new ATOM 0 HE3 LYS A 132 3.272 8.681 -9.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 5.230 9.699 -10.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 3.853 10.622 -11.122 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 4.928 11.142 -9.915 1.00 0.00 H new ATOM 860 N ARG A 133 1.189 6.295 -7.417 1.00 0.00 N ATOM 861 CA ARG A 133 0.688 5.180 -8.252 1.00 0.00 C ATOM 862 C ARG A 133 -0.182 5.533 -9.472 1.00 0.00 C ATOM 863 O ARG A 133 0.299 5.717 -10.587 1.00 0.00 O ATOM 864 CB ARG A 133 0.068 4.035 -7.429 1.00 0.00 C ATOM 865 CG ARG A 133 0.000 4.175 -5.899 1.00 0.00 C ATOM 866 CD ARG A 133 -0.959 3.167 -5.280 1.00 0.00 C ATOM 867 NE ARG A 133 -2.304 3.326 -5.845 1.00 0.00 N ATOM 868 CZ ARG A 133 -3.111 2.360 -6.273 1.00 0.00 C ATOM 869 NH1 ARG A 133 -2.987 1.131 -5.792 1.00 0.00 N ATOM 870 NH2 ARG A 133 -4.247 2.650 -6.886 1.00 0.00 N ATOM 0 H ARG A 133 2.206 6.289 -7.344 1.00 0.00 H new ATOM 0 HA ARG A 133 1.616 4.827 -8.703 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.948 3.880 -7.792 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.628 3.127 -7.653 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.995 4.036 -5.477 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.318 5.185 -5.640 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.599 2.154 -5.461 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -0.993 3.304 -4.199 1.00 0.00 H new ATOM 0 HE ARG A 133 -2.658 4.280 -5.917 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -2.272 0.926 -5.093 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -3.606 0.390 -6.120 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -4.512 3.624 -7.035 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -4.858 1.900 -7.210 1.00 0.00 H new ATOM 871 N GLY A 134 -1.476 5.643 -9.196 1.00 0.00 N ATOM 872 CA GLY A 134 -2.567 5.814 -10.178 1.00 0.00 C ATOM 873 C GLY A 134 -2.476 4.874 -11.387 1.00 0.00 C ATOM 874 O GLY A 134 -2.528 3.664 -11.197 1.00 0.00 O ATOM 0 H GLY A 134 -1.822 5.615 -8.237 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -3.521 5.652 -9.677 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -2.564 6.845 -10.532 1.00 0.00 H new ATOM 875 N PRO A 135 -2.317 5.435 -12.595 1.00 0.00 N ATOM 876 CA PRO A 135 -2.437 4.634 -13.817 1.00 0.00 C ATOM 877 C PRO A 135 -1.116 4.114 -14.422 1.00 0.00 C ATOM 878 O PRO A 135 -1.120 3.544 -15.512 1.00 0.00 O ATOM 879 CB PRO A 135 -3.164 5.558 -14.795 1.00 0.00 C ATOM 880 CG PRO A 135 -2.760 6.971 -14.370 1.00 0.00 C ATOM 881 CD PRO A 135 -2.265 6.875 -12.915 1.00 0.00 C ATOM 0 HA PRO A 135 -2.964 3.707 -13.591 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.869 5.355 -15.825 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -4.244 5.422 -14.740 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.976 7.361 -15.020 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -3.606 7.654 -14.446 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -1.253 7.267 -12.815 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -2.899 7.453 -12.242 1.00 0.00 H new ATOM 882 N ARG A 136 0.004 4.424 -13.770 1.00 0.00 N ATOM 883 CA ARG A 136 1.343 3.985 -14.235 1.00 0.00 C ATOM 884 C ARG A 136 1.887 2.689 -13.639 1.00 0.00 C ATOM 885 O ARG A 136 2.828 2.087 -14.169 1.00 0.00 O ATOM 886 CB ARG A 136 2.373 5.133 -14.144 1.00 0.00 C ATOM 887 CG ARG A 136 2.522 5.824 -12.782 1.00 0.00 C ATOM 888 CD ARG A 136 3.507 5.143 -11.821 1.00 0.00 C ATOM 889 NE ARG A 136 3.477 5.843 -10.522 1.00 0.00 N ATOM 890 CZ ARG A 136 4.368 5.730 -9.532 1.00 0.00 C ATOM 891 NH1 ARG A 136 5.415 4.929 -9.620 1.00 0.00 N ATOM 892 NH2 ARG A 136 4.250 6.429 -8.413 1.00 0.00 N ATOM 0 H ARG A 136 0.023 4.979 -12.914 1.00 0.00 H new ATOM 0 HA ARG A 136 1.178 3.725 -15.280 1.00 0.00 H new ATOM 0 HB2 ARG A 136 3.347 4.739 -14.433 1.00 0.00 H new ATOM 0 HB3 ARG A 136 2.104 5.890 -14.881 1.00 0.00 H new ATOM 0 HG2 ARG A 136 2.846 6.852 -12.945 1.00 0.00 H new ATOM 0 HG3 ARG A 136 1.543 5.871 -12.305 1.00 0.00 H new ATOM 0 HD2 ARG A 136 3.240 4.095 -11.689 1.00 0.00 H new ATOM 0 HD3 ARG A 136 4.514 5.165 -12.237 1.00 0.00 H new ATOM 0 HE ARG A 136 2.695 6.479 -10.363 1.00 0.00 H new ATOM 0 HH11 ARG A 136 5.562 4.373 -10.462 1.00 0.00 H new ATOM 0 HH12 ARG A 136 6.076 4.867 -8.846 1.00 0.00 H new ATOM 0 HH21 ARG A 136 3.466 7.071 -8.293 1.00 0.00 H new ATOM 0 HH22 ARG A 136 4.943 6.326 -7.672 1.00 0.00 H new ATOM 893 N THR A 137 1.298 2.304 -12.525 1.00 0.00 N ATOM 894 CA THR A 137 1.679 1.138 -11.711 1.00 0.00 C ATOM 895 C THR A 137 1.044 -0.168 -12.178 1.00 0.00 C ATOM 896 O THR A 137 -0.165 -0.368 -12.091 1.00 0.00 O ATOM 897 CB THR A 137 1.261 1.395 -10.266 1.00 0.00 C ATOM 898 OG1 THR A 137 0.014 2.104 -10.239 1.00 0.00 O ATOM 899 CG2 THR A 137 2.346 2.114 -9.474 1.00 0.00 C ATOM 0 H THR A 137 0.503 2.810 -12.134 1.00 0.00 H new ATOM 0 HA THR A 137 2.758 1.019 -11.811 1.00 0.00 H new ATOM 0 HB THR A 137 1.120 0.433 -9.774 1.00 0.00 H new ATOM 0 HG1 THR A 137 -0.540 1.764 -9.505 1.00 0.00 H new ATOM 0 HG21 THR A 137 2.004 2.275 -8.452 1.00 0.00 H new ATOM 0 HG22 THR A 137 3.251 1.506 -9.462 1.00 0.00 H new ATOM 0 HG23 THR A 137 2.561 3.075 -9.941 1.00 0.00 H new ATOM 900 N HIS A 138 1.907 -1.031 -12.708 1.00 0.00 N ATOM 901 CA HIS A 138 1.593 -2.413 -13.112 1.00 0.00 C ATOM 902 C HIS A 138 2.862 -3.233 -13.338 1.00 0.00 C ATOM 903 O HIS A 138 3.951 -2.724 -13.596 1.00 0.00 O ATOM 904 CB HIS A 138 0.627 -2.492 -14.302 1.00 0.00 C ATOM 905 CG HIS A 138 1.021 -1.539 -15.438 1.00 0.00 C ATOM 906 ND1 HIS A 138 2.188 -1.539 -16.065 1.00 0.00 N ATOM 907 CD2 HIS A 138 0.395 -0.404 -15.755 1.00 0.00 C ATOM 908 CE1 HIS A 138 2.316 -0.398 -16.744 1.00 0.00 C ATOM 909 NE2 HIS A 138 1.208 0.303 -16.536 1.00 0.00 N ATOM 0 H HIS A 138 2.882 -0.785 -12.877 1.00 0.00 H new ATOM 0 HA HIS A 138 1.059 -2.864 -12.275 1.00 0.00 H new ATOM 0 HB2 HIS A 138 0.603 -3.514 -14.680 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -0.382 -2.254 -13.964 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -0.594 -0.112 -15.435 1.00 0.00 H new ATOM 0 HE1 HIS A 138 3.161 -0.101 -17.348 1.00 0.00 H new ATOM 0 HE2 HIS A 138 1.012 1.230 -16.913 1.00 0.00 H new ATOM 910 N TYR A 139 2.630 -4.515 -13.130 1.00 0.00 N ATOM 911 CA TYR A 139 3.639 -5.587 -13.129 1.00 0.00 C ATOM 912 C TYR A 139 4.543 -5.610 -14.359 1.00 0.00 C ATOM 913 O TYR A 139 4.270 -5.082 -15.432 1.00 0.00 O ATOM 914 CB TYR A 139 2.877 -6.893 -12.907 1.00 0.00 C ATOM 915 CG TYR A 139 3.724 -8.126 -12.578 1.00 0.00 C ATOM 916 CD1 TYR A 139 4.844 -8.057 -11.715 1.00 0.00 C ATOM 917 CD2 TYR A 139 3.269 -9.360 -13.093 1.00 0.00 C ATOM 918 CE1 TYR A 139 5.499 -9.242 -11.328 1.00 0.00 C ATOM 919 CE2 TYR A 139 3.915 -10.545 -12.705 1.00 0.00 C ATOM 920 CZ TYR A 139 5.005 -10.476 -11.803 1.00 0.00 C ATOM 921 OH TYR A 139 5.367 -11.603 -11.149 1.00 0.00 O ATOM 0 H TYR A 139 1.690 -4.867 -12.947 1.00 0.00 H new ATOM 0 HA TYR A 139 4.357 -5.415 -12.327 1.00 0.00 H new ATOM 0 HB2 TYR A 139 2.166 -6.740 -12.095 1.00 0.00 H new ATOM 0 HB3 TYR A 139 2.296 -7.107 -13.804 1.00 0.00 H new ATOM 0 HD1 TYR A 139 5.194 -7.101 -11.355 1.00 0.00 H new ATOM 0 HD2 TYR A 139 2.434 -9.392 -13.777 1.00 0.00 H new ATOM 0 HE1 TYR A 139 6.363 -9.207 -10.680 1.00 0.00 H new ATOM 0 HE2 TYR A 139 3.584 -11.498 -13.090 1.00 0.00 H new ATOM 0 HH TYR A 139 4.954 -12.379 -11.582 1.00 0.00 H new ATOM 922 N GLY A 140 5.704 -6.160 -14.036 1.00 0.00 N ATOM 923 CA GLY A 140 6.942 -6.070 -14.843 1.00 0.00 C ATOM 924 C GLY A 140 7.897 -5.022 -14.222 1.00 0.00 C ATOM 925 O GLY A 140 9.109 -5.153 -14.289 1.00 0.00 O ATOM 0 H GLY A 140 5.829 -6.701 -13.181 1.00 0.00 H new ATOM 0 HA2 GLY A 140 7.432 -7.043 -14.884 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.699 -5.792 -15.869 1.00 0.00 H new ATOM 926 N GLN A 141 7.292 -3.987 -13.649 1.00 0.00 N ATOM 927 CA GLN A 141 7.985 -2.931 -12.901 1.00 0.00 C ATOM 928 C GLN A 141 8.173 -3.340 -11.439 1.00 0.00 C ATOM 929 O GLN A 141 7.238 -3.707 -10.729 1.00 0.00 O ATOM 930 CB GLN A 141 7.115 -1.678 -12.921 1.00 0.00 C ATOM 931 CG GLN A 141 7.005 -1.020 -14.292 1.00 0.00 C ATOM 932 CD GLN A 141 6.183 0.264 -14.142 1.00 0.00 C ATOM 933 OE1 GLN A 141 6.680 1.308 -13.756 1.00 0.00 O ATOM 934 NE2 GLN A 141 4.886 0.143 -14.326 1.00 0.00 N ATOM 0 H GLN A 141 6.282 -3.851 -13.690 1.00 0.00 H new ATOM 0 HA GLN A 141 8.958 -2.756 -13.359 1.00 0.00 H new ATOM 0 HB2 GLN A 141 6.115 -1.937 -12.573 1.00 0.00 H new ATOM 0 HB3 GLN A 141 7.522 -0.955 -12.214 1.00 0.00 H new ATOM 0 HG2 GLN A 141 7.996 -0.793 -14.685 1.00 0.00 H new ATOM 0 HG3 GLN A 141 6.528 -1.696 -15.001 1.00 0.00 H new ATOM 0 HE21 GLN A 141 4.497 -0.743 -14.650 1.00 0.00 H new ATOM 0 HE22 GLN A 141 4.269 0.935 -14.145 1.00 0.00 H new ATOM 935 N LYS A 142 9.396 -3.090 -10.996 1.00 0.00 N ATOM 936 CA LYS A 142 9.760 -3.096 -9.552 1.00 0.00 C ATOM 937 C LYS A 142 8.943 -2.113 -8.721 1.00 0.00 C ATOM 938 O LYS A 142 8.662 -2.385 -7.554 1.00 0.00 O ATOM 939 CB LYS A 142 11.277 -2.884 -9.365 1.00 0.00 C ATOM 940 CG LYS A 142 11.840 -1.519 -9.779 1.00 0.00 C ATOM 941 CD LYS A 142 11.985 -1.348 -11.298 1.00 0.00 C ATOM 942 CE LYS A 142 12.599 -0.003 -11.701 1.00 0.00 C ATOM 943 NZ LYS A 142 11.657 1.099 -11.451 1.00 0.00 N ATOM 0 H LYS A 142 10.179 -2.875 -11.614 1.00 0.00 H new ATOM 0 HA LYS A 142 9.505 -4.085 -9.170 1.00 0.00 H new ATOM 0 HB2 LYS A 142 11.516 -3.045 -8.314 1.00 0.00 H new ATOM 0 HB3 LYS A 142 11.800 -3.654 -9.932 1.00 0.00 H new ATOM 0 HG2 LYS A 142 11.188 -0.735 -9.394 1.00 0.00 H new ATOM 0 HG3 LYS A 142 12.815 -1.381 -9.312 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.605 -2.154 -11.690 1.00 0.00 H new ATOM 0 HD3 LYS A 142 11.004 -1.445 -11.763 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.518 0.165 -11.140 1.00 0.00 H new ATOM 0 HE3 LYS A 142 12.869 -0.024 -12.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 12.081 1.996 -11.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 10.777 0.930 -11.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.446 1.151 -10.434 1.00 0.00 H new ATOM 944 N ALA A 143 8.422 -1.087 -9.397 1.00 0.00 N ATOM 945 CA ALA A 143 7.419 -0.135 -8.898 1.00 0.00 C ATOM 946 C ALA A 143 6.324 -0.774 -8.030 1.00 0.00 C ATOM 947 O ALA A 143 6.108 -0.345 -6.902 1.00 0.00 O ATOM 948 CB ALA A 143 6.776 0.599 -10.075 1.00 0.00 C ATOM 0 H ALA A 143 8.701 -0.885 -10.357 1.00 0.00 H new ATOM 0 HA ALA A 143 7.955 0.559 -8.251 1.00 0.00 H new ATOM 0 HB1 ALA A 143 6.033 1.304 -9.702 1.00 0.00 H new ATOM 0 HB2 ALA A 143 7.543 1.140 -10.629 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.293 -0.123 -10.734 1.00 0.00 H new ATOM 949 N ILE A 144 5.868 -1.958 -8.444 1.00 0.00 N ATOM 950 CA ILE A 144 4.766 -2.647 -7.756 1.00 0.00 C ATOM 951 C ILE A 144 5.193 -3.653 -6.672 1.00 0.00 C ATOM 952 O ILE A 144 4.444 -3.899 -5.730 1.00 0.00 O ATOM 953 CB ILE A 144 3.762 -3.265 -8.757 1.00 0.00 C ATOM 954 CG1 ILE A 144 4.361 -4.380 -9.611 1.00 0.00 C ATOM 955 CG2 ILE A 144 3.163 -2.190 -9.664 1.00 0.00 C ATOM 956 CD1 ILE A 144 3.886 -5.744 -9.116 1.00 0.00 C ATOM 0 H ILE A 144 6.241 -2.461 -9.249 1.00 0.00 H new ATOM 0 HA ILE A 144 4.257 -1.859 -7.202 1.00 0.00 H new ATOM 0 HB ILE A 144 2.978 -3.714 -8.147 1.00 0.00 H new ATOM 0 HG12 ILE A 144 4.072 -4.244 -10.653 1.00 0.00 H new ATOM 0 HG13 ILE A 144 5.449 -4.331 -9.573 1.00 0.00 H new ATOM 0 HG21 ILE A 144 2.460 -2.650 -10.359 1.00 0.00 H new ATOM 0 HG22 ILE A 144 2.641 -1.451 -9.056 1.00 0.00 H new ATOM 0 HG23 ILE A 144 3.960 -1.701 -10.225 1.00 0.00 H new ATOM 0 HD11 ILE A 144 4.322 -6.528 -9.735 1.00 0.00 H new ATOM 0 HD12 ILE A 144 4.197 -5.884 -8.081 1.00 0.00 H new ATOM 0 HD13 ILE A 144 2.799 -5.795 -9.178 1.00 0.00 H new ATOM 957 N LEU A 145 6.457 -4.053 -6.758 1.00 0.00 N ATOM 958 CA LEU A 145 7.096 -5.087 -5.911 1.00 0.00 C ATOM 959 C LEU A 145 7.196 -4.636 -4.449 1.00 0.00 C ATOM 960 O LEU A 145 8.106 -3.899 -4.059 1.00 0.00 O ATOM 961 CB LEU A 145 8.495 -5.386 -6.465 1.00 0.00 C ATOM 962 CG LEU A 145 8.575 -6.606 -7.394 1.00 0.00 C ATOM 963 CD1 LEU A 145 7.738 -6.473 -8.664 1.00 0.00 C ATOM 964 CD2 LEU A 145 10.041 -6.844 -7.748 1.00 0.00 C ATOM 0 H LEU A 145 7.101 -3.658 -7.443 1.00 0.00 H new ATOM 0 HA LEU A 145 6.480 -5.986 -5.934 1.00 0.00 H new ATOM 0 HB2 LEU A 145 8.850 -4.510 -7.008 1.00 0.00 H new ATOM 0 HB3 LEU A 145 9.176 -5.540 -5.628 1.00 0.00 H new ATOM 0 HG LEU A 145 8.154 -7.456 -6.857 1.00 0.00 H new ATOM 0 HD11 LEU A 145 7.847 -7.374 -9.268 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.690 -6.340 -8.397 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.079 -5.610 -9.236 1.00 0.00 H new ATOM 0 HD21 LEU A 145 10.120 -7.708 -8.408 1.00 0.00 H new ATOM 0 HD22 LEU A 145 10.441 -5.964 -8.252 1.00 0.00 H new ATOM 0 HD23 LEU A 145 10.610 -7.030 -6.837 1.00 0.00 H new ATOM 965 N PHE A 146 6.171 -4.984 -3.691 1.00 0.00 N ATOM 966 CA PHE A 146 6.123 -4.685 -2.261 1.00 0.00 C ATOM 967 C PHE A 146 6.125 -5.984 -1.471 1.00 0.00 C ATOM 968 O PHE A 146 5.678 -7.038 -1.916 1.00 0.00 O ATOM 969 CB PHE A 146 4.902 -3.834 -1.924 1.00 0.00 C ATOM 970 CG PHE A 146 4.954 -2.344 -2.324 1.00 0.00 C ATOM 971 CD1 PHE A 146 5.663 -1.888 -3.456 1.00 0.00 C ATOM 972 CD2 PHE A 146 4.159 -1.440 -1.573 1.00 0.00 C ATOM 973 CE1 PHE A 146 5.576 -0.539 -3.858 1.00 0.00 C ATOM 974 CE2 PHE A 146 4.062 -0.091 -1.974 1.00 0.00 C ATOM 975 CZ PHE A 146 4.771 0.354 -3.116 1.00 0.00 C ATOM 0 H PHE A 146 5.351 -5.479 -4.042 1.00 0.00 H new ATOM 0 HA PHE A 146 7.006 -4.107 -1.987 1.00 0.00 H new ATOM 0 HB2 PHE A 146 4.033 -4.283 -2.404 1.00 0.00 H new ATOM 0 HB3 PHE A 146 4.736 -3.890 -0.848 1.00 0.00 H new ATOM 0 HD1 PHE A 146 6.276 -2.577 -4.018 1.00 0.00 H new ATOM 0 HD2 PHE A 146 3.630 -1.784 -0.697 1.00 0.00 H new ATOM 0 HE1 PHE A 146 6.119 -0.192 -4.724 1.00 0.00 H new ATOM 0 HE2 PHE A 146 3.450 0.599 -1.413 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.696 1.387 -3.423 1.00 0.00 H new ATOM 976 N LEU A 147 6.832 -5.868 -0.373 1.00 0.00 N ATOM 977 CA LEU A 147 7.141 -6.996 0.521 1.00 0.00 C ATOM 978 C LEU A 147 6.703 -6.709 1.956 1.00 0.00 C ATOM 979 O LEU A 147 7.299 -5.874 2.642 1.00 0.00 O ATOM 980 CB LEU A 147 8.654 -7.254 0.437 1.00 0.00 C ATOM 981 CG LEU A 147 9.039 -8.630 0.992 1.00 0.00 C ATOM 982 CD1 LEU A 147 8.428 -9.765 0.155 1.00 0.00 C ATOM 983 CD2 LEU A 147 10.561 -8.758 0.988 1.00 0.00 C ATOM 0 H LEU A 147 7.222 -4.980 -0.056 1.00 0.00 H new ATOM 0 HA LEU A 147 6.591 -7.883 0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 147 8.976 -7.180 -0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 147 9.184 -6.479 0.991 1.00 0.00 H new ATOM 0 HG LEU A 147 8.651 -8.714 2.007 1.00 0.00 H new ATOM 0 HD11 LEU A 147 8.721 -10.726 0.577 1.00 0.00 H new ATOM 0 HD12 LEU A 147 7.341 -9.680 0.166 1.00 0.00 H new ATOM 0 HD13 LEU A 147 8.787 -9.694 -0.872 1.00 0.00 H new ATOM 0 HD21 LEU A 147 10.845 -9.734 1.381 1.00 0.00 H new ATOM 0 HD22 LEU A 147 10.932 -8.656 -0.032 1.00 0.00 H new ATOM 0 HD23 LEU A 147 10.994 -7.976 1.612 1.00 0.00 H new ATOM 984 N PRO A 148 5.543 -7.238 2.333 1.00 0.00 N ATOM 985 CA PRO A 148 5.148 -7.331 3.749 1.00 0.00 C ATOM 986 C PRO A 148 6.195 -8.083 4.571 1.00 0.00 C ATOM 987 O PRO A 148 6.638 -9.179 4.205 1.00 0.00 O ATOM 988 CB PRO A 148 3.835 -8.112 3.695 1.00 0.00 C ATOM 989 CG PRO A 148 3.195 -7.598 2.407 1.00 0.00 C ATOM 990 CD PRO A 148 4.385 -7.498 1.460 1.00 0.00 C ATOM 0 HA PRO A 148 5.050 -6.356 4.225 1.00 0.00 H new ATOM 0 HB2 PRO A 148 4.004 -9.188 3.662 1.00 0.00 H new ATOM 0 HB3 PRO A 148 3.210 -7.914 4.566 1.00 0.00 H new ATOM 0 HG2 PRO A 148 2.435 -8.283 2.031 1.00 0.00 H new ATOM 0 HG3 PRO A 148 2.711 -6.632 2.553 1.00 0.00 H new ATOM 0 HD2 PRO A 148 4.517 -8.419 0.893 1.00 0.00 H new ATOM 0 HD3 PRO A 148 4.248 -6.695 0.736 1.00 0.00 H new ATOM 991 N LEU A 149 6.709 -7.348 5.536 1.00 0.00 N ATOM 992 CA LEU A 149 7.521 -7.882 6.655 1.00 0.00 C ATOM 993 C LEU A 149 6.755 -7.658 7.967 1.00 0.00 C ATOM 994 O LEU A 149 7.029 -6.715 8.700 1.00 0.00 O ATOM 995 CB LEU A 149 8.885 -7.170 6.660 1.00 0.00 C ATOM 996 CG LEU A 149 9.742 -7.564 5.459 1.00 0.00 C ATOM 997 CD1 LEU A 149 10.846 -6.535 5.251 1.00 0.00 C ATOM 998 CD2 LEU A 149 10.322 -8.969 5.616 1.00 0.00 C ATOM 0 H LEU A 149 6.581 -6.337 5.582 1.00 0.00 H new ATOM 0 HA LEU A 149 7.698 -8.952 6.542 1.00 0.00 H new ATOM 0 HB2 LEU A 149 8.730 -6.091 6.656 1.00 0.00 H new ATOM 0 HB3 LEU A 149 9.417 -7.413 7.580 1.00 0.00 H new ATOM 0 HG LEU A 149 9.104 -7.580 4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 149 11.454 -6.822 4.393 1.00 0.00 H new ATOM 0 HD12 LEU A 149 10.402 -5.556 5.070 1.00 0.00 H new ATOM 0 HD13 LEU A 149 11.474 -6.490 6.141 1.00 0.00 H new ATOM 0 HD21 LEU A 149 10.926 -9.213 4.742 1.00 0.00 H new ATOM 0 HD22 LEU A 149 10.945 -9.008 6.509 1.00 0.00 H new ATOM 0 HD23 LEU A 149 9.510 -9.690 5.709 1.00 0.00 H new ATOM 999 N PRO A 150 5.668 -8.406 8.195 1.00 0.00 N ATOM 1000 CA PRO A 150 4.843 -8.183 9.386 1.00 0.00 C ATOM 1001 C PRO A 150 5.466 -8.878 10.593 1.00 0.00 C ATOM 1002 O PRO A 150 6.364 -9.700 10.473 1.00 0.00 O ATOM 1003 CB PRO A 150 3.472 -8.674 8.971 1.00 0.00 C ATOM 1004 CG PRO A 150 3.781 -9.882 8.084 1.00 0.00 C ATOM 1005 CD PRO A 150 5.086 -9.501 7.379 1.00 0.00 C ATOM 0 HA PRO A 150 4.770 -7.146 9.715 1.00 0.00 H new ATOM 0 HB2 PRO A 150 2.867 -8.953 9.834 1.00 0.00 H new ATOM 0 HB3 PRO A 150 2.918 -7.908 8.428 1.00 0.00 H new ATOM 0 HG2 PRO A 150 3.897 -10.791 8.674 1.00 0.00 H new ATOM 0 HG3 PRO A 150 2.980 -10.067 7.368 1.00 0.00 H new ATOM 0 HD2 PRO A 150 5.765 -10.352 7.322 1.00 0.00 H new ATOM 0 HD3 PRO A 150 4.899 -9.173 6.357 1.00 0.00 H new