USER MOD reduce.3.24.130724 H: found=0, std=0, add=921, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 110 THR OG1 : rot -133:sc= -0.147 USER MOD Set 1.2: A 139 TYR OH : rot 180:sc= 0.508 USER MOD Set 2.1: A 81 MET CE :methyl 135:sc= -0.642 (180deg=-1.98!) USER MOD Set 2.2: A 113 SER OG : rot 139:sc= 0.266 USER MOD Set 2.3: A 116 HIS : no HD1:sc= -2.51 K(o=-4.1,f=-4.6!) USER MOD Set 2.4: A 119 LYS NZ :NH3+ -135:sc= -1.18 (180deg=0) USER MOD Set 3.1: A 109 ASN : amide:sc= 0.934 K(o=0.87,f=-1.4) USER MOD Set 3.2: A 111 TYR OH : rot 55:sc= -0.0652 USER MOD Set 4.1: A 31 SER OG : rot 165:sc= 1.08 USER MOD Set 4.2: A 108 TYR OH : rot 180:sc= 0.723 USER MOD Set 5.1: A 77 GLN : amide:sc= -0.194 K(o=-0.84,f=-1.3) USER MOD Set 5.2: A 91 GLN : amide:sc= -0.65 X(o=-0.84,f=-0.67) USER MOD Set 6.1: A 59 GLN : amide:sc= 0 X(o=0.81,f=0.59) USER MOD Set 6.2: A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.3: A 73 THR OG1 : rot 78:sc= 0.807 USER MOD Set 7.1: A 72 SER OG : rot -79:sc= 1.2 USER MOD Set 7.2: A 75 THR OG1 : rot 165:sc= 0.742 USER MOD Set 8.1: A 61 SER OG : rot 177:sc= -0.468 USER MOD Set 8.2: A 78 TYR OH : rot 180:sc= 0.0181 USER MOD Set 9.1: A 54 GLN : amide:sc= 0.998 K(o=1.9,f=-0.52) USER MOD Set 9.2: A 57 GLN : amide:sc= 0.855 K(o=1.9,f=-0.85) USER MOD Set10.1: A 52 SER OG : rot 90:sc= 0.86 USER MOD Set10.2: A 55 HIS : no HD1:sc= -1.19 K(o=-0.33,f=-3.6) USER MOD Set11.1: A 30 CYS SG : rot 85:sc= -3.91! USER MOD Set11.2: A 32 ASN : amide:sc= -8.15! C(o=-12!,f=-11!) USER MOD Single : A 35 HIS : no HE2:sc= -1.77 K(o=-1.8,f=-4.3!) USER MOD Single : A 44 THR OG1 : rot 2:sc= 0.249 USER MOD Single : A 48 THR OG1 : rot -66:sc= -1.81 USER MOD Single : A 64 SER OG : rot 52:sc= 0.266 USER MOD Single : A 69 TYR OH : rot 169:sc= 1.24 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0584 USER MOD Single : A 88 TYR OH : rot 19:sc= -0.274 USER MOD Single : A 90 SER OG : rot -111:sc= 1.24 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0479 USER MOD Single : A 94 ASN : amide:sc= 0.499 K(o=0.5,f=-5.6!) USER MOD Single : A 97 CYS SG : rot -19:sc= -4.32! USER MOD Single : A 106 ASN : amide:sc= -1.69! C(o=-1.7!,f=-3.8!) USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 114 LYS NZ :NH3+ 179:sc= -0.0611 (180deg=-0.0644) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 144:sc= -0.0433 (180deg=-1.57) USER MOD Single : A 127 LYS NZ :NH3+ -160:sc= -0.146 (180deg=-0.702) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 74:sc= 1.29 USER MOD Single : A 131 CYS SG : rot 0:sc= -6.06! USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot 28:sc= 1.01 USER MOD Single : A 138 HIS : no HE2:sc= 0.588 K(o=0.59,f=-3.1!) USER MOD Single : A 141 GLN : amide:sc= 1.06 K(o=1.1,f=-0.068) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N CYS A 30 -7.286 4.802 2.978 1.00 0.00 N ATOM 22 CA CYS A 30 -7.909 3.508 2.634 1.00 0.00 C ATOM 23 C CYS A 30 -9.191 3.273 3.437 1.00 0.00 C ATOM 24 O CYS A 30 -9.186 3.320 4.666 1.00 0.00 O ATOM 25 CB CYS A 30 -6.925 2.359 2.818 1.00 0.00 C ATOM 26 SG CYS A 30 -5.944 2.481 4.358 1.00 0.00 S ATOM 0 HA CYS A 30 -8.185 3.546 1.580 1.00 0.00 H new ATOM 0 HB2 CYS A 30 -7.474 1.417 2.819 1.00 0.00 H new ATOM 0 HB3 CYS A 30 -6.247 2.331 1.965 1.00 0.00 H new ATOM 0 HG CYS A 30 -6.619 1.970 5.344 1.00 0.00 H new ATOM 27 N SER A 31 -10.247 2.940 2.703 1.00 0.00 N ATOM 28 CA SER A 31 -11.604 2.714 3.260 1.00 0.00 C ATOM 29 C SER A 31 -11.806 1.370 3.990 1.00 0.00 C ATOM 30 O SER A 31 -12.838 1.162 4.620 1.00 0.00 O ATOM 31 CB SER A 31 -12.674 2.820 2.174 1.00 0.00 C ATOM 32 OG SER A 31 -12.702 4.144 1.620 1.00 0.00 O ATOM 0 H SER A 31 -10.199 2.814 1.692 1.00 0.00 H new ATOM 0 HA SER A 31 -11.705 3.503 4.005 1.00 0.00 H new ATOM 0 HB2 SER A 31 -12.473 2.094 1.386 1.00 0.00 H new ATOM 0 HB3 SER A 31 -13.650 2.574 2.592 1.00 0.00 H new ATOM 0 HG SER A 31 -13.202 4.135 0.777 1.00 0.00 H new ATOM 33 N ASN A 32 -10.719 0.599 4.092 1.00 0.00 N ATOM 34 CA ASN A 32 -10.670 -0.776 4.617 1.00 0.00 C ATOM 35 C ASN A 32 -11.516 -1.013 5.889 1.00 0.00 C ATOM 36 O ASN A 32 -12.465 -1.786 5.868 1.00 0.00 O ATOM 37 CB ASN A 32 -9.180 -1.140 4.763 1.00 0.00 C ATOM 38 CG ASN A 32 -8.390 -0.358 5.813 1.00 0.00 C ATOM 39 OD1 ASN A 32 -8.216 0.847 5.785 1.00 0.00 O ATOM 40 ND2 ASN A 32 -8.000 -1.080 6.840 1.00 0.00 N ATOM 0 H ASN A 32 -9.801 0.931 3.796 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.153 -1.456 3.916 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -9.109 -2.201 5.002 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -8.697 -0.998 3.796 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -7.542 -0.632 7.634 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.156 -2.088 6.843 1.00 0.00 H new ATOM 41 N GLY A 33 -10.948 -0.593 7.018 1.00 0.00 N ATOM 42 CA GLY A 33 -11.636 -0.214 8.257 1.00 0.00 C ATOM 43 C GLY A 33 -10.969 1.132 8.560 1.00 0.00 C ATOM 44 O GLY A 33 -9.964 1.153 9.255 1.00 0.00 O ATOM 0 H GLY A 33 -9.935 -0.502 7.100 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -12.713 -0.119 8.118 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -11.480 -0.941 9.054 1.00 0.00 H new ATOM 45 N GLY A 34 -11.318 2.075 7.685 1.00 0.00 N ATOM 46 CA GLY A 34 -10.631 3.343 7.393 1.00 0.00 C ATOM 47 C GLY A 34 -9.392 3.783 8.193 1.00 0.00 C ATOM 48 O GLY A 34 -9.489 4.380 9.267 1.00 0.00 O ATOM 0 H GLY A 34 -12.156 1.968 7.113 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.337 3.311 6.344 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -11.372 4.136 7.493 1.00 0.00 H new ATOM 49 N HIS A 35 -8.262 3.649 7.509 1.00 0.00 N ATOM 50 CA HIS A 35 -6.933 4.103 7.961 1.00 0.00 C ATOM 51 C HIS A 35 -6.130 4.744 6.805 1.00 0.00 C ATOM 52 O HIS A 35 -6.681 5.082 5.763 1.00 0.00 O ATOM 53 CB HIS A 35 -6.175 2.907 8.537 1.00 0.00 C ATOM 54 CG HIS A 35 -6.607 2.543 9.960 1.00 0.00 C ATOM 55 ND1 HIS A 35 -7.519 1.652 10.295 1.00 0.00 N ATOM 56 CD2 HIS A 35 -6.000 2.951 11.062 1.00 0.00 C ATOM 57 CE1 HIS A 35 -7.446 1.466 11.607 1.00 0.00 C ATOM 58 NE2 HIS A 35 -6.523 2.298 12.083 1.00 0.00 N ATOM 0 H HIS A 35 -8.235 3.207 6.590 1.00 0.00 H new ATOM 0 HA HIS A 35 -7.062 4.868 8.727 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -6.324 2.044 7.888 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -5.107 3.127 8.534 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -8.166 1.188 9.658 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.214 3.689 11.117 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -8.031 0.765 12.185 1.00 0.00 H new ATOM 59 N PHE A 36 -4.810 4.870 6.990 1.00 0.00 N ATOM 60 CA PHE A 36 -3.913 5.406 5.954 1.00 0.00 C ATOM 61 C PHE A 36 -2.861 4.382 5.556 1.00 0.00 C ATOM 62 O PHE A 36 -2.699 3.349 6.198 1.00 0.00 O ATOM 63 CB PHE A 36 -3.246 6.674 6.482 1.00 0.00 C ATOM 64 CG PHE A 36 -4.137 7.907 6.399 1.00 0.00 C ATOM 65 CD1 PHE A 36 -5.034 8.194 7.455 1.00 0.00 C ATOM 66 CD2 PHE A 36 -3.943 8.823 5.340 1.00 0.00 C ATOM 67 CE1 PHE A 36 -5.722 9.425 7.467 1.00 0.00 C ATOM 68 CE2 PHE A 36 -4.632 10.054 5.351 1.00 0.00 C ATOM 69 CZ PHE A 36 -5.518 10.345 6.420 1.00 0.00 C ATOM 0 H PHE A 36 -4.335 4.606 7.853 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.498 5.640 5.065 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -2.953 6.516 7.520 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -2.332 6.857 5.917 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -5.191 7.476 8.246 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.272 8.582 4.528 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -6.401 9.661 8.273 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.486 10.768 4.554 1.00 0.00 H new ATOM 0 HZ PHE A 36 -6.045 11.288 6.431 1.00 0.00 H new ATOM 70 N LEU A 37 -2.191 4.644 4.438 1.00 0.00 N ATOM 71 CA LEU A 37 -1.066 3.810 4.000 1.00 0.00 C ATOM 72 C LEU A 37 0.225 4.584 4.264 1.00 0.00 C ATOM 73 O LEU A 37 0.705 5.374 3.434 1.00 0.00 O ATOM 74 CB LEU A 37 -1.237 3.418 2.534 1.00 0.00 C ATOM 75 CG LEU A 37 -0.081 2.548 2.008 1.00 0.00 C ATOM 76 CD1 LEU A 37 -0.194 1.102 2.482 1.00 0.00 C ATOM 77 CD2 LEU A 37 -0.081 2.595 0.482 1.00 0.00 C ATOM 0 H LEU A 37 -2.403 5.425 3.817 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.027 2.875 4.559 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.176 2.877 2.415 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.311 4.321 1.928 1.00 0.00 H new ATOM 0 HG LEU A 37 0.854 2.947 2.402 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.642 0.524 2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.173 1.074 3.571 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.131 0.675 2.126 1.00 0.00 H new ATOM 0 HD21 LEU A 37 0.735 1.982 0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.030 2.213 0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 37 0.052 3.624 0.150 1.00 0.00 H new ATOM 78 N ARG A 38 0.707 4.422 5.495 1.00 0.00 N ATOM 79 CA ARG A 38 1.930 5.096 5.946 1.00 0.00 C ATOM 80 C ARG A 38 3.139 4.191 5.793 1.00 0.00 C ATOM 81 O ARG A 38 3.229 3.097 6.355 1.00 0.00 O ATOM 82 CB ARG A 38 1.769 5.577 7.397 1.00 0.00 C ATOM 83 CG ARG A 38 2.955 6.448 7.824 1.00 0.00 C ATOM 84 CD ARG A 38 2.777 7.247 9.117 1.00 0.00 C ATOM 85 NE ARG A 38 2.482 6.349 10.236 1.00 0.00 N ATOM 86 CZ ARG A 38 1.739 6.643 11.297 1.00 0.00 C ATOM 87 NH1 ARG A 38 0.634 7.375 11.172 1.00 0.00 N ATOM 88 NH2 ARG A 38 1.761 5.855 12.359 1.00 0.00 N ATOM 0 H ARG A 38 0.271 3.829 6.201 1.00 0.00 H new ATOM 0 HA ARG A 38 2.097 5.970 5.316 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.843 6.144 7.495 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.687 4.717 8.062 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.829 5.806 7.936 1.00 0.00 H new ATOM 0 HG3 ARG A 38 3.174 7.147 7.017 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.683 7.816 9.328 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.968 7.968 8.998 1.00 0.00 H new ATOM 0 HE ARG A 38 2.884 5.412 10.197 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.350 7.717 10.254 1.00 0.00 H new ATOM 0 HH12 ARG A 38 0.072 7.594 11.994 1.00 0.00 H new ATOM 0 HH21 ARG A 38 2.349 5.021 12.363 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.190 6.081 13.174 1.00 0.00 H new ATOM 89 N ILE A 39 4.019 4.675 4.931 1.00 0.00 N ATOM 90 CA ILE A 39 5.382 4.132 4.776 1.00 0.00 C ATOM 91 C ILE A 39 6.300 5.049 5.578 1.00 0.00 C ATOM 92 O ILE A 39 6.744 6.125 5.176 1.00 0.00 O ATOM 93 CB ILE A 39 5.797 4.015 3.291 1.00 0.00 C ATOM 94 CG1 ILE A 39 4.764 3.269 2.437 1.00 0.00 C ATOM 95 CG2 ILE A 39 7.137 3.279 3.184 1.00 0.00 C ATOM 96 CD1 ILE A 39 3.782 4.212 1.737 1.00 0.00 C ATOM 0 H ILE A 39 3.818 5.459 4.311 1.00 0.00 H new ATOM 0 HA ILE A 39 5.443 3.111 5.153 1.00 0.00 H new ATOM 0 HB ILE A 39 5.874 5.033 2.910 1.00 0.00 H new ATOM 0 HG12 ILE A 39 5.283 2.670 1.688 1.00 0.00 H new ATOM 0 HG13 ILE A 39 4.208 2.577 3.069 1.00 0.00 H new ATOM 0 HG21 ILE A 39 7.425 3.199 2.136 1.00 0.00 H new ATOM 0 HG22 ILE A 39 7.901 3.833 3.729 1.00 0.00 H new ATOM 0 HG23 ILE A 39 7.039 2.281 3.611 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.075 3.629 1.147 1.00 0.00 H new ATOM 0 HD12 ILE A 39 3.240 4.792 2.484 1.00 0.00 H new ATOM 0 HD13 ILE A 39 4.331 4.887 1.081 1.00 0.00 H new ATOM 97 N LEU A 40 6.471 4.531 6.787 1.00 0.00 N ATOM 98 CA LEU A 40 7.140 5.185 7.914 1.00 0.00 C ATOM 99 C LEU A 40 8.599 5.556 7.629 1.00 0.00 C ATOM 100 O LEU A 40 9.304 4.719 7.057 1.00 0.00 O ATOM 101 CB LEU A 40 7.140 4.267 9.145 1.00 0.00 C ATOM 102 CG LEU A 40 5.870 4.145 9.985 1.00 0.00 C ATOM 103 CD1 LEU A 40 5.658 5.465 10.694 1.00 0.00 C ATOM 104 CD2 LEU A 40 4.649 3.704 9.203 1.00 0.00 C ATOM 0 H LEU A 40 6.132 3.599 7.024 1.00 0.00 H new ATOM 0 HA LEU A 40 6.575 6.100 8.089 1.00 0.00 H new ATOM 0 HB2 LEU A 40 7.407 3.266 8.807 1.00 0.00 H new ATOM 0 HB3 LEU A 40 7.939 4.604 9.805 1.00 0.00 H new ATOM 0 HG LEU A 40 6.009 3.343 10.710 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.756 5.410 11.304 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.516 5.677 11.333 1.00 0.00 H new ATOM 0 HD13 LEU A 40 5.549 6.261 9.957 1.00 0.00 H new ATOM 0 HD21 LEU A 40 3.791 3.642 9.872 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.442 4.426 8.413 1.00 0.00 H new ATOM 0 HD23 LEU A 40 4.835 2.726 8.760 1.00 0.00 H new ATOM 105 N PRO A 41 9.104 6.602 8.303 1.00 0.00 N ATOM 106 CA PRO A 41 10.525 7.000 8.254 1.00 0.00 C ATOM 107 C PRO A 41 11.503 5.921 8.747 1.00 0.00 C ATOM 108 O PRO A 41 12.644 5.864 8.296 1.00 0.00 O ATOM 109 CB PRO A 41 10.617 8.278 9.098 1.00 0.00 C ATOM 110 CG PRO A 41 9.414 8.199 10.047 1.00 0.00 C ATOM 111 CD PRO A 41 8.346 7.475 9.228 1.00 0.00 C ATOM 0 HA PRO A 41 10.830 7.158 7.220 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.556 8.322 9.650 1.00 0.00 H new ATOM 0 HB3 PRO A 41 10.572 9.170 8.473 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.659 7.652 10.957 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.080 9.191 10.352 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.684 6.892 9.869 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.720 8.181 8.682 1.00 0.00 H new ATOM 112 N ASP A 42 10.971 5.000 9.555 1.00 0.00 N ATOM 113 CA ASP A 42 11.676 3.840 10.121 1.00 0.00 C ATOM 114 C ASP A 42 11.583 2.573 9.250 1.00 0.00 C ATOM 115 O ASP A 42 11.611 1.450 9.756 1.00 0.00 O ATOM 116 CB ASP A 42 11.063 3.641 11.516 1.00 0.00 C ATOM 117 CG ASP A 42 11.670 4.606 12.542 1.00 0.00 C ATOM 118 OD1 ASP A 42 11.114 5.720 12.647 1.00 0.00 O ATOM 119 OD2 ASP A 42 12.672 4.214 13.174 1.00 0.00 O ATOM 0 H ASP A 42 9.995 5.042 9.847 1.00 0.00 H new ATOM 0 HA ASP A 42 12.749 4.027 10.170 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.985 3.794 11.465 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.225 2.614 11.842 1.00 0.00 H new ATOM 120 N GLY A 43 11.434 2.775 7.937 1.00 0.00 N ATOM 121 CA GLY A 43 11.319 1.697 6.926 1.00 0.00 C ATOM 122 C GLY A 43 10.231 0.668 7.254 1.00 0.00 C ATOM 123 O GLY A 43 10.285 -0.473 6.780 1.00 0.00 O ATOM 0 H GLY A 43 11.388 3.709 7.530 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.107 2.142 5.954 1.00 0.00 H new ATOM 0 HA3 GLY A 43 12.278 1.186 6.840 1.00 0.00 H new ATOM 124 N THR A 44 9.142 1.166 7.840 1.00 0.00 N ATOM 125 CA THR A 44 8.063 0.326 8.413 1.00 0.00 C ATOM 126 C THR A 44 6.775 0.702 7.675 1.00 0.00 C ATOM 127 O THR A 44 6.652 1.836 7.210 1.00 0.00 O ATOM 128 CB THR A 44 7.833 0.681 9.889 1.00 0.00 C ATOM 129 OG1 THR A 44 9.047 0.987 10.599 1.00 0.00 O ATOM 130 CG2 THR A 44 7.036 -0.381 10.639 1.00 0.00 C ATOM 0 H THR A 44 8.973 2.167 7.936 1.00 0.00 H new ATOM 0 HA THR A 44 8.329 -0.727 8.319 1.00 0.00 H new ATOM 0 HB THR A 44 7.234 1.591 9.859 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.807 0.946 9.981 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.906 -0.073 11.677 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.059 -0.501 10.171 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.573 -1.329 10.606 1.00 0.00 H new ATOM 131 N VAL A 45 5.846 -0.237 7.524 1.00 0.00 N ATOM 132 CA VAL A 45 4.557 0.109 6.900 1.00 0.00 C ATOM 133 C VAL A 45 3.359 -0.197 7.816 1.00 0.00 C ATOM 134 O VAL A 45 3.080 -1.332 8.187 1.00 0.00 O ATOM 135 CB VAL A 45 4.413 -0.482 5.489 1.00 0.00 C ATOM 136 CG1 VAL A 45 3.158 0.016 4.771 1.00 0.00 C ATOM 137 CG2 VAL A 45 5.562 -0.005 4.600 1.00 0.00 C ATOM 0 H VAL A 45 5.946 -1.211 7.810 1.00 0.00 H new ATOM 0 HA VAL A 45 4.553 1.191 6.767 1.00 0.00 H new ATOM 0 HB VAL A 45 4.387 -1.563 5.629 1.00 0.00 H new ATOM 0 HG11 VAL A 45 3.105 -0.432 3.779 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.275 -0.266 5.344 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.199 1.101 4.677 1.00 0.00 H new ATOM 0 HG21 VAL A 45 5.451 -0.430 3.602 1.00 0.00 H new ATOM 0 HG22 VAL A 45 5.545 1.083 4.535 1.00 0.00 H new ATOM 0 HG23 VAL A 45 6.511 -0.328 5.028 1.00 0.00 H new ATOM 138 N ASP A 46 2.704 0.905 8.175 1.00 0.00 N ATOM 139 CA ASP A 46 1.552 0.899 9.101 1.00 0.00 C ATOM 140 C ASP A 46 0.428 1.830 8.651 1.00 0.00 C ATOM 141 O ASP A 46 0.622 2.693 7.804 1.00 0.00 O ATOM 142 CB ASP A 46 1.976 1.324 10.506 1.00 0.00 C ATOM 143 CG ASP A 46 3.073 0.428 11.080 1.00 0.00 C ATOM 144 OD1 ASP A 46 2.821 -0.792 11.200 1.00 0.00 O ATOM 145 OD2 ASP A 46 4.151 0.993 11.366 1.00 0.00 O ATOM 0 H ASP A 46 2.951 1.835 7.836 1.00 0.00 H new ATOM 0 HA ASP A 46 1.183 -0.127 9.103 1.00 0.00 H new ATOM 0 HB2 ASP A 46 2.329 2.355 10.480 1.00 0.00 H new ATOM 0 HB3 ASP A 46 1.109 1.301 11.167 1.00 0.00 H new ATOM 146 N GLY A 47 -0.777 1.481 9.095 1.00 0.00 N ATOM 147 CA GLY A 47 -1.976 2.328 8.969 1.00 0.00 C ATOM 148 C GLY A 47 -1.823 3.479 9.953 1.00 0.00 C ATOM 149 O GLY A 47 -0.769 4.105 10.048 1.00 0.00 O ATOM 0 H GLY A 47 -0.958 0.591 9.560 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -2.076 2.704 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -2.877 1.754 9.186 1.00 0.00 H new ATOM 150 N THR A 48 -2.864 3.662 10.762 1.00 0.00 N ATOM 151 CA THR A 48 -2.819 4.725 11.790 1.00 0.00 C ATOM 152 C THR A 48 -3.555 4.457 13.102 1.00 0.00 C ATOM 153 O THR A 48 -4.750 4.706 13.252 1.00 0.00 O ATOM 154 CB THR A 48 -3.122 6.128 11.233 1.00 0.00 C ATOM 155 OG1 THR A 48 -3.251 7.044 12.326 1.00 0.00 O ATOM 156 CG2 THR A 48 -4.350 6.162 10.325 1.00 0.00 C ATOM 0 H THR A 48 -3.725 3.115 10.738 1.00 0.00 H new ATOM 0 HA THR A 48 -1.769 4.699 12.083 1.00 0.00 H new ATOM 0 HB THR A 48 -2.288 6.426 10.598 1.00 0.00 H new ATOM 0 HG1 THR A 48 -4.042 6.812 12.856 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.509 7.179 9.966 1.00 0.00 H new ATOM 0 HG22 THR A 48 -4.193 5.497 9.475 1.00 0.00 H new ATOM 0 HG23 THR A 48 -5.226 5.834 10.885 1.00 0.00 H new ATOM 157 N ARG A 49 -2.750 4.055 14.067 1.00 0.00 N ATOM 158 CA ARG A 49 -3.170 4.131 15.487 1.00 0.00 C ATOM 159 C ARG A 49 -3.157 5.569 16.023 1.00 0.00 C ATOM 160 O ARG A 49 -3.885 5.908 16.947 1.00 0.00 O ATOM 161 CB ARG A 49 -2.274 3.224 16.335 1.00 0.00 C ATOM 162 CG ARG A 49 -2.805 1.806 16.198 1.00 0.00 C ATOM 163 CD ARG A 49 -1.664 0.815 16.056 1.00 0.00 C ATOM 164 NE ARG A 49 -2.237 -0.508 15.776 1.00 0.00 N ATOM 165 CZ ARG A 49 -1.588 -1.524 15.210 1.00 0.00 C ATOM 166 NH1 ARG A 49 -0.350 -1.383 14.782 1.00 0.00 N ATOM 167 NH2 ARG A 49 -2.119 -2.740 15.219 1.00 0.00 N ATOM 0 H ARG A 49 -1.815 3.676 13.917 1.00 0.00 H new ATOM 0 HA ARG A 49 -4.202 3.786 15.551 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -1.239 3.281 15.996 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -2.286 3.539 17.378 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -3.407 1.552 17.071 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -3.460 1.740 15.329 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.996 1.118 15.250 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -1.070 0.786 16.969 1.00 0.00 H new ATOM 0 HE ARG A 49 -3.211 -0.661 16.036 1.00 0.00 H new ATOM 0 HH11 ARG A 49 0.125 -0.486 14.882 1.00 0.00 H new ATOM 0 HH12 ARG A 49 0.133 -2.171 14.351 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -3.025 -2.897 15.660 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -1.621 -3.517 14.785 1.00 0.00 H new ATOM 168 N ASP A 50 -2.444 6.423 15.283 1.00 0.00 N ATOM 169 CA ASP A 50 -2.133 7.838 15.559 1.00 0.00 C ATOM 170 C ASP A 50 -1.304 8.343 14.366 1.00 0.00 C ATOM 171 O ASP A 50 -0.265 7.761 14.045 1.00 0.00 O ATOM 172 CB ASP A 50 -1.300 7.872 16.834 1.00 0.00 C ATOM 173 CG ASP A 50 -1.044 9.289 17.362 1.00 0.00 C ATOM 174 OD1 ASP A 50 -1.903 9.790 18.118 1.00 0.00 O ATOM 175 OD2 ASP A 50 -0.004 9.849 16.945 1.00 0.00 O ATOM 0 H ASP A 50 -2.033 6.122 14.400 1.00 0.00 H new ATOM 0 HA ASP A 50 -3.022 8.456 15.687 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -1.807 7.292 17.605 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -0.343 7.385 16.646 1.00 0.00 H new ATOM 176 N ARG A 51 -1.832 9.327 13.649 1.00 0.00 N ATOM 177 CA ARG A 51 -1.181 9.888 12.438 1.00 0.00 C ATOM 178 C ARG A 51 0.082 10.693 12.760 1.00 0.00 C ATOM 179 O ARG A 51 0.025 11.789 13.331 1.00 0.00 O ATOM 180 CB ARG A 51 -2.135 10.725 11.587 1.00 0.00 C ATOM 181 CG ARG A 51 -3.275 9.904 10.963 1.00 0.00 C ATOM 182 CD ARG A 51 -4.601 10.325 11.599 1.00 0.00 C ATOM 183 NE ARG A 51 -5.610 9.278 11.384 1.00 0.00 N ATOM 184 CZ ARG A 51 -6.079 8.430 12.298 1.00 0.00 C ATOM 185 NH1 ARG A 51 -5.682 8.459 13.569 1.00 0.00 N ATOM 186 NH2 ARG A 51 -7.013 7.551 11.974 1.00 0.00 N ATOM 0 H ARG A 51 -2.722 9.769 13.878 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.883 9.019 11.852 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.562 11.516 12.204 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.570 11.211 10.792 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.307 10.064 9.885 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.103 8.840 11.122 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -4.464 10.498 12.667 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.941 11.265 11.165 1.00 0.00 H new ATOM 0 HE ARG A 51 -5.989 9.192 10.441 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.994 9.148 13.873 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.066 7.792 14.238 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -7.377 7.521 11.021 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -7.370 6.903 12.677 1.00 0.00 H new ATOM 187 N SER A 52 1.202 10.174 12.273 1.00 0.00 N ATOM 188 CA SER A 52 2.508 10.816 12.415 1.00 0.00 C ATOM 189 C SER A 52 2.815 11.696 11.193 1.00 0.00 C ATOM 190 O SER A 52 3.000 11.232 10.073 1.00 0.00 O ATOM 191 CB SER A 52 3.636 9.844 12.724 1.00 0.00 C ATOM 192 OG SER A 52 3.785 8.821 11.726 1.00 0.00 O ATOM 0 H SER A 52 1.233 9.290 11.765 1.00 0.00 H new ATOM 0 HA SER A 52 2.446 11.460 13.292 1.00 0.00 H new ATOM 0 HB2 SER A 52 4.571 10.397 12.812 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.450 9.376 13.691 1.00 0.00 H new ATOM 0 HG SER A 52 4.406 9.128 11.033 1.00 0.00 H new ATOM 193 N ASP A 53 2.290 12.887 11.437 1.00 0.00 N ATOM 194 CA ASP A 53 2.325 14.119 10.613 1.00 0.00 C ATOM 195 C ASP A 53 1.923 14.025 9.140 1.00 0.00 C ATOM 196 O ASP A 53 0.835 14.477 8.770 1.00 0.00 O ATOM 197 CB ASP A 53 3.578 14.984 10.874 1.00 0.00 C ATOM 198 CG ASP A 53 4.929 14.267 10.796 1.00 0.00 C ATOM 199 OD1 ASP A 53 5.088 13.473 9.857 1.00 0.00 O ATOM 200 OD2 ASP A 53 5.756 14.511 11.701 1.00 0.00 O ATOM 0 H ASP A 53 1.773 13.047 12.301 1.00 0.00 H new ATOM 0 HA ASP A 53 1.465 14.664 11.003 1.00 0.00 H new ATOM 0 HB2 ASP A 53 3.584 15.803 10.154 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.485 15.430 11.864 1.00 0.00 H new ATOM 201 N GLN A 54 2.785 13.432 8.308 1.00 0.00 N ATOM 202 CA GLN A 54 2.554 13.345 6.858 1.00 0.00 C ATOM 203 C GLN A 54 3.216 12.140 6.146 1.00 0.00 C ATOM 204 O GLN A 54 2.955 11.950 4.953 1.00 0.00 O ATOM 205 CB GLN A 54 2.979 14.682 6.253 1.00 0.00 C ATOM 206 CG GLN A 54 2.267 15.054 4.948 1.00 0.00 C ATOM 207 CD GLN A 54 2.707 16.424 4.426 1.00 0.00 C ATOM 208 OE1 GLN A 54 3.357 17.224 5.079 1.00 0.00 O ATOM 209 NE2 GLN A 54 2.312 16.740 3.220 1.00 0.00 N ATOM 0 H GLN A 54 3.657 13.001 8.615 1.00 0.00 H new ATOM 0 HA GLN A 54 1.493 13.153 6.698 1.00 0.00 H new ATOM 0 HB2 GLN A 54 2.799 15.469 6.985 1.00 0.00 H new ATOM 0 HB3 GLN A 54 4.053 14.656 6.069 1.00 0.00 H new ATOM 0 HG2 GLN A 54 2.473 14.295 4.193 1.00 0.00 H new ATOM 0 HG3 GLN A 54 1.189 15.057 5.111 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.768 16.074 2.671 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.547 17.652 2.829 1.00 0.00 H new ATOM 210 N HIS A 55 3.879 11.221 6.861 1.00 0.00 N ATOM 211 CA HIS A 55 4.472 10.005 6.232 1.00 0.00 C ATOM 212 C HIS A 55 3.355 9.136 5.601 1.00 0.00 C ATOM 213 O HIS A 55 3.601 8.255 4.773 1.00 0.00 O ATOM 214 CB HIS A 55 5.292 9.167 7.230 1.00 0.00 C ATOM 215 CG HIS A 55 5.978 9.956 8.353 1.00 0.00 C ATOM 216 ND1 HIS A 55 5.701 9.833 9.643 1.00 0.00 N ATOM 217 CD2 HIS A 55 6.901 10.906 8.226 1.00 0.00 C ATOM 218 CE1 HIS A 55 6.439 10.703 10.321 1.00 0.00 C ATOM 219 NE2 HIS A 55 7.172 11.377 9.434 1.00 0.00 N ATOM 0 H HIS A 55 4.024 11.284 7.869 1.00 0.00 H new ATOM 0 HA HIS A 55 5.158 10.345 5.456 1.00 0.00 H new ATOM 0 HB2 HIS A 55 4.633 8.426 7.682 1.00 0.00 H new ATOM 0 HB3 HIS A 55 6.055 8.620 6.676 1.00 0.00 H new ATOM 0 HD2 HIS A 55 7.350 11.235 7.301 1.00 0.00 H new ATOM 0 HE1 HIS A 55 6.445 10.840 11.392 1.00 0.00 H new ATOM 0 HE2 HIS A 55 7.829 12.127 9.649 1.00 0.00 H new ATOM 220 N ILE A 56 2.163 9.331 6.171 1.00 0.00 N ATOM 221 CA ILE A 56 0.831 8.829 5.749 1.00 0.00 C ATOM 222 C ILE A 56 0.380 9.097 4.305 1.00 0.00 C ATOM 223 O ILE A 56 -0.443 8.332 3.792 1.00 0.00 O ATOM 224 CB ILE A 56 -0.288 9.301 6.709 1.00 0.00 C ATOM 225 CG1 ILE A 56 -0.166 10.756 7.175 1.00 0.00 C ATOM 226 CG2 ILE A 56 -0.456 8.372 7.908 1.00 0.00 C ATOM 227 CD1 ILE A 56 -1.338 11.621 6.711 1.00 0.00 C ATOM 0 H ILE A 56 2.087 9.894 7.018 1.00 0.00 H new ATOM 0 HA ILE A 56 0.988 7.751 5.796 1.00 0.00 H new ATOM 0 HB ILE A 56 -1.189 9.255 6.098 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.108 10.782 8.263 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.765 11.178 6.797 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.253 8.747 8.550 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.712 7.371 7.560 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.476 8.333 8.472 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.201 12.642 7.069 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.382 11.621 5.622 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.268 11.218 7.111 1.00 0.00 H new ATOM 228 N GLN A 57 0.827 10.195 3.713 1.00 0.00 N ATOM 229 CA GLN A 57 0.342 10.614 2.378 1.00 0.00 C ATOM 230 C GLN A 57 0.865 9.750 1.220 1.00 0.00 C ATOM 231 O GLN A 57 1.925 9.991 0.632 1.00 0.00 O ATOM 232 CB GLN A 57 0.570 12.106 2.118 1.00 0.00 C ATOM 233 CG GLN A 57 -0.451 12.939 2.899 1.00 0.00 C ATOM 234 CD GLN A 57 -0.626 14.328 2.290 1.00 0.00 C ATOM 235 OE1 GLN A 57 0.297 15.110 2.105 1.00 0.00 O ATOM 236 NE2 GLN A 57 -1.850 14.648 1.949 1.00 0.00 N ATOM 0 H GLN A 57 1.522 10.819 4.123 1.00 0.00 H new ATOM 0 HA GLN A 57 -0.734 10.444 2.407 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.581 12.384 2.415 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.482 12.315 1.052 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -1.411 12.422 2.910 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -0.128 13.034 3.936 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -2.612 13.989 2.107 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -2.040 15.556 1.525 1.00 0.00 H new ATOM 237 N LEU A 58 0.094 8.707 0.928 1.00 0.00 N ATOM 238 CA LEU A 58 0.454 7.731 -0.117 1.00 0.00 C ATOM 239 C LEU A 58 0.353 8.290 -1.545 1.00 0.00 C ATOM 240 O LEU A 58 -0.591 8.976 -1.936 1.00 0.00 O ATOM 241 CB LEU A 58 -0.331 6.429 0.143 1.00 0.00 C ATOM 242 CG LEU A 58 -1.637 6.283 -0.663 1.00 0.00 C ATOM 243 CD1 LEU A 58 -1.338 5.497 -1.942 1.00 0.00 C ATOM 244 CD2 LEU A 58 -2.726 5.566 0.140 1.00 0.00 C ATOM 0 H LEU A 58 -0.789 8.508 1.398 1.00 0.00 H new ATOM 0 HA LEU A 58 1.516 7.496 -0.050 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.315 5.581 -0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.569 6.372 1.205 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.009 7.279 -0.901 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -2.253 5.386 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.596 6.033 -2.533 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.951 4.512 -1.682 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.629 5.484 -0.464 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.380 4.569 0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.945 6.134 1.044 1.00 0.00 H new ATOM 245 N GLN A 59 1.398 7.944 -2.287 1.00 0.00 N ATOM 246 CA GLN A 59 1.617 8.429 -3.663 1.00 0.00 C ATOM 247 C GLN A 59 2.278 7.401 -4.582 1.00 0.00 C ATOM 248 O GLN A 59 2.686 6.329 -4.144 1.00 0.00 O ATOM 249 CB GLN A 59 2.531 9.653 -3.564 1.00 0.00 C ATOM 250 CG GLN A 59 2.080 10.751 -4.526 1.00 0.00 C ATOM 251 CD GLN A 59 3.290 11.558 -5.006 1.00 0.00 C ATOM 252 OE1 GLN A 59 3.888 11.279 -6.033 1.00 0.00 O ATOM 253 NE2 GLN A 59 3.732 12.483 -4.180 1.00 0.00 N ATOM 0 H GLN A 59 2.129 7.314 -1.957 1.00 0.00 H new ATOM 0 HA GLN A 59 0.644 8.652 -4.101 1.00 0.00 H new ATOM 0 HB2 GLN A 59 2.525 10.034 -2.543 1.00 0.00 H new ATOM 0 HB3 GLN A 59 3.557 9.364 -3.791 1.00 0.00 H new ATOM 0 HG2 GLN A 59 1.566 10.309 -5.379 1.00 0.00 H new ATOM 0 HG3 GLN A 59 1.367 11.410 -4.030 1.00 0.00 H new ATOM 0 HE21 GLN A 59 3.213 12.697 -3.328 1.00 0.00 H new ATOM 0 HE22 GLN A 59 4.594 12.986 -4.392 1.00 0.00 H new ATOM 254 N LEU A 60 2.434 7.789 -5.839 1.00 0.00 N ATOM 255 CA LEU A 60 2.959 6.879 -6.865 1.00 0.00 C ATOM 256 C LEU A 60 4.093 7.514 -7.665 1.00 0.00 C ATOM 257 O LEU A 60 3.947 8.607 -8.212 1.00 0.00 O ATOM 258 CB LEU A 60 1.944 6.402 -7.923 1.00 0.00 C ATOM 259 CG LEU A 60 0.434 6.501 -7.664 1.00 0.00 C ATOM 260 CD1 LEU A 60 0.063 5.595 -6.489 1.00 0.00 C ATOM 261 CD2 LEU A 60 -0.098 7.937 -7.532 1.00 0.00 C ATOM 0 H LEU A 60 2.207 8.723 -6.180 1.00 0.00 H new ATOM 0 HA LEU A 60 3.279 6.027 -6.265 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.149 6.958 -8.838 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.165 5.355 -8.130 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.079 6.140 -8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -1.009 5.662 -6.302 1.00 0.00 H new ATOM 0 HD12 LEU A 60 0.326 4.564 -6.727 1.00 0.00 H new ATOM 0 HD13 LEU A 60 0.607 5.912 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.172 7.912 -7.351 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.399 8.434 -6.699 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.102 8.485 -8.453 1.00 0.00 H new ATOM 262 N SER A 61 5.148 6.726 -7.795 1.00 0.00 N ATOM 263 CA SER A 61 6.258 6.976 -8.720 1.00 0.00 C ATOM 264 C SER A 61 6.138 5.999 -9.898 1.00 0.00 C ATOM 265 O SER A 61 6.789 4.961 -10.001 1.00 0.00 O ATOM 266 CB SER A 61 7.611 6.753 -8.055 1.00 0.00 C ATOM 267 OG SER A 61 7.777 7.576 -6.900 1.00 0.00 O ATOM 0 H SER A 61 5.266 5.872 -7.250 1.00 0.00 H new ATOM 0 HA SER A 61 6.201 8.014 -9.047 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.708 5.705 -7.771 1.00 0.00 H new ATOM 0 HB3 SER A 61 8.406 6.965 -8.770 1.00 0.00 H new ATOM 0 HG SER A 61 8.631 7.365 -6.468 1.00 0.00 H new ATOM 268 N ALA A 62 5.041 6.187 -10.607 1.00 0.00 N ATOM 269 CA ALA A 62 4.710 5.377 -11.790 1.00 0.00 C ATOM 270 C ALA A 62 5.767 5.471 -12.898 1.00 0.00 C ATOM 271 O ALA A 62 6.187 6.539 -13.339 1.00 0.00 O ATOM 272 CB ALA A 62 3.319 5.728 -12.327 1.00 0.00 C ATOM 0 H ALA A 62 4.347 6.902 -10.389 1.00 0.00 H new ATOM 0 HA ALA A 62 4.703 4.339 -11.458 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.101 5.114 -13.201 1.00 0.00 H new ATOM 0 HB2 ALA A 62 2.573 5.539 -11.555 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.292 6.781 -12.607 1.00 0.00 H new ATOM 273 N GLU A 63 6.210 4.268 -13.211 1.00 0.00 N ATOM 274 CA GLU A 63 7.271 3.958 -14.188 1.00 0.00 C ATOM 275 C GLU A 63 6.735 3.785 -15.632 1.00 0.00 C ATOM 276 O GLU A 63 7.400 4.146 -16.598 1.00 0.00 O ATOM 277 CB GLU A 63 7.929 2.657 -13.707 1.00 0.00 C ATOM 278 CG GLU A 63 9.127 2.229 -14.555 1.00 0.00 C ATOM 279 CD GLU A 63 9.693 0.889 -14.078 1.00 0.00 C ATOM 280 OE1 GLU A 63 9.202 -0.143 -14.583 1.00 0.00 O ATOM 281 OE2 GLU A 63 10.572 0.919 -13.194 1.00 0.00 O ATOM 0 H GLU A 63 5.829 3.428 -12.776 1.00 0.00 H new ATOM 0 HA GLU A 63 7.976 4.788 -14.237 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.252 2.783 -12.674 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.186 1.860 -13.714 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.826 2.148 -15.600 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.903 2.993 -14.505 1.00 0.00 H new ATOM 282 N SER A 64 5.564 3.158 -15.732 1.00 0.00 N ATOM 283 CA SER A 64 4.988 2.653 -17.000 1.00 0.00 C ATOM 284 C SER A 64 3.484 2.316 -16.801 1.00 0.00 C ATOM 285 O SER A 64 2.931 2.558 -15.732 1.00 0.00 O ATOM 286 CB SER A 64 5.808 1.418 -17.417 1.00 0.00 C ATOM 287 OG SER A 64 5.312 0.791 -18.608 1.00 0.00 O ATOM 0 H SER A 64 4.969 2.978 -14.924 1.00 0.00 H new ATOM 0 HA SER A 64 5.039 3.403 -17.789 1.00 0.00 H new ATOM 0 HB2 SER A 64 6.845 1.714 -17.574 1.00 0.00 H new ATOM 0 HB3 SER A 64 5.803 0.694 -16.603 1.00 0.00 H new ATOM 0 HG SER A 64 5.218 1.462 -19.316 1.00 0.00 H new ATOM 288 N VAL A 65 2.908 1.642 -17.785 1.00 0.00 N ATOM 289 CA VAL A 65 1.512 1.206 -17.928 1.00 0.00 C ATOM 290 C VAL A 65 1.001 0.408 -16.698 1.00 0.00 C ATOM 291 O VAL A 65 1.437 -0.703 -16.416 1.00 0.00 O ATOM 292 CB VAL A 65 1.417 0.440 -19.262 1.00 0.00 C ATOM 293 CG1 VAL A 65 2.257 -0.838 -19.293 1.00 0.00 C ATOM 294 CG2 VAL A 65 -0.038 0.163 -19.659 1.00 0.00 C ATOM 0 H VAL A 65 3.459 1.353 -18.593 1.00 0.00 H new ATOM 0 HA VAL A 65 0.840 2.064 -17.957 1.00 0.00 H new ATOM 0 HB VAL A 65 1.849 1.103 -20.011 1.00 0.00 H new ATOM 0 HG11 VAL A 65 2.142 -1.325 -20.261 1.00 0.00 H new ATOM 0 HG12 VAL A 65 3.306 -0.588 -19.135 1.00 0.00 H new ATOM 0 HG13 VAL A 65 1.922 -1.513 -18.505 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.060 -0.378 -20.605 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.518 -0.437 -18.886 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.571 1.107 -19.769 1.00 0.00 H new ATOM 295 N GLY A 66 0.374 1.196 -15.829 1.00 0.00 N ATOM 296 CA GLY A 66 -0.183 0.759 -14.533 1.00 0.00 C ATOM 297 C GLY A 66 0.875 0.542 -13.441 1.00 0.00 C ATOM 298 O GLY A 66 0.564 0.471 -12.252 1.00 0.00 O ATOM 0 H GLY A 66 0.230 2.190 -16.004 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.900 1.504 -14.187 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -0.734 -0.170 -14.680 1.00 0.00 H new ATOM 299 N GLU A 67 2.107 0.360 -13.878 1.00 0.00 N ATOM 300 CA GLU A 67 3.288 0.075 -13.067 1.00 0.00 C ATOM 301 C GLU A 67 3.729 1.263 -12.212 1.00 0.00 C ATOM 302 O GLU A 67 4.289 2.251 -12.697 1.00 0.00 O ATOM 303 CB GLU A 67 4.404 -0.352 -14.012 1.00 0.00 C ATOM 304 CG GLU A 67 4.063 -1.614 -14.802 1.00 0.00 C ATOM 305 CD GLU A 67 5.005 -1.803 -15.994 1.00 0.00 C ATOM 306 OE1 GLU A 67 6.236 -1.838 -15.776 1.00 0.00 O ATOM 307 OE2 GLU A 67 4.481 -1.841 -17.137 1.00 0.00 O ATOM 0 H GLU A 67 2.330 0.409 -14.872 1.00 0.00 H new ATOM 0 HA GLU A 67 3.044 -0.718 -12.360 1.00 0.00 H new ATOM 0 HB2 GLU A 67 4.615 0.460 -14.708 1.00 0.00 H new ATOM 0 HB3 GLU A 67 5.314 -0.524 -13.437 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.126 -2.483 -14.146 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.034 -1.556 -15.156 1.00 0.00 H new ATOM 308 N VAL A 68 3.421 1.086 -10.945 1.00 0.00 N ATOM 309 CA VAL A 68 3.592 2.089 -9.873 1.00 0.00 C ATOM 310 C VAL A 68 4.501 1.660 -8.725 1.00 0.00 C ATOM 311 O VAL A 68 4.303 0.635 -8.076 1.00 0.00 O ATOM 312 CB VAL A 68 2.250 2.627 -9.346 1.00 0.00 C ATOM 313 CG1 VAL A 68 1.075 1.650 -9.409 1.00 0.00 C ATOM 314 CG2 VAL A 68 2.157 2.991 -7.882 1.00 0.00 C ATOM 0 H VAL A 68 3.027 0.210 -10.602 1.00 0.00 H new ATOM 0 HA VAL A 68 4.117 2.906 -10.368 1.00 0.00 H new ATOM 0 HB VAL A 68 2.202 3.485 -10.017 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.180 2.131 -9.013 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.901 1.356 -10.444 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.305 0.766 -8.814 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.153 3.354 -7.660 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.367 2.111 -7.274 1.00 0.00 H new ATOM 0 HG23 VAL A 68 2.883 3.771 -7.654 1.00 0.00 H new ATOM 315 N TYR A 69 5.347 2.609 -8.380 1.00 0.00 N ATOM 316 CA TYR A 69 6.177 2.531 -7.175 1.00 0.00 C ATOM 317 C TYR A 69 5.522 3.350 -6.056 1.00 0.00 C ATOM 318 O TYR A 69 5.319 4.551 -6.236 1.00 0.00 O ATOM 319 CB TYR A 69 7.533 3.133 -7.475 1.00 0.00 C ATOM 320 CG TYR A 69 8.401 2.256 -8.371 1.00 0.00 C ATOM 321 CD1 TYR A 69 8.744 0.957 -7.933 1.00 0.00 C ATOM 322 CD2 TYR A 69 8.918 2.791 -9.573 1.00 0.00 C ATOM 323 CE1 TYR A 69 9.617 0.168 -8.704 1.00 0.00 C ATOM 324 CE2 TYR A 69 9.787 2.004 -10.358 1.00 0.00 C ATOM 325 CZ TYR A 69 10.113 0.694 -9.909 1.00 0.00 C ATOM 326 OH TYR A 69 10.868 -0.111 -10.704 1.00 0.00 O ATOM 0 H TYR A 69 5.485 3.462 -8.922 1.00 0.00 H new ATOM 0 HA TYR A 69 6.280 1.490 -6.868 1.00 0.00 H new ATOM 0 HB2 TYR A 69 7.394 4.103 -7.953 1.00 0.00 H new ATOM 0 HB3 TYR A 69 8.058 3.313 -6.537 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.337 0.571 -7.010 1.00 0.00 H new ATOM 0 HD2 TYR A 69 8.651 3.789 -9.886 1.00 0.00 H new ATOM 0 HE1 TYR A 69 9.900 -0.821 -8.377 1.00 0.00 H new ATOM 0 HE2 TYR A 69 10.196 2.388 -11.281 1.00 0.00 H new ATOM 0 HH TYR A 69 11.000 0.320 -11.574 1.00 0.00 H new ATOM 327 N ILE A 70 5.155 2.723 -4.946 1.00 0.00 N ATOM 328 CA ILE A 70 4.360 3.471 -3.950 1.00 0.00 C ATOM 329 C ILE A 70 5.209 4.288 -2.962 1.00 0.00 C ATOM 330 O ILE A 70 5.662 3.838 -1.920 1.00 0.00 O ATOM 331 CB ILE A 70 3.151 2.696 -3.392 1.00 0.00 C ATOM 332 CG1 ILE A 70 2.337 2.199 -4.588 1.00 0.00 C ATOM 333 CG2 ILE A 70 2.253 3.610 -2.556 1.00 0.00 C ATOM 334 CD1 ILE A 70 1.275 1.132 -4.280 1.00 0.00 C ATOM 0 H ILE A 70 5.373 1.755 -4.709 1.00 0.00 H new ATOM 0 HA ILE A 70 3.853 4.264 -4.499 1.00 0.00 H new ATOM 0 HB ILE A 70 3.503 1.879 -2.762 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.842 3.055 -5.047 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.026 1.795 -5.329 1.00 0.00 H new ATOM 0 HG21 ILE A 70 1.407 3.038 -2.174 1.00 0.00 H new ATOM 0 HG22 ILE A 70 2.824 4.016 -1.721 1.00 0.00 H new ATOM 0 HG23 ILE A 70 1.887 4.428 -3.177 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.760 0.855 -5.200 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.756 0.252 -3.854 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.554 1.532 -3.567 1.00 0.00 H new ATOM 335 N LYS A 71 5.211 5.561 -3.303 1.00 0.00 N ATOM 336 CA LYS A 71 5.937 6.660 -2.642 1.00 0.00 C ATOM 337 C LYS A 71 5.101 7.199 -1.485 1.00 0.00 C ATOM 338 O LYS A 71 3.872 7.073 -1.456 1.00 0.00 O ATOM 339 CB LYS A 71 6.130 7.650 -3.800 1.00 0.00 C ATOM 340 CG LYS A 71 6.916 8.915 -3.467 1.00 0.00 C ATOM 341 CD LYS A 71 6.921 9.858 -4.672 1.00 0.00 C ATOM 342 CE LYS A 71 7.526 11.201 -4.264 1.00 0.00 C ATOM 343 NZ LYS A 71 7.510 12.157 -5.380 1.00 0.00 N ATOM 0 H LYS A 71 4.672 5.892 -4.103 1.00 0.00 H new ATOM 0 HA LYS A 71 6.889 6.398 -2.180 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.638 7.133 -4.614 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.148 7.942 -4.171 1.00 0.00 H new ATOM 0 HG2 LYS A 71 6.471 9.414 -2.606 1.00 0.00 H new ATOM 0 HG3 LYS A 71 7.939 8.656 -3.192 1.00 0.00 H new ATOM 0 HD2 LYS A 71 7.497 9.420 -5.488 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.905 10.001 -5.040 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.969 11.612 -3.422 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.551 11.052 -3.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.927 13.058 -5.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 8.062 11.774 -6.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.529 12.317 -5.686 1.00 0.00 H new ATOM 344 N SER A 72 5.805 7.714 -0.495 1.00 0.00 N ATOM 345 CA SER A 72 5.152 8.184 0.743 1.00 0.00 C ATOM 346 C SER A 72 5.131 9.702 0.997 1.00 0.00 C ATOM 347 O SER A 72 4.745 10.157 2.073 1.00 0.00 O ATOM 348 CB SER A 72 5.751 7.443 1.919 1.00 0.00 C ATOM 349 OG SER A 72 7.176 7.398 1.869 1.00 0.00 O ATOM 0 H SER A 72 6.819 7.823 -0.509 1.00 0.00 H new ATOM 0 HA SER A 72 4.095 7.955 0.610 1.00 0.00 H new ATOM 0 HB2 SER A 72 5.438 7.925 2.845 1.00 0.00 H new ATOM 0 HB3 SER A 72 5.359 6.426 1.941 1.00 0.00 H new ATOM 0 HG SER A 72 7.459 6.702 1.241 1.00 0.00 H new ATOM 350 N THR A 73 5.290 10.440 -0.105 1.00 0.00 N ATOM 351 CA THR A 73 5.315 11.917 -0.181 1.00 0.00 C ATOM 352 C THR A 73 6.276 12.591 0.813 1.00 0.00 C ATOM 353 O THR A 73 7.417 12.827 0.449 1.00 0.00 O ATOM 354 CB THR A 73 3.897 12.501 -0.153 1.00 0.00 C ATOM 355 OG1 THR A 73 3.057 11.700 -0.985 1.00 0.00 O ATOM 356 CG2 THR A 73 3.848 13.928 -0.699 1.00 0.00 C ATOM 0 H THR A 73 5.412 10.008 -1.021 1.00 0.00 H new ATOM 0 HA THR A 73 5.745 12.161 -1.153 1.00 0.00 H new ATOM 0 HB THR A 73 3.567 12.510 0.886 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.814 10.878 -0.510 1.00 0.00 H new ATOM 0 HG21 THR A 73 2.824 14.298 -0.659 1.00 0.00 H new ATOM 0 HG22 THR A 73 4.490 14.570 -0.096 1.00 0.00 H new ATOM 0 HG23 THR A 73 4.196 13.934 -1.732 1.00 0.00 H new ATOM 357 N GLU A 74 5.883 12.684 2.089 1.00 0.00 N ATOM 358 CA GLU A 74 6.734 13.326 3.114 1.00 0.00 C ATOM 359 C GLU A 74 8.076 12.581 3.271 1.00 0.00 C ATOM 360 O GLU A 74 9.142 13.190 3.286 1.00 0.00 O ATOM 361 CB GLU A 74 6.073 13.404 4.495 1.00 0.00 C ATOM 362 CG GLU A 74 6.738 14.579 5.229 1.00 0.00 C ATOM 363 CD GLU A 74 6.318 14.780 6.678 1.00 0.00 C ATOM 364 OE1 GLU A 74 5.944 13.783 7.334 1.00 0.00 O ATOM 365 OE2 GLU A 74 6.420 15.939 7.143 1.00 0.00 O ATOM 0 H GLU A 74 4.993 12.329 2.440 1.00 0.00 H new ATOM 0 HA GLU A 74 6.894 14.341 2.751 1.00 0.00 H new ATOM 0 HB2 GLU A 74 4.998 13.562 4.403 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.212 12.473 5.045 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.818 14.436 5.200 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.523 15.495 4.678 1.00 0.00 H new ATOM 366 N THR A 75 7.945 11.285 3.531 1.00 0.00 N ATOM 367 CA THR A 75 9.086 10.367 3.631 1.00 0.00 C ATOM 368 C THR A 75 9.697 9.929 2.299 1.00 0.00 C ATOM 369 O THR A 75 10.876 9.567 2.267 1.00 0.00 O ATOM 370 CB THR A 75 8.690 9.114 4.427 1.00 0.00 C ATOM 371 OG1 THR A 75 7.279 8.887 4.331 1.00 0.00 O ATOM 372 CG2 THR A 75 9.126 9.311 5.872 1.00 0.00 C ATOM 0 H THR A 75 7.042 10.834 3.680 1.00 0.00 H new ATOM 0 HA THR A 75 9.857 10.945 4.141 1.00 0.00 H new ATOM 0 HB THR A 75 9.184 8.232 4.019 1.00 0.00 H new ATOM 0 HG1 THR A 75 7.074 7.974 4.622 1.00 0.00 H new ATOM 0 HG21 THR A 75 8.855 8.432 6.457 1.00 0.00 H new ATOM 0 HG22 THR A 75 10.206 9.453 5.910 1.00 0.00 H new ATOM 0 HG23 THR A 75 8.630 10.189 6.285 1.00 0.00 H new ATOM 373 N GLY A 76 8.822 9.710 1.322 1.00 0.00 N ATOM 374 CA GLY A 76 9.203 9.279 -0.037 1.00 0.00 C ATOM 375 C GLY A 76 9.495 7.768 -0.132 1.00 0.00 C ATOM 376 O GLY A 76 9.082 7.133 -1.109 1.00 0.00 O ATOM 0 H GLY A 76 7.816 9.825 1.444 1.00 0.00 H new ATOM 0 HA2 GLY A 76 8.401 9.532 -0.730 1.00 0.00 H new ATOM 0 HA3 GLY A 76 10.086 9.834 -0.354 1.00 0.00 H new ATOM 377 N GLN A 77 10.099 7.232 0.929 1.00 0.00 N ATOM 378 CA GLN A 77 10.358 5.791 1.180 1.00 0.00 C ATOM 379 C GLN A 77 9.219 4.921 0.622 1.00 0.00 C ATOM 380 O GLN A 77 8.042 5.173 0.857 1.00 0.00 O ATOM 381 CB GLN A 77 10.503 5.512 2.681 1.00 0.00 C ATOM 382 CG GLN A 77 11.707 6.218 3.305 1.00 0.00 C ATOM 383 CD GLN A 77 11.940 5.868 4.785 1.00 0.00 C ATOM 384 OE1 GLN A 77 11.510 4.859 5.335 1.00 0.00 O ATOM 385 NE2 GLN A 77 12.863 6.574 5.402 1.00 0.00 N ATOM 0 H GLN A 77 10.446 7.817 1.689 1.00 0.00 H new ATOM 0 HA GLN A 77 11.289 5.538 0.673 1.00 0.00 H new ATOM 0 HB2 GLN A 77 9.596 5.831 3.194 1.00 0.00 H new ATOM 0 HB3 GLN A 77 10.597 4.437 2.838 1.00 0.00 H new ATOM 0 HG2 GLN A 77 12.601 5.961 2.736 1.00 0.00 H new ATOM 0 HG3 GLN A 77 11.571 7.296 3.214 1.00 0.00 H new ATOM 0 HE21 GLN A 77 13.237 7.417 4.966 1.00 0.00 H new ATOM 0 HE22 GLN A 77 13.205 6.278 6.316 1.00 0.00 H new ATOM 386 N TYR A 78 9.628 3.885 -0.076 1.00 0.00 N ATOM 387 CA TYR A 78 8.748 3.079 -0.921 1.00 0.00 C ATOM 388 C TYR A 78 8.012 1.944 -0.200 1.00 0.00 C ATOM 389 O TYR A 78 8.597 1.200 0.587 1.00 0.00 O ATOM 390 CB TYR A 78 9.601 2.526 -2.054 1.00 0.00 C ATOM 391 CG TYR A 78 9.989 3.620 -3.061 1.00 0.00 C ATOM 392 CD1 TYR A 78 8.996 4.052 -3.956 1.00 0.00 C ATOM 393 CD2 TYR A 78 11.172 4.356 -2.842 1.00 0.00 C ATOM 394 CE1 TYR A 78 9.157 5.274 -4.630 1.00 0.00 C ATOM 395 CE2 TYR A 78 11.334 5.592 -3.498 1.00 0.00 C ATOM 396 CZ TYR A 78 10.318 6.033 -4.370 1.00 0.00 C ATOM 397 OH TYR A 78 10.430 7.236 -4.997 1.00 0.00 O ATOM 0 H TYR A 78 10.597 3.566 -0.078 1.00 0.00 H new ATOM 0 HA TYR A 78 7.948 3.727 -1.278 1.00 0.00 H new ATOM 0 HB2 TYR A 78 10.503 2.074 -1.643 1.00 0.00 H new ATOM 0 HB3 TYR A 78 9.054 1.736 -2.568 1.00 0.00 H new ATOM 0 HD1 TYR A 78 8.116 3.449 -4.125 1.00 0.00 H new ATOM 0 HD2 TYR A 78 11.940 3.979 -2.183 1.00 0.00 H new ATOM 0 HE1 TYR A 78 8.412 5.624 -5.329 1.00 0.00 H new ATOM 0 HE2 TYR A 78 12.219 6.190 -3.336 1.00 0.00 H new ATOM 0 HH TYR A 78 11.272 7.664 -4.736 1.00 0.00 H new ATOM 398 N LEU A 79 6.739 1.818 -0.538 1.00 0.00 N ATOM 399 CA LEU A 79 5.936 0.637 -0.162 1.00 0.00 C ATOM 400 C LEU A 79 6.443 -0.541 -0.984 1.00 0.00 C ATOM 401 O LEU A 79 6.546 -0.471 -2.200 1.00 0.00 O ATOM 402 CB LEU A 79 4.440 0.831 -0.446 1.00 0.00 C ATOM 403 CG LEU A 79 3.592 -0.369 0.012 1.00 0.00 C ATOM 404 CD1 LEU A 79 3.639 -0.530 1.521 1.00 0.00 C ATOM 405 CD2 LEU A 79 2.170 -0.134 -0.455 1.00 0.00 C ATOM 0 H LEU A 79 6.226 2.517 -1.075 1.00 0.00 H new ATOM 0 HA LEU A 79 6.043 0.470 0.910 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.092 1.732 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.294 0.988 -1.515 1.00 0.00 H new ATOM 0 HG LEU A 79 3.988 -1.289 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.031 -1.385 1.815 1.00 0.00 H new ATOM 0 HD12 LEU A 79 4.669 -0.691 1.838 1.00 0.00 H new ATOM 0 HD13 LEU A 79 3.251 0.371 1.995 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.542 -0.970 -0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 79 1.790 0.788 -0.015 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.153 -0.051 -1.542 1.00 0.00 H new ATOM 406 N ALA A 80 6.764 -1.563 -0.234 1.00 0.00 N ATOM 407 CA ALA A 80 7.308 -2.822 -0.761 1.00 0.00 C ATOM 408 C ALA A 80 6.634 -4.018 -0.096 1.00 0.00 C ATOM 409 O ALA A 80 6.041 -3.891 0.971 1.00 0.00 O ATOM 410 CB ALA A 80 8.814 -2.849 -0.496 1.00 0.00 C ATOM 0 H ALA A 80 6.659 -1.560 0.781 1.00 0.00 H new ATOM 0 HA ALA A 80 7.117 -2.883 -1.832 1.00 0.00 H new ATOM 0 HB1 ALA A 80 9.235 -3.778 -0.881 1.00 0.00 H new ATOM 0 HB2 ALA A 80 9.286 -2.003 -0.994 1.00 0.00 H new ATOM 0 HB3 ALA A 80 8.996 -2.786 0.577 1.00 0.00 H new ATOM 411 N MET A 81 6.755 -5.165 -0.737 1.00 0.00 N ATOM 412 CA MET A 81 6.123 -6.401 -0.246 1.00 0.00 C ATOM 413 C MET A 81 7.100 -7.596 -0.216 1.00 0.00 C ATOM 414 O MET A 81 8.032 -7.704 -1.014 1.00 0.00 O ATOM 415 CB MET A 81 4.873 -6.749 -1.064 1.00 0.00 C ATOM 416 CG MET A 81 4.030 -7.781 -0.297 1.00 0.00 C ATOM 417 SD MET A 81 2.508 -8.345 -1.147 1.00 0.00 S ATOM 418 CE MET A 81 1.567 -6.841 -1.356 1.00 0.00 C ATOM 0 H MET A 81 7.284 -5.279 -1.602 1.00 0.00 H new ATOM 0 HA MET A 81 5.823 -6.205 0.783 1.00 0.00 H new ATOM 0 HB2 MET A 81 4.285 -5.850 -1.251 1.00 0.00 H new ATOM 0 HB3 MET A 81 5.161 -7.149 -2.036 1.00 0.00 H new ATOM 0 HG2 MET A 81 4.653 -8.651 -0.090 1.00 0.00 H new ATOM 0 HG3 MET A 81 3.750 -7.353 0.665 1.00 0.00 H new ATOM 0 HE1 MET A 81 1.165 -6.801 -2.368 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.746 -6.823 -0.639 1.00 0.00 H new ATOM 0 HE3 MET A 81 2.215 -5.980 -1.189 1.00 0.00 H new ATOM 419 N ASP A 82 6.925 -8.393 0.836 1.00 0.00 N ATOM 420 CA ASP A 82 7.709 -9.611 1.068 1.00 0.00 C ATOM 421 C ASP A 82 6.875 -10.867 0.794 1.00 0.00 C ATOM 422 O ASP A 82 5.703 -10.953 1.156 1.00 0.00 O ATOM 423 CB ASP A 82 8.119 -9.593 2.541 1.00 0.00 C ATOM 424 CG ASP A 82 9.292 -10.507 2.900 1.00 0.00 C ATOM 425 OD1 ASP A 82 10.359 -10.359 2.273 1.00 0.00 O ATOM 426 OD2 ASP A 82 9.033 -11.422 3.710 1.00 0.00 O ATOM 0 H ASP A 82 6.229 -8.213 1.560 1.00 0.00 H new ATOM 0 HA ASP A 82 8.571 -9.635 0.402 1.00 0.00 H new ATOM 0 HB2 ASP A 82 8.377 -8.571 2.818 1.00 0.00 H new ATOM 0 HB3 ASP A 82 7.258 -9.879 3.145 1.00 0.00 H new ATOM 427 N THR A 83 7.680 -11.894 0.571 1.00 0.00 N ATOM 428 CA THR A 83 7.237 -13.292 0.355 1.00 0.00 C ATOM 429 C THR A 83 6.486 -13.882 1.565 1.00 0.00 C ATOM 430 O THR A 83 5.737 -14.838 1.416 1.00 0.00 O ATOM 431 CB THR A 83 8.458 -14.187 0.112 1.00 0.00 C ATOM 432 OG1 THR A 83 9.511 -13.748 0.960 1.00 0.00 O ATOM 433 CG2 THR A 83 8.845 -14.209 -1.365 1.00 0.00 C ATOM 0 H THR A 83 8.694 -11.791 0.531 1.00 0.00 H new ATOM 0 HA THR A 83 6.563 -13.266 -0.501 1.00 0.00 H new ATOM 0 HB THR A 83 8.225 -15.222 0.362 1.00 0.00 H new ATOM 0 HG1 THR A 83 10.301 -14.311 0.819 1.00 0.00 H new ATOM 0 HG21 THR A 83 9.714 -14.852 -1.504 1.00 0.00 H new ATOM 0 HG22 THR A 83 8.012 -14.593 -1.954 1.00 0.00 H new ATOM 0 HG23 THR A 83 9.086 -13.198 -1.693 1.00 0.00 H new ATOM 434 N ASP A 84 6.811 -13.367 2.752 1.00 0.00 N ATOM 435 CA ASP A 84 6.086 -13.691 4.000 1.00 0.00 C ATOM 436 C ASP A 84 4.640 -13.186 4.097 1.00 0.00 C ATOM 437 O ASP A 84 3.921 -13.554 5.024 1.00 0.00 O ATOM 438 CB ASP A 84 6.910 -13.204 5.192 1.00 0.00 C ATOM 439 CG ASP A 84 8.051 -14.173 5.527 1.00 0.00 C ATOM 440 OD1 ASP A 84 9.042 -14.170 4.762 1.00 0.00 O ATOM 441 OD2 ASP A 84 7.886 -14.914 6.527 1.00 0.00 O ATOM 0 H ASP A 84 7.583 -12.713 2.884 1.00 0.00 H new ATOM 0 HA ASP A 84 5.977 -14.776 4.001 1.00 0.00 H new ATOM 0 HB2 ASP A 84 7.322 -12.219 4.972 1.00 0.00 H new ATOM 0 HB3 ASP A 84 6.262 -13.091 6.061 1.00 0.00 H new ATOM 442 N GLY A 85 4.241 -12.354 3.135 1.00 0.00 N ATOM 443 CA GLY A 85 2.894 -11.749 3.066 1.00 0.00 C ATOM 444 C GLY A 85 2.724 -10.598 4.039 1.00 0.00 C ATOM 445 O GLY A 85 1.810 -10.575 4.855 1.00 0.00 O ATOM 0 H GLY A 85 4.848 -12.072 2.365 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.710 -11.394 2.052 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.145 -12.512 3.277 1.00 0.00 H new ATOM 446 N LEU A 86 3.583 -9.594 3.834 1.00 0.00 N ATOM 447 CA LEU A 86 3.651 -8.376 4.659 1.00 0.00 C ATOM 448 C LEU A 86 4.406 -7.247 3.925 1.00 0.00 C ATOM 449 O LEU A 86 5.298 -7.497 3.114 1.00 0.00 O ATOM 450 CB LEU A 86 4.213 -8.710 6.055 1.00 0.00 C ATOM 451 CG LEU A 86 5.607 -9.315 5.993 1.00 0.00 C ATOM 452 CD1 LEU A 86 6.596 -8.159 6.135 1.00 0.00 C ATOM 453 CD2 LEU A 86 5.812 -10.324 7.117 1.00 0.00 C ATOM 0 H LEU A 86 4.265 -9.602 3.076 1.00 0.00 H new ATOM 0 HA LEU A 86 2.646 -7.987 4.821 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.241 -7.803 6.658 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.541 -9.406 6.557 1.00 0.00 H new ATOM 0 HG LEU A 86 5.753 -9.847 5.053 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.615 -8.545 6.096 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.446 -7.449 5.321 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.434 -7.657 7.089 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.816 -10.743 7.051 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.688 -9.827 8.079 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.078 -11.125 7.025 1.00 0.00 H new ATOM 454 N LEU A 87 4.024 -6.016 4.271 1.00 0.00 N ATOM 455 CA LEU A 87 4.535 -4.805 3.600 1.00 0.00 C ATOM 456 C LEU A 87 5.675 -4.162 4.408 1.00 0.00 C ATOM 457 O LEU A 87 5.557 -3.919 5.607 1.00 0.00 O ATOM 458 CB LEU A 87 3.418 -3.767 3.381 1.00 0.00 C ATOM 459 CG LEU A 87 2.175 -4.346 2.692 1.00 0.00 C ATOM 460 CD1 LEU A 87 0.939 -3.522 3.061 1.00 0.00 C ATOM 461 CD2 LEU A 87 2.319 -4.500 1.183 1.00 0.00 C ATOM 0 H LEU A 87 3.357 -5.824 5.018 1.00 0.00 H new ATOM 0 HA LEU A 87 4.918 -5.119 2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.128 -3.347 4.344 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.808 -2.946 2.780 1.00 0.00 H new ATOM 0 HG LEU A 87 2.054 -5.362 3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 87 0.062 -3.941 2.567 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.794 -3.547 4.141 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.080 -2.491 2.738 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.399 -4.915 0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.511 -3.525 0.734 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.150 -5.170 0.963 1.00 0.00 H new ATOM 462 N TYR A 88 6.711 -3.802 3.662 1.00 0.00 N ATOM 463 CA TYR A 88 7.896 -3.099 4.202 1.00 0.00 C ATOM 464 C TYR A 88 8.149 -1.759 3.502 1.00 0.00 C ATOM 465 O TYR A 88 7.587 -1.481 2.446 1.00 0.00 O ATOM 466 CB TYR A 88 9.188 -3.941 4.267 1.00 0.00 C ATOM 467 CG TYR A 88 9.655 -4.625 2.984 1.00 0.00 C ATOM 468 CD1 TYR A 88 9.057 -5.847 2.631 1.00 0.00 C ATOM 469 CD2 TYR A 88 10.745 -4.094 2.267 1.00 0.00 C ATOM 470 CE1 TYR A 88 9.554 -6.532 1.517 1.00 0.00 C ATOM 471 CE2 TYR A 88 11.232 -4.784 1.140 1.00 0.00 C ATOM 472 CZ TYR A 88 10.597 -5.988 0.756 1.00 0.00 C ATOM 473 OH TYR A 88 10.785 -6.478 -0.488 1.00 0.00 O ATOM 0 H TYR A 88 6.766 -3.984 2.660 1.00 0.00 H new ATOM 0 HA TYR A 88 7.628 -2.904 5.240 1.00 0.00 H new ATOM 0 HB2 TYR A 88 9.993 -3.293 4.614 1.00 0.00 H new ATOM 0 HB3 TYR A 88 9.049 -4.711 5.026 1.00 0.00 H new ATOM 0 HD1 TYR A 88 8.235 -6.247 3.205 1.00 0.00 H new ATOM 0 HD2 TYR A 88 11.203 -3.167 2.578 1.00 0.00 H new ATOM 0 HE1 TYR A 88 9.131 -7.487 1.242 1.00 0.00 H new ATOM 0 HE2 TYR A 88 12.073 -4.402 0.581 1.00 0.00 H new ATOM 0 HH TYR A 88 9.973 -6.941 -0.784 1.00 0.00 H new ATOM 474 N GLY A 89 8.848 -0.903 4.241 1.00 0.00 N ATOM 475 CA GLY A 89 9.197 0.465 3.824 1.00 0.00 C ATOM 476 C GLY A 89 10.618 0.534 3.239 1.00 0.00 C ATOM 477 O GLY A 89 11.492 1.210 3.760 1.00 0.00 O ATOM 0 H GLY A 89 9.199 -1.140 5.169 1.00 0.00 H new ATOM 0 HA2 GLY A 89 8.480 0.813 3.081 1.00 0.00 H new ATOM 0 HA3 GLY A 89 9.122 1.137 4.679 1.00 0.00 H new ATOM 478 N SER A 90 10.755 -0.145 2.110 1.00 0.00 N ATOM 479 CA SER A 90 12.036 -0.191 1.364 1.00 0.00 C ATOM 480 C SER A 90 12.419 1.188 0.807 1.00 0.00 C ATOM 481 O SER A 90 11.664 1.837 0.100 1.00 0.00 O ATOM 482 CB SER A 90 11.979 -1.250 0.251 1.00 0.00 C ATOM 483 OG SER A 90 13.105 -1.080 -0.625 1.00 0.00 O ATOM 0 H SER A 90 10.001 -0.678 1.677 1.00 0.00 H new ATOM 0 HA SER A 90 12.819 -0.480 2.065 1.00 0.00 H new ATOM 0 HB2 SER A 90 11.989 -2.250 0.684 1.00 0.00 H new ATOM 0 HB3 SER A 90 11.049 -1.155 -0.310 1.00 0.00 H new ATOM 0 HG SER A 90 12.794 -0.765 -1.500 1.00 0.00 H new ATOM 484 N GLN A 91 13.641 1.580 1.121 1.00 0.00 N ATOM 485 CA GLN A 91 14.232 2.874 0.717 1.00 0.00 C ATOM 486 C GLN A 91 14.352 3.056 -0.810 1.00 0.00 C ATOM 487 O GLN A 91 14.219 4.150 -1.353 1.00 0.00 O ATOM 488 CB GLN A 91 15.633 2.943 1.315 1.00 0.00 C ATOM 489 CG GLN A 91 15.720 2.760 2.847 1.00 0.00 C ATOM 490 CD GLN A 91 14.903 3.762 3.677 1.00 0.00 C ATOM 491 OE1 GLN A 91 15.243 4.922 3.828 1.00 0.00 O ATOM 492 NE2 GLN A 91 13.794 3.304 4.233 1.00 0.00 N ATOM 0 H GLN A 91 14.276 1.006 1.676 1.00 0.00 H new ATOM 0 HA GLN A 91 13.571 3.662 1.077 1.00 0.00 H new ATOM 0 HB2 GLN A 91 16.248 2.178 0.841 1.00 0.00 H new ATOM 0 HB3 GLN A 91 16.070 3.908 1.058 1.00 0.00 H new ATOM 0 HG2 GLN A 91 15.388 1.752 3.095 1.00 0.00 H new ATOM 0 HG3 GLN A 91 16.766 2.833 3.146 1.00 0.00 H new ATOM 0 HE21 GLN A 91 13.521 2.331 4.099 1.00 0.00 H new ATOM 0 HE22 GLN A 91 13.212 3.924 4.796 1.00 0.00 H new ATOM 493 N THR A 92 14.616 1.925 -1.464 1.00 0.00 N ATOM 494 CA THR A 92 14.841 1.809 -2.914 1.00 0.00 C ATOM 495 C THR A 92 13.666 1.085 -3.600 1.00 0.00 C ATOM 496 O THR A 92 13.015 0.250 -2.947 1.00 0.00 O ATOM 497 CB THR A 92 16.192 1.093 -3.161 1.00 0.00 C ATOM 498 OG1 THR A 92 16.517 1.204 -4.555 1.00 0.00 O ATOM 499 CG2 THR A 92 16.184 -0.389 -2.772 1.00 0.00 C ATOM 0 H THR A 92 14.683 1.027 -0.985 1.00 0.00 H new ATOM 0 HA THR A 92 14.891 2.803 -3.358 1.00 0.00 H new ATOM 0 HB THR A 92 16.933 1.580 -2.527 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.372 0.757 -4.728 1.00 0.00 H new ATOM 0 HG21 THR A 92 17.163 -0.823 -2.973 1.00 0.00 H new ATOM 0 HG22 THR A 92 15.955 -0.485 -1.711 1.00 0.00 H new ATOM 0 HG23 THR A 92 15.428 -0.914 -3.355 1.00 0.00 H new ATOM 500 N PRO A 93 13.356 1.387 -4.861 1.00 0.00 N ATOM 501 CA PRO A 93 12.314 0.699 -5.606 1.00 0.00 C ATOM 502 C PRO A 93 12.803 -0.491 -6.440 1.00 0.00 C ATOM 503 O PRO A 93 13.831 -0.460 -7.114 1.00 0.00 O ATOM 504 CB PRO A 93 11.691 1.773 -6.483 1.00 0.00 C ATOM 505 CG PRO A 93 12.879 2.665 -6.845 1.00 0.00 C ATOM 506 CD PRO A 93 13.805 2.553 -5.627 1.00 0.00 C ATOM 0 HA PRO A 93 11.605 0.242 -4.916 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.223 1.346 -7.370 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.918 2.328 -5.951 1.00 0.00 H new ATOM 0 HG2 PRO A 93 13.372 2.324 -7.755 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.568 3.695 -7.018 1.00 0.00 H new ATOM 0 HD2 PRO A 93 14.842 2.434 -5.940 1.00 0.00 H new ATOM 0 HD3 PRO A 93 13.756 3.457 -5.020 1.00 0.00 H new ATOM 507 N ASN A 94 12.011 -1.552 -6.336 1.00 0.00 N ATOM 508 CA ASN A 94 12.214 -2.836 -7.052 1.00 0.00 C ATOM 509 C ASN A 94 10.844 -3.334 -7.523 1.00 0.00 C ATOM 510 O ASN A 94 9.823 -2.764 -7.135 1.00 0.00 O ATOM 511 CB ASN A 94 12.832 -3.799 -6.029 1.00 0.00 C ATOM 512 CG ASN A 94 13.603 -4.950 -6.679 1.00 0.00 C ATOM 513 OD1 ASN A 94 13.062 -5.811 -7.349 1.00 0.00 O ATOM 514 ND2 ASN A 94 14.894 -4.973 -6.467 1.00 0.00 N ATOM 0 H ASN A 94 11.184 -1.558 -5.739 1.00 0.00 H new ATOM 0 HA ASN A 94 12.864 -2.746 -7.922 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.504 -3.243 -5.375 1.00 0.00 H new ATOM 0 HB3 ASN A 94 12.041 -4.208 -5.400 1.00 0.00 H new ATOM 0 HD21 ASN A 94 15.463 -5.720 -6.865 1.00 0.00 H new ATOM 0 HD22 ASN A 94 15.331 -4.244 -5.903 1.00 0.00 H new ATOM 515 N GLU A 95 10.791 -4.522 -8.117 1.00 0.00 N ATOM 516 CA GLU A 95 9.529 -5.222 -8.481 1.00 0.00 C ATOM 517 C GLU A 95 8.600 -5.413 -7.267 1.00 0.00 C ATOM 518 O GLU A 95 7.379 -5.489 -7.381 1.00 0.00 O ATOM 519 CB GLU A 95 9.852 -6.639 -8.931 1.00 0.00 C ATOM 520 CG GLU A 95 10.739 -6.712 -10.178 1.00 0.00 C ATOM 521 CD GLU A 95 11.152 -8.157 -10.450 1.00 0.00 C ATOM 522 OE1 GLU A 95 12.166 -8.563 -9.852 1.00 0.00 O ATOM 523 OE2 GLU A 95 10.426 -8.826 -11.216 1.00 0.00 O ATOM 0 H GLU A 95 11.628 -5.047 -8.370 1.00 0.00 H new ATOM 0 HA GLU A 95 9.053 -4.612 -9.249 1.00 0.00 H new ATOM 0 HB2 GLU A 95 10.348 -7.164 -8.114 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.919 -7.167 -9.130 1.00 0.00 H new ATOM 0 HG2 GLU A 95 10.203 -6.312 -11.038 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.625 -6.093 -10.039 1.00 0.00 H new ATOM 524 N GLU A 96 9.264 -5.658 -6.143 1.00 0.00 N ATOM 525 CA GLU A 96 8.679 -5.776 -4.793 1.00 0.00 C ATOM 526 C GLU A 96 7.892 -4.530 -4.346 1.00 0.00 C ATOM 527 O GLU A 96 6.956 -4.638 -3.553 1.00 0.00 O ATOM 528 CB GLU A 96 9.823 -6.042 -3.821 1.00 0.00 C ATOM 529 CG GLU A 96 10.267 -7.496 -3.999 1.00 0.00 C ATOM 530 CD GLU A 96 11.187 -7.993 -2.888 1.00 0.00 C ATOM 531 OE1 GLU A 96 12.368 -7.604 -2.926 1.00 0.00 O ATOM 532 OE2 GLU A 96 10.694 -8.798 -2.057 1.00 0.00 O ATOM 0 H GLU A 96 10.276 -5.788 -6.138 1.00 0.00 H new ATOM 0 HA GLU A 96 7.955 -6.590 -4.808 1.00 0.00 H new ATOM 0 HB2 GLU A 96 10.654 -5.363 -4.015 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.500 -5.865 -2.795 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.384 -8.134 -4.041 1.00 0.00 H new ATOM 0 HG3 GLU A 96 10.779 -7.596 -4.956 1.00 0.00 H new ATOM 533 N CYS A 97 8.403 -3.398 -4.793 1.00 0.00 N ATOM 534 CA CYS A 97 7.831 -2.054 -4.570 1.00 0.00 C ATOM 535 C CYS A 97 6.893 -1.624 -5.717 1.00 0.00 C ATOM 536 O CYS A 97 6.208 -0.609 -5.617 1.00 0.00 O ATOM 537 CB CYS A 97 9.032 -1.113 -4.483 1.00 0.00 C ATOM 538 SG CYS A 97 8.594 0.650 -4.485 1.00 0.00 S ATOM 0 H CYS A 97 9.261 -3.373 -5.344 1.00 0.00 H new ATOM 0 HA CYS A 97 7.221 -2.038 -3.667 1.00 0.00 H new ATOM 0 HB2 CYS A 97 9.590 -1.337 -3.574 1.00 0.00 H new ATOM 0 HB3 CYS A 97 9.698 -1.312 -5.323 1.00 0.00 H new ATOM 0 HG CYS A 97 7.390 0.798 -4.953 1.00 0.00 H new ATOM 539 N LEU A 98 7.134 -2.225 -6.875 1.00 0.00 N ATOM 540 CA LEU A 98 6.304 -2.036 -8.069 1.00 0.00 C ATOM 541 C LEU A 98 5.007 -2.817 -7.948 1.00 0.00 C ATOM 542 O LEU A 98 4.933 -3.944 -7.475 1.00 0.00 O ATOM 543 CB LEU A 98 7.059 -2.345 -9.358 1.00 0.00 C ATOM 544 CG LEU A 98 6.455 -1.542 -10.515 1.00 0.00 C ATOM 545 CD1 LEU A 98 6.486 -0.061 -10.273 1.00 0.00 C ATOM 546 CD2 LEU A 98 7.362 -1.632 -11.726 1.00 0.00 C ATOM 0 H LEU A 98 7.916 -2.864 -7.018 1.00 0.00 H new ATOM 0 HA LEU A 98 6.045 -0.979 -8.130 1.00 0.00 H new ATOM 0 HB2 LEU A 98 8.114 -2.096 -9.242 1.00 0.00 H new ATOM 0 HB3 LEU A 98 7.005 -3.412 -9.576 1.00 0.00 H new ATOM 0 HG LEU A 98 5.448 -1.943 -10.632 1.00 0.00 H new ATOM 0 HD11 LEU A 98 6.045 0.456 -11.125 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.917 0.173 -9.373 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.518 0.265 -10.145 1.00 0.00 H new ATOM 0 HD21 LEU A 98 6.930 -1.060 -12.547 1.00 0.00 H new ATOM 0 HD22 LEU A 98 8.342 -1.226 -11.477 1.00 0.00 H new ATOM 0 HD23 LEU A 98 7.467 -2.675 -12.026 1.00 0.00 H new ATOM 547 N PHE A 99 3.993 -1.993 -8.090 1.00 0.00 N ATOM 548 CA PHE A 99 2.593 -2.394 -8.010 1.00 0.00 C ATOM 549 C PHE A 99 1.817 -2.070 -9.285 1.00 0.00 C ATOM 550 O PHE A 99 2.208 -1.208 -10.072 1.00 0.00 O ATOM 551 CB PHE A 99 1.914 -1.684 -6.822 1.00 0.00 C ATOM 552 CG PHE A 99 2.355 -2.208 -5.449 1.00 0.00 C ATOM 553 CD1 PHE A 99 3.537 -1.704 -4.853 1.00 0.00 C ATOM 554 CD2 PHE A 99 1.543 -3.124 -4.752 1.00 0.00 C ATOM 555 CE1 PHE A 99 3.908 -2.128 -3.555 1.00 0.00 C ATOM 556 CE2 PHE A 99 1.901 -3.549 -3.459 1.00 0.00 C ATOM 557 CZ PHE A 99 3.083 -3.045 -2.863 1.00 0.00 C ATOM 0 H PHE A 99 4.115 -0.996 -8.270 1.00 0.00 H new ATOM 0 HA PHE A 99 2.580 -3.475 -7.874 1.00 0.00 H new ATOM 0 HB2 PHE A 99 2.129 -0.617 -6.879 1.00 0.00 H new ATOM 0 HB3 PHE A 99 0.834 -1.797 -6.913 1.00 0.00 H new ATOM 0 HD1 PHE A 99 4.154 -0.997 -5.388 1.00 0.00 H new ATOM 0 HD2 PHE A 99 0.642 -3.502 -5.212 1.00 0.00 H new ATOM 0 HE1 PHE A 99 4.812 -1.755 -3.097 1.00 0.00 H new ATOM 0 HE2 PHE A 99 1.280 -4.253 -2.926 1.00 0.00 H new ATOM 0 HZ PHE A 99 3.357 -3.365 -1.869 1.00 0.00 H new ATOM 558 N LEU A 100 0.799 -2.865 -9.536 1.00 0.00 N ATOM 559 CA LEU A 100 -0.007 -2.728 -10.745 1.00 0.00 C ATOM 560 C LEU A 100 -1.369 -2.069 -10.490 1.00 0.00 C ATOM 561 O LEU A 100 -2.212 -2.611 -9.773 1.00 0.00 O ATOM 562 CB LEU A 100 -0.206 -4.132 -11.315 1.00 0.00 C ATOM 563 CG LEU A 100 -0.352 -4.058 -12.835 1.00 0.00 C ATOM 564 CD1 LEU A 100 0.992 -4.414 -13.458 1.00 0.00 C ATOM 565 CD2 LEU A 100 -1.431 -5.020 -13.313 1.00 0.00 C ATOM 0 H LEU A 100 0.503 -3.620 -8.918 1.00 0.00 H new ATOM 0 HA LEU A 100 0.516 -2.074 -11.443 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.642 -4.765 -11.052 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -1.093 -4.590 -10.877 1.00 0.00 H new ATOM 0 HG LEU A 100 -0.648 -3.052 -13.134 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.913 -4.368 -14.544 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.749 -3.707 -13.119 1.00 0.00 H new ATOM 0 HD13 LEU A 100 1.277 -5.422 -13.157 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.522 -4.955 -14.397 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.161 -6.038 -13.032 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.383 -4.757 -12.852 1.00 0.00 H new ATOM 566 N GLU A 101 -1.518 -0.897 -11.104 1.00 0.00 N ATOM 567 CA GLU A 101 -2.707 -0.034 -10.904 1.00 0.00 C ATOM 568 C GLU A 101 -4.017 -0.583 -11.481 1.00 0.00 C ATOM 569 O GLU A 101 -4.463 -0.266 -12.592 1.00 0.00 O ATOM 570 CB GLU A 101 -2.401 1.384 -11.367 1.00 0.00 C ATOM 571 CG GLU A 101 -3.284 2.485 -10.771 1.00 0.00 C ATOM 572 CD GLU A 101 -4.665 2.612 -11.429 1.00 0.00 C ATOM 573 OE1 GLU A 101 -4.705 3.223 -12.516 1.00 0.00 O ATOM 574 OE2 GLU A 101 -5.643 2.119 -10.825 1.00 0.00 O ATOM 0 H GLU A 101 -0.831 -0.511 -11.751 1.00 0.00 H new ATOM 0 HA GLU A 101 -2.902 -0.022 -9.832 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.362 1.608 -11.127 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.492 1.419 -12.453 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.418 2.291 -9.707 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.764 3.439 -10.858 1.00 0.00 H new ATOM 575 N ARG A 102 -4.657 -1.314 -10.584 1.00 0.00 N ATOM 576 CA ARG A 102 -5.995 -1.910 -10.687 1.00 0.00 C ATOM 577 C ARG A 102 -6.990 -0.884 -10.110 1.00 0.00 C ATOM 578 O ARG A 102 -6.801 -0.374 -9.014 1.00 0.00 O ATOM 579 CB ARG A 102 -6.020 -3.128 -9.753 1.00 0.00 C ATOM 580 CG ARG A 102 -4.965 -4.219 -9.919 1.00 0.00 C ATOM 581 CD ARG A 102 -5.224 -5.125 -11.130 1.00 0.00 C ATOM 582 NE ARG A 102 -6.348 -6.043 -10.870 1.00 0.00 N ATOM 583 CZ ARG A 102 -6.356 -7.355 -11.127 1.00 0.00 C ATOM 584 NH1 ARG A 102 -5.291 -7.997 -11.561 1.00 0.00 N ATOM 585 NH2 ARG A 102 -7.447 -8.089 -10.919 1.00 0.00 N ATOM 0 H ARG A 102 -4.224 -1.529 -9.686 1.00 0.00 H new ATOM 0 HA ARG A 102 -6.238 -2.181 -11.714 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.950 -2.758 -8.730 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -6.997 -3.599 -9.855 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -3.984 -3.755 -10.023 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -4.936 -4.829 -9.016 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -5.443 -4.514 -12.006 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -4.326 -5.699 -11.358 1.00 0.00 H new ATOM 0 HE ARG A 102 -7.191 -5.643 -10.459 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -4.418 -7.492 -11.713 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.339 -8.999 -11.745 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.295 -7.652 -10.558 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -7.435 -9.089 -11.121 1.00 0.00 H new ATOM 586 N LEU A 103 -8.140 -0.725 -10.758 1.00 0.00 N ATOM 587 CA LEU A 103 -9.108 0.305 -10.344 1.00 0.00 C ATOM 588 C LEU A 103 -10.548 -0.202 -10.168 1.00 0.00 C ATOM 589 O LEU A 103 -11.011 -1.136 -10.826 1.00 0.00 O ATOM 590 CB LEU A 103 -9.031 1.470 -11.352 1.00 0.00 C ATOM 591 CG LEU A 103 -9.871 2.726 -11.052 1.00 0.00 C ATOM 592 CD1 LEU A 103 -9.590 3.390 -9.702 1.00 0.00 C ATOM 593 CD2 LEU A 103 -9.673 3.742 -12.185 1.00 0.00 C ATOM 0 H LEU A 103 -8.429 -1.283 -11.561 1.00 0.00 H new ATOM 0 HA LEU A 103 -8.828 0.639 -9.345 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.988 1.775 -11.435 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -9.331 1.090 -12.329 1.00 0.00 H new ATOM 0 HG LEU A 103 -10.905 2.388 -10.991 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.231 4.264 -9.586 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.793 2.682 -8.899 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.545 3.698 -9.658 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -10.264 4.635 -11.981 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.619 4.012 -12.251 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -9.995 3.302 -13.129 1.00 0.00 H new ATOM 594 N GLU A 104 -11.143 0.403 -9.146 1.00 0.00 N ATOM 595 CA GLU A 104 -12.580 0.398 -8.819 1.00 0.00 C ATOM 596 C GLU A 104 -13.002 1.854 -9.054 1.00 0.00 C ATOM 597 O GLU A 104 -12.510 2.750 -8.358 1.00 0.00 O ATOM 598 CB GLU A 104 -12.853 0.122 -7.341 1.00 0.00 C ATOM 599 CG GLU A 104 -12.294 -1.176 -6.760 1.00 0.00 C ATOM 600 CD GLU A 104 -13.226 -2.364 -6.982 1.00 0.00 C ATOM 601 OE1 GLU A 104 -13.325 -2.839 -8.140 1.00 0.00 O ATOM 602 OE2 GLU A 104 -13.864 -2.774 -5.986 1.00 0.00 O ATOM 0 H GLU A 104 -10.605 0.949 -8.473 1.00 0.00 H new ATOM 0 HA GLU A 104 -13.095 -0.364 -9.404 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -12.450 0.953 -6.762 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.933 0.122 -7.191 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -11.326 -1.387 -7.215 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.122 -1.048 -5.691 1.00 0.00 H new ATOM 603 N GLU A 105 -13.645 2.078 -10.196 1.00 0.00 N ATOM 604 CA GLU A 105 -14.145 3.382 -10.680 1.00 0.00 C ATOM 605 C GLU A 105 -14.098 4.614 -9.766 1.00 0.00 C ATOM 606 O GLU A 105 -13.538 5.639 -10.118 1.00 0.00 O ATOM 607 CB GLU A 105 -15.541 3.225 -11.309 1.00 0.00 C ATOM 608 CG GLU A 105 -16.598 2.538 -10.428 1.00 0.00 C ATOM 609 CD GLU A 105 -17.975 2.552 -11.085 1.00 0.00 C ATOM 610 OE1 GLU A 105 -18.675 3.585 -10.941 1.00 0.00 O ATOM 611 OE2 GLU A 105 -18.295 1.528 -11.737 1.00 0.00 O ATOM 0 H GLU A 105 -13.847 1.322 -10.850 1.00 0.00 H new ATOM 0 HA GLU A 105 -13.380 3.640 -11.412 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -15.909 4.214 -11.581 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -15.441 2.656 -12.234 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -16.297 1.508 -10.235 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -16.650 3.041 -9.463 1.00 0.00 H new ATOM 612 N ASN A 106 -14.752 4.462 -8.619 1.00 0.00 N ATOM 613 CA ASN A 106 -14.801 5.388 -7.478 1.00 0.00 C ATOM 614 C ASN A 106 -13.462 5.768 -6.789 1.00 0.00 C ATOM 615 O ASN A 106 -13.419 6.013 -5.581 1.00 0.00 O ATOM 616 CB ASN A 106 -15.742 4.698 -6.487 1.00 0.00 C ATOM 617 CG ASN A 106 -17.183 4.661 -6.988 1.00 0.00 C ATOM 618 OD1 ASN A 106 -17.589 3.753 -7.694 1.00 0.00 O ATOM 619 ND2 ASN A 106 -17.933 5.696 -6.704 1.00 0.00 N ATOM 0 H ASN A 106 -15.307 3.625 -8.443 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.128 6.361 -7.845 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.395 3.680 -6.308 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -15.705 5.220 -5.531 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -18.881 5.756 -7.076 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -17.569 6.442 -6.111 1.00 0.00 H new ATOM 620 N HIS A 107 -12.434 5.952 -7.615 1.00 0.00 N ATOM 621 CA HIS A 107 -11.055 6.351 -7.259 1.00 0.00 C ATOM 622 C HIS A 107 -10.262 5.321 -6.420 1.00 0.00 C ATOM 623 O HIS A 107 -9.061 5.477 -6.221 1.00 0.00 O ATOM 624 CB HIS A 107 -11.011 7.730 -6.585 1.00 0.00 C ATOM 625 CG HIS A 107 -11.802 8.791 -7.368 1.00 0.00 C ATOM 626 ND1 HIS A 107 -13.098 9.038 -7.207 1.00 0.00 N ATOM 627 CD2 HIS A 107 -11.368 9.512 -8.391 1.00 0.00 C ATOM 628 CE1 HIS A 107 -13.476 9.908 -8.131 1.00 0.00 C ATOM 629 NE2 HIS A 107 -12.404 10.195 -8.869 1.00 0.00 N ATOM 0 H HIS A 107 -12.539 5.820 -8.621 1.00 0.00 H new ATOM 0 HA HIS A 107 -10.546 6.400 -8.222 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -11.415 7.651 -5.576 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -9.974 8.051 -6.489 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -10.356 9.540 -8.768 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -14.470 10.311 -8.262 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -12.382 10.831 -9.666 1.00 0.00 H new ATOM 630 N TYR A 108 -10.872 4.152 -6.219 1.00 0.00 N ATOM 631 CA TYR A 108 -10.301 3.066 -5.412 1.00 0.00 C ATOM 632 C TYR A 108 -9.286 2.239 -6.198 1.00 0.00 C ATOM 633 O TYR A 108 -9.600 1.373 -7.025 1.00 0.00 O ATOM 634 CB TYR A 108 -11.351 2.132 -4.826 1.00 0.00 C ATOM 635 CG TYR A 108 -12.159 2.806 -3.714 1.00 0.00 C ATOM 636 CD1 TYR A 108 -11.529 3.053 -2.482 1.00 0.00 C ATOM 637 CD2 TYR A 108 -13.508 3.139 -3.969 1.00 0.00 C ATOM 638 CE1 TYR A 108 -12.273 3.673 -1.462 1.00 0.00 C ATOM 639 CE2 TYR A 108 -14.248 3.771 -2.940 1.00 0.00 C ATOM 640 CZ TYR A 108 -13.618 4.031 -1.714 1.00 0.00 C ATOM 641 OH TYR A 108 -14.341 4.524 -0.669 1.00 0.00 O ATOM 0 H TYR A 108 -11.785 3.928 -6.614 1.00 0.00 H new ATOM 0 HA TYR A 108 -9.798 3.571 -4.587 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -12.026 1.803 -5.616 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -10.864 1.240 -4.431 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -10.498 2.773 -2.322 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -13.963 2.918 -4.923 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -11.824 3.873 -0.500 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -15.280 4.048 -3.097 1.00 0.00 H new ATOM 0 HH TYR A 108 -15.250 4.734 -0.970 1.00 0.00 H new ATOM 642 N ASN A 109 -8.046 2.547 -5.865 1.00 0.00 N ATOM 643 CA ASN A 109 -6.846 1.946 -6.439 1.00 0.00 C ATOM 644 C ASN A 109 -6.444 0.716 -5.634 1.00 0.00 C ATOM 645 O ASN A 109 -6.142 0.787 -4.435 1.00 0.00 O ATOM 646 CB ASN A 109 -5.740 2.988 -6.370 1.00 0.00 C ATOM 647 CG ASN A 109 -5.676 3.902 -7.588 1.00 0.00 C ATOM 648 OD1 ASN A 109 -4.700 3.935 -8.336 1.00 0.00 O ATOM 649 ND2 ASN A 109 -6.638 4.788 -7.725 1.00 0.00 N ATOM 0 H ASN A 109 -7.834 3.251 -5.158 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.026 1.637 -7.469 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -5.884 3.597 -5.478 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -4.782 2.480 -6.258 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -6.574 5.502 -8.451 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -7.448 4.762 -7.105 1.00 0.00 H new ATOM 650 N THR A 110 -6.663 -0.428 -6.259 1.00 0.00 N ATOM 651 CA THR A 110 -6.121 -1.701 -5.750 1.00 0.00 C ATOM 652 C THR A 110 -4.846 -1.953 -6.574 1.00 0.00 C ATOM 653 O THR A 110 -4.628 -1.346 -7.625 1.00 0.00 O ATOM 654 CB THR A 110 -7.160 -2.835 -5.838 1.00 0.00 C ATOM 655 OG1 THR A 110 -7.490 -3.151 -7.198 1.00 0.00 O ATOM 656 CG2 THR A 110 -8.442 -2.512 -5.068 1.00 0.00 C ATOM 0 H THR A 110 -7.208 -0.514 -7.117 1.00 0.00 H new ATOM 0 HA THR A 110 -5.879 -1.660 -4.688 1.00 0.00 H new ATOM 0 HB THR A 110 -6.690 -3.703 -5.375 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.463 -3.214 -7.292 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.142 -3.343 -5.161 1.00 0.00 H new ATOM 0 HG22 THR A 110 -8.205 -2.354 -4.016 1.00 0.00 H new ATOM 0 HG23 THR A 110 -8.894 -1.609 -5.477 1.00 0.00 H new ATOM 657 N TYR A 111 -3.892 -2.688 -6.001 1.00 0.00 N ATOM 658 CA TYR A 111 -2.564 -2.825 -6.649 1.00 0.00 C ATOM 659 C TYR A 111 -1.905 -4.170 -6.376 1.00 0.00 C ATOM 660 O TYR A 111 -1.494 -4.425 -5.245 1.00 0.00 O ATOM 661 CB TYR A 111 -1.573 -1.742 -6.194 1.00 0.00 C ATOM 662 CG TYR A 111 -2.025 -0.287 -6.280 1.00 0.00 C ATOM 663 CD1 TYR A 111 -1.734 0.447 -7.448 1.00 0.00 C ATOM 664 CD2 TYR A 111 -2.509 0.349 -5.119 1.00 0.00 C ATOM 665 CE1 TYR A 111 -1.933 1.837 -7.442 1.00 0.00 C ATOM 666 CE2 TYR A 111 -2.695 1.740 -5.109 1.00 0.00 C ATOM 667 CZ TYR A 111 -2.410 2.467 -6.276 1.00 0.00 C ATOM 668 OH TYR A 111 -2.590 3.812 -6.268 1.00 0.00 O ATOM 0 H TYR A 111 -3.996 -3.188 -5.118 1.00 0.00 H new ATOM 0 HA TYR A 111 -2.777 -2.724 -7.713 1.00 0.00 H new ATOM 0 HB2 TYR A 111 -1.302 -1.949 -5.159 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.665 -1.847 -6.788 1.00 0.00 H new ATOM 0 HD1 TYR A 111 -1.364 -0.051 -8.332 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.736 -0.233 -4.238 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -1.722 2.420 -8.326 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.050 2.242 -4.221 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.172 4.069 -7.013 1.00 0.00 H new ATOM 669 N ILE A 112 -1.796 -4.994 -7.411 1.00 0.00 N ATOM 670 CA ILE A 112 -1.033 -6.261 -7.337 1.00 0.00 C ATOM 671 C ILE A 112 0.451 -5.869 -7.225 1.00 0.00 C ATOM 672 O ILE A 112 0.969 -5.157 -8.079 1.00 0.00 O ATOM 673 CB ILE A 112 -1.083 -7.146 -8.608 1.00 0.00 C ATOM 674 CG1 ILE A 112 -2.476 -7.332 -9.213 1.00 0.00 C ATOM 675 CG2 ILE A 112 -0.345 -8.488 -8.399 1.00 0.00 C ATOM 676 CD1 ILE A 112 -3.421 -8.361 -8.574 1.00 0.00 C ATOM 0 H ILE A 112 -2.223 -4.818 -8.320 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.466 -6.821 -6.508 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.541 -6.580 -9.365 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -2.978 -6.364 -9.194 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.349 -7.604 -10.261 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.402 -9.081 -9.312 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.700 -8.295 -8.157 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -0.812 -9.036 -7.581 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.366 -8.373 -9.117 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.965 -9.350 -8.617 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.603 -8.091 -7.534 1.00 0.00 H new ATOM 677 N SER A 113 1.133 -6.456 -6.252 1.00 0.00 N ATOM 678 CA SER A 113 2.606 -6.386 -6.184 1.00 0.00 C ATOM 679 C SER A 113 3.224 -7.186 -7.335 1.00 0.00 C ATOM 680 O SER A 113 2.994 -8.391 -7.463 1.00 0.00 O ATOM 681 CB SER A 113 3.178 -6.829 -4.832 1.00 0.00 C ATOM 682 OG SER A 113 2.765 -8.154 -4.465 1.00 0.00 O ATOM 0 H SER A 113 0.702 -6.987 -5.496 1.00 0.00 H new ATOM 0 HA SER A 113 2.877 -5.335 -6.287 1.00 0.00 H new ATOM 0 HB2 SER A 113 4.267 -6.790 -4.872 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.862 -6.127 -4.060 1.00 0.00 H new ATOM 0 HG SER A 113 3.521 -8.633 -4.065 1.00 0.00 H new ATOM 683 N LYS A 114 3.843 -6.452 -8.263 1.00 0.00 N ATOM 684 CA LYS A 114 4.502 -6.981 -9.475 1.00 0.00 C ATOM 685 C LYS A 114 5.264 -8.301 -9.232 1.00 0.00 C ATOM 686 O LYS A 114 5.010 -9.281 -9.924 1.00 0.00 O ATOM 687 CB LYS A 114 5.429 -5.903 -10.049 1.00 0.00 C ATOM 688 CG LYS A 114 6.139 -6.282 -11.359 1.00 0.00 C ATOM 689 CD LYS A 114 5.213 -6.320 -12.574 1.00 0.00 C ATOM 690 CE LYS A 114 4.985 -4.937 -13.199 1.00 0.00 C ATOM 691 NZ LYS A 114 6.180 -4.477 -13.918 1.00 0.00 N ATOM 0 H LYS A 114 3.905 -5.436 -8.195 1.00 0.00 H new ATOM 0 HA LYS A 114 3.722 -7.227 -10.196 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.846 -4.998 -10.219 1.00 0.00 H new ATOM 0 HB3 LYS A 114 6.184 -5.660 -9.302 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.940 -5.567 -11.547 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.606 -7.260 -11.239 1.00 0.00 H new ATOM 0 HD2 LYS A 114 5.636 -6.987 -13.325 1.00 0.00 H new ATOM 0 HD3 LYS A 114 4.252 -6.742 -12.278 1.00 0.00 H new ATOM 0 HE2 LYS A 114 4.139 -4.980 -13.884 1.00 0.00 H new ATOM 0 HE3 LYS A 114 4.728 -4.220 -12.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.992 -3.547 -14.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 6.976 -4.398 -13.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 6.419 -5.159 -14.666 1.00 0.00 H new ATOM 692 N LYS A 115 6.098 -8.327 -8.182 1.00 0.00 N ATOM 693 CA LYS A 115 6.799 -9.551 -7.774 1.00 0.00 C ATOM 694 C LYS A 115 5.810 -10.718 -7.525 1.00 0.00 C ATOM 695 O LYS A 115 5.856 -11.744 -8.207 1.00 0.00 O ATOM 696 CB LYS A 115 7.682 -9.320 -6.538 1.00 0.00 C ATOM 697 CG LYS A 115 8.408 -10.632 -6.254 1.00 0.00 C ATOM 698 CD LYS A 115 8.679 -10.936 -4.791 1.00 0.00 C ATOM 699 CE LYS A 115 8.853 -12.447 -4.700 1.00 0.00 C ATOM 700 NZ LYS A 115 10.154 -12.879 -5.250 1.00 0.00 N ATOM 0 H LYS A 115 6.303 -7.514 -7.601 1.00 0.00 H new ATOM 0 HA LYS A 115 7.451 -9.829 -8.602 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.396 -8.516 -6.719 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.076 -9.022 -5.682 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.819 -11.449 -6.672 1.00 0.00 H new ATOM 0 HG3 LYS A 115 9.360 -10.621 -6.785 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.574 -10.419 -4.445 1.00 0.00 H new ATOM 0 HD3 LYS A 115 7.854 -10.600 -4.163 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.775 -12.761 -3.659 1.00 0.00 H new ATOM 0 HE3 LYS A 115 8.046 -12.940 -5.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.238 -13.913 -5.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.218 -12.601 -6.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.924 -12.428 -4.716 1.00 0.00 H new ATOM 701 N HIS A 116 4.873 -10.500 -6.603 1.00 0.00 N ATOM 702 CA HIS A 116 3.883 -11.520 -6.233 1.00 0.00 C ATOM 703 C HIS A 116 2.673 -11.508 -7.194 1.00 0.00 C ATOM 704 O HIS A 116 1.548 -11.812 -6.808 1.00 0.00 O ATOM 705 CB HIS A 116 3.429 -11.289 -4.785 1.00 0.00 C ATOM 706 CG HIS A 116 4.587 -11.074 -3.809 1.00 0.00 C ATOM 707 ND1 HIS A 116 4.881 -9.899 -3.295 1.00 0.00 N ATOM 708 CD2 HIS A 116 5.449 -11.977 -3.337 1.00 0.00 C ATOM 709 CE1 HIS A 116 5.934 -10.052 -2.503 1.00 0.00 C ATOM 710 NE2 HIS A 116 6.275 -11.330 -2.527 1.00 0.00 N ATOM 0 H HIS A 116 4.776 -9.622 -6.094 1.00 0.00 H new ATOM 0 HA HIS A 116 4.349 -12.502 -6.313 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.771 -10.420 -4.753 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.841 -12.146 -4.456 1.00 0.00 H new ATOM 0 HD2 HIS A 116 5.470 -13.031 -3.570 1.00 0.00 H new ATOM 0 HE1 HIS A 116 6.425 -9.273 -1.939 1.00 0.00 H new ATOM 0 HE2 HIS A 116 7.047 -11.749 -2.008 1.00 0.00 H new ATOM 711 N ALA A 117 2.975 -11.299 -8.476 1.00 0.00 N ATOM 712 CA ALA A 117 2.031 -11.531 -9.585 1.00 0.00 C ATOM 713 C ALA A 117 1.562 -12.994 -9.546 1.00 0.00 C ATOM 714 O ALA A 117 0.356 -13.230 -9.430 1.00 0.00 O ATOM 715 CB ALA A 117 2.720 -11.248 -10.919 1.00 0.00 C ATOM 0 H ALA A 117 3.887 -10.961 -8.783 1.00 0.00 H new ATOM 0 HA ALA A 117 1.174 -10.866 -9.481 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.018 -11.421 -11.735 1.00 0.00 H new ATOM 0 HB2 ALA A 117 3.055 -10.211 -10.943 1.00 0.00 H new ATOM 0 HB3 ALA A 117 3.579 -11.910 -11.033 1.00 0.00 H new ATOM 716 N GLU A 118 2.505 -13.873 -9.202 1.00 0.00 N ATOM 717 CA GLU A 118 2.234 -15.325 -9.109 1.00 0.00 C ATOM 718 C GLU A 118 1.393 -15.761 -7.879 1.00 0.00 C ATOM 719 O GLU A 118 1.022 -16.925 -7.756 1.00 0.00 O ATOM 720 CB GLU A 118 3.512 -16.157 -9.268 1.00 0.00 C ATOM 721 CG GLU A 118 4.647 -15.680 -8.361 1.00 0.00 C ATOM 722 CD GLU A 118 5.878 -16.583 -8.394 1.00 0.00 C ATOM 723 OE1 GLU A 118 6.585 -16.567 -9.422 1.00 0.00 O ATOM 724 OE2 GLU A 118 6.120 -17.221 -7.350 1.00 0.00 O ATOM 0 H GLU A 118 3.466 -13.613 -8.981 1.00 0.00 H new ATOM 0 HA GLU A 118 1.588 -15.539 -9.960 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.290 -17.201 -9.046 1.00 0.00 H new ATOM 0 HB3 GLU A 118 3.841 -16.115 -10.306 1.00 0.00 H new ATOM 0 HG2 GLU A 118 4.938 -14.672 -8.657 1.00 0.00 H new ATOM 0 HG3 GLU A 118 4.280 -15.618 -7.337 1.00 0.00 H new ATOM 725 N LYS A 119 1.150 -14.809 -6.987 1.00 0.00 N ATOM 726 CA LYS A 119 0.240 -14.954 -5.831 1.00 0.00 C ATOM 727 C LYS A 119 -0.954 -13.980 -5.847 1.00 0.00 C ATOM 728 O LYS A 119 -1.886 -14.148 -5.074 1.00 0.00 O ATOM 729 CB LYS A 119 1.080 -14.763 -4.560 1.00 0.00 C ATOM 730 CG LYS A 119 1.862 -16.026 -4.209 1.00 0.00 C ATOM 731 CD LYS A 119 3.276 -15.690 -3.725 1.00 0.00 C ATOM 732 CE LYS A 119 4.190 -15.344 -4.893 1.00 0.00 C ATOM 733 NZ LYS A 119 5.536 -15.041 -4.397 1.00 0.00 N ATOM 0 H LYS A 119 1.585 -13.888 -7.038 1.00 0.00 H new ATOM 0 HA LYS A 119 -0.210 -15.946 -5.872 1.00 0.00 H new ATOM 0 HB2 LYS A 119 1.772 -13.933 -4.702 1.00 0.00 H new ATOM 0 HB3 LYS A 119 0.428 -14.495 -3.729 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.332 -16.580 -3.434 1.00 0.00 H new ATOM 0 HG3 LYS A 119 1.919 -16.675 -5.083 1.00 0.00 H new ATOM 0 HD2 LYS A 119 3.236 -14.851 -3.030 1.00 0.00 H new ATOM 0 HD3 LYS A 119 3.687 -16.538 -3.177 1.00 0.00 H new ATOM 0 HE2 LYS A 119 4.230 -16.177 -5.595 1.00 0.00 H new ATOM 0 HE3 LYS A 119 3.792 -14.488 -5.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 5.894 -14.185 -4.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 5.500 -14.883 -3.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 6.170 -15.840 -4.602 1.00 0.00 H new ATOM 734 N ASN A 120 -0.987 -13.096 -6.860 1.00 0.00 N ATOM 735 CA ASN A 120 -1.935 -11.967 -7.034 1.00 0.00 C ATOM 736 C ASN A 120 -2.059 -11.047 -5.816 1.00 0.00 C ATOM 737 O ASN A 120 -3.082 -10.405 -5.593 1.00 0.00 O ATOM 738 CB ASN A 120 -3.327 -12.480 -7.428 1.00 0.00 C ATOM 739 CG ASN A 120 -3.360 -13.353 -8.686 1.00 0.00 C ATOM 740 OD1 ASN A 120 -3.684 -12.944 -9.791 1.00 0.00 O ATOM 741 ND2 ASN A 120 -3.155 -14.637 -8.483 1.00 0.00 N ATOM 0 H ASN A 120 -0.316 -13.148 -7.627 1.00 0.00 H new ATOM 0 HA ASN A 120 -1.508 -11.364 -7.835 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -3.736 -13.052 -6.595 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -3.984 -11.624 -7.580 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.266 -15.299 -9.251 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -2.885 -14.970 -7.558 1.00 0.00 H new ATOM 742 N TRP A 121 -0.943 -10.854 -5.107 1.00 0.00 N ATOM 743 CA TRP A 121 -0.970 -10.129 -3.821 1.00 0.00 C ATOM 744 C TRP A 121 -1.075 -8.616 -3.945 1.00 0.00 C ATOM 745 O TRP A 121 -0.112 -7.941 -4.322 1.00 0.00 O ATOM 746 CB TRP A 121 0.232 -10.442 -2.946 1.00 0.00 C ATOM 747 CG TRP A 121 0.206 -11.850 -2.355 1.00 0.00 C ATOM 748 CD1 TRP A 121 -0.837 -12.668 -2.300 1.00 0.00 C ATOM 749 CD2 TRP A 121 1.258 -12.436 -1.672 1.00 0.00 C ATOM 750 NE1 TRP A 121 -0.482 -13.783 -1.648 1.00 0.00 N ATOM 751 CE2 TRP A 121 0.769 -13.669 -1.211 1.00 0.00 C ATOM 752 CE3 TRP A 121 2.541 -11.990 -1.335 1.00 0.00 C ATOM 753 CZ2 TRP A 121 1.564 -14.468 -0.362 1.00 0.00 C ATOM 754 CZ3 TRP A 121 3.355 -12.795 -0.522 1.00 0.00 C ATOM 755 CH2 TRP A 121 2.857 -14.017 -0.012 1.00 0.00 C ATOM 0 H TRP A 121 -0.020 -11.182 -5.391 1.00 0.00 H new ATOM 0 HA TRP A 121 -1.885 -10.496 -3.356 1.00 0.00 H new ATOM 0 HB2 TRP A 121 1.141 -10.321 -3.535 1.00 0.00 H new ATOM 0 HB3 TRP A 121 0.279 -9.717 -2.134 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -1.814 -12.467 -2.714 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -1.081 -14.597 -1.508 1.00 0.00 H new ATOM 0 HE3 TRP A 121 2.901 -11.038 -1.696 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 1.191 -15.409 0.014 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.361 -12.481 -0.286 1.00 0.00 H new ATOM 0 HH2 TRP A 121 3.470 -14.610 0.650 1.00 0.00 H new ATOM 756 N PHE A 122 -2.202 -8.117 -3.452 1.00 0.00 N ATOM 757 CA PHE A 122 -2.447 -6.671 -3.440 1.00 0.00 C ATOM 758 C PHE A 122 -1.944 -6.027 -2.152 1.00 0.00 C ATOM 759 O PHE A 122 -1.762 -6.651 -1.112 1.00 0.00 O ATOM 760 CB PHE A 122 -3.920 -6.298 -3.618 1.00 0.00 C ATOM 761 CG PHE A 122 -4.596 -6.819 -4.891 1.00 0.00 C ATOM 762 CD1 PHE A 122 -5.041 -8.161 -4.949 1.00 0.00 C ATOM 763 CD2 PHE A 122 -4.991 -5.897 -5.876 1.00 0.00 C ATOM 764 CE1 PHE A 122 -5.887 -8.575 -5.996 1.00 0.00 C ATOM 765 CE2 PHE A 122 -5.857 -6.293 -6.915 1.00 0.00 C ATOM 766 CZ PHE A 122 -6.295 -7.641 -6.968 1.00 0.00 C ATOM 0 H PHE A 122 -2.956 -8.680 -3.058 1.00 0.00 H new ATOM 0 HA PHE A 122 -1.892 -6.290 -4.297 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -4.475 -6.671 -2.757 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.003 -5.211 -3.605 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.732 -8.866 -4.192 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.629 -4.880 -5.836 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -6.220 -9.601 -6.053 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -6.182 -5.581 -7.659 1.00 0.00 H new ATOM 0 HZ PHE A 122 -6.951 -7.956 -7.766 1.00 0.00 H new ATOM 767 N VAL A 123 -1.662 -4.744 -2.343 1.00 0.00 N ATOM 768 CA VAL A 123 -1.491 -3.754 -1.265 1.00 0.00 C ATOM 769 C VAL A 123 -2.704 -3.852 -0.324 1.00 0.00 C ATOM 770 O VAL A 123 -3.829 -3.922 -0.802 1.00 0.00 O ATOM 771 CB VAL A 123 -1.373 -2.369 -1.951 1.00 0.00 C ATOM 772 CG1 VAL A 123 -2.606 -1.995 -2.770 1.00 0.00 C ATOM 773 CG2 VAL A 123 -1.087 -1.245 -0.954 1.00 0.00 C ATOM 0 H VAL A 123 -1.541 -4.344 -3.273 1.00 0.00 H new ATOM 0 HA VAL A 123 -0.600 -3.924 -0.660 1.00 0.00 H new ATOM 0 HB VAL A 123 -0.526 -2.474 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -2.458 -1.015 -3.223 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -2.762 -2.737 -3.553 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -3.480 -1.966 -2.119 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -1.014 -0.297 -1.486 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.896 -1.191 -0.225 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -0.147 -1.446 -0.439 1.00 0.00 H new ATOM 774 N GLY A 124 -2.456 -3.738 0.964 1.00 0.00 N ATOM 775 CA GLY A 124 -3.488 -4.139 1.931 1.00 0.00 C ATOM 776 C GLY A 124 -3.331 -3.432 3.254 1.00 0.00 C ATOM 777 O GLY A 124 -2.273 -2.899 3.591 1.00 0.00 O ATOM 0 H GLY A 124 -1.587 -3.386 1.367 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -4.474 -3.922 1.519 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -3.438 -5.216 2.088 1.00 0.00 H new ATOM 778 N LEU A 125 -4.512 -3.181 3.771 1.00 0.00 N ATOM 779 CA LEU A 125 -4.610 -2.565 5.087 1.00 0.00 C ATOM 780 C LEU A 125 -5.215 -3.395 6.196 1.00 0.00 C ATOM 781 O LEU A 125 -6.410 -3.688 6.247 1.00 0.00 O ATOM 782 CB LEU A 125 -5.200 -1.158 5.029 1.00 0.00 C ATOM 783 CG LEU A 125 -4.029 -0.410 5.624 1.00 0.00 C ATOM 784 CD1 LEU A 125 -3.291 0.383 4.578 1.00 0.00 C ATOM 785 CD2 LEU A 125 -4.445 0.439 6.826 1.00 0.00 C ATOM 0 H LEU A 125 -5.403 -3.386 3.318 1.00 0.00 H new ATOM 0 HA LEU A 125 -3.565 -2.492 5.389 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -5.437 -0.838 4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -6.112 -1.055 5.617 1.00 0.00 H new ATOM 0 HG LEU A 125 -3.326 -1.151 6.006 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -2.456 0.908 5.041 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.914 -0.291 3.809 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -3.968 1.107 4.125 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -3.573 0.959 7.223 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -5.193 1.168 6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -4.866 -0.205 7.598 1.00 0.00 H new ATOM 786 N LYS A 126 -4.365 -3.424 7.219 1.00 0.00 N ATOM 787 CA LYS A 126 -4.639 -4.185 8.415 1.00 0.00 C ATOM 788 C LYS A 126 -5.548 -3.351 9.336 1.00 0.00 C ATOM 789 O LYS A 126 -5.163 -2.289 9.837 1.00 0.00 O ATOM 790 CB LYS A 126 -3.290 -4.544 9.065 1.00 0.00 C ATOM 791 CG LYS A 126 -3.255 -5.826 9.899 1.00 0.00 C ATOM 792 CD LYS A 126 -4.095 -5.740 11.180 1.00 0.00 C ATOM 793 CE LYS A 126 -3.607 -4.618 12.100 1.00 0.00 C ATOM 794 NZ LYS A 126 -2.457 -5.095 12.887 1.00 0.00 N ATOM 0 H LYS A 126 -3.477 -2.922 7.234 1.00 0.00 H new ATOM 0 HA LYS A 126 -5.168 -5.114 8.202 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -2.543 -4.630 8.276 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -2.987 -3.714 9.703 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -3.615 -6.656 9.292 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -2.222 -6.050 10.165 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -5.140 -5.569 10.920 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -4.050 -6.691 11.710 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.322 -3.747 11.510 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -4.411 -4.303 12.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -1.778 -4.318 13.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -2.786 -5.425 13.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -1.994 -5.879 12.385 1.00 0.00 H new ATOM 795 N LYS A 127 -6.651 -3.995 9.674 1.00 0.00 N ATOM 796 CA LYS A 127 -7.881 -3.368 10.216 1.00 0.00 C ATOM 797 C LYS A 127 -7.843 -2.695 11.601 1.00 0.00 C ATOM 798 O LYS A 127 -8.844 -2.153 12.053 1.00 0.00 O ATOM 799 CB LYS A 127 -9.013 -4.423 10.210 1.00 0.00 C ATOM 800 CG LYS A 127 -9.350 -5.009 8.821 1.00 0.00 C ATOM 801 CD LYS A 127 -9.781 -3.931 7.828 1.00 0.00 C ATOM 802 CE LYS A 127 -10.011 -4.521 6.433 1.00 0.00 C ATOM 803 NZ LYS A 127 -11.414 -4.913 6.248 1.00 0.00 N ATOM 0 H LYS A 127 -6.735 -5.007 9.582 1.00 0.00 H new ATOM 0 HA LYS A 127 -8.036 -2.523 9.545 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.731 -5.240 10.874 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -9.913 -3.971 10.625 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -8.479 -5.534 8.429 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -10.147 -5.746 8.923 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -10.696 -3.455 8.179 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -9.017 -3.155 7.776 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -9.732 -3.789 5.675 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -9.366 -5.388 6.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.483 -5.597 5.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.771 -5.348 7.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.983 -4.072 6.023 1.00 0.00 H new ATOM 804 N ASN A 128 -6.650 -2.588 12.157 1.00 0.00 N ATOM 805 CA ASN A 128 -6.439 -2.130 13.542 1.00 0.00 C ATOM 806 C ASN A 128 -5.406 -1.000 13.698 1.00 0.00 C ATOM 807 O ASN A 128 -5.125 -0.574 14.815 1.00 0.00 O ATOM 808 CB ASN A 128 -5.948 -3.349 14.318 1.00 0.00 C ATOM 809 CG ASN A 128 -6.985 -4.468 14.439 1.00 0.00 C ATOM 810 OD1 ASN A 128 -6.810 -5.572 13.947 1.00 0.00 O ATOM 811 ND2 ASN A 128 -8.128 -4.180 15.034 1.00 0.00 N ATOM 0 H ASN A 128 -5.785 -2.815 11.666 1.00 0.00 H new ATOM 0 HA ASN A 128 -7.379 -1.715 13.907 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.058 -3.744 13.829 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -5.649 -3.034 15.318 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -8.868 -4.880 15.084 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -8.271 -3.257 15.444 1.00 0.00 H new ATOM 812 N GLY A 129 -4.866 -0.549 12.572 1.00 0.00 N ATOM 813 CA GLY A 129 -3.825 0.493 12.562 1.00 0.00 C ATOM 814 C GLY A 129 -2.467 0.127 11.972 1.00 0.00 C ATOM 815 O GLY A 129 -1.564 0.968 11.950 1.00 0.00 O ATOM 0 H GLY A 129 -5.128 -0.885 11.645 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -4.212 1.349 12.010 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -3.668 0.821 13.589 1.00 0.00 H new ATOM 816 N SER A 130 -2.325 -1.085 11.455 1.00 0.00 N ATOM 817 CA SER A 130 -1.141 -1.441 10.653 1.00 0.00 C ATOM 818 C SER A 130 -1.516 -1.711 9.180 1.00 0.00 C ATOM 819 O SER A 130 -2.619 -1.374 8.750 1.00 0.00 O ATOM 820 CB SER A 130 -0.344 -2.586 11.302 1.00 0.00 C ATOM 821 OG SER A 130 0.919 -2.760 10.635 1.00 0.00 O ATOM 0 H SER A 130 -3.002 -1.839 11.569 1.00 0.00 H new ATOM 0 HA SER A 130 -0.471 -0.582 10.638 1.00 0.00 H new ATOM 0 HB2 SER A 130 -0.178 -2.369 12.357 1.00 0.00 H new ATOM 0 HB3 SER A 130 -0.919 -3.511 11.253 1.00 0.00 H new ATOM 0 HG SER A 130 1.524 -2.031 10.885 1.00 0.00 H new ATOM 822 N CYS A 131 -0.540 -2.120 8.394 1.00 0.00 N ATOM 823 CA CYS A 131 -0.701 -2.408 6.958 1.00 0.00 C ATOM 824 C CYS A 131 -0.385 -3.867 6.590 1.00 0.00 C ATOM 825 O CYS A 131 -1.227 -4.575 6.048 1.00 0.00 O ATOM 826 CB CYS A 131 0.185 -1.461 6.150 1.00 0.00 C ATOM 827 SG CYS A 131 -0.418 0.261 6.119 1.00 0.00 S ATOM 0 H CYS A 131 0.412 -2.269 8.730 1.00 0.00 H new ATOM 0 HA CYS A 131 -1.752 -2.251 6.715 1.00 0.00 H new ATOM 0 HB2 CYS A 131 1.192 -1.476 6.566 1.00 0.00 H new ATOM 0 HB3 CYS A 131 0.257 -1.830 5.127 1.00 0.00 H new ATOM 0 HG CYS A 131 -1.517 0.349 6.808 1.00 0.00 H new ATOM 828 N LYS A 132 0.852 -4.241 6.912 1.00 0.00 N ATOM 829 CA LYS A 132 1.518 -5.536 6.681 1.00 0.00 C ATOM 830 C LYS A 132 0.755 -6.745 6.107 1.00 0.00 C ATOM 831 O LYS A 132 0.581 -7.778 6.756 1.00 0.00 O ATOM 832 CB LYS A 132 2.426 -5.865 7.890 1.00 0.00 C ATOM 833 CG LYS A 132 1.779 -5.772 9.269 1.00 0.00 C ATOM 834 CD LYS A 132 1.018 -7.044 9.685 1.00 0.00 C ATOM 835 CE LYS A 132 0.278 -6.829 11.005 1.00 0.00 C ATOM 836 NZ LYS A 132 -0.385 -8.069 11.408 1.00 0.00 N ATOM 0 H LYS A 132 1.477 -3.589 7.386 1.00 0.00 H new ATOM 0 HA LYS A 132 2.095 -5.345 5.776 1.00 0.00 H new ATOM 0 HB2 LYS A 132 2.813 -6.876 7.762 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.282 -5.191 7.868 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.551 -5.564 10.009 1.00 0.00 H new ATOM 0 HG3 LYS A 132 1.090 -4.927 9.281 1.00 0.00 H new ATOM 0 HD2 LYS A 132 0.307 -7.319 8.906 1.00 0.00 H new ATOM 0 HD3 LYS A 132 1.717 -7.874 9.786 1.00 0.00 H new ATOM 0 HE2 LYS A 132 0.978 -6.512 11.778 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -0.457 -6.032 10.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -0.887 -7.918 12.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -1.065 -8.353 10.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 0.325 -8.819 11.530 1.00 0.00 H new ATOM 837 N ARG A 133 0.507 -6.669 4.799 1.00 0.00 N ATOM 838 CA ARG A 133 -0.150 -7.768 4.083 1.00 0.00 C ATOM 839 C ARG A 133 0.353 -8.286 2.722 1.00 0.00 C ATOM 840 O ARG A 133 1.299 -7.760 2.139 1.00 0.00 O ATOM 841 CB ARG A 133 -1.656 -7.466 4.013 1.00 0.00 C ATOM 842 CG ARG A 133 -2.364 -8.196 5.158 1.00 0.00 C ATOM 843 CD ARG A 133 -3.390 -7.261 5.794 1.00 0.00 C ATOM 844 NE ARG A 133 -4.160 -7.956 6.836 1.00 0.00 N ATOM 845 CZ ARG A 133 -5.488 -7.955 6.949 1.00 0.00 C ATOM 846 NH1 ARG A 133 -6.266 -7.625 5.921 1.00 0.00 N ATOM 847 NH2 ARG A 133 -6.073 -8.550 7.981 1.00 0.00 N ATOM 0 H ARG A 133 0.748 -5.867 4.217 1.00 0.00 H new ATOM 0 HA ARG A 133 0.137 -8.620 4.699 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.829 -6.392 4.087 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.061 -7.788 3.054 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -2.856 -9.094 4.783 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.637 -8.518 5.904 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -2.883 -6.398 6.226 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -4.067 -6.882 5.028 1.00 0.00 H new ATOM 0 HE ARG A 133 -3.633 -8.484 7.532 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -5.848 -7.367 5.027 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -7.280 -7.630 6.027 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -5.506 -9.011 8.693 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -7.090 -8.546 8.063 1.00 0.00 H new ATOM 848 N GLY A 134 -0.310 -9.367 2.336 1.00 0.00 N ATOM 849 CA GLY A 134 -0.044 -10.187 1.127 1.00 0.00 C ATOM 850 C GLY A 134 -1.197 -11.162 0.821 1.00 0.00 C ATOM 851 O GLY A 134 -2.115 -10.788 0.089 1.00 0.00 O ATOM 0 H GLY A 134 -1.095 -9.729 2.878 1.00 0.00 H new ATOM 0 HA2 GLY A 134 0.111 -9.530 0.271 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.878 -10.750 1.268 1.00 0.00 H new ATOM 852 N PRO A 135 -1.249 -12.353 1.441 1.00 0.00 N ATOM 853 CA PRO A 135 -2.221 -13.405 1.083 1.00 0.00 C ATOM 854 C PRO A 135 -3.664 -13.149 1.529 1.00 0.00 C ATOM 855 O PRO A 135 -4.619 -13.517 0.844 1.00 0.00 O ATOM 856 CB PRO A 135 -1.592 -14.688 1.626 1.00 0.00 C ATOM 857 CG PRO A 135 -0.939 -14.212 2.920 1.00 0.00 C ATOM 858 CD PRO A 135 -0.405 -12.820 2.570 1.00 0.00 C ATOM 0 HA PRO A 135 -2.376 -13.454 0.005 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.339 -15.461 1.808 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -0.862 -15.107 0.933 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -1.657 -14.171 3.739 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -0.137 -14.881 3.233 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -0.478 -12.144 3.422 1.00 0.00 H new ATOM 0 HD3 PRO A 135 0.646 -12.861 2.285 1.00 0.00 H new ATOM 859 N ARG A 136 -3.791 -12.478 2.676 1.00 0.00 N ATOM 860 CA ARG A 136 -5.053 -11.946 3.210 1.00 0.00 C ATOM 861 C ARG A 136 -5.751 -10.914 2.302 1.00 0.00 C ATOM 862 O ARG A 136 -6.954 -10.686 2.435 1.00 0.00 O ATOM 863 CB ARG A 136 -4.660 -11.280 4.531 1.00 0.00 C ATOM 864 CG ARG A 136 -4.617 -12.286 5.676 1.00 0.00 C ATOM 865 CD ARG A 136 -3.629 -11.863 6.769 1.00 0.00 C ATOM 866 NE ARG A 136 -2.434 -12.722 6.694 1.00 0.00 N ATOM 867 CZ ARG A 136 -1.196 -12.341 6.350 1.00 0.00 C ATOM 868 NH1 ARG A 136 -0.789 -11.084 6.440 1.00 0.00 N ATOM 869 NH2 ARG A 136 -0.243 -13.251 6.234 1.00 0.00 N ATOM 0 H ARG A 136 -2.993 -12.282 3.281 1.00 0.00 H new ATOM 0 HA ARG A 136 -5.776 -12.756 3.307 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -3.684 -10.807 4.424 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -5.373 -10.490 4.767 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.613 -12.389 6.107 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -4.334 -13.265 5.289 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -3.350 -10.817 6.640 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -4.094 -11.950 7.751 1.00 0.00 H new ATOM 0 HE ARG A 136 -2.562 -13.707 6.928 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -1.427 -10.365 6.781 1.00 0.00 H new ATOM 0 HH12 ARG A 136 0.162 -10.835 6.168 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -0.453 -14.234 6.406 1.00 0.00 H new ATOM 0 HH22 ARG A 136 0.702 -12.969 5.973 1.00 0.00 H new ATOM 870 N THR A 137 -4.995 -10.362 1.358 1.00 0.00 N ATOM 871 CA THR A 137 -5.405 -9.194 0.552 1.00 0.00 C ATOM 872 C THR A 137 -5.520 -9.422 -0.960 1.00 0.00 C ATOM 873 O THR A 137 -4.632 -9.078 -1.751 1.00 0.00 O ATOM 874 CB THR A 137 -4.481 -8.031 0.883 1.00 0.00 C ATOM 875 OG1 THR A 137 -3.114 -8.462 0.968 1.00 0.00 O ATOM 876 CG2 THR A 137 -4.962 -7.348 2.163 1.00 0.00 C ATOM 0 H THR A 137 -4.066 -10.711 1.120 1.00 0.00 H new ATOM 0 HA THR A 137 -6.434 -8.971 0.835 1.00 0.00 H new ATOM 0 HB THR A 137 -4.517 -7.298 0.077 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.982 -9.247 0.396 1.00 0.00 H new ATOM 0 HG21 THR A 137 -4.301 -6.515 2.401 1.00 0.00 H new ATOM 0 HG22 THR A 137 -5.976 -6.976 2.018 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.952 -8.065 2.984 1.00 0.00 H new ATOM 877 N HIS A 138 -6.707 -9.890 -1.311 1.00 0.00 N ATOM 878 CA HIS A 138 -7.162 -10.092 -2.693 1.00 0.00 C ATOM 879 C HIS A 138 -8.432 -9.274 -2.990 1.00 0.00 C ATOM 880 O HIS A 138 -9.087 -8.771 -2.073 1.00 0.00 O ATOM 881 CB HIS A 138 -7.434 -11.583 -2.947 1.00 0.00 C ATOM 882 CG HIS A 138 -8.534 -12.144 -2.040 1.00 0.00 C ATOM 883 ND1 HIS A 138 -9.846 -11.917 -2.160 1.00 0.00 N ATOM 884 CD2 HIS A 138 -8.350 -12.875 -0.945 1.00 0.00 C ATOM 885 CE1 HIS A 138 -10.467 -12.492 -1.137 1.00 0.00 C ATOM 886 NE2 HIS A 138 -9.544 -13.090 -0.393 1.00 0.00 N ATOM 0 H HIS A 138 -7.412 -10.152 -0.622 1.00 0.00 H new ATOM 0 HA HIS A 138 -6.371 -9.747 -3.359 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.721 -11.724 -3.989 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -6.515 -12.148 -2.790 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -10.294 -11.391 -2.910 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -7.402 -13.231 -0.570 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -11.530 -12.476 -0.945 1.00 0.00 H new ATOM 887 N TYR A 139 -8.687 -9.053 -4.278 1.00 0.00 N ATOM 888 CA TYR A 139 -9.979 -8.501 -4.748 1.00 0.00 C ATOM 889 C TYR A 139 -11.222 -9.127 -4.082 1.00 0.00 C ATOM 890 O TYR A 139 -11.400 -10.343 -4.085 1.00 0.00 O ATOM 891 CB TYR A 139 -10.091 -8.541 -6.267 1.00 0.00 C ATOM 892 CG TYR A 139 -10.305 -7.144 -6.893 1.00 0.00 C ATOM 893 CD1 TYR A 139 -10.900 -6.109 -6.146 1.00 0.00 C ATOM 894 CD2 TYR A 139 -9.756 -6.905 -8.168 1.00 0.00 C ATOM 895 CE1 TYR A 139 -10.903 -4.789 -6.656 1.00 0.00 C ATOM 896 CE2 TYR A 139 -9.770 -5.590 -8.691 1.00 0.00 C ATOM 897 CZ TYR A 139 -10.327 -4.547 -7.923 1.00 0.00 C ATOM 898 OH TYR A 139 -10.095 -3.258 -8.292 1.00 0.00 O ATOM 0 H TYR A 139 -8.020 -9.245 -5.026 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.970 -7.459 -4.427 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.185 -8.984 -6.681 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -10.920 -9.190 -6.548 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -11.352 -6.322 -5.188 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -9.329 -7.716 -8.740 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.338 -3.981 -6.087 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -9.358 -5.387 -9.669 1.00 0.00 H new ATOM 0 HH TYR A 139 -9.695 -3.241 -9.187 1.00 0.00 H new ATOM 899 N GLY A 140 -11.819 -8.262 -3.267 1.00 0.00 N ATOM 900 CA GLY A 140 -13.005 -8.571 -2.435 1.00 0.00 C ATOM 901 C GLY A 140 -12.806 -8.019 -1.024 1.00 0.00 C ATOM 902 O GLY A 140 -13.696 -7.394 -0.454 1.00 0.00 O ATOM 0 H GLY A 140 -11.493 -7.302 -3.156 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.898 -8.136 -2.883 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -13.162 -9.649 -2.395 1.00 0.00 H new ATOM 903 N GLN A 141 -11.568 -8.123 -0.538 1.00 0.00 N ATOM 904 CA GLN A 141 -11.160 -7.542 0.742 1.00 0.00 C ATOM 905 C GLN A 141 -11.135 -6.026 0.651 1.00 0.00 C ATOM 906 O GLN A 141 -10.371 -5.413 -0.099 1.00 0.00 O ATOM 907 CB GLN A 141 -9.775 -8.036 1.130 1.00 0.00 C ATOM 908 CG GLN A 141 -9.607 -9.565 1.079 1.00 0.00 C ATOM 909 CD GLN A 141 -10.404 -10.314 2.156 1.00 0.00 C ATOM 910 OE1 GLN A 141 -11.623 -10.425 2.148 1.00 0.00 O ATOM 911 NE2 GLN A 141 -9.685 -10.956 3.051 1.00 0.00 N ATOM 0 H GLN A 141 -10.817 -8.614 -1.023 1.00 0.00 H new ATOM 0 HA GLN A 141 -11.882 -7.850 1.498 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -9.041 -7.580 0.466 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -9.549 -7.692 2.139 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -9.917 -9.922 0.097 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.550 -9.809 1.188 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -8.670 -10.860 3.053 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -10.143 -11.550 3.743 1.00 0.00 H new ATOM 912 N LYS A 142 -11.947 -5.489 1.534 1.00 0.00 N ATOM 913 CA LYS A 142 -11.998 -4.048 1.865 1.00 0.00 C ATOM 914 C LYS A 142 -10.600 -3.454 2.138 1.00 0.00 C ATOM 915 O LYS A 142 -10.292 -2.335 1.727 1.00 0.00 O ATOM 916 CB LYS A 142 -12.894 -3.886 3.085 1.00 0.00 C ATOM 917 CG LYS A 142 -14.311 -4.409 2.799 1.00 0.00 C ATOM 918 CD LYS A 142 -15.225 -4.137 3.991 1.00 0.00 C ATOM 919 CE LYS A 142 -16.666 -4.528 3.690 1.00 0.00 C ATOM 920 NZ LYS A 142 -17.490 -4.258 4.879 1.00 0.00 N ATOM 0 H LYS A 142 -12.617 -6.043 2.067 1.00 0.00 H new ATOM 0 HA LYS A 142 -12.396 -3.501 1.010 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -12.466 -4.426 3.929 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -12.941 -2.835 3.370 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -14.711 -3.927 1.907 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -14.277 -5.479 2.594 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -14.869 -4.694 4.858 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -15.181 -3.079 4.251 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -17.040 -3.963 2.836 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -16.723 -5.583 3.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -18.477 -4.522 4.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -17.134 -4.816 5.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -17.442 -3.246 5.112 1.00 0.00 H new ATOM 921 N ALA A 143 -9.708 -4.344 2.604 1.00 0.00 N ATOM 922 CA ALA A 143 -8.284 -4.078 2.859 1.00 0.00 C ATOM 923 C ALA A 143 -7.483 -3.519 1.667 1.00 0.00 C ATOM 924 O ALA A 143 -6.618 -2.678 1.892 1.00 0.00 O ATOM 925 CB ALA A 143 -7.628 -5.359 3.388 1.00 0.00 C ATOM 0 H ALA A 143 -9.970 -5.305 2.822 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.259 -3.276 3.597 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -6.571 -5.174 3.581 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -8.118 -5.663 4.313 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -7.728 -6.152 2.647 1.00 0.00 H new ATOM 926 N ILE A 144 -7.891 -3.848 0.445 1.00 0.00 N ATOM 927 CA ILE A 144 -7.136 -3.439 -0.759 1.00 0.00 C ATOM 928 C ILE A 144 -7.624 -2.147 -1.450 1.00 0.00 C ATOM 929 O ILE A 144 -7.056 -1.741 -2.457 1.00 0.00 O ATOM 930 CB ILE A 144 -7.010 -4.593 -1.781 1.00 0.00 C ATOM 931 CG1 ILE A 144 -8.331 -4.999 -2.420 1.00 0.00 C ATOM 932 CG2 ILE A 144 -6.236 -5.742 -1.127 1.00 0.00 C ATOM 933 CD1 ILE A 144 -8.070 -5.805 -3.692 1.00 0.00 C ATOM 0 H ILE A 144 -8.732 -4.392 0.252 1.00 0.00 H new ATOM 0 HA ILE A 144 -6.148 -3.192 -0.369 1.00 0.00 H new ATOM 0 HB ILE A 144 -6.438 -4.245 -2.641 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -8.917 -5.592 -1.718 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -8.918 -4.112 -2.656 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -6.138 -6.565 -1.835 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.245 -5.394 -0.836 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.773 -6.086 -0.243 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -9.020 -6.091 -4.143 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -7.502 -5.198 -4.397 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -7.501 -6.701 -3.445 1.00 0.00 H new ATOM 934 N LEU A 145 -8.462 -1.383 -0.759 1.00 0.00 N ATOM 935 CA LEU A 145 -9.162 -0.230 -1.365 1.00 0.00 C ATOM 936 C LEU A 145 -8.527 1.124 -0.985 1.00 0.00 C ATOM 937 O LEU A 145 -8.884 1.752 0.009 1.00 0.00 O ATOM 938 CB LEU A 145 -10.645 -0.257 -1.000 1.00 0.00 C ATOM 939 CG LEU A 145 -11.368 -1.501 -1.546 1.00 0.00 C ATOM 940 CD1 LEU A 145 -12.761 -1.593 -0.920 1.00 0.00 C ATOM 941 CD2 LEU A 145 -11.469 -1.484 -3.073 1.00 0.00 C ATOM 0 H LEU A 145 -8.681 -1.533 0.226 1.00 0.00 H new ATOM 0 HA LEU A 145 -9.058 -0.327 -2.446 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -10.749 -0.228 0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -11.127 0.639 -1.390 1.00 0.00 H new ATOM 0 HG LEU A 145 -10.782 -2.379 -1.276 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -13.276 -2.473 -1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -12.669 -1.671 0.163 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -13.333 -0.700 -1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -11.986 -2.381 -3.413 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -12.025 -0.602 -3.391 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -10.468 -1.457 -3.504 1.00 0.00 H new ATOM 942 N PHE A 146 -7.545 1.502 -1.802 1.00 0.00 N ATOM 943 CA PHE A 146 -6.726 2.701 -1.556 1.00 0.00 C ATOM 944 C PHE A 146 -7.072 3.929 -2.421 1.00 0.00 C ATOM 945 O PHE A 146 -7.603 3.820 -3.514 1.00 0.00 O ATOM 946 CB PHE A 146 -5.249 2.377 -1.771 1.00 0.00 C ATOM 947 CG PHE A 146 -4.726 1.337 -0.773 1.00 0.00 C ATOM 948 CD1 PHE A 146 -5.100 -0.011 -0.939 1.00 0.00 C ATOM 949 CD2 PHE A 146 -3.936 1.752 0.311 1.00 0.00 C ATOM 950 CE1 PHE A 146 -4.700 -0.967 0.016 1.00 0.00 C ATOM 951 CE2 PHE A 146 -3.516 0.789 1.253 1.00 0.00 C ATOM 952 CZ PHE A 146 -3.903 -0.559 1.105 1.00 0.00 C ATOM 0 H PHE A 146 -7.291 0.994 -2.649 1.00 0.00 H new ATOM 0 HA PHE A 146 -6.947 2.974 -0.524 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -5.105 2.006 -2.786 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -4.662 3.291 -1.679 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -5.690 -0.310 -1.793 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -3.655 2.789 0.422 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -5.000 -1.999 -0.085 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -2.898 1.084 2.088 1.00 0.00 H new ATOM 0 HZ PHE A 146 -3.585 -1.288 1.835 1.00 0.00 H new ATOM 953 N LEU A 147 -6.850 5.083 -1.810 1.00 0.00 N ATOM 954 CA LEU A 147 -6.921 6.382 -2.505 1.00 0.00 C ATOM 955 C LEU A 147 -5.584 7.128 -2.428 1.00 0.00 C ATOM 956 O LEU A 147 -5.129 7.445 -1.331 1.00 0.00 O ATOM 957 CB LEU A 147 -8.008 7.302 -1.930 1.00 0.00 C ATOM 958 CG LEU A 147 -9.396 6.801 -2.293 1.00 0.00 C ATOM 959 CD1 LEU A 147 -10.033 6.204 -1.040 1.00 0.00 C ATOM 960 CD2 LEU A 147 -10.246 7.965 -2.798 1.00 0.00 C ATOM 0 H LEU A 147 -6.615 5.157 -0.820 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.167 6.145 -3.540 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.909 7.354 -0.846 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -7.872 8.314 -2.312 1.00 0.00 H new ATOM 0 HG LEU A 147 -9.331 6.047 -3.077 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -11.032 5.838 -1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -9.420 5.378 -0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -10.102 6.969 -0.267 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -11.241 7.603 -3.058 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -10.327 8.722 -2.018 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -9.777 8.402 -3.680 1.00 0.00 H new ATOM 961 N PRO A 148 -4.940 7.315 -3.581 1.00 0.00 N ATOM 962 CA PRO A 148 -3.675 8.064 -3.633 1.00 0.00 C ATOM 963 C PRO A 148 -3.834 9.559 -3.916 1.00 0.00 C ATOM 964 O PRO A 148 -4.814 10.014 -4.522 1.00 0.00 O ATOM 965 CB PRO A 148 -2.868 7.377 -4.740 1.00 0.00 C ATOM 966 CG PRO A 148 -3.928 6.867 -5.710 1.00 0.00 C ATOM 967 CD PRO A 148 -5.137 6.528 -4.818 1.00 0.00 C ATOM 0 HA PRO A 148 -3.186 8.042 -2.659 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -2.185 8.073 -5.226 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -2.263 6.561 -4.345 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.183 7.623 -6.453 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.578 5.990 -6.255 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.074 6.793 -5.308 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -5.180 5.460 -4.603 1.00 0.00 H new