USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1001 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 117 LYS NZ :NH3+ -123:sc= -2.24! (180deg=-2.65!) USER MOD Set 1.2: A 119 LYS NZ :NH3+ -178:sc= -0.206 (180deg=0) USER MOD Set 2.1: A 34 LYS NZ :NH3+ 143:sc= 0.456 (180deg=0) USER MOD Set 2.2: A 69 GLN : amide:sc= 0.413 K(o=0.87,f=-1.8) USER MOD Set 3.1: A 33 SER OG : rot 124:sc= 0.8 USER MOD Set 3.2: A 40 CYS SG : rot 163:sc= 1.64 USER MOD Single : A 1 GLY N :NH3+ -147:sc= 0.0401 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -2.86! C(o=-2.9!,f=-12!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.508 K(o=-0.51,f=-2) USER MOD Single : A 19 GLN : amide:sc= -0.484 K(o=-0.48,f=-3.1!) USER MOD Single : A 21 GLN : amide:sc= 0.288 X(o=0.29,f=-0.068) USER MOD Single : A 23 THR OG1 : rot 75:sc= 0.819 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0.777 K(o=0.78,f=0) USER MOD Single : A 35 THR OG1 : rot 66:sc= 1.18 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot -79:sc= -0.385 USER MOD Single : A 38 SER OG : rot 180:sc= -0.194 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -157:sc= -0.15 (180deg=-0.681) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HD1:sc= -0.0196 X(o=-0.02,f=0) USER MOD Single : A 50 MET CE :methyl -148:sc= -0.098 (180deg=-0.819) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 ASN : amide:sc=-0.00391 X(o=-0.0039,f=-0.0039) USER MOD Single : A 54 TYR OH : rot 165:sc= -0.0103 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.38 K(o=-0.38,f=-1.1) USER MOD Single : A 67 GLN : amide:sc= -0.31 K(o=-0.31,f=-5.3!) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 156:sc= 0.0435 (180deg=0) USER MOD Single : A 75 MET CE :methyl -170:sc= 0 (180deg=-0.077) USER MOD Single : A 76 THR OG1 : rot 138:sc= 0.589 USER MOD Single : A 80 THR OG1 : rot 42:sc= 0.624 USER MOD Single : A 87 ASN : amide:sc= -0.298 K(o=-0.3,f=-2.3!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.00556 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0845 USER MOD Single : A 97 THR OG1 : rot 63:sc= 0.134 USER MOD Single : A 98 HIS : no HD1:sc= -0.174 X(o=-0.17,f=-0.65) USER MOD Single : A 101 HIS : no HD1:sc= -5.15! C(o=-5.2!,f=-5.1!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 HIS : no HD1:sc= -7.02! C(o=-7!,f=-5.8!) USER MOD Single : A 112 GLN : amide:sc= -0.436 K(o=-0.44,f=-1.1) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.042 -23.315 -33.053 1.00 0.00 N ATOM 2 CA GLY A 1 10.456 -21.929 -33.166 1.00 0.00 C ATOM 3 C GLY A 1 11.300 -21.479 -31.990 1.00 0.00 C ATOM 4 O GLY A 1 11.951 -22.294 -31.337 1.00 0.00 O ATOM 0 H1 GLY A 1 9.986 -23.739 -34.001 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.734 -23.838 -32.480 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.108 -23.362 -32.597 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.022 -21.796 -34.088 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.573 -21.294 -33.240 1.00 0.00 H new ATOM 8 N SER A 2 11.291 -20.177 -31.721 1.00 0.00 N ATOM 9 CA SER A 2 12.067 -19.619 -30.619 1.00 0.00 C ATOM 10 C SER A 2 11.393 -19.906 -29.281 1.00 0.00 C ATOM 11 O SER A 2 10.284 -20.437 -29.233 1.00 0.00 O ATOM 12 CB SER A 2 12.240 -18.110 -30.803 1.00 0.00 C ATOM 13 OG SER A 2 12.861 -17.815 -32.042 1.00 0.00 O ATOM 0 H SER A 2 10.755 -19.489 -32.251 1.00 0.00 H new ATOM 0 HA SER A 2 13.049 -20.093 -30.621 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.267 -17.621 -30.755 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.840 -17.707 -29.987 1.00 0.00 H new ATOM 0 HG SER A 2 12.959 -16.844 -32.136 1.00 0.00 H new ATOM 19 N SER A 3 12.073 -19.551 -28.195 1.00 0.00 N ATOM 20 CA SER A 3 11.544 -19.773 -26.855 1.00 0.00 C ATOM 21 C SER A 3 10.158 -19.152 -26.708 1.00 0.00 C ATOM 22 O SER A 3 9.762 -18.297 -27.499 1.00 0.00 O ATOM 23 CB SER A 3 12.491 -19.188 -25.806 1.00 0.00 C ATOM 24 OG SER A 3 12.487 -17.771 -25.849 1.00 0.00 O ATOM 0 H SER A 3 12.992 -19.108 -28.218 1.00 0.00 H new ATOM 0 HA SER A 3 11.460 -20.848 -26.698 1.00 0.00 H new ATOM 0 HB2 SER A 3 12.193 -19.526 -24.814 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.502 -19.557 -25.978 1.00 0.00 H new ATOM 0 HG SER A 3 13.099 -17.421 -25.168 1.00 0.00 H new ATOM 30 N GLY A 4 9.425 -19.589 -25.688 1.00 0.00 N ATOM 31 CA GLY A 4 8.092 -19.066 -25.455 1.00 0.00 C ATOM 32 C GLY A 4 8.023 -18.179 -24.227 1.00 0.00 C ATOM 33 O GLY A 4 7.507 -18.588 -23.187 1.00 0.00 O ATOM 0 H GLY A 4 9.731 -20.296 -25.019 1.00 0.00 H new ATOM 0 HA2 GLY A 4 7.770 -18.498 -26.328 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.395 -19.896 -25.340 1.00 0.00 H new ATOM 37 N SER A 5 8.546 -16.963 -24.347 1.00 0.00 N ATOM 38 CA SER A 5 8.546 -16.019 -23.237 1.00 0.00 C ATOM 39 C SER A 5 9.398 -16.538 -22.082 1.00 0.00 C ATOM 40 O SER A 5 9.014 -16.433 -20.917 1.00 0.00 O ATOM 41 CB SER A 5 7.117 -15.763 -22.756 1.00 0.00 C ATOM 42 OG SER A 5 7.014 -14.507 -22.107 1.00 0.00 O ATOM 0 H SER A 5 8.975 -16.609 -25.202 1.00 0.00 H new ATOM 0 HA SER A 5 8.976 -15.082 -23.591 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.433 -15.795 -23.604 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.813 -16.555 -22.072 1.00 0.00 H new ATOM 0 HG SER A 5 6.091 -14.367 -21.810 1.00 0.00 H new ATOM 48 N SER A 6 10.556 -17.099 -22.415 1.00 0.00 N ATOM 49 CA SER A 6 11.461 -17.639 -21.407 1.00 0.00 C ATOM 50 C SER A 6 12.578 -16.648 -21.094 1.00 0.00 C ATOM 51 O SER A 6 13.194 -16.084 -21.997 1.00 0.00 O ATOM 52 CB SER A 6 12.058 -18.964 -21.885 1.00 0.00 C ATOM 53 OG SER A 6 12.603 -19.698 -20.802 1.00 0.00 O ATOM 0 H SER A 6 10.890 -17.191 -23.374 1.00 0.00 H new ATOM 0 HA SER A 6 10.889 -17.814 -20.496 1.00 0.00 H new ATOM 0 HB2 SER A 6 11.288 -19.556 -22.379 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.835 -18.771 -22.625 1.00 0.00 H new ATOM 0 HG SER A 6 12.977 -20.541 -21.133 1.00 0.00 H new ATOM 59 N GLY A 7 12.834 -16.442 -19.805 1.00 0.00 N ATOM 60 CA GLY A 7 13.876 -15.520 -19.394 1.00 0.00 C ATOM 61 C GLY A 7 13.621 -14.932 -18.020 1.00 0.00 C ATOM 62 O GLY A 7 13.725 -13.721 -17.827 1.00 0.00 O ATOM 0 H GLY A 7 12.338 -16.897 -19.039 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.835 -16.038 -19.392 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.951 -14.713 -20.123 1.00 0.00 H new ATOM 66 N SER A 8 13.285 -15.791 -17.064 1.00 0.00 N ATOM 67 CA SER A 8 13.008 -15.349 -15.702 1.00 0.00 C ATOM 68 C SER A 8 14.302 -15.195 -14.908 1.00 0.00 C ATOM 69 O SER A 8 14.715 -16.105 -14.187 1.00 0.00 O ATOM 70 CB SER A 8 12.081 -16.342 -14.999 1.00 0.00 C ATOM 71 OG SER A 8 11.545 -15.786 -13.811 1.00 0.00 O ATOM 0 H SER A 8 13.198 -16.797 -17.207 1.00 0.00 H new ATOM 0 HA SER A 8 12.515 -14.378 -15.755 1.00 0.00 H new ATOM 0 HB2 SER A 8 11.270 -16.625 -15.670 1.00 0.00 H new ATOM 0 HB3 SER A 8 12.631 -17.253 -14.762 1.00 0.00 H new ATOM 0 HG SER A 8 10.955 -16.440 -13.381 1.00 0.00 H new ATOM 77 N LEU A 9 14.938 -14.037 -15.044 1.00 0.00 N ATOM 78 CA LEU A 9 16.185 -13.761 -14.340 1.00 0.00 C ATOM 79 C LEU A 9 15.938 -12.881 -13.119 1.00 0.00 C ATOM 80 O LEU A 9 15.702 -11.680 -13.245 1.00 0.00 O ATOM 81 CB LEU A 9 17.184 -13.081 -15.279 1.00 0.00 C ATOM 82 CG LEU A 9 17.991 -14.010 -16.187 1.00 0.00 C ATOM 83 CD1 LEU A 9 17.172 -14.408 -17.405 1.00 0.00 C ATOM 84 CD2 LEU A 9 19.291 -13.343 -16.612 1.00 0.00 C ATOM 0 H LEU A 9 14.610 -13.274 -15.636 1.00 0.00 H new ATOM 0 HA LEU A 9 16.601 -14.710 -14.003 1.00 0.00 H new ATOM 0 HB2 LEU A 9 16.640 -12.375 -15.906 1.00 0.00 H new ATOM 0 HB3 LEU A 9 17.881 -12.500 -14.676 1.00 0.00 H new ATOM 0 HG LEU A 9 18.235 -14.913 -15.627 1.00 0.00 H new ATOM 0 HD11 LEU A 9 17.762 -15.069 -18.040 1.00 0.00 H new ATOM 0 HD12 LEU A 9 16.269 -14.926 -17.083 1.00 0.00 H new ATOM 0 HD13 LEU A 9 16.898 -13.515 -17.967 1.00 0.00 H new ATOM 0 HD21 LEU A 9 19.852 -14.018 -17.258 1.00 0.00 H new ATOM 0 HD22 LEU A 9 19.068 -12.424 -17.154 1.00 0.00 H new ATOM 0 HD23 LEU A 9 19.885 -13.108 -15.729 1.00 0.00 H new ATOM 96 N GLU A 10 15.996 -13.488 -11.937 1.00 0.00 N ATOM 97 CA GLU A 10 15.780 -12.759 -10.693 1.00 0.00 C ATOM 98 C GLU A 10 16.762 -13.214 -9.618 1.00 0.00 C ATOM 99 O GLU A 10 17.145 -14.382 -9.566 1.00 0.00 O ATOM 100 CB GLU A 10 14.344 -12.955 -10.204 1.00 0.00 C ATOM 101 CG GLU A 10 13.945 -14.414 -10.059 1.00 0.00 C ATOM 102 CD GLU A 10 12.612 -14.587 -9.356 1.00 0.00 C ATOM 103 OE1 GLU A 10 12.573 -14.455 -8.116 1.00 0.00 O ATOM 104 OE2 GLU A 10 11.607 -14.855 -10.049 1.00 0.00 O ATOM 0 H GLU A 10 16.191 -14.482 -11.815 1.00 0.00 H new ATOM 0 HA GLU A 10 15.948 -11.700 -10.889 1.00 0.00 H new ATOM 0 HB2 GLU A 10 14.226 -12.457 -9.242 1.00 0.00 H new ATOM 0 HB3 GLU A 10 13.662 -12.468 -10.901 1.00 0.00 H new ATOM 0 HG2 GLU A 10 13.893 -14.872 -11.047 1.00 0.00 H new ATOM 0 HG3 GLU A 10 14.717 -14.944 -9.502 1.00 0.00 H new ATOM 111 N ASN A 11 17.167 -12.282 -8.761 1.00 0.00 N ATOM 112 CA ASN A 11 18.105 -12.587 -7.687 1.00 0.00 C ATOM 113 C ASN A 11 17.635 -11.984 -6.367 1.00 0.00 C ATOM 114 O ASN A 11 16.864 -11.023 -6.349 1.00 0.00 O ATOM 115 CB ASN A 11 19.498 -12.058 -8.034 1.00 0.00 C ATOM 116 CG ASN A 11 20.049 -12.671 -9.307 1.00 0.00 C ATOM 117 OD1 ASN A 11 19.295 -13.053 -10.202 1.00 0.00 O ATOM 118 ND2 ASN A 11 21.371 -12.768 -9.393 1.00 0.00 N ATOM 0 H ASN A 11 16.860 -11.310 -8.790 1.00 0.00 H new ATOM 0 HA ASN A 11 18.152 -13.670 -7.575 1.00 0.00 H new ATOM 0 HB2 ASN A 11 19.455 -10.975 -8.145 1.00 0.00 H new ATOM 0 HB3 ASN A 11 20.179 -12.267 -7.209 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.800 -13.172 -10.226 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.958 -12.438 -8.626 1.00 0.00 H new ATOM 125 N LEU A 12 18.103 -12.556 -5.262 1.00 0.00 N ATOM 126 CA LEU A 12 17.731 -12.075 -3.936 1.00 0.00 C ATOM 127 C LEU A 12 18.786 -11.120 -3.387 1.00 0.00 C ATOM 128 O LEU A 12 19.917 -11.521 -3.112 1.00 0.00 O ATOM 129 CB LEU A 12 17.546 -13.254 -2.979 1.00 0.00 C ATOM 130 CG LEU A 12 16.320 -14.133 -3.226 1.00 0.00 C ATOM 131 CD1 LEU A 12 16.581 -15.105 -4.366 1.00 0.00 C ATOM 132 CD2 LEU A 12 15.938 -14.885 -1.959 1.00 0.00 C ATOM 0 H LEU A 12 18.740 -13.353 -5.258 1.00 0.00 H new ATOM 0 HA LEU A 12 16.789 -11.534 -4.023 1.00 0.00 H new ATOM 0 HB2 LEU A 12 18.435 -13.882 -3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 12 17.491 -12.865 -1.962 1.00 0.00 H new ATOM 0 HG LEU A 12 15.487 -13.489 -3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 12 15.697 -15.722 -4.527 1.00 0.00 H new ATOM 0 HD12 LEU A 12 16.805 -14.547 -5.275 1.00 0.00 H new ATOM 0 HD13 LEU A 12 17.428 -15.743 -4.114 1.00 0.00 H new ATOM 0 HD21 LEU A 12 15.063 -15.505 -2.154 1.00 0.00 H new ATOM 0 HD22 LEU A 12 16.769 -15.517 -1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 12 15.708 -14.171 -1.168 1.00 0.00 H new ATOM 144 N ALA A 13 18.408 -9.856 -3.229 1.00 0.00 N ATOM 145 CA ALA A 13 19.320 -8.845 -2.709 1.00 0.00 C ATOM 146 C ALA A 13 18.666 -8.039 -1.591 1.00 0.00 C ATOM 147 O ALA A 13 19.086 -6.921 -1.290 1.00 0.00 O ATOM 148 CB ALA A 13 19.779 -7.923 -3.828 1.00 0.00 C ATOM 0 H ALA A 13 17.476 -9.508 -3.454 1.00 0.00 H new ATOM 0 HA ALA A 13 20.189 -9.354 -2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 13 20.460 -7.173 -3.425 1.00 0.00 H new ATOM 0 HB2 ALA A 13 20.293 -8.506 -4.592 1.00 0.00 H new ATOM 0 HB3 ALA A 13 18.914 -7.428 -4.270 1.00 0.00 H new ATOM 154 N THR A 14 17.635 -8.613 -0.979 1.00 0.00 N ATOM 155 CA THR A 14 16.923 -7.947 0.104 1.00 0.00 C ATOM 156 C THR A 14 16.620 -6.495 -0.248 1.00 0.00 C ATOM 157 O THR A 14 16.847 -5.592 0.556 1.00 0.00 O ATOM 158 CB THR A 14 17.729 -7.988 1.416 1.00 0.00 C ATOM 159 OG1 THR A 14 18.408 -9.243 1.535 1.00 0.00 O ATOM 160 CG2 THR A 14 16.818 -7.783 2.617 1.00 0.00 C ATOM 0 H THR A 14 17.275 -9.538 -1.215 1.00 0.00 H new ATOM 0 HA THR A 14 15.987 -8.487 0.245 1.00 0.00 H new ATOM 0 HB THR A 14 18.461 -7.180 1.393 1.00 0.00 H new ATOM 0 HG1 THR A 14 18.919 -9.260 2.371 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.409 -7.816 3.532 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.325 -6.814 2.538 1.00 0.00 H new ATOM 0 HG23 THR A 14 16.066 -8.572 2.642 1.00 0.00 H new ATOM 168 N ALA A 15 16.105 -6.279 -1.454 1.00 0.00 N ATOM 169 CA ALA A 15 15.768 -4.936 -1.911 1.00 0.00 C ATOM 170 C ALA A 15 14.616 -4.353 -1.100 1.00 0.00 C ATOM 171 O ALA A 15 13.869 -5.070 -0.434 1.00 0.00 O ATOM 172 CB ALA A 15 15.419 -4.955 -3.391 1.00 0.00 C ATOM 0 H ALA A 15 15.912 -7.016 -2.132 1.00 0.00 H new ATOM 0 HA ALA A 15 16.640 -4.299 -1.763 1.00 0.00 H new ATOM 0 HB1 ALA A 15 15.169 -3.946 -3.719 1.00 0.00 H new ATOM 0 HB2 ALA A 15 16.273 -5.321 -3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.564 -5.612 -3.555 1.00 0.00 H new ATOM 178 N PRO A 16 14.466 -3.021 -1.156 1.00 0.00 N ATOM 179 CA PRO A 16 13.406 -2.313 -0.433 1.00 0.00 C ATOM 180 C PRO A 16 12.023 -2.591 -1.012 1.00 0.00 C ATOM 181 O PRO A 16 11.063 -2.814 -0.274 1.00 0.00 O ATOM 182 CB PRO A 16 13.776 -0.839 -0.616 1.00 0.00 C ATOM 183 CG PRO A 16 14.572 -0.801 -1.875 1.00 0.00 C ATOM 184 CD PRO A 16 15.320 -2.105 -1.930 1.00 0.00 C ATOM 0 HA PRO A 16 13.345 -2.625 0.609 1.00 0.00 H new ATOM 0 HB2 PRO A 16 12.886 -0.214 -0.691 1.00 0.00 H new ATOM 0 HB3 PRO A 16 14.355 -0.468 0.230 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.924 -0.686 -2.744 1.00 0.00 H new ATOM 0 HG3 PRO A 16 15.260 0.044 -1.877 1.00 0.00 H new ATOM 0 HD2 PRO A 16 15.452 -2.449 -2.956 1.00 0.00 H new ATOM 0 HD3 PRO A 16 16.314 -2.017 -1.493 1.00 0.00 H new ATOM 192 N VAL A 17 11.928 -2.577 -2.338 1.00 0.00 N ATOM 193 CA VAL A 17 10.662 -2.829 -3.016 1.00 0.00 C ATOM 194 C VAL A 17 10.035 -4.135 -2.541 1.00 0.00 C ATOM 195 O VAL A 17 8.824 -4.218 -2.344 1.00 0.00 O ATOM 196 CB VAL A 17 10.846 -2.886 -4.544 1.00 0.00 C ATOM 197 CG1 VAL A 17 11.565 -4.164 -4.948 1.00 0.00 C ATOM 198 CG2 VAL A 17 9.501 -2.777 -5.247 1.00 0.00 C ATOM 0 H VAL A 17 12.712 -2.394 -2.964 1.00 0.00 H new ATOM 0 HA VAL A 17 9.999 -2.000 -2.768 1.00 0.00 H new ATOM 0 HB VAL A 17 11.460 -2.039 -4.850 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.686 -4.187 -6.031 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.545 -4.196 -4.473 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.980 -5.027 -4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.650 -2.819 -6.326 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.860 -3.602 -4.937 1.00 0.00 H new ATOM 0 HG23 VAL A 17 9.028 -1.831 -4.983 1.00 0.00 H new ATOM 208 N ASN A 18 10.869 -5.154 -2.360 1.00 0.00 N ATOM 209 CA ASN A 18 10.396 -6.457 -1.908 1.00 0.00 C ATOM 210 C ASN A 18 9.707 -6.346 -0.551 1.00 0.00 C ATOM 211 O ASN A 18 8.617 -6.882 -0.352 1.00 0.00 O ATOM 212 CB ASN A 18 11.563 -7.444 -1.820 1.00 0.00 C ATOM 213 CG ASN A 18 12.344 -7.532 -3.117 1.00 0.00 C ATOM 214 OD1 ASN A 18 11.830 -7.209 -4.187 1.00 0.00 O ATOM 215 ND2 ASN A 18 13.594 -7.972 -3.025 1.00 0.00 N ATOM 0 H ASN A 18 11.875 -5.102 -2.519 1.00 0.00 H new ATOM 0 HA ASN A 18 9.671 -6.824 -2.635 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.233 -7.140 -1.016 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.181 -8.432 -1.561 1.00 0.00 H new ATOM 0 HD21 ASN A 18 14.169 -8.053 -3.863 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.979 -8.229 -2.116 1.00 0.00 H new ATOM 222 N GLN A 19 10.351 -5.646 0.378 1.00 0.00 N ATOM 223 CA GLN A 19 9.799 -5.464 1.715 1.00 0.00 C ATOM 224 C GLN A 19 8.379 -4.913 1.648 1.00 0.00 C ATOM 225 O GLN A 19 7.585 -5.102 2.571 1.00 0.00 O ATOM 226 CB GLN A 19 10.686 -4.522 2.532 1.00 0.00 C ATOM 227 CG GLN A 19 12.107 -5.031 2.716 1.00 0.00 C ATOM 228 CD GLN A 19 12.768 -4.477 3.962 1.00 0.00 C ATOM 229 OE1 GLN A 19 12.125 -3.817 4.779 1.00 0.00 O ATOM 230 NE2 GLN A 19 14.060 -4.742 4.115 1.00 0.00 N ATOM 0 H GLN A 19 11.254 -5.196 0.229 1.00 0.00 H new ATOM 0 HA GLN A 19 9.768 -6.438 2.203 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.718 -3.549 2.041 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.234 -4.369 3.512 1.00 0.00 H new ATOM 0 HG2 GLN A 19 12.095 -6.120 2.769 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.702 -4.761 1.843 1.00 0.00 H new ATOM 0 HE21 GLN A 19 14.554 -5.293 3.413 1.00 0.00 H new ATOM 0 HE22 GLN A 19 14.558 -4.395 4.934 1.00 0.00 H new ATOM 239 N ILE A 20 8.065 -4.231 0.552 1.00 0.00 N ATOM 240 CA ILE A 20 6.739 -3.654 0.365 1.00 0.00 C ATOM 241 C ILE A 20 5.788 -4.658 -0.278 1.00 0.00 C ATOM 242 O ILE A 20 4.636 -4.786 0.135 1.00 0.00 O ATOM 243 CB ILE A 20 6.795 -2.386 -0.507 1.00 0.00 C ATOM 244 CG1 ILE A 20 7.659 -1.316 0.165 1.00 0.00 C ATOM 245 CG2 ILE A 20 5.392 -1.858 -0.764 1.00 0.00 C ATOM 246 CD1 ILE A 20 8.217 -0.296 -0.801 1.00 0.00 C ATOM 0 H ILE A 20 8.710 -4.064 -0.220 1.00 0.00 H new ATOM 0 HA ILE A 20 6.368 -3.388 1.355 1.00 0.00 H new ATOM 0 HB ILE A 20 7.247 -2.641 -1.465 1.00 0.00 H new ATOM 0 HG12 ILE A 20 7.064 -0.802 0.920 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.485 -1.801 0.685 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.448 -0.962 -1.382 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.806 -2.618 -1.280 1.00 0.00 H new ATOM 0 HG23 ILE A 20 4.915 -1.615 0.186 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.819 0.431 -0.255 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.839 -0.799 -1.542 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.396 0.216 -1.303 1.00 0.00 H new ATOM 258 N GLN A 21 6.280 -5.368 -1.288 1.00 0.00 N ATOM 259 CA GLN A 21 5.474 -6.361 -1.987 1.00 0.00 C ATOM 260 C GLN A 21 4.942 -7.411 -1.016 1.00 0.00 C ATOM 261 O GLN A 21 3.930 -8.059 -1.282 1.00 0.00 O ATOM 262 CB GLN A 21 6.297 -7.036 -3.085 1.00 0.00 C ATOM 263 CG GLN A 21 6.894 -6.059 -4.085 1.00 0.00 C ATOM 264 CD GLN A 21 7.093 -6.676 -5.456 1.00 0.00 C ATOM 265 OE1 GLN A 21 7.507 -7.829 -5.576 1.00 0.00 O ATOM 266 NE2 GLN A 21 6.798 -5.909 -6.499 1.00 0.00 N ATOM 0 H GLN A 21 7.233 -5.274 -1.640 1.00 0.00 H new ATOM 0 HA GLN A 21 4.626 -5.849 -2.442 1.00 0.00 H new ATOM 0 HB2 GLN A 21 7.102 -7.609 -2.624 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.664 -7.746 -3.617 1.00 0.00 H new ATOM 0 HG2 GLN A 21 6.241 -5.191 -4.173 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.852 -5.701 -3.709 1.00 0.00 H new ATOM 0 HE21 GLN A 21 6.458 -4.959 -6.353 1.00 0.00 H new ATOM 0 HE22 GLN A 21 6.912 -6.270 -7.446 1.00 0.00 H new ATOM 275 N GLU A 22 5.631 -7.573 0.109 1.00 0.00 N ATOM 276 CA GLU A 22 5.227 -8.545 1.118 1.00 0.00 C ATOM 277 C GLU A 22 4.185 -7.950 2.061 1.00 0.00 C ATOM 278 O GLU A 22 3.230 -8.621 2.454 1.00 0.00 O ATOM 279 CB GLU A 22 6.443 -9.018 1.917 1.00 0.00 C ATOM 280 CG GLU A 22 7.105 -7.917 2.728 1.00 0.00 C ATOM 281 CD GLU A 22 8.125 -8.452 3.714 1.00 0.00 C ATOM 282 OE1 GLU A 22 7.727 -9.197 4.634 1.00 0.00 O ATOM 283 OE2 GLU A 22 9.321 -8.125 3.567 1.00 0.00 O ATOM 0 H GLU A 22 6.471 -7.044 0.345 1.00 0.00 H new ATOM 0 HA GLU A 22 4.783 -9.399 0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.136 -9.819 2.590 1.00 0.00 H new ATOM 0 HB3 GLU A 22 7.176 -9.442 1.230 1.00 0.00 H new ATOM 0 HG2 GLU A 22 7.593 -7.215 2.051 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.340 -7.359 3.269 1.00 0.00 H new ATOM 290 N THR A 23 4.376 -6.684 2.422 1.00 0.00 N ATOM 291 CA THR A 23 3.456 -5.998 3.320 1.00 0.00 C ATOM 292 C THR A 23 2.069 -5.876 2.698 1.00 0.00 C ATOM 293 O THR A 23 1.057 -5.971 3.392 1.00 0.00 O ATOM 294 CB THR A 23 3.969 -4.592 3.683 1.00 0.00 C ATOM 295 OG1 THR A 23 5.303 -4.674 4.195 1.00 0.00 O ATOM 296 CG2 THR A 23 3.063 -3.935 4.714 1.00 0.00 C ATOM 0 H THR A 23 5.160 -6.114 2.106 1.00 0.00 H new ATOM 0 HA THR A 23 3.393 -6.599 4.227 1.00 0.00 H new ATOM 0 HB THR A 23 3.965 -3.983 2.779 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.926 -4.843 3.458 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.445 -2.943 4.955 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.055 -3.847 4.309 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.039 -4.544 5.618 1.00 0.00 H new ATOM 304 N ILE A 24 2.031 -5.667 1.386 1.00 0.00 N ATOM 305 CA ILE A 24 0.768 -5.534 0.671 1.00 0.00 C ATOM 306 C ILE A 24 0.093 -6.890 0.491 1.00 0.00 C ATOM 307 O ILE A 24 -1.134 -6.986 0.468 1.00 0.00 O ATOM 308 CB ILE A 24 0.969 -4.885 -0.711 1.00 0.00 C ATOM 309 CG1 ILE A 24 1.988 -5.681 -1.529 1.00 0.00 C ATOM 310 CG2 ILE A 24 1.418 -3.440 -0.557 1.00 0.00 C ATOM 311 CD1 ILE A 24 1.980 -5.338 -3.003 1.00 0.00 C ATOM 0 H ILE A 24 2.860 -5.586 0.797 1.00 0.00 H new ATOM 0 HA ILE A 24 0.129 -4.890 1.276 1.00 0.00 H new ATOM 0 HB ILE A 24 0.017 -4.895 -1.243 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.985 -5.500 -1.128 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.785 -6.745 -1.411 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.556 -2.995 -1.542 1.00 0.00 H new ATOM 0 HG22 ILE A 24 0.660 -2.880 -0.009 1.00 0.00 H new ATOM 0 HG23 ILE A 24 2.360 -3.408 -0.009 1.00 0.00 H new ATOM 0 HD11 ILE A 24 2.727 -5.940 -3.521 1.00 0.00 H new ATOM 0 HD12 ILE A 24 0.994 -5.546 -3.420 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.213 -4.281 -3.132 1.00 0.00 H new ATOM 323 N SER A 25 0.904 -7.936 0.364 1.00 0.00 N ATOM 324 CA SER A 25 0.386 -9.287 0.184 1.00 0.00 C ATOM 325 C SER A 25 -0.149 -9.844 1.499 1.00 0.00 C ATOM 326 O SER A 25 -1.325 -10.194 1.606 1.00 0.00 O ATOM 327 CB SER A 25 1.478 -10.206 -0.366 1.00 0.00 C ATOM 328 OG SER A 25 0.919 -11.287 -1.091 1.00 0.00 O ATOM 0 H SER A 25 1.922 -7.873 0.382 1.00 0.00 H new ATOM 0 HA SER A 25 -0.435 -9.242 -0.532 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.145 -9.636 -1.013 1.00 0.00 H new ATOM 0 HB3 SER A 25 2.083 -10.590 0.456 1.00 0.00 H new ATOM 0 HG SER A 25 1.638 -11.858 -1.433 1.00 0.00 H new ATOM 334 N ASP A 26 0.723 -9.923 2.499 1.00 0.00 N ATOM 335 CA ASP A 26 0.340 -10.436 3.809 1.00 0.00 C ATOM 336 C ASP A 26 -0.902 -9.720 4.331 1.00 0.00 C ATOM 337 O ASP A 26 -1.852 -10.356 4.786 1.00 0.00 O ATOM 338 CB ASP A 26 1.492 -10.274 4.801 1.00 0.00 C ATOM 339 CG ASP A 26 1.319 -11.135 6.036 1.00 0.00 C ATOM 340 OD1 ASP A 26 0.161 -11.444 6.386 1.00 0.00 O ATOM 341 OD2 ASP A 26 2.342 -11.501 6.653 1.00 0.00 O ATOM 0 H ASP A 26 1.700 -9.638 2.427 1.00 0.00 H new ATOM 0 HA ASP A 26 0.109 -11.496 3.703 1.00 0.00 H new ATOM 0 HB2 ASP A 26 2.430 -10.533 4.310 1.00 0.00 H new ATOM 0 HB3 ASP A 26 1.567 -9.228 5.099 1.00 0.00 H new ATOM 346 N ASN A 27 -0.886 -8.393 4.263 1.00 0.00 N ATOM 347 CA ASN A 27 -2.010 -7.590 4.731 1.00 0.00 C ATOM 348 C ASN A 27 -3.057 -7.428 3.633 1.00 0.00 C ATOM 349 O ASN A 27 -2.930 -7.999 2.549 1.00 0.00 O ATOM 350 CB ASN A 27 -1.524 -6.215 5.195 1.00 0.00 C ATOM 351 CG ASN A 27 -0.634 -6.300 6.420 1.00 0.00 C ATOM 352 OD1 ASN A 27 -1.101 -6.590 7.521 1.00 0.00 O ATOM 353 ND2 ASN A 27 0.656 -6.046 6.232 1.00 0.00 N ATOM 0 H ASN A 27 -0.107 -7.851 3.888 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.469 -8.108 5.573 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.977 -5.733 4.384 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.385 -5.584 5.418 1.00 0.00 H new ATOM 0 HD21 ASN A 27 1.304 -6.087 7.019 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.999 -5.810 5.301 1.00 0.00 H new ATOM 360 N CYS A 28 -4.091 -6.644 3.920 1.00 0.00 N ATOM 361 CA CYS A 28 -5.160 -6.405 2.958 1.00 0.00 C ATOM 362 C CYS A 28 -4.987 -5.051 2.277 1.00 0.00 C ATOM 363 O CYS A 28 -5.082 -4.942 1.054 1.00 0.00 O ATOM 364 CB CYS A 28 -6.522 -6.468 3.652 1.00 0.00 C ATOM 365 SG CYS A 28 -7.253 -8.136 3.705 1.00 0.00 S ATOM 0 H CYS A 28 -4.211 -6.163 4.812 1.00 0.00 H new ATOM 0 HA CYS A 28 -5.110 -7.184 2.197 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -6.416 -6.097 4.671 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -7.211 -5.797 3.139 1.00 0.00 H new ATOM 370 N VAL A 29 -4.731 -4.021 3.077 1.00 0.00 N ATOM 371 CA VAL A 29 -4.542 -2.673 2.552 1.00 0.00 C ATOM 372 C VAL A 29 -3.358 -1.984 3.221 1.00 0.00 C ATOM 373 O VAL A 29 -3.228 -1.998 4.445 1.00 0.00 O ATOM 374 CB VAL A 29 -5.803 -1.812 2.751 1.00 0.00 C ATOM 375 CG1 VAL A 29 -5.573 -0.400 2.234 1.00 0.00 C ATOM 376 CG2 VAL A 29 -7.000 -2.452 2.064 1.00 0.00 C ATOM 0 H VAL A 29 -4.650 -4.094 4.091 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.344 -2.773 1.485 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.016 -1.752 3.818 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.475 0.194 2.383 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.745 0.056 2.777 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.334 -0.436 1.171 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -7.882 -1.830 2.215 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.800 -2.545 0.997 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.177 -3.441 2.487 1.00 0.00 H new ATOM 386 N VAL A 30 -2.497 -1.380 2.409 1.00 0.00 N ATOM 387 CA VAL A 30 -1.323 -0.683 2.921 1.00 0.00 C ATOM 388 C VAL A 30 -1.232 0.730 2.355 1.00 0.00 C ATOM 389 O VAL A 30 -0.985 0.917 1.163 1.00 0.00 O ATOM 390 CB VAL A 30 -0.027 -1.443 2.584 1.00 0.00 C ATOM 391 CG1 VAL A 30 1.190 -0.660 3.054 1.00 0.00 C ATOM 392 CG2 VAL A 30 -0.048 -2.832 3.204 1.00 0.00 C ATOM 0 H VAL A 30 -2.590 -1.359 1.393 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.434 -0.631 4.004 1.00 0.00 H new ATOM 0 HB VAL A 30 0.037 -1.553 1.501 1.00 0.00 H new ATOM 0 HG11 VAL A 30 2.096 -1.213 2.807 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.211 0.311 2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.136 -0.516 4.133 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.875 -3.355 2.956 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.136 -2.746 4.287 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -0.898 -3.392 2.814 1.00 0.00 H new ATOM 402 N ILE A 31 -1.434 1.721 3.217 1.00 0.00 N ATOM 403 CA ILE A 31 -1.373 3.117 2.803 1.00 0.00 C ATOM 404 C ILE A 31 0.011 3.705 3.055 1.00 0.00 C ATOM 405 O ILE A 31 0.340 4.087 4.179 1.00 0.00 O ATOM 406 CB ILE A 31 -2.422 3.969 3.541 1.00 0.00 C ATOM 407 CG1 ILE A 31 -3.835 3.527 3.151 1.00 0.00 C ATOM 408 CG2 ILE A 31 -2.219 5.445 3.231 1.00 0.00 C ATOM 409 CD1 ILE A 31 -4.925 4.365 3.781 1.00 0.00 C ATOM 0 H ILE A 31 -1.641 1.583 4.206 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.585 3.139 1.734 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.298 3.823 4.614 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -3.935 3.571 2.066 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.975 2.486 3.442 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.968 6.034 3.760 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.223 5.751 3.553 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.320 5.609 2.158 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.899 3.995 3.461 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.852 4.301 4.867 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.811 5.404 3.470 1.00 0.00 H new ATOM 421 N PHE A 32 0.818 3.778 2.002 1.00 0.00 N ATOM 422 CA PHE A 32 2.167 4.321 2.108 1.00 0.00 C ATOM 423 C PHE A 32 2.161 5.834 1.915 1.00 0.00 C ATOM 424 O PHE A 32 2.025 6.327 0.795 1.00 0.00 O ATOM 425 CB PHE A 32 3.086 3.667 1.075 1.00 0.00 C ATOM 426 CG PHE A 32 3.524 2.281 1.454 1.00 0.00 C ATOM 427 CD1 PHE A 32 4.522 2.089 2.395 1.00 0.00 C ATOM 428 CD2 PHE A 32 2.938 1.170 0.868 1.00 0.00 C ATOM 429 CE1 PHE A 32 4.927 0.815 2.747 1.00 0.00 C ATOM 430 CE2 PHE A 32 3.339 -0.106 1.215 1.00 0.00 C ATOM 431 CZ PHE A 32 4.335 -0.284 2.155 1.00 0.00 C ATOM 0 H PHE A 32 0.561 3.468 1.065 1.00 0.00 H new ATOM 0 HA PHE A 32 2.542 4.102 3.108 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.570 3.627 0.116 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.968 4.293 0.937 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.989 2.945 2.859 1.00 0.00 H new ATOM 0 HD2 PHE A 32 2.159 1.303 0.132 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.705 0.679 3.484 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.874 -0.963 0.751 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.651 -1.280 2.427 1.00 0.00 H new ATOM 441 N SER A 33 2.309 6.566 3.014 1.00 0.00 N ATOM 442 CA SER A 33 2.317 8.024 2.967 1.00 0.00 C ATOM 443 C SER A 33 3.366 8.593 3.917 1.00 0.00 C ATOM 444 O SER A 33 3.970 7.863 4.703 1.00 0.00 O ATOM 445 CB SER A 33 0.935 8.574 3.326 1.00 0.00 C ATOM 446 OG SER A 33 0.617 8.308 4.682 1.00 0.00 O ATOM 0 H SER A 33 2.425 6.174 3.948 1.00 0.00 H new ATOM 0 HA SER A 33 2.569 8.329 1.951 1.00 0.00 H new ATOM 0 HB2 SER A 33 0.910 9.649 3.147 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.182 8.126 2.678 1.00 0.00 H new ATOM 0 HG SER A 33 0.413 9.149 5.141 1.00 0.00 H new ATOM 452 N LYS A 34 3.578 9.902 3.838 1.00 0.00 N ATOM 453 CA LYS A 34 4.553 10.573 4.691 1.00 0.00 C ATOM 454 C LYS A 34 3.891 11.676 5.510 1.00 0.00 C ATOM 455 O LYS A 34 2.670 11.830 5.492 1.00 0.00 O ATOM 456 CB LYS A 34 5.683 11.161 3.843 1.00 0.00 C ATOM 457 CG LYS A 34 5.263 12.367 3.021 1.00 0.00 C ATOM 458 CD LYS A 34 6.358 12.794 2.058 1.00 0.00 C ATOM 459 CE LYS A 34 6.473 11.833 0.885 1.00 0.00 C ATOM 460 NZ LYS A 34 7.705 12.080 0.085 1.00 0.00 N ATOM 0 H LYS A 34 3.088 10.520 3.192 1.00 0.00 H new ATOM 0 HA LYS A 34 4.968 9.835 5.377 1.00 0.00 H new ATOM 0 HB2 LYS A 34 6.506 11.447 4.498 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.062 10.389 3.173 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.358 12.130 2.462 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.019 13.195 3.687 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.148 13.798 1.688 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.310 12.841 2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.479 10.808 1.255 1.00 0.00 H new ATOM 0 HE3 LYS A 34 5.597 11.935 0.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.093 11.173 -0.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.472 12.675 -0.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.411 12.565 0.675 1.00 0.00 H new ATOM 474 N THR A 35 4.706 12.442 6.229 1.00 0.00 N ATOM 475 CA THR A 35 4.200 13.531 7.055 1.00 0.00 C ATOM 476 C THR A 35 4.566 14.887 6.462 1.00 0.00 C ATOM 477 O THR A 35 5.248 15.690 7.098 1.00 0.00 O ATOM 478 CB THR A 35 4.747 13.448 8.492 1.00 0.00 C ATOM 479 OG1 THR A 35 6.110 13.886 8.523 1.00 0.00 O ATOM 480 CG2 THR A 35 4.655 12.026 9.025 1.00 0.00 C ATOM 0 H THR A 35 5.719 12.328 6.256 1.00 0.00 H new ATOM 0 HA THR A 35 3.115 13.429 7.081 1.00 0.00 H new ATOM 0 HB THR A 35 4.142 14.097 9.125 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.153 14.838 8.296 1.00 0.00 H new ATOM 0 HG21 THR A 35 5.047 11.992 10.041 1.00 0.00 H new ATOM 0 HG22 THR A 35 3.613 11.705 9.027 1.00 0.00 H new ATOM 0 HG23 THR A 35 5.238 11.360 8.389 1.00 0.00 H new ATOM 488 N SER A 36 4.107 15.136 5.240 1.00 0.00 N ATOM 489 CA SER A 36 4.389 16.395 4.559 1.00 0.00 C ATOM 490 C SER A 36 3.123 16.968 3.930 1.00 0.00 C ATOM 491 O SER A 36 2.894 18.178 3.960 1.00 0.00 O ATOM 492 CB SER A 36 5.458 16.190 3.485 1.00 0.00 C ATOM 493 OG SER A 36 6.734 15.987 4.067 1.00 0.00 O ATOM 0 H SER A 36 3.538 14.483 4.701 1.00 0.00 H new ATOM 0 HA SER A 36 4.759 17.105 5.299 1.00 0.00 H new ATOM 0 HB2 SER A 36 5.196 15.332 2.866 1.00 0.00 H new ATOM 0 HB3 SER A 36 5.489 17.059 2.828 1.00 0.00 H new ATOM 0 HG SER A 36 7.399 15.857 3.359 1.00 0.00 H new ATOM 499 N CYS A 37 2.304 16.091 3.360 1.00 0.00 N ATOM 500 CA CYS A 37 1.060 16.508 2.722 1.00 0.00 C ATOM 501 C CYS A 37 -0.118 16.362 3.680 1.00 0.00 C ATOM 502 O CYS A 37 -0.044 15.624 4.662 1.00 0.00 O ATOM 503 CB CYS A 37 0.810 15.685 1.458 1.00 0.00 C ATOM 504 SG CYS A 37 0.804 13.898 1.730 1.00 0.00 S ATOM 0 H CYS A 37 2.479 15.087 3.327 1.00 0.00 H new ATOM 0 HA CYS A 37 1.155 17.559 2.449 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -0.148 15.980 1.029 1.00 0.00 H new ATOM 0 HB3 CYS A 37 1.577 15.927 0.722 1.00 0.00 H new ATOM 0 HG CYS A 37 2.028 13.467 1.810 1.00 0.00 H new ATOM 510 N SER A 38 -1.203 17.071 3.387 1.00 0.00 N ATOM 511 CA SER A 38 -2.395 17.025 4.225 1.00 0.00 C ATOM 512 C SER A 38 -3.208 15.765 3.944 1.00 0.00 C ATOM 513 O SER A 38 -3.654 15.082 4.866 1.00 0.00 O ATOM 514 CB SER A 38 -3.259 18.266 3.990 1.00 0.00 C ATOM 515 OG SER A 38 -4.123 18.083 2.881 1.00 0.00 O ATOM 0 H SER A 38 -1.281 17.684 2.576 1.00 0.00 H new ATOM 0 HA SER A 38 -2.076 17.006 5.267 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.848 18.478 4.883 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.619 19.131 3.818 1.00 0.00 H new ATOM 0 HG SER A 38 -4.666 18.889 2.753 1.00 0.00 H new ATOM 521 N TYR A 39 -3.397 15.464 2.664 1.00 0.00 N ATOM 522 CA TYR A 39 -4.158 14.288 2.260 1.00 0.00 C ATOM 523 C TYR A 39 -3.740 13.064 3.069 1.00 0.00 C ATOM 524 O TYR A 39 -4.570 12.225 3.422 1.00 0.00 O ATOM 525 CB TYR A 39 -3.965 14.018 0.767 1.00 0.00 C ATOM 526 CG TYR A 39 -4.531 15.101 -0.123 1.00 0.00 C ATOM 527 CD1 TYR A 39 -5.758 15.687 0.158 1.00 0.00 C ATOM 528 CD2 TYR A 39 -3.837 15.538 -1.245 1.00 0.00 C ATOM 529 CE1 TYR A 39 -6.280 16.677 -0.652 1.00 0.00 C ATOM 530 CE2 TYR A 39 -4.350 16.529 -2.060 1.00 0.00 C ATOM 531 CZ TYR A 39 -5.572 17.094 -1.760 1.00 0.00 C ATOM 532 OH TYR A 39 -6.087 18.081 -2.570 1.00 0.00 O ATOM 0 H TYR A 39 -3.034 16.018 1.889 1.00 0.00 H new ATOM 0 HA TYR A 39 -5.213 14.485 2.453 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.900 13.910 0.561 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -4.437 13.068 0.514 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -6.314 15.363 1.025 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.881 15.096 -1.484 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -7.236 17.122 -0.419 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -3.797 16.859 -2.927 1.00 0.00 H new ATOM 0 HH TYR A 39 -5.464 18.259 -3.306 1.00 0.00 H new ATOM 542 N CYS A 40 -2.447 12.968 3.358 1.00 0.00 N ATOM 543 CA CYS A 40 -1.916 11.847 4.125 1.00 0.00 C ATOM 544 C CYS A 40 -2.860 11.470 5.262 1.00 0.00 C ATOM 545 O CYS A 40 -2.865 10.330 5.729 1.00 0.00 O ATOM 546 CB CYS A 40 -0.536 12.193 4.686 1.00 0.00 C ATOM 547 SG CYS A 40 -0.058 11.214 6.129 1.00 0.00 S ATOM 0 H CYS A 40 -1.747 13.653 3.073 1.00 0.00 H new ATOM 0 HA CYS A 40 -1.824 10.992 3.455 1.00 0.00 H new ATOM 0 HB2 CYS A 40 0.208 12.052 3.902 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.520 13.249 4.955 1.00 0.00 H new ATOM 0 HG CYS A 40 1.227 11.300 6.305 1.00 0.00 H new ATOM 553 N THR A 41 -3.658 12.436 5.706 1.00 0.00 N ATOM 554 CA THR A 41 -4.605 12.207 6.790 1.00 0.00 C ATOM 555 C THR A 41 -5.982 11.839 6.250 1.00 0.00 C ATOM 556 O THR A 41 -6.670 10.985 6.808 1.00 0.00 O ATOM 557 CB THR A 41 -4.736 13.448 7.693 1.00 0.00 C ATOM 558 OG1 THR A 41 -5.137 13.055 9.011 1.00 0.00 O ATOM 559 CG2 THR A 41 -5.748 14.429 7.121 1.00 0.00 C ATOM 0 H THR A 41 -3.667 13.385 5.331 1.00 0.00 H new ATOM 0 HA THR A 41 -4.215 11.377 7.379 1.00 0.00 H new ATOM 0 HB THR A 41 -3.764 13.939 7.741 1.00 0.00 H new ATOM 0 HG1 THR A 41 -5.217 13.849 9.579 1.00 0.00 H new ATOM 0 HG21 THR A 41 -5.823 15.297 7.776 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.425 14.749 6.130 1.00 0.00 H new ATOM 0 HG23 THR A 41 -6.722 13.945 7.047 1.00 0.00 H new ATOM 567 N MET A 42 -6.377 12.488 5.159 1.00 0.00 N ATOM 568 CA MET A 42 -7.672 12.226 4.542 1.00 0.00 C ATOM 569 C MET A 42 -7.832 10.743 4.221 1.00 0.00 C ATOM 570 O MET A 42 -8.865 10.143 4.516 1.00 0.00 O ATOM 571 CB MET A 42 -7.831 13.056 3.267 1.00 0.00 C ATOM 572 CG MET A 42 -7.364 12.336 2.012 1.00 0.00 C ATOM 573 SD MET A 42 -7.740 13.252 0.505 1.00 0.00 S ATOM 574 CE MET A 42 -9.530 13.191 0.510 1.00 0.00 C ATOM 0 H MET A 42 -5.819 13.198 4.685 1.00 0.00 H new ATOM 0 HA MET A 42 -8.449 12.511 5.252 1.00 0.00 H new ATOM 0 HB2 MET A 42 -8.879 13.330 3.150 1.00 0.00 H new ATOM 0 HB3 MET A 42 -7.269 13.984 3.374 1.00 0.00 H new ATOM 0 HG2 MET A 42 -6.289 12.169 2.072 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.836 11.355 1.964 1.00 0.00 H new ATOM 0 HE1 MET A 42 -9.902 13.332 -0.505 1.00 0.00 H new ATOM 0 HE2 MET A 42 -9.860 12.223 0.886 1.00 0.00 H new ATOM 0 HE3 MET A 42 -9.919 13.981 1.152 1.00 0.00 H new ATOM 584 N ALA A 43 -6.803 10.159 3.616 1.00 0.00 N ATOM 585 CA ALA A 43 -6.829 8.747 3.257 1.00 0.00 C ATOM 586 C ALA A 43 -7.120 7.876 4.474 1.00 0.00 C ATOM 587 O ALA A 43 -8.019 7.035 4.449 1.00 0.00 O ATOM 588 CB ALA A 43 -5.510 8.340 2.618 1.00 0.00 C ATOM 0 H ALA A 43 -5.941 10.642 3.364 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.632 8.597 2.535 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.544 7.283 2.355 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.343 8.932 1.718 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.696 8.513 3.322 1.00 0.00 H new ATOM 594 N LYS A 44 -6.353 8.082 5.540 1.00 0.00 N ATOM 595 CA LYS A 44 -6.528 7.317 6.769 1.00 0.00 C ATOM 596 C LYS A 44 -7.954 7.449 7.294 1.00 0.00 C ATOM 597 O LYS A 44 -8.620 6.452 7.570 1.00 0.00 O ATOM 598 CB LYS A 44 -5.535 7.789 7.833 1.00 0.00 C ATOM 599 CG LYS A 44 -4.240 8.335 7.258 1.00 0.00 C ATOM 600 CD LYS A 44 -3.100 8.235 8.257 1.00 0.00 C ATOM 601 CE LYS A 44 -3.358 9.094 9.485 1.00 0.00 C ATOM 602 NZ LYS A 44 -2.645 8.576 10.685 1.00 0.00 N ATOM 0 H LYS A 44 -5.604 8.773 5.577 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.339 6.267 6.544 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -6.007 8.561 8.441 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.305 6.956 8.498 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.982 7.784 6.354 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -4.380 9.376 6.968 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -2.970 7.196 8.559 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -2.170 8.548 7.782 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -3.038 10.117 9.286 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -4.429 9.128 9.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.847 9.189 11.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -2.968 7.609 10.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -1.621 8.567 10.504 1.00 0.00 H new ATOM 616 N LYS A 45 -8.417 8.687 7.429 1.00 0.00 N ATOM 617 CA LYS A 45 -9.765 8.951 7.918 1.00 0.00 C ATOM 618 C LYS A 45 -10.808 8.279 7.031 1.00 0.00 C ATOM 619 O LYS A 45 -11.741 7.644 7.524 1.00 0.00 O ATOM 620 CB LYS A 45 -10.024 10.459 7.974 1.00 0.00 C ATOM 621 CG LYS A 45 -9.426 11.134 9.196 1.00 0.00 C ATOM 622 CD LYS A 45 -9.857 12.587 9.298 1.00 0.00 C ATOM 623 CE LYS A 45 -9.891 13.059 10.743 1.00 0.00 C ATOM 624 NZ LYS A 45 -8.527 13.353 11.263 1.00 0.00 N ATOM 0 H LYS A 45 -7.878 9.524 7.206 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.847 8.536 8.923 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.615 10.923 7.076 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.100 10.635 7.962 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.733 10.599 10.095 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.338 11.079 9.147 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.171 13.212 8.726 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.844 12.707 8.852 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -10.509 13.954 10.818 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -10.359 12.295 11.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -8.593 13.672 12.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -7.944 12.493 11.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -8.089 14.100 10.687 1.00 0.00 H new ATOM 638 N LEU A 46 -10.642 8.420 5.720 1.00 0.00 N ATOM 639 CA LEU A 46 -11.568 7.824 4.764 1.00 0.00 C ATOM 640 C LEU A 46 -11.935 6.401 5.174 1.00 0.00 C ATOM 641 O LEU A 46 -13.054 6.141 5.616 1.00 0.00 O ATOM 642 CB LEU A 46 -10.953 7.820 3.363 1.00 0.00 C ATOM 643 CG LEU A 46 -11.674 6.971 2.316 1.00 0.00 C ATOM 644 CD1 LEU A 46 -12.980 7.630 1.901 1.00 0.00 C ATOM 645 CD2 LEU A 46 -10.780 6.745 1.105 1.00 0.00 C ATOM 0 H LEU A 46 -9.875 8.942 5.295 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.477 8.425 4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.913 8.848 3.003 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.924 7.469 3.441 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.905 6.002 2.758 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.479 7.011 1.155 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -13.625 7.739 2.773 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -12.773 8.613 1.477 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -11.309 6.139 0.370 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.518 7.706 0.662 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.872 6.228 1.415 1.00 0.00 H new ATOM 657 N PHE A 47 -10.984 5.485 5.028 1.00 0.00 N ATOM 658 CA PHE A 47 -11.206 4.088 5.385 1.00 0.00 C ATOM 659 C PHE A 47 -11.703 3.967 6.822 1.00 0.00 C ATOM 660 O PHE A 47 -12.558 3.135 7.128 1.00 0.00 O ATOM 661 CB PHE A 47 -9.917 3.284 5.209 1.00 0.00 C ATOM 662 CG PHE A 47 -9.551 3.045 3.772 1.00 0.00 C ATOM 663 CD1 PHE A 47 -8.786 3.967 3.076 1.00 0.00 C ATOM 664 CD2 PHE A 47 -9.971 1.898 3.118 1.00 0.00 C ATOM 665 CE1 PHE A 47 -8.449 3.750 1.753 1.00 0.00 C ATOM 666 CE2 PHE A 47 -9.635 1.675 1.795 1.00 0.00 C ATOM 667 CZ PHE A 47 -8.873 2.602 1.113 1.00 0.00 C ATOM 0 H PHE A 47 -10.052 5.684 4.665 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.970 3.685 4.720 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -9.099 3.811 5.701 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -10.026 2.323 5.713 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -8.449 4.865 3.573 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -10.568 1.170 3.647 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -7.855 4.478 1.220 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -9.968 0.777 1.296 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.609 2.430 0.080 1.00 0.00 H new ATOM 677 N HIS A 48 -11.161 4.803 7.702 1.00 0.00 N ATOM 678 CA HIS A 48 -11.548 4.790 9.108 1.00 0.00 C ATOM 679 C HIS A 48 -13.067 4.807 9.254 1.00 0.00 C ATOM 680 O HIS A 48 -13.639 4.003 9.989 1.00 0.00 O ATOM 681 CB HIS A 48 -10.940 5.988 9.838 1.00 0.00 C ATOM 682 CG HIS A 48 -10.760 5.766 11.308 1.00 0.00 C ATOM 683 ND1 HIS A 48 -9.757 6.364 12.042 1.00 0.00 N ATOM 684 CD2 HIS A 48 -11.463 5.009 12.182 1.00 0.00 C ATOM 685 CE1 HIS A 48 -9.850 5.981 13.303 1.00 0.00 C ATOM 686 NE2 HIS A 48 -10.877 5.159 13.414 1.00 0.00 N ATOM 0 H HIS A 48 -10.453 5.498 7.466 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.168 3.871 9.555 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -9.973 6.221 9.393 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -11.579 6.858 9.686 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -12.325 4.400 11.953 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.197 6.288 14.106 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -11.185 4.708 14.276 1.00 0.00 H new ATOM 694 N ASP A 49 -13.713 5.730 8.549 1.00 0.00 N ATOM 695 CA ASP A 49 -15.165 5.852 8.599 1.00 0.00 C ATOM 696 C ASP A 49 -15.835 4.618 8.002 1.00 0.00 C ATOM 697 O ASP A 49 -16.952 4.264 8.378 1.00 0.00 O ATOM 698 CB ASP A 49 -15.619 7.106 7.851 1.00 0.00 C ATOM 699 CG ASP A 49 -15.541 8.353 8.710 1.00 0.00 C ATOM 700 OD1 ASP A 49 -14.775 8.347 9.697 1.00 0.00 O ATOM 701 OD2 ASP A 49 -16.245 9.335 8.395 1.00 0.00 O ATOM 0 H ASP A 49 -13.254 6.404 7.937 1.00 0.00 H new ATOM 0 HA ASP A 49 -15.462 5.935 9.644 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -15.000 7.240 6.964 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -16.644 6.969 7.507 1.00 0.00 H new ATOM 706 N MET A 50 -15.145 3.969 7.070 1.00 0.00 N ATOM 707 CA MET A 50 -15.674 2.775 6.421 1.00 0.00 C ATOM 708 C MET A 50 -15.454 1.541 7.291 1.00 0.00 C ATOM 709 O MET A 50 -15.986 0.468 7.008 1.00 0.00 O ATOM 710 CB MET A 50 -15.014 2.575 5.056 1.00 0.00 C ATOM 711 CG MET A 50 -15.010 3.827 4.194 1.00 0.00 C ATOM 712 SD MET A 50 -15.066 3.457 2.430 1.00 0.00 S ATOM 713 CE MET A 50 -13.746 2.254 2.295 1.00 0.00 C ATOM 0 H MET A 50 -14.219 4.250 6.747 1.00 0.00 H new ATOM 0 HA MET A 50 -16.746 2.913 6.281 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.987 2.242 5.204 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.534 1.779 4.523 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.866 4.448 4.458 1.00 0.00 H new ATOM 0 HG3 MET A 50 -14.115 4.410 4.411 1.00 0.00 H new ATOM 0 HE1 MET A 50 -13.273 2.341 1.317 1.00 0.00 H new ATOM 0 HE2 MET A 50 -13.006 2.437 3.074 1.00 0.00 H new ATOM 0 HE3 MET A 50 -14.155 1.250 2.412 1.00 0.00 H new ATOM 723 N ASN A 51 -14.667 1.702 8.349 1.00 0.00 N ATOM 724 CA ASN A 51 -14.376 0.600 9.260 1.00 0.00 C ATOM 725 C ASN A 51 -13.598 -0.503 8.548 1.00 0.00 C ATOM 726 O ASN A 51 -13.814 -1.690 8.796 1.00 0.00 O ATOM 727 CB ASN A 51 -15.673 0.033 9.838 1.00 0.00 C ATOM 728 CG ASN A 51 -16.505 1.090 10.538 1.00 0.00 C ATOM 729 OD1 ASN A 51 -16.140 1.575 11.609 1.00 0.00 O ATOM 730 ND2 ASN A 51 -17.631 1.453 9.934 1.00 0.00 N ATOM 0 H ASN A 51 -14.219 2.584 8.597 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.762 0.986 10.074 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.260 -0.415 9.036 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.436 -0.764 10.543 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -18.232 2.160 10.357 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -17.895 1.025 9.047 1.00 0.00 H new ATOM 737 N VAL A 52 -12.692 -0.104 7.661 1.00 0.00 N ATOM 738 CA VAL A 52 -11.881 -1.057 6.914 1.00 0.00 C ATOM 739 C VAL A 52 -10.440 -1.063 7.413 1.00 0.00 C ATOM 740 O VAL A 52 -9.625 -0.243 6.993 1.00 0.00 O ATOM 741 CB VAL A 52 -11.889 -0.741 5.406 1.00 0.00 C ATOM 742 CG1 VAL A 52 -11.004 -1.720 4.650 1.00 0.00 C ATOM 743 CG2 VAL A 52 -13.311 -0.768 4.865 1.00 0.00 C ATOM 0 H VAL A 52 -12.501 0.874 7.442 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.322 -2.041 7.074 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.487 0.262 5.260 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.022 -1.481 3.587 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -9.982 -1.647 5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -11.373 -2.735 4.800 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.299 -0.543 3.799 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -13.741 -1.757 5.022 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -13.913 -0.024 5.386 1.00 0.00 H new ATOM 753 N ASN A 53 -10.135 -1.994 8.311 1.00 0.00 N ATOM 754 CA ASN A 53 -8.792 -2.107 8.868 1.00 0.00 C ATOM 755 C ASN A 53 -7.738 -1.749 7.824 1.00 0.00 C ATOM 756 O ASN A 53 -7.580 -2.447 6.821 1.00 0.00 O ATOM 757 CB ASN A 53 -8.550 -3.525 9.387 1.00 0.00 C ATOM 758 CG ASN A 53 -9.430 -3.864 10.575 1.00 0.00 C ATOM 759 OD1 ASN A 53 -9.193 -3.399 11.690 1.00 0.00 O ATOM 760 ND2 ASN A 53 -10.453 -4.678 10.340 1.00 0.00 N ATOM 0 H ASN A 53 -10.799 -2.681 8.668 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.710 -1.405 9.698 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -8.736 -4.239 8.585 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -7.503 -3.631 9.672 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -11.080 -4.941 11.100 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.611 -5.040 9.400 1.00 0.00 H new ATOM 767 N TYR A 54 -7.019 -0.659 8.066 1.00 0.00 N ATOM 768 CA TYR A 54 -5.982 -0.208 7.146 1.00 0.00 C ATOM 769 C TYR A 54 -4.629 -0.131 7.847 1.00 0.00 C ATOM 770 O TYR A 54 -4.548 -0.179 9.074 1.00 0.00 O ATOM 771 CB TYR A 54 -6.346 1.160 6.565 1.00 0.00 C ATOM 772 CG TYR A 54 -6.269 2.286 7.571 1.00 0.00 C ATOM 773 CD1 TYR A 54 -7.285 2.485 8.498 1.00 0.00 C ATOM 774 CD2 TYR A 54 -5.181 3.150 7.595 1.00 0.00 C ATOM 775 CE1 TYR A 54 -7.219 3.513 9.419 1.00 0.00 C ATOM 776 CE2 TYR A 54 -5.107 4.179 8.513 1.00 0.00 C ATOM 777 CZ TYR A 54 -6.128 4.357 9.423 1.00 0.00 C ATOM 778 OH TYR A 54 -6.058 5.382 10.338 1.00 0.00 O ATOM 0 H TYR A 54 -7.135 -0.071 8.892 1.00 0.00 H new ATOM 0 HA TYR A 54 -5.911 -0.933 6.335 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.678 1.381 5.733 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.357 1.116 6.159 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -8.140 1.825 8.499 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.380 3.014 6.884 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -8.018 3.655 10.132 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.254 4.841 8.518 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.142 5.728 10.372 1.00 0.00 H new ATOM 788 N LYS A 55 -3.567 -0.010 7.057 1.00 0.00 N ATOM 789 CA LYS A 55 -2.216 0.075 7.598 1.00 0.00 C ATOM 790 C LYS A 55 -1.444 1.223 6.955 1.00 0.00 C ATOM 791 O LYS A 55 -1.023 1.132 5.802 1.00 0.00 O ATOM 792 CB LYS A 55 -1.471 -1.242 7.375 1.00 0.00 C ATOM 793 CG LYS A 55 0.039 -1.113 7.480 1.00 0.00 C ATOM 794 CD LYS A 55 0.482 -0.903 8.918 1.00 0.00 C ATOM 795 CE LYS A 55 1.894 -1.418 9.147 1.00 0.00 C ATOM 796 NZ LYS A 55 2.092 -1.892 10.545 1.00 0.00 N ATOM 0 H LYS A 55 -3.616 0.031 6.039 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.292 0.265 8.669 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.816 -1.973 8.106 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -1.726 -1.632 6.389 1.00 0.00 H new ATOM 0 HG2 LYS A 55 0.510 -2.011 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.377 -0.277 6.868 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.437 0.158 9.162 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.207 -1.415 9.590 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.100 -2.234 8.454 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.610 -0.626 8.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 3.067 -2.235 10.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.921 -1.107 11.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.427 -2.665 10.747 1.00 0.00 H new ATOM 810 N VAL A 56 -1.261 2.303 7.708 1.00 0.00 N ATOM 811 CA VAL A 56 -0.537 3.467 7.212 1.00 0.00 C ATOM 812 C VAL A 56 0.918 3.445 7.667 1.00 0.00 C ATOM 813 O VAL A 56 1.209 3.221 8.842 1.00 0.00 O ATOM 814 CB VAL A 56 -1.191 4.779 7.687 1.00 0.00 C ATOM 815 CG1 VAL A 56 -0.628 5.199 9.036 1.00 0.00 C ATOM 816 CG2 VAL A 56 -0.994 5.876 6.652 1.00 0.00 C ATOM 0 H VAL A 56 -1.604 2.396 8.664 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.575 3.423 6.124 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.261 4.610 7.805 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.102 6.127 9.355 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.826 4.419 9.772 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.448 5.352 8.950 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.462 6.796 7.003 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.072 6.046 6.500 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.451 5.573 5.710 1.00 0.00 H new ATOM 826 N VAL A 57 1.830 3.678 6.728 1.00 0.00 N ATOM 827 CA VAL A 57 3.256 3.686 7.032 1.00 0.00 C ATOM 828 C VAL A 57 3.875 5.045 6.725 1.00 0.00 C ATOM 829 O VAL A 57 3.787 5.538 5.601 1.00 0.00 O ATOM 830 CB VAL A 57 4.005 2.601 6.236 1.00 0.00 C ATOM 831 CG1 VAL A 57 5.479 2.585 6.612 1.00 0.00 C ATOM 832 CG2 VAL A 57 3.372 1.237 6.469 1.00 0.00 C ATOM 0 H VAL A 57 1.606 3.864 5.750 1.00 0.00 H new ATOM 0 HA VAL A 57 3.354 3.477 8.097 1.00 0.00 H new ATOM 0 HB VAL A 57 3.928 2.835 5.174 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.992 1.812 6.040 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.922 3.556 6.389 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.581 2.376 7.677 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.914 0.482 5.899 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.417 0.992 7.530 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.331 1.259 6.145 1.00 0.00 H new ATOM 842 N GLU A 58 4.502 5.644 7.733 1.00 0.00 N ATOM 843 CA GLU A 58 5.136 6.947 7.570 1.00 0.00 C ATOM 844 C GLU A 58 6.563 6.797 7.050 1.00 0.00 C ATOM 845 O GLU A 58 7.466 6.404 7.789 1.00 0.00 O ATOM 846 CB GLU A 58 5.143 7.706 8.899 1.00 0.00 C ATOM 847 CG GLU A 58 3.786 7.748 9.582 1.00 0.00 C ATOM 848 CD GLU A 58 3.565 6.572 10.513 1.00 0.00 C ATOM 849 OE1 GLU A 58 4.529 6.166 11.195 1.00 0.00 O ATOM 850 OE2 GLU A 58 2.428 6.057 10.559 1.00 0.00 O ATOM 0 H GLU A 58 4.584 5.248 8.670 1.00 0.00 H new ATOM 0 HA GLU A 58 4.559 7.514 6.839 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.864 7.240 9.570 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.484 8.726 8.723 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.696 8.676 10.147 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.002 7.759 8.824 1.00 0.00 H new ATOM 857 N LEU A 59 6.758 7.111 5.775 1.00 0.00 N ATOM 858 CA LEU A 59 8.075 7.011 5.154 1.00 0.00 C ATOM 859 C LEU A 59 8.992 8.128 5.642 1.00 0.00 C ATOM 860 O LEU A 59 10.214 8.041 5.513 1.00 0.00 O ATOM 861 CB LEU A 59 7.948 7.067 3.631 1.00 0.00 C ATOM 862 CG LEU A 59 7.005 6.044 2.998 1.00 0.00 C ATOM 863 CD1 LEU A 59 6.607 6.480 1.596 1.00 0.00 C ATOM 864 CD2 LEU A 59 7.654 4.668 2.966 1.00 0.00 C ATOM 0 H LEU A 59 6.021 7.437 5.150 1.00 0.00 H new ATOM 0 HA LEU A 59 8.514 6.055 5.440 1.00 0.00 H new ATOM 0 HB2 LEU A 59 7.610 8.065 3.351 1.00 0.00 H new ATOM 0 HB3 LEU A 59 8.940 6.933 3.199 1.00 0.00 H new ATOM 0 HG LEU A 59 6.103 5.984 3.608 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.936 5.739 1.161 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.101 7.444 1.645 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.499 6.569 0.976 1.00 0.00 H new ATOM 0 HD21 LEU A 59 6.968 3.953 2.512 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.572 4.712 2.380 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.887 4.352 3.983 1.00 0.00 H new ATOM 876 N ASP A 60 8.396 9.174 6.203 1.00 0.00 N ATOM 877 CA ASP A 60 9.160 10.306 6.713 1.00 0.00 C ATOM 878 C ASP A 60 10.024 9.889 7.898 1.00 0.00 C ATOM 879 O ASP A 60 11.245 10.052 7.878 1.00 0.00 O ATOM 880 CB ASP A 60 8.219 11.439 7.125 1.00 0.00 C ATOM 881 CG ASP A 60 8.892 12.797 7.078 1.00 0.00 C ATOM 882 OD1 ASP A 60 10.012 12.923 7.615 1.00 0.00 O ATOM 883 OD2 ASP A 60 8.298 13.733 6.503 1.00 0.00 O ATOM 0 H ASP A 60 7.386 9.261 6.316 1.00 0.00 H new ATOM 0 HA ASP A 60 9.815 10.659 5.916 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.351 11.444 6.466 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.852 11.253 8.134 1.00 0.00 H new ATOM 888 N LEU A 61 9.384 9.352 8.931 1.00 0.00 N ATOM 889 CA LEU A 61 10.094 8.912 10.127 1.00 0.00 C ATOM 890 C LEU A 61 10.991 7.718 9.819 1.00 0.00 C ATOM 891 O LEU A 61 12.008 7.505 10.481 1.00 0.00 O ATOM 892 CB LEU A 61 9.098 8.546 11.229 1.00 0.00 C ATOM 893 CG LEU A 61 8.221 9.686 11.747 1.00 0.00 C ATOM 894 CD1 LEU A 61 9.001 10.991 11.772 1.00 0.00 C ATOM 895 CD2 LEU A 61 6.970 9.827 10.893 1.00 0.00 C ATOM 0 H LEU A 61 8.374 9.211 8.964 1.00 0.00 H new ATOM 0 HA LEU A 61 10.721 9.734 10.471 1.00 0.00 H new ATOM 0 HB2 LEU A 61 8.448 7.755 10.855 1.00 0.00 H new ATOM 0 HB3 LEU A 61 9.654 8.131 12.070 1.00 0.00 H new ATOM 0 HG LEU A 61 7.916 9.449 12.766 1.00 0.00 H new ATOM 0 HD11 LEU A 61 8.360 11.791 12.143 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.866 10.885 12.427 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.337 11.234 10.764 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.358 10.643 11.276 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.255 10.040 9.863 1.00 0.00 H new ATOM 0 HD23 LEU A 61 6.400 8.899 10.927 1.00 0.00 H new ATOM 907 N LEU A 62 10.611 6.943 8.810 1.00 0.00 N ATOM 908 CA LEU A 62 11.382 5.771 8.412 1.00 0.00 C ATOM 909 C LEU A 62 12.797 6.164 8.000 1.00 0.00 C ATOM 910 O LEU A 62 13.002 6.765 6.945 1.00 0.00 O ATOM 911 CB LEU A 62 10.686 5.045 7.259 1.00 0.00 C ATOM 912 CG LEU A 62 9.636 4.007 7.656 1.00 0.00 C ATOM 913 CD1 LEU A 62 8.995 3.396 6.420 1.00 0.00 C ATOM 914 CD2 LEU A 62 10.257 2.925 8.527 1.00 0.00 C ATOM 0 H LEU A 62 9.773 7.105 8.252 1.00 0.00 H new ATOM 0 HA LEU A 62 11.446 5.101 9.269 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.209 5.790 6.622 1.00 0.00 H new ATOM 0 HB3 LEU A 62 11.447 4.550 6.655 1.00 0.00 H new ATOM 0 HG LEU A 62 8.859 4.508 8.233 1.00 0.00 H new ATOM 0 HD11 LEU A 62 8.250 2.660 6.723 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.514 4.179 5.835 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.761 2.910 5.815 1.00 0.00 H new ATOM 0 HD21 LEU A 62 9.495 2.195 8.800 1.00 0.00 H new ATOM 0 HD22 LEU A 62 11.055 2.427 7.976 1.00 0.00 H new ATOM 0 HD23 LEU A 62 10.667 3.376 9.431 1.00 0.00 H new ATOM 926 N GLU A 63 13.770 5.820 8.838 1.00 0.00 N ATOM 927 CA GLU A 63 15.165 6.137 8.559 1.00 0.00 C ATOM 928 C GLU A 63 15.489 5.917 7.084 1.00 0.00 C ATOM 929 O GLU A 63 16.209 6.706 6.471 1.00 0.00 O ATOM 930 CB GLU A 63 16.089 5.280 9.427 1.00 0.00 C ATOM 931 CG GLU A 63 16.026 3.797 9.105 1.00 0.00 C ATOM 932 CD GLU A 63 16.402 2.926 10.287 1.00 0.00 C ATOM 933 OE1 GLU A 63 17.568 2.996 10.730 1.00 0.00 O ATOM 934 OE2 GLU A 63 15.530 2.174 10.771 1.00 0.00 O ATOM 0 H GLU A 63 13.618 5.322 9.715 1.00 0.00 H new ATOM 0 HA GLU A 63 15.326 7.189 8.796 1.00 0.00 H new ATOM 0 HB2 GLU A 63 17.115 5.627 9.302 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.828 5.427 10.475 1.00 0.00 H new ATOM 0 HG2 GLU A 63 15.018 3.543 8.778 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.695 3.581 8.272 1.00 0.00 H new ATOM 941 N TYR A 64 14.952 4.841 6.520 1.00 0.00 N ATOM 942 CA TYR A 64 15.185 4.515 5.118 1.00 0.00 C ATOM 943 C TYR A 64 14.005 4.950 4.255 1.00 0.00 C ATOM 944 O TYR A 64 13.594 4.237 3.340 1.00 0.00 O ATOM 945 CB TYR A 64 15.425 3.014 4.955 1.00 0.00 C ATOM 946 CG TYR A 64 14.513 2.159 5.805 1.00 0.00 C ATOM 947 CD1 TYR A 64 13.238 1.821 5.368 1.00 0.00 C ATOM 948 CD2 TYR A 64 14.925 1.689 7.046 1.00 0.00 C ATOM 949 CE1 TYR A 64 12.401 1.040 6.142 1.00 0.00 C ATOM 950 CE2 TYR A 64 14.095 0.907 7.826 1.00 0.00 C ATOM 951 CZ TYR A 64 12.834 0.586 7.370 1.00 0.00 C ATOM 952 OH TYR A 64 12.004 -0.192 8.144 1.00 0.00 O ATOM 0 H TYR A 64 14.352 4.179 7.012 1.00 0.00 H new ATOM 0 HA TYR A 64 16.072 5.055 4.788 1.00 0.00 H new ATOM 0 HB2 TYR A 64 15.290 2.745 3.908 1.00 0.00 H new ATOM 0 HB3 TYR A 64 16.461 2.790 5.210 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.895 2.175 4.407 1.00 0.00 H new ATOM 0 HD2 TYR A 64 15.912 1.939 7.407 1.00 0.00 H new ATOM 0 HE1 TYR A 64 11.413 0.787 5.787 1.00 0.00 H new ATOM 0 HE2 TYR A 64 14.432 0.549 8.788 1.00 0.00 H new ATOM 0 HH TYR A 64 12.461 -0.429 8.978 1.00 0.00 H new ATOM 962 N GLY A 65 13.463 6.128 4.552 1.00 0.00 N ATOM 963 CA GLY A 65 12.336 6.639 3.795 1.00 0.00 C ATOM 964 C GLY A 65 12.691 6.924 2.349 1.00 0.00 C ATOM 965 O GLY A 65 12.002 6.477 1.434 1.00 0.00 O ATOM 0 H GLY A 65 13.785 6.737 5.304 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.521 5.916 3.830 1.00 0.00 H new ATOM 0 HA3 GLY A 65 11.972 7.553 4.264 1.00 0.00 H new ATOM 969 N ASN A 66 13.770 7.673 2.143 1.00 0.00 N ATOM 970 CA ASN A 66 14.214 8.020 0.798 1.00 0.00 C ATOM 971 C ASN A 66 14.370 6.770 -0.063 1.00 0.00 C ATOM 972 O ASN A 66 14.374 6.847 -1.291 1.00 0.00 O ATOM 973 CB ASN A 66 15.539 8.782 0.856 1.00 0.00 C ATOM 974 CG ASN A 66 15.569 9.805 1.975 1.00 0.00 C ATOM 975 OD1 ASN A 66 14.531 10.327 2.382 1.00 0.00 O ATOM 976 ND2 ASN A 66 16.763 10.096 2.478 1.00 0.00 N ATOM 0 H ASN A 66 14.353 8.051 2.890 1.00 0.00 H new ATOM 0 HA ASN A 66 13.455 8.659 0.346 1.00 0.00 H new ATOM 0 HB2 ASN A 66 16.356 8.074 0.993 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.708 9.284 -0.096 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.846 10.777 3.233 1.00 0.00 H new ATOM 0 HD22 ASN A 66 17.597 9.639 2.110 1.00 0.00 H new ATOM 983 N GLN A 67 14.498 5.620 0.592 1.00 0.00 N ATOM 984 CA GLN A 67 14.655 4.354 -0.114 1.00 0.00 C ATOM 985 C GLN A 67 13.310 3.840 -0.617 1.00 0.00 C ATOM 986 O GLN A 67 13.047 3.832 -1.820 1.00 0.00 O ATOM 987 CB GLN A 67 15.302 3.313 0.802 1.00 0.00 C ATOM 988 CG GLN A 67 16.751 3.618 1.141 1.00 0.00 C ATOM 989 CD GLN A 67 17.496 2.405 1.663 1.00 0.00 C ATOM 990 OE1 GLN A 67 17.147 1.848 2.704 1.00 0.00 O ATOM 991 NE2 GLN A 67 18.530 1.989 0.941 1.00 0.00 N ATOM 0 H GLN A 67 14.496 5.539 1.609 1.00 0.00 H new ATOM 0 HA GLN A 67 15.302 4.524 -0.974 1.00 0.00 H new ATOM 0 HB2 GLN A 67 14.728 3.247 1.726 1.00 0.00 H new ATOM 0 HB3 GLN A 67 15.248 2.336 0.323 1.00 0.00 H new ATOM 0 HG2 GLN A 67 17.256 3.995 0.252 1.00 0.00 H new ATOM 0 HG3 GLN A 67 16.786 4.411 1.888 1.00 0.00 H new ATOM 0 HE21 GLN A 67 18.785 2.481 0.084 1.00 0.00 H new ATOM 0 HE22 GLN A 67 19.070 1.178 1.243 1.00 0.00 H new ATOM 1000 N PHE A 68 12.461 3.413 0.312 1.00 0.00 N ATOM 1001 CA PHE A 68 11.142 2.896 -0.038 1.00 0.00 C ATOM 1002 C PHE A 68 10.369 3.905 -0.882 1.00 0.00 C ATOM 1003 O PHE A 68 9.430 3.545 -1.591 1.00 0.00 O ATOM 1004 CB PHE A 68 10.351 2.560 1.228 1.00 0.00 C ATOM 1005 CG PHE A 68 10.729 1.242 1.840 1.00 0.00 C ATOM 1006 CD1 PHE A 68 12.061 0.900 2.013 1.00 0.00 C ATOM 1007 CD2 PHE A 68 9.753 0.343 2.240 1.00 0.00 C ATOM 1008 CE1 PHE A 68 12.413 -0.312 2.576 1.00 0.00 C ATOM 1009 CE2 PHE A 68 10.099 -0.871 2.803 1.00 0.00 C ATOM 1010 CZ PHE A 68 11.430 -1.199 2.970 1.00 0.00 C ATOM 0 H PHE A 68 12.662 3.415 1.312 1.00 0.00 H new ATOM 0 HA PHE A 68 11.279 1.988 -0.625 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.505 3.350 1.963 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.287 2.549 0.990 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.833 1.589 1.704 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.711 0.594 2.110 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.455 -0.565 2.708 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.329 -1.562 3.112 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.702 -2.148 3.408 1.00 0.00 H new ATOM 1020 N GLN A 69 10.771 5.169 -0.797 1.00 0.00 N ATOM 1021 CA GLN A 69 10.115 6.231 -1.552 1.00 0.00 C ATOM 1022 C GLN A 69 10.300 6.026 -3.052 1.00 0.00 C ATOM 1023 O GLN A 69 9.371 6.227 -3.835 1.00 0.00 O ATOM 1024 CB GLN A 69 10.669 7.596 -1.140 1.00 0.00 C ATOM 1025 CG GLN A 69 9.920 8.230 0.021 1.00 0.00 C ATOM 1026 CD GLN A 69 10.174 9.721 0.134 1.00 0.00 C ATOM 1027 OE1 GLN A 69 9.901 10.481 -0.795 1.00 0.00 O ATOM 1028 NE2 GLN A 69 10.699 10.147 1.277 1.00 0.00 N ATOM 0 H GLN A 69 11.547 5.483 -0.214 1.00 0.00 H new ATOM 0 HA GLN A 69 9.049 6.197 -1.327 1.00 0.00 H new ATOM 0 HB2 GLN A 69 11.719 7.486 -0.868 1.00 0.00 H new ATOM 0 HB3 GLN A 69 10.631 8.268 -1.997 1.00 0.00 H new ATOM 0 HG2 GLN A 69 8.851 8.056 -0.102 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.217 7.743 0.950 1.00 0.00 H new ATOM 0 HE21 GLN A 69 10.910 9.482 2.021 1.00 0.00 H new ATOM 0 HE22 GLN A 69 10.892 11.140 1.411 1.00 0.00 H new ATOM 1037 N ASP A 70 11.503 5.625 -3.446 1.00 0.00 N ATOM 1038 CA ASP A 70 11.810 5.392 -4.852 1.00 0.00 C ATOM 1039 C ASP A 70 11.121 4.128 -5.356 1.00 0.00 C ATOM 1040 O ASP A 70 10.498 4.130 -6.418 1.00 0.00 O ATOM 1041 CB ASP A 70 13.322 5.280 -5.055 1.00 0.00 C ATOM 1042 CG ASP A 70 13.697 5.075 -6.509 1.00 0.00 C ATOM 1043 OD1 ASP A 70 13.774 3.907 -6.943 1.00 0.00 O ATOM 1044 OD2 ASP A 70 13.915 6.084 -7.214 1.00 0.00 O ATOM 0 H ASP A 70 12.283 5.454 -2.811 1.00 0.00 H new ATOM 0 HA ASP A 70 11.437 6.241 -5.425 1.00 0.00 H new ATOM 0 HB2 ASP A 70 13.804 6.184 -4.683 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.704 4.448 -4.463 1.00 0.00 H new ATOM 1049 N ALA A 71 11.239 3.050 -4.589 1.00 0.00 N ATOM 1050 CA ALA A 71 10.627 1.779 -4.957 1.00 0.00 C ATOM 1051 C ALA A 71 9.146 1.955 -5.277 1.00 0.00 C ATOM 1052 O ALA A 71 8.648 1.424 -6.270 1.00 0.00 O ATOM 1053 CB ALA A 71 10.810 0.762 -3.841 1.00 0.00 C ATOM 0 H ALA A 71 11.753 3.031 -3.708 1.00 0.00 H new ATOM 0 HA ALA A 71 11.125 1.411 -5.854 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.348 -0.182 -4.130 1.00 0.00 H new ATOM 0 HB2 ALA A 71 11.874 0.606 -3.662 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.339 1.133 -2.930 1.00 0.00 H new ATOM 1059 N LEU A 72 8.448 2.702 -4.429 1.00 0.00 N ATOM 1060 CA LEU A 72 7.023 2.948 -4.621 1.00 0.00 C ATOM 1061 C LEU A 72 6.779 3.791 -5.869 1.00 0.00 C ATOM 1062 O LEU A 72 5.963 3.436 -6.721 1.00 0.00 O ATOM 1063 CB LEU A 72 6.436 3.650 -3.395 1.00 0.00 C ATOM 1064 CG LEU A 72 6.152 2.760 -2.185 1.00 0.00 C ATOM 1065 CD1 LEU A 72 5.916 3.606 -0.943 1.00 0.00 C ATOM 1066 CD2 LEU A 72 4.954 1.860 -2.454 1.00 0.00 C ATOM 0 H LEU A 72 8.845 3.148 -3.602 1.00 0.00 H new ATOM 0 HA LEU A 72 6.528 1.986 -4.752 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.124 4.438 -3.088 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.506 4.136 -3.690 1.00 0.00 H new ATOM 0 HG LEU A 72 7.024 2.129 -2.010 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.715 2.955 -0.092 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.802 4.208 -0.739 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.061 4.262 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.766 1.233 -1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.076 2.474 -2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.161 1.228 -3.317 1.00 0.00 H new ATOM 1078 N TYR A 73 7.492 4.907 -5.971 1.00 0.00 N ATOM 1079 CA TYR A 73 7.353 5.801 -7.114 1.00 0.00 C ATOM 1080 C TYR A 73 7.429 5.025 -8.425 1.00 0.00 C ATOM 1081 O TYR A 73 6.999 5.508 -9.473 1.00 0.00 O ATOM 1082 CB TYR A 73 8.439 6.877 -7.082 1.00 0.00 C ATOM 1083 CG TYR A 73 8.639 7.576 -8.408 1.00 0.00 C ATOM 1084 CD1 TYR A 73 9.496 7.053 -9.369 1.00 0.00 C ATOM 1085 CD2 TYR A 73 7.972 8.759 -8.700 1.00 0.00 C ATOM 1086 CE1 TYR A 73 9.682 7.689 -10.581 1.00 0.00 C ATOM 1087 CE2 TYR A 73 8.150 9.401 -9.910 1.00 0.00 C ATOM 1088 CZ TYR A 73 9.007 8.862 -10.847 1.00 0.00 C ATOM 1089 OH TYR A 73 9.189 9.498 -12.054 1.00 0.00 O ATOM 0 H TYR A 73 8.172 5.214 -5.276 1.00 0.00 H new ATOM 0 HA TYR A 73 6.375 6.279 -7.052 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.182 7.618 -6.325 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.381 6.422 -6.775 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.025 6.134 -9.165 1.00 0.00 H new ATOM 0 HD2 TYR A 73 7.302 9.185 -7.968 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.353 7.270 -11.317 1.00 0.00 H new ATOM 0 HE2 TYR A 73 7.622 10.319 -10.121 1.00 0.00 H new ATOM 0 HH TYR A 73 8.640 10.309 -12.082 1.00 0.00 H new ATOM 1099 N LYS A 74 7.979 3.817 -8.359 1.00 0.00 N ATOM 1100 CA LYS A 74 8.111 2.970 -9.538 1.00 0.00 C ATOM 1101 C LYS A 74 6.858 2.125 -9.745 1.00 0.00 C ATOM 1102 O LYS A 74 6.305 2.076 -10.843 1.00 0.00 O ATOM 1103 CB LYS A 74 9.335 2.061 -9.404 1.00 0.00 C ATOM 1104 CG LYS A 74 10.655 2.811 -9.433 1.00 0.00 C ATOM 1105 CD LYS A 74 11.801 1.942 -8.941 1.00 0.00 C ATOM 1106 CE LYS A 74 13.131 2.390 -9.526 1.00 0.00 C ATOM 1107 NZ LYS A 74 14.275 1.632 -8.947 1.00 0.00 N ATOM 0 H LYS A 74 8.341 3.403 -7.500 1.00 0.00 H new ATOM 0 HA LYS A 74 8.239 3.617 -10.406 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.263 1.504 -8.470 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.324 1.330 -10.212 1.00 0.00 H new ATOM 0 HG2 LYS A 74 10.862 3.146 -10.449 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.581 3.704 -8.812 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.849 1.983 -7.853 1.00 0.00 H new ATOM 0 HD3 LYS A 74 11.614 0.903 -9.213 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.116 2.255 -10.607 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.269 3.455 -9.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.075 1.649 -9.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.562 2.069 -8.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 13.988 0.647 -8.777 1.00 0.00 H new ATOM 1121 N MET A 75 6.413 1.464 -8.681 1.00 0.00 N ATOM 1122 CA MET A 75 5.223 0.623 -8.747 1.00 0.00 C ATOM 1123 C MET A 75 3.969 1.471 -8.929 1.00 0.00 C ATOM 1124 O MET A 75 2.904 0.958 -9.274 1.00 0.00 O ATOM 1125 CB MET A 75 5.101 -0.224 -7.479 1.00 0.00 C ATOM 1126 CG MET A 75 6.369 -0.987 -7.133 1.00 0.00 C ATOM 1127 SD MET A 75 6.043 -2.474 -6.165 1.00 0.00 S ATOM 1128 CE MET A 75 5.239 -1.771 -4.727 1.00 0.00 C ATOM 0 H MET A 75 6.858 1.494 -7.764 1.00 0.00 H new ATOM 0 HA MET A 75 5.322 -0.038 -9.608 1.00 0.00 H new ATOM 0 HB2 MET A 75 4.837 0.424 -6.643 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.283 -0.933 -7.603 1.00 0.00 H new ATOM 0 HG2 MET A 75 6.885 -1.263 -8.053 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.040 -0.334 -6.575 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.135 -2.536 -3.958 1.00 0.00 H new ATOM 0 HE2 MET A 75 5.839 -0.947 -4.341 1.00 0.00 H new ATOM 0 HE3 MET A 75 4.252 -1.401 -5.006 1.00 0.00 H new ATOM 1138 N THR A 76 4.100 2.773 -8.694 1.00 0.00 N ATOM 1139 CA THR A 76 2.977 3.692 -8.831 1.00 0.00 C ATOM 1140 C THR A 76 3.130 4.567 -10.070 1.00 0.00 C ATOM 1141 O THR A 76 2.160 4.831 -10.779 1.00 0.00 O ATOM 1142 CB THR A 76 2.837 4.596 -7.592 1.00 0.00 C ATOM 1143 OG1 THR A 76 3.783 5.669 -7.659 1.00 0.00 O ATOM 1144 CG2 THR A 76 3.055 3.801 -6.314 1.00 0.00 C ATOM 0 H THR A 76 4.974 3.215 -8.408 1.00 0.00 H new ATOM 0 HA THR A 76 2.079 3.082 -8.930 1.00 0.00 H new ATOM 0 HB THR A 76 1.826 5.003 -7.580 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.353 6.502 -7.373 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.951 4.461 -5.453 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.315 3.003 -6.251 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.055 3.368 -6.321 1.00 0.00 H new ATOM 1152 N GLY A 77 4.356 5.014 -10.325 1.00 0.00 N ATOM 1153 CA GLY A 77 4.613 5.855 -11.480 1.00 0.00 C ATOM 1154 C GLY A 77 4.784 7.315 -11.108 1.00 0.00 C ATOM 1155 O GLY A 77 5.275 8.111 -11.907 1.00 0.00 O ATOM 0 H GLY A 77 5.175 4.809 -9.753 1.00 0.00 H new ATOM 0 HA2 GLY A 77 5.512 5.505 -11.988 1.00 0.00 H new ATOM 0 HA3 GLY A 77 3.789 5.758 -12.187 1.00 0.00 H new ATOM 1159 N GLU A 78 4.375 7.666 -9.893 1.00 0.00 N ATOM 1160 CA GLU A 78 4.483 9.041 -9.419 1.00 0.00 C ATOM 1161 C GLU A 78 4.746 9.079 -7.916 1.00 0.00 C ATOM 1162 O GLU A 78 4.475 8.113 -7.203 1.00 0.00 O ATOM 1163 CB GLU A 78 3.206 9.818 -9.745 1.00 0.00 C ATOM 1164 CG GLU A 78 3.439 11.301 -9.979 1.00 0.00 C ATOM 1165 CD GLU A 78 2.333 11.944 -10.792 1.00 0.00 C ATOM 1166 OE1 GLU A 78 1.171 11.926 -10.333 1.00 0.00 O ATOM 1167 OE2 GLU A 78 2.629 12.467 -11.887 1.00 0.00 O ATOM 0 H GLU A 78 3.966 7.018 -9.220 1.00 0.00 H new ATOM 0 HA GLU A 78 5.324 9.510 -9.929 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.745 9.387 -10.634 1.00 0.00 H new ATOM 0 HB3 GLU A 78 2.497 9.695 -8.926 1.00 0.00 H new ATOM 0 HG2 GLU A 78 3.520 11.808 -9.018 1.00 0.00 H new ATOM 0 HG3 GLU A 78 4.390 11.439 -10.493 1.00 0.00 H new ATOM 1174 N ARG A 79 5.275 10.202 -7.443 1.00 0.00 N ATOM 1175 CA ARG A 79 5.576 10.367 -6.026 1.00 0.00 C ATOM 1176 C ARG A 79 4.547 11.271 -5.353 1.00 0.00 C ATOM 1177 O ARG A 79 4.901 12.238 -4.677 1.00 0.00 O ATOM 1178 CB ARG A 79 6.979 10.950 -5.845 1.00 0.00 C ATOM 1179 CG ARG A 79 7.119 12.372 -6.361 1.00 0.00 C ATOM 1180 CD ARG A 79 8.558 12.691 -6.735 1.00 0.00 C ATOM 1181 NE ARG A 79 8.824 14.127 -6.716 1.00 0.00 N ATOM 1182 CZ ARG A 79 8.426 14.960 -7.672 1.00 0.00 C ATOM 1183 NH1 ARG A 79 7.748 14.502 -8.715 1.00 0.00 N ATOM 1184 NH2 ARG A 79 8.706 16.254 -7.584 1.00 0.00 N ATOM 0 H ARG A 79 5.504 11.011 -8.020 1.00 0.00 H new ATOM 0 HA ARG A 79 5.535 9.385 -5.555 1.00 0.00 H new ATOM 0 HB2 ARG A 79 7.238 10.930 -4.786 1.00 0.00 H new ATOM 0 HB3 ARG A 79 7.697 10.313 -6.361 1.00 0.00 H new ATOM 0 HG2 ARG A 79 6.477 12.509 -7.231 1.00 0.00 H new ATOM 0 HG3 ARG A 79 6.777 13.072 -5.599 1.00 0.00 H new ATOM 0 HD2 ARG A 79 9.232 12.188 -6.042 1.00 0.00 H new ATOM 0 HD3 ARG A 79 8.770 12.296 -7.729 1.00 0.00 H new ATOM 0 HE ARG A 79 9.343 14.511 -5.927 1.00 0.00 H new ATOM 0 HH11 ARG A 79 7.530 13.508 -8.785 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.444 15.144 -9.447 1.00 0.00 H new ATOM 0 HH21 ARG A 79 9.227 16.610 -6.782 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.400 16.893 -8.318 1.00 0.00 H new ATOM 1198 N THR A 80 3.271 10.951 -5.542 1.00 0.00 N ATOM 1199 CA THR A 80 2.191 11.734 -4.956 1.00 0.00 C ATOM 1200 C THR A 80 1.541 10.991 -3.795 1.00 0.00 C ATOM 1201 O THR A 80 0.818 10.015 -3.996 1.00 0.00 O ATOM 1202 CB THR A 80 1.112 12.074 -6.001 1.00 0.00 C ATOM 1203 OG1 THR A 80 0.617 10.873 -6.603 1.00 0.00 O ATOM 1204 CG2 THR A 80 1.671 12.993 -7.077 1.00 0.00 C ATOM 0 H THR A 80 2.960 10.154 -6.097 1.00 0.00 H new ATOM 0 HA THR A 80 2.635 12.659 -4.589 1.00 0.00 H new ATOM 0 HB THR A 80 0.296 12.589 -5.494 1.00 0.00 H new ATOM 0 HG1 THR A 80 0.491 10.189 -5.913 1.00 0.00 H new ATOM 0 HG21 THR A 80 0.891 13.219 -7.804 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.020 13.919 -6.619 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.503 12.500 -7.580 1.00 0.00 H new ATOM 1212 N VAL A 81 1.802 11.459 -2.578 1.00 0.00 N ATOM 1213 CA VAL A 81 1.240 10.839 -1.384 1.00 0.00 C ATOM 1214 C VAL A 81 -0.034 11.551 -0.943 1.00 0.00 C ATOM 1215 O VAL A 81 -0.293 12.697 -1.311 1.00 0.00 O ATOM 1216 CB VAL A 81 2.249 10.848 -0.220 1.00 0.00 C ATOM 1217 CG1 VAL A 81 3.084 9.576 -0.228 1.00 0.00 C ATOM 1218 CG2 VAL A 81 3.138 12.080 -0.295 1.00 0.00 C ATOM 0 H VAL A 81 2.399 12.265 -2.393 1.00 0.00 H new ATOM 0 HA VAL A 81 1.005 9.807 -1.644 1.00 0.00 H new ATOM 0 HB VAL A 81 1.695 10.885 0.718 1.00 0.00 H new ATOM 0 HG11 VAL A 81 3.791 9.600 0.601 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.430 8.711 -0.122 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.630 9.505 -1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.845 12.070 0.535 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.685 12.077 -1.238 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.522 12.977 -0.236 1.00 0.00 H new ATOM 1228 N PRO A 82 -0.849 10.858 -0.134 1.00 0.00 N ATOM 1229 CA PRO A 82 -0.551 9.493 0.310 1.00 0.00 C ATOM 1230 C PRO A 82 -0.653 8.479 -0.824 1.00 0.00 C ATOM 1231 O PRO A 82 -0.914 8.841 -1.972 1.00 0.00 O ATOM 1232 CB PRO A 82 -1.623 9.222 1.368 1.00 0.00 C ATOM 1233 CG PRO A 82 -2.753 10.122 1.002 1.00 0.00 C ATOM 1234 CD PRO A 82 -2.125 11.353 0.408 1.00 0.00 C ATOM 0 HA PRO A 82 0.469 9.400 0.683 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.931 8.177 1.360 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.253 9.438 2.370 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.420 9.640 0.287 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -3.352 10.373 1.878 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.751 11.787 -0.371 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.969 12.127 1.160 1.00 0.00 H new ATOM 1242 N ARG A 83 -0.446 7.208 -0.496 1.00 0.00 N ATOM 1243 CA ARG A 83 -0.514 6.142 -1.488 1.00 0.00 C ATOM 1244 C ARG A 83 -1.286 4.943 -0.945 1.00 0.00 C ATOM 1245 O ARG A 83 -0.858 4.299 0.013 1.00 0.00 O ATOM 1246 CB ARG A 83 0.894 5.710 -1.901 1.00 0.00 C ATOM 1247 CG ARG A 83 1.869 6.868 -2.041 1.00 0.00 C ATOM 1248 CD ARG A 83 1.947 7.361 -3.477 1.00 0.00 C ATOM 1249 NE ARG A 83 0.624 7.604 -4.045 1.00 0.00 N ATOM 1250 CZ ARG A 83 0.375 7.618 -5.350 1.00 0.00 C ATOM 1251 NH1 ARG A 83 1.355 7.404 -6.217 1.00 0.00 N ATOM 1252 NH2 ARG A 83 -0.856 7.847 -5.789 1.00 0.00 N ATOM 0 H ARG A 83 -0.230 6.891 0.449 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.040 6.526 -2.362 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.281 5.007 -1.163 1.00 0.00 H new ATOM 0 HB3 ARG A 83 0.838 5.176 -2.850 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.559 7.686 -1.391 1.00 0.00 H new ATOM 0 HG3 ARG A 83 2.859 6.554 -1.709 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.531 8.280 -3.513 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.473 6.625 -4.085 1.00 0.00 H new ATOM 0 HE ARG A 83 -0.152 7.772 -3.405 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.302 7.228 -5.883 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.161 7.415 -7.218 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -1.612 8.012 -5.124 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -1.046 7.858 -6.791 1.00 0.00 H new ATOM 1266 N ILE A 84 -2.426 4.651 -1.563 1.00 0.00 N ATOM 1267 CA ILE A 84 -3.256 3.529 -1.142 1.00 0.00 C ATOM 1268 C ILE A 84 -3.004 2.302 -2.010 1.00 0.00 C ATOM 1269 O ILE A 84 -2.871 2.407 -3.230 1.00 0.00 O ATOM 1270 CB ILE A 84 -4.754 3.886 -1.199 1.00 0.00 C ATOM 1271 CG1 ILE A 84 -5.048 5.090 -0.301 1.00 0.00 C ATOM 1272 CG2 ILE A 84 -5.599 2.690 -0.784 1.00 0.00 C ATOM 1273 CD1 ILE A 84 -4.758 6.420 -0.961 1.00 0.00 C ATOM 0 H ILE A 84 -2.795 5.175 -2.356 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.983 3.303 -0.111 1.00 0.00 H new ATOM 0 HB ILE A 84 -5.011 4.150 -2.225 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -6.096 5.063 -0.002 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.454 5.008 0.609 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.655 2.957 -0.829 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.406 1.857 -1.460 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.342 2.399 0.234 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.989 7.228 -0.267 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.704 6.468 -1.236 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -5.371 6.523 -1.856 1.00 0.00 H new ATOM 1285 N PHE A 85 -2.942 1.137 -1.375 1.00 0.00 N ATOM 1286 CA PHE A 85 -2.706 -0.113 -2.089 1.00 0.00 C ATOM 1287 C PHE A 85 -3.674 -1.197 -1.623 1.00 0.00 C ATOM 1288 O PHE A 85 -3.677 -1.581 -0.453 1.00 0.00 O ATOM 1289 CB PHE A 85 -1.263 -0.578 -1.884 1.00 0.00 C ATOM 1290 CG PHE A 85 -0.275 0.121 -2.773 1.00 0.00 C ATOM 1291 CD1 PHE A 85 0.100 1.430 -2.519 1.00 0.00 C ATOM 1292 CD2 PHE A 85 0.278 -0.531 -3.863 1.00 0.00 C ATOM 1293 CE1 PHE A 85 1.008 2.076 -3.336 1.00 0.00 C ATOM 1294 CE2 PHE A 85 1.188 0.110 -4.683 1.00 0.00 C ATOM 1295 CZ PHE A 85 1.554 1.415 -4.419 1.00 0.00 C ATOM 0 H PHE A 85 -3.052 1.032 -0.366 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.874 0.067 -3.151 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.982 -0.415 -0.844 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -1.207 -1.651 -2.065 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.322 1.952 -1.673 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -0.005 -1.552 -4.075 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.291 3.097 -3.128 1.00 0.00 H new ATOM 0 HE2 PHE A 85 1.612 -0.410 -5.529 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.265 1.918 -5.058 1.00 0.00 H new ATOM 1305 N VAL A 86 -4.495 -1.686 -2.546 1.00 0.00 N ATOM 1306 CA VAL A 86 -5.468 -2.725 -2.231 1.00 0.00 C ATOM 1307 C VAL A 86 -5.073 -4.056 -2.863 1.00 0.00 C ATOM 1308 O VAL A 86 -4.583 -4.098 -3.990 1.00 0.00 O ATOM 1309 CB VAL A 86 -6.879 -2.339 -2.713 1.00 0.00 C ATOM 1310 CG1 VAL A 86 -7.851 -3.488 -2.495 1.00 0.00 C ATOM 1311 CG2 VAL A 86 -7.358 -1.082 -2.002 1.00 0.00 C ATOM 0 H VAL A 86 -4.506 -1.379 -3.519 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.480 -2.829 -1.146 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.835 -2.131 -3.782 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.842 -3.197 -2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.513 -4.361 -3.054 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -7.895 -3.731 -1.433 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.357 -0.823 -2.354 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.387 -1.261 -0.927 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.674 -0.261 -2.215 1.00 0.00 H new ATOM 1321 N ASN A 87 -5.292 -5.141 -2.127 1.00 0.00 N ATOM 1322 CA ASN A 87 -4.959 -6.475 -2.615 1.00 0.00 C ATOM 1323 C ASN A 87 -3.697 -6.441 -3.472 1.00 0.00 C ATOM 1324 O ASN A 87 -3.659 -7.010 -4.562 1.00 0.00 O ATOM 1325 CB ASN A 87 -6.123 -7.049 -3.425 1.00 0.00 C ATOM 1326 CG ASN A 87 -6.030 -8.554 -3.584 1.00 0.00 C ATOM 1327 OD1 ASN A 87 -4.943 -9.130 -3.520 1.00 0.00 O ATOM 1328 ND2 ASN A 87 -7.172 -9.199 -3.794 1.00 0.00 N ATOM 0 H ASN A 87 -5.698 -5.123 -1.192 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.774 -7.115 -1.752 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -7.063 -6.796 -2.935 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -6.141 -6.583 -4.410 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -7.172 -10.212 -3.910 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -8.049 -8.681 -3.840 1.00 0.00 H new ATOM 1335 N GLY A 88 -2.664 -5.771 -2.969 1.00 0.00 N ATOM 1336 CA GLY A 88 -1.415 -5.676 -3.701 1.00 0.00 C ATOM 1337 C GLY A 88 -1.573 -4.962 -5.029 1.00 0.00 C ATOM 1338 O GLY A 88 -0.975 -5.358 -6.030 1.00 0.00 O ATOM 0 H GLY A 88 -2.670 -5.293 -2.068 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.681 -5.147 -3.093 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -1.023 -6.678 -3.875 1.00 0.00 H new ATOM 1342 N THR A 89 -2.381 -3.907 -5.039 1.00 0.00 N ATOM 1343 CA THR A 89 -2.619 -3.138 -6.254 1.00 0.00 C ATOM 1344 C THR A 89 -2.391 -1.650 -6.017 1.00 0.00 C ATOM 1345 O THR A 89 -2.013 -1.237 -4.920 1.00 0.00 O ATOM 1346 CB THR A 89 -4.051 -3.349 -6.782 1.00 0.00 C ATOM 1347 OG1 THR A 89 -4.071 -3.227 -8.208 1.00 0.00 O ATOM 1348 CG2 THR A 89 -5.008 -2.338 -6.168 1.00 0.00 C ATOM 0 H THR A 89 -2.882 -3.565 -4.219 1.00 0.00 H new ATOM 0 HA THR A 89 -1.909 -3.497 -6.999 1.00 0.00 H new ATOM 0 HB THR A 89 -4.375 -4.351 -6.500 1.00 0.00 H new ATOM 0 HG1 THR A 89 -4.984 -3.364 -8.535 1.00 0.00 H new ATOM 0 HG21 THR A 89 -6.013 -2.506 -6.555 1.00 0.00 H new ATOM 0 HG22 THR A 89 -5.013 -2.453 -5.084 1.00 0.00 H new ATOM 0 HG23 THR A 89 -4.685 -1.329 -6.424 1.00 0.00 H new ATOM 1356 N PHE A 90 -2.623 -0.848 -7.050 1.00 0.00 N ATOM 1357 CA PHE A 90 -2.443 0.596 -6.954 1.00 0.00 C ATOM 1358 C PHE A 90 -3.649 1.334 -7.526 1.00 0.00 C ATOM 1359 O PHE A 90 -3.572 1.935 -8.598 1.00 0.00 O ATOM 1360 CB PHE A 90 -1.172 1.023 -7.692 1.00 0.00 C ATOM 1361 CG PHE A 90 -0.935 2.506 -7.669 1.00 0.00 C ATOM 1362 CD1 PHE A 90 -1.285 3.259 -6.560 1.00 0.00 C ATOM 1363 CD2 PHE A 90 -0.364 3.147 -8.756 1.00 0.00 C ATOM 1364 CE1 PHE A 90 -1.068 4.624 -6.535 1.00 0.00 C ATOM 1365 CE2 PHE A 90 -0.144 4.511 -8.737 1.00 0.00 C ATOM 1366 CZ PHE A 90 -0.497 5.251 -7.625 1.00 0.00 C ATOM 0 H PHE A 90 -2.936 -1.174 -7.964 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.347 0.856 -5.900 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.315 0.519 -7.245 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.233 0.689 -8.728 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.733 2.774 -5.705 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.087 2.574 -9.629 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.345 5.199 -5.664 1.00 0.00 H new ATOM 0 HE2 PHE A 90 0.304 4.998 -9.591 1.00 0.00 H new ATOM 0 HZ PHE A 90 -0.327 6.317 -7.608 1.00 0.00 H new ATOM 1376 N ILE A 91 -4.763 1.284 -6.803 1.00 0.00 N ATOM 1377 CA ILE A 91 -5.986 1.948 -7.237 1.00 0.00 C ATOM 1378 C ILE A 91 -5.758 3.443 -7.438 1.00 0.00 C ATOM 1379 O ILE A 91 -6.534 4.113 -8.118 1.00 0.00 O ATOM 1380 CB ILE A 91 -7.127 1.746 -6.223 1.00 0.00 C ATOM 1381 CG1 ILE A 91 -6.801 2.457 -4.908 1.00 0.00 C ATOM 1382 CG2 ILE A 91 -7.368 0.263 -5.985 1.00 0.00 C ATOM 1383 CD1 ILE A 91 -5.704 1.784 -4.113 1.00 0.00 C ATOM 0 H ILE A 91 -4.844 0.790 -5.914 1.00 0.00 H new ATOM 0 HA ILE A 91 -6.271 1.495 -8.187 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.039 2.180 -6.633 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -6.505 3.484 -5.123 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.703 2.506 -4.298 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -8.177 0.137 -5.266 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.640 -0.217 -6.925 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -6.460 -0.195 -5.593 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.526 2.342 -3.194 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -6.005 0.766 -3.867 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -4.789 1.758 -4.705 1.00 0.00 H new ATOM 1395 N GLY A 92 -4.686 3.958 -6.843 1.00 0.00 N ATOM 1396 CA GLY A 92 -4.374 5.369 -6.971 1.00 0.00 C ATOM 1397 C GLY A 92 -3.973 5.996 -5.650 1.00 0.00 C ATOM 1398 O GLY A 92 -3.507 5.306 -4.744 1.00 0.00 O ATOM 0 H GLY A 92 -4.029 3.423 -6.275 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.565 5.495 -7.690 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.241 5.895 -7.371 1.00 0.00 H new ATOM 1402 N GLY A 93 -4.153 7.309 -5.540 1.00 0.00 N ATOM 1403 CA GLY A 93 -3.800 8.006 -4.317 1.00 0.00 C ATOM 1404 C GLY A 93 -5.012 8.345 -3.472 1.00 0.00 C ATOM 1405 O GLY A 93 -6.070 7.733 -3.619 1.00 0.00 O ATOM 0 H GLY A 93 -4.537 7.902 -6.276 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.116 7.388 -3.735 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.267 8.923 -4.566 1.00 0.00 H new ATOM 1409 N ALA A 94 -4.858 9.321 -2.584 1.00 0.00 N ATOM 1410 CA ALA A 94 -5.949 9.740 -1.712 1.00 0.00 C ATOM 1411 C ALA A 94 -7.177 10.140 -2.523 1.00 0.00 C ATOM 1412 O ALA A 94 -8.187 9.435 -2.529 1.00 0.00 O ATOM 1413 CB ALA A 94 -5.502 10.892 -0.824 1.00 0.00 C ATOM 0 H ALA A 94 -3.988 9.837 -2.449 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.222 8.894 -1.081 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.326 11.195 -0.178 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.659 10.573 -0.211 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.200 11.735 -1.446 1.00 0.00 H new ATOM 1419 N THR A 95 -7.084 11.276 -3.207 1.00 0.00 N ATOM 1420 CA THR A 95 -8.188 11.771 -4.020 1.00 0.00 C ATOM 1421 C THR A 95 -8.892 10.629 -4.745 1.00 0.00 C ATOM 1422 O THR A 95 -10.038 10.299 -4.439 1.00 0.00 O ATOM 1423 CB THR A 95 -7.704 12.801 -5.057 1.00 0.00 C ATOM 1424 OG1 THR A 95 -6.557 13.497 -4.558 1.00 0.00 O ATOM 1425 CG2 THR A 95 -8.806 13.799 -5.383 1.00 0.00 C ATOM 0 H THR A 95 -6.255 11.871 -3.214 1.00 0.00 H new ATOM 0 HA THR A 95 -8.890 12.254 -3.340 1.00 0.00 H new ATOM 0 HB THR A 95 -7.436 12.267 -5.969 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.254 14.149 -5.224 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.441 14.517 -6.118 1.00 0.00 H new ATOM 0 HG22 THR A 95 -9.668 13.270 -5.790 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.100 14.326 -4.475 1.00 0.00 H new ATOM 1433 N ASP A 96 -8.199 10.029 -5.706 1.00 0.00 N ATOM 1434 CA ASP A 96 -8.757 8.922 -6.474 1.00 0.00 C ATOM 1435 C ASP A 96 -9.472 7.932 -5.560 1.00 0.00 C ATOM 1436 O ASP A 96 -10.678 7.716 -5.682 1.00 0.00 O ATOM 1437 CB ASP A 96 -7.653 8.207 -7.256 1.00 0.00 C ATOM 1438 CG ASP A 96 -8.161 7.595 -8.546 1.00 0.00 C ATOM 1439 OD1 ASP A 96 -9.318 7.124 -8.565 1.00 0.00 O ATOM 1440 OD2 ASP A 96 -7.402 7.587 -9.538 1.00 0.00 O ATOM 0 H ASP A 96 -7.250 10.290 -5.972 1.00 0.00 H new ATOM 0 HA ASP A 96 -9.483 9.330 -7.177 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -6.855 8.915 -7.482 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -7.218 7.425 -6.633 1.00 0.00 H new ATOM 1445 N THR A 97 -8.719 7.331 -4.643 1.00 0.00 N ATOM 1446 CA THR A 97 -9.280 6.362 -3.710 1.00 0.00 C ATOM 1447 C THR A 97 -10.638 6.820 -3.192 1.00 0.00 C ATOM 1448 O THR A 97 -11.582 6.033 -3.113 1.00 0.00 O ATOM 1449 CB THR A 97 -8.340 6.126 -2.512 1.00 0.00 C ATOM 1450 OG1 THR A 97 -7.088 5.600 -2.968 1.00 0.00 O ATOM 1451 CG2 THR A 97 -8.966 5.165 -1.513 1.00 0.00 C ATOM 0 H THR A 97 -7.720 7.499 -4.527 1.00 0.00 H new ATOM 0 HA THR A 97 -9.399 5.428 -4.259 1.00 0.00 H new ATOM 0 HB THR A 97 -8.173 7.082 -2.016 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.649 6.257 -3.548 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.284 5.014 -0.676 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.904 5.582 -1.146 1.00 0.00 H new ATOM 0 HG23 THR A 97 -9.160 4.209 -2.000 1.00 0.00 H new ATOM 1459 N HIS A 98 -10.732 8.099 -2.841 1.00 0.00 N ATOM 1460 CA HIS A 98 -11.977 8.662 -2.331 1.00 0.00 C ATOM 1461 C HIS A 98 -13.092 8.541 -3.366 1.00 0.00 C ATOM 1462 O HIS A 98 -14.175 8.037 -3.069 1.00 0.00 O ATOM 1463 CB HIS A 98 -11.779 10.129 -1.948 1.00 0.00 C ATOM 1464 CG HIS A 98 -12.984 10.750 -1.312 1.00 0.00 C ATOM 1465 ND1 HIS A 98 -14.048 10.013 -0.836 1.00 0.00 N ATOM 1466 CD2 HIS A 98 -13.289 12.047 -1.072 1.00 0.00 C ATOM 1467 CE1 HIS A 98 -14.956 10.830 -0.333 1.00 0.00 C ATOM 1468 NE2 HIS A 98 -14.520 12.070 -0.464 1.00 0.00 N ATOM 0 H HIS A 98 -9.961 8.764 -2.900 1.00 0.00 H new ATOM 0 HA HIS A 98 -12.265 8.098 -1.444 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -10.936 10.206 -1.262 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -11.516 10.697 -2.841 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -12.678 12.904 -1.314 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.895 10.534 0.110 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -15.017 12.908 -0.163 1.00 0.00 H new ATOM 1476 N ARG A 99 -12.819 9.006 -4.580 1.00 0.00 N ATOM 1477 CA ARG A 99 -13.800 8.951 -5.658 1.00 0.00 C ATOM 1478 C ARG A 99 -14.225 7.511 -5.933 1.00 0.00 C ATOM 1479 O ARG A 99 -15.403 7.233 -6.159 1.00 0.00 O ATOM 1480 CB ARG A 99 -13.226 9.576 -6.930 1.00 0.00 C ATOM 1481 CG ARG A 99 -14.279 9.899 -7.978 1.00 0.00 C ATOM 1482 CD ARG A 99 -13.668 10.008 -9.367 1.00 0.00 C ATOM 1483 NE ARG A 99 -14.418 10.920 -10.225 1.00 0.00 N ATOM 1484 CZ ARG A 99 -14.545 12.220 -9.983 1.00 0.00 C ATOM 1485 NH1 ARG A 99 -13.973 12.758 -8.915 1.00 0.00 N ATOM 1486 NH2 ARG A 99 -15.244 12.986 -10.812 1.00 0.00 N ATOM 0 H ARG A 99 -11.927 9.425 -4.842 1.00 0.00 H new ATOM 0 HA ARG A 99 -14.678 9.518 -5.347 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -12.694 10.491 -6.667 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.493 8.894 -7.361 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -15.045 9.124 -7.976 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -14.773 10.836 -7.722 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.638 10.354 -9.284 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.637 9.021 -9.828 1.00 0.00 H new ATOM 0 HE ARG A 99 -14.869 10.538 -11.056 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -13.434 12.173 -8.276 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -14.072 13.756 -8.732 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -15.684 12.576 -11.636 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.341 13.984 -10.625 1.00 0.00 H new ATOM 1500 N LEU A 100 -13.258 6.600 -5.912 1.00 0.00 N ATOM 1501 CA LEU A 100 -13.532 5.189 -6.160 1.00 0.00 C ATOM 1502 C LEU A 100 -14.677 4.694 -5.282 1.00 0.00 C ATOM 1503 O LEU A 100 -15.668 4.158 -5.780 1.00 0.00 O ATOM 1504 CB LEU A 100 -12.278 4.353 -5.900 1.00 0.00 C ATOM 1505 CG LEU A 100 -11.130 4.539 -6.894 1.00 0.00 C ATOM 1506 CD1 LEU A 100 -10.009 3.552 -6.605 1.00 0.00 C ATOM 1507 CD2 LEU A 100 -11.630 4.378 -8.322 1.00 0.00 C ATOM 0 H LEU A 100 -12.278 6.813 -5.726 1.00 0.00 H new ATOM 0 HA LEU A 100 -13.825 5.079 -7.204 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.909 4.588 -4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -12.562 3.301 -5.896 1.00 0.00 H new ATOM 0 HG LEU A 100 -10.736 5.549 -6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.201 3.699 -7.322 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.632 3.715 -5.595 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.389 2.534 -6.691 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -10.800 4.514 -9.016 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -12.051 3.381 -8.450 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -12.398 5.124 -8.525 1.00 0.00 H new ATOM 1519 N HIS A 101 -14.536 4.880 -3.973 1.00 0.00 N ATOM 1520 CA HIS A 101 -15.560 4.455 -3.026 1.00 0.00 C ATOM 1521 C HIS A 101 -16.924 5.021 -3.410 1.00 0.00 C ATOM 1522 O HIS A 101 -17.936 4.322 -3.357 1.00 0.00 O ATOM 1523 CB HIS A 101 -15.191 4.898 -1.610 1.00 0.00 C ATOM 1524 CG HIS A 101 -16.162 4.440 -0.566 1.00 0.00 C ATOM 1525 ND1 HIS A 101 -16.476 3.113 -0.360 1.00 0.00 N ATOM 1526 CD2 HIS A 101 -16.890 5.141 0.334 1.00 0.00 C ATOM 1527 CE1 HIS A 101 -17.356 3.018 0.621 1.00 0.00 C ATOM 1528 NE2 HIS A 101 -17.624 4.235 1.059 1.00 0.00 N ATOM 0 H HIS A 101 -13.723 5.322 -3.545 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.617 3.367 -3.055 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -14.200 4.515 -1.365 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.128 5.986 -1.583 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.893 6.214 0.459 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -17.783 2.101 1.000 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -18.271 4.464 1.813 1.00 0.00 H new ATOM 1536 N LYS A 102 -16.943 6.293 -3.795 1.00 0.00 N ATOM 1537 CA LYS A 102 -18.182 6.954 -4.188 1.00 0.00 C ATOM 1538 C LYS A 102 -18.874 6.190 -5.312 1.00 0.00 C ATOM 1539 O LYS A 102 -19.950 5.625 -5.119 1.00 0.00 O ATOM 1540 CB LYS A 102 -17.898 8.391 -4.634 1.00 0.00 C ATOM 1541 CG LYS A 102 -17.310 9.262 -3.538 1.00 0.00 C ATOM 1542 CD LYS A 102 -18.394 9.996 -2.767 1.00 0.00 C ATOM 1543 CE LYS A 102 -19.191 9.047 -1.886 1.00 0.00 C ATOM 1544 NZ LYS A 102 -19.979 9.777 -0.855 1.00 0.00 N ATOM 0 H LYS A 102 -16.115 6.886 -3.843 1.00 0.00 H new ATOM 0 HA LYS A 102 -18.845 6.972 -3.323 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -17.210 8.371 -5.479 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.825 8.843 -4.988 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -16.730 8.644 -2.853 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -16.621 9.984 -3.976 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -17.941 10.773 -2.151 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -19.065 10.495 -3.466 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -19.864 8.455 -2.506 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -18.512 8.349 -1.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -20.508 9.095 -0.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -19.335 10.322 -0.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -20.645 10.425 -1.322 1.00 0.00 H new ATOM 1558 N GLU A 103 -18.248 6.175 -6.485 1.00 0.00 N ATOM 1559 CA GLU A 103 -18.806 5.479 -7.639 1.00 0.00 C ATOM 1560 C GLU A 103 -19.058 4.009 -7.317 1.00 0.00 C ATOM 1561 O GLU A 103 -19.892 3.359 -7.946 1.00 0.00 O ATOM 1562 CB GLU A 103 -17.861 5.595 -8.837 1.00 0.00 C ATOM 1563 CG GLU A 103 -17.768 7.001 -9.405 1.00 0.00 C ATOM 1564 CD GLU A 103 -17.386 7.014 -10.872 1.00 0.00 C ATOM 1565 OE1 GLU A 103 -18.192 6.540 -11.700 1.00 0.00 O ATOM 1566 OE2 GLU A 103 -16.280 7.498 -11.193 1.00 0.00 O ATOM 0 H GLU A 103 -17.355 6.636 -6.661 1.00 0.00 H new ATOM 0 HA GLU A 103 -19.758 5.947 -7.889 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -16.866 5.267 -8.537 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -18.197 4.917 -9.621 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -18.727 7.504 -9.279 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.032 7.570 -8.837 1.00 0.00 H new ATOM 1573 N GLY A 104 -18.331 3.491 -6.332 1.00 0.00 N ATOM 1574 CA GLY A 104 -18.490 2.102 -5.943 1.00 0.00 C ATOM 1575 C GLY A 104 -17.513 1.185 -6.654 1.00 0.00 C ATOM 1576 O GLY A 104 -17.862 0.067 -7.032 1.00 0.00 O ATOM 0 H GLY A 104 -17.634 4.009 -5.796 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.350 2.011 -4.866 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -19.509 1.781 -6.161 1.00 0.00 H new ATOM 1580 N LYS A 105 -16.286 1.660 -6.838 1.00 0.00 N ATOM 1581 CA LYS A 105 -15.255 0.877 -7.509 1.00 0.00 C ATOM 1582 C LYS A 105 -14.184 0.427 -6.520 1.00 0.00 C ATOM 1583 O LYS A 105 -13.260 -0.303 -6.880 1.00 0.00 O ATOM 1584 CB LYS A 105 -14.615 1.695 -8.633 1.00 0.00 C ATOM 1585 CG LYS A 105 -15.593 2.101 -9.722 1.00 0.00 C ATOM 1586 CD LYS A 105 -15.013 3.185 -10.616 1.00 0.00 C ATOM 1587 CE LYS A 105 -16.003 3.610 -11.690 1.00 0.00 C ATOM 1588 NZ LYS A 105 -15.980 2.689 -12.860 1.00 0.00 N ATOM 0 H LYS A 105 -15.981 2.584 -6.532 1.00 0.00 H new ATOM 0 HA LYS A 105 -15.726 -0.009 -7.935 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -14.165 2.592 -8.207 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.808 1.114 -9.079 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -15.850 1.230 -10.325 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -16.517 2.458 -9.268 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -14.738 4.049 -10.011 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -14.099 2.821 -11.085 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -17.008 3.636 -11.268 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -15.769 4.622 -12.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -16.668 3.012 -13.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.028 2.683 -13.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -16.228 1.728 -12.550 1.00 0.00 H new ATOM 1602 N LEU A 106 -14.316 0.865 -5.273 1.00 0.00 N ATOM 1603 CA LEU A 106 -13.360 0.506 -4.231 1.00 0.00 C ATOM 1604 C LEU A 106 -13.901 -0.626 -3.363 1.00 0.00 C ATOM 1605 O LEU A 106 -13.147 -1.486 -2.906 1.00 0.00 O ATOM 1606 CB LEU A 106 -13.041 1.723 -3.362 1.00 0.00 C ATOM 1607 CG LEU A 106 -11.806 1.605 -2.468 1.00 0.00 C ATOM 1608 CD1 LEU A 106 -11.264 2.983 -2.122 1.00 0.00 C ATOM 1609 CD2 LEU A 106 -12.137 0.826 -1.203 1.00 0.00 C ATOM 0 H LEU A 106 -15.075 1.469 -4.959 1.00 0.00 H new ATOM 0 HA LEU A 106 -12.445 0.163 -4.714 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -12.911 2.586 -4.015 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -13.904 1.929 -2.729 1.00 0.00 H new ATOM 0 HG LEU A 106 -11.035 1.061 -3.014 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -10.385 2.879 -1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -10.989 3.506 -3.038 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.029 3.553 -1.595 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -11.247 0.751 -0.578 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.924 1.342 -0.653 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -12.477 -0.174 -1.470 1.00 0.00 H new ATOM 1621 N LEU A 107 -15.210 -0.619 -3.140 1.00 0.00 N ATOM 1622 CA LEU A 107 -15.853 -1.646 -2.328 1.00 0.00 C ATOM 1623 C LEU A 107 -15.679 -3.025 -2.956 1.00 0.00 C ATOM 1624 O LEU A 107 -15.376 -4.009 -2.280 1.00 0.00 O ATOM 1625 CB LEU A 107 -17.341 -1.334 -2.160 1.00 0.00 C ATOM 1626 CG LEU A 107 -18.000 -1.867 -0.887 1.00 0.00 C ATOM 1627 CD1 LEU A 107 -18.380 -3.330 -1.055 1.00 0.00 C ATOM 1628 CD2 LEU A 107 -17.073 -1.688 0.307 1.00 0.00 C ATOM 0 H LEU A 107 -15.847 0.086 -3.510 1.00 0.00 H new ATOM 0 HA LEU A 107 -15.376 -1.650 -1.348 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -17.470 -0.252 -2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.876 -1.739 -3.019 1.00 0.00 H new ATOM 0 HG LEU A 107 -18.910 -1.296 -0.704 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -18.847 -3.692 -0.139 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -19.080 -3.431 -1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -17.485 -3.917 -1.262 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -17.557 -2.072 1.205 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -16.146 -2.234 0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -16.851 -0.629 0.440 1.00 0.00 H new ATOM 1640 N PRO A 108 -15.873 -3.101 -4.282 1.00 0.00 N ATOM 1641 CA PRO A 108 -15.740 -4.354 -5.031 1.00 0.00 C ATOM 1642 C PRO A 108 -14.455 -5.101 -4.688 1.00 0.00 C ATOM 1643 O PRO A 108 -14.383 -6.324 -4.813 1.00 0.00 O ATOM 1644 CB PRO A 108 -15.718 -3.894 -6.490 1.00 0.00 C ATOM 1645 CG PRO A 108 -16.457 -2.600 -6.491 1.00 0.00 C ATOM 1646 CD PRO A 108 -16.236 -1.969 -5.151 1.00 0.00 C ATOM 0 HA PRO A 108 -16.544 -5.053 -4.802 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -14.697 -3.767 -6.850 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -16.197 -4.624 -7.142 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -16.095 -1.950 -7.288 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.520 -2.763 -6.670 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.443 -1.222 -5.187 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -17.133 -1.463 -4.795 1.00 0.00 H new ATOM 1654 N LEU A 109 -13.442 -4.358 -4.256 1.00 0.00 N ATOM 1655 CA LEU A 109 -12.159 -4.950 -3.894 1.00 0.00 C ATOM 1656 C LEU A 109 -12.083 -5.211 -2.393 1.00 0.00 C ATOM 1657 O LEU A 109 -11.621 -6.266 -1.958 1.00 0.00 O ATOM 1658 CB LEU A 109 -11.013 -4.032 -4.322 1.00 0.00 C ATOM 1659 CG LEU A 109 -11.177 -3.338 -5.674 1.00 0.00 C ATOM 1660 CD1 LEU A 109 -10.406 -2.027 -5.699 1.00 0.00 C ATOM 1661 CD2 LEU A 109 -10.719 -4.251 -6.802 1.00 0.00 C ATOM 0 H LEU A 109 -13.484 -3.345 -4.148 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.067 -5.903 -4.415 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.882 -3.267 -3.557 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.094 -4.618 -4.346 1.00 0.00 H new ATOM 0 HG LEU A 109 -12.234 -3.116 -5.820 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.535 -1.548 -6.669 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -10.782 -1.369 -4.916 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.347 -2.224 -5.529 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -10.843 -3.740 -7.757 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.669 -4.505 -6.660 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.317 -5.162 -6.798 1.00 0.00 H new ATOM 1673 N VAL A 110 -12.543 -4.244 -1.605 1.00 0.00 N ATOM 1674 CA VAL A 110 -12.530 -4.371 -0.153 1.00 0.00 C ATOM 1675 C VAL A 110 -13.151 -5.691 0.289 1.00 0.00 C ATOM 1676 O VAL A 110 -12.687 -6.321 1.240 1.00 0.00 O ATOM 1677 CB VAL A 110 -13.288 -3.210 0.518 1.00 0.00 C ATOM 1678 CG1 VAL A 110 -13.520 -3.505 1.992 1.00 0.00 C ATOM 1679 CG2 VAL A 110 -12.528 -1.905 0.340 1.00 0.00 C ATOM 0 H VAL A 110 -12.929 -3.364 -1.948 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.486 -4.342 0.158 1.00 0.00 H new ATOM 0 HB VAL A 110 -14.260 -3.106 0.036 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -14.057 -2.674 2.449 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -14.109 -4.417 2.092 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -12.560 -3.636 2.492 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -13.078 -1.095 0.820 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.541 -1.994 0.795 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -12.419 -1.689 -0.723 1.00 0.00 H new ATOM 1689 N HIS A 111 -14.204 -6.107 -0.408 1.00 0.00 N ATOM 1690 CA HIS A 111 -14.889 -7.354 -0.089 1.00 0.00 C ATOM 1691 C HIS A 111 -14.022 -8.557 -0.448 1.00 0.00 C ATOM 1692 O HIS A 111 -14.216 -9.653 0.078 1.00 0.00 O ATOM 1693 CB HIS A 111 -16.223 -7.433 -0.831 1.00 0.00 C ATOM 1694 CG HIS A 111 -17.325 -6.668 -0.164 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -18.550 -6.444 -0.755 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -17.382 -6.075 1.051 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -19.312 -5.745 0.067 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -18.627 -5.509 1.171 1.00 0.00 N ATOM 0 H HIS A 111 -14.601 -5.598 -1.198 1.00 0.00 H new ATOM 0 HA HIS A 111 -15.078 -7.371 0.984 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -16.089 -7.053 -1.844 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -16.519 -8.478 -0.919 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -16.594 -6.051 1.789 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -20.323 -5.422 -0.130 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -18.967 -4.991 1.981 1.00 0.00 H new ATOM 1706 N GLN A 112 -13.067 -8.345 -1.348 1.00 0.00 N ATOM 1707 CA GLN A 112 -12.172 -9.413 -1.778 1.00 0.00 C ATOM 1708 C GLN A 112 -11.112 -9.694 -0.719 1.00 0.00 C ATOM 1709 O GLN A 112 -10.415 -10.708 -0.777 1.00 0.00 O ATOM 1710 CB GLN A 112 -11.502 -9.043 -3.103 1.00 0.00 C ATOM 1711 CG GLN A 112 -12.487 -8.677 -4.201 1.00 0.00 C ATOM 1712 CD GLN A 112 -11.803 -8.362 -5.517 1.00 0.00 C ATOM 1713 OE1 GLN A 112 -10.817 -7.625 -5.556 1.00 0.00 O ATOM 1714 NE2 GLN A 112 -12.324 -8.919 -6.604 1.00 0.00 N ATOM 0 H GLN A 112 -12.893 -7.444 -1.793 1.00 0.00 H new ATOM 0 HA GLN A 112 -12.766 -10.316 -1.919 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -10.827 -8.203 -2.937 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -10.892 -9.881 -3.439 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.185 -9.501 -4.347 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -13.074 -7.814 -3.885 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -13.142 -9.523 -6.525 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -11.906 -8.743 -7.518 1.00 0.00 H new ATOM 1723 N CYS A 113 -10.994 -8.790 0.248 1.00 0.00 N ATOM 1724 CA CYS A 113 -10.018 -8.940 1.320 1.00 0.00 C ATOM 1725 C CYS A 113 -10.455 -10.018 2.307 1.00 0.00 C ATOM 1726 O CYS A 113 -9.716 -10.966 2.575 1.00 0.00 O ATOM 1727 CB CYS A 113 -9.826 -7.610 2.052 1.00 0.00 C ATOM 1728 SG CYS A 113 -9.216 -7.783 3.760 1.00 0.00 S ATOM 0 H CYS A 113 -11.563 -7.946 0.311 1.00 0.00 H new ATOM 0 HA CYS A 113 -9.070 -9.243 0.875 1.00 0.00 H new ATOM 0 HB2 CYS A 113 -9.125 -6.995 1.488 1.00 0.00 H new ATOM 0 HB3 CYS A 113 -10.776 -7.076 2.069 1.00 0.00 H new ATOM 1733 N TYR A 114 -11.660 -9.866 2.845 1.00 0.00 N ATOM 1734 CA TYR A 114 -12.196 -10.825 3.804 1.00 0.00 C ATOM 1735 C TYR A 114 -12.449 -12.176 3.140 1.00 0.00 C ATOM 1736 O TYR A 114 -12.352 -13.224 3.780 1.00 0.00 O ATOM 1737 CB TYR A 114 -13.492 -10.295 4.418 1.00 0.00 C ATOM 1738 CG TYR A 114 -14.690 -10.417 3.503 1.00 0.00 C ATOM 1739 CD1 TYR A 114 -15.240 -11.658 3.208 1.00 0.00 C ATOM 1740 CD2 TYR A 114 -15.272 -9.290 2.935 1.00 0.00 C ATOM 1741 CE1 TYR A 114 -16.333 -11.774 2.372 1.00 0.00 C ATOM 1742 CE2 TYR A 114 -16.367 -9.397 2.099 1.00 0.00 C ATOM 1743 CZ TYR A 114 -16.894 -10.640 1.820 1.00 0.00 C ATOM 1744 OH TYR A 114 -17.984 -10.752 0.988 1.00 0.00 O ATOM 0 H TYR A 114 -12.284 -9.088 2.633 1.00 0.00 H new ATOM 0 HA TYR A 114 -11.458 -10.961 4.594 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -13.694 -10.837 5.342 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -13.355 -9.247 4.686 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -14.805 -12.547 3.640 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -14.862 -8.315 3.151 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -16.747 -12.747 2.151 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -16.808 -8.511 1.666 1.00 0.00 H new ATOM 0 HH TYR A 114 -18.257 -9.861 0.685 1.00 0.00 H new ATOM 1754 N LEU A 115 -12.775 -12.143 1.853 1.00 0.00 N ATOM 1755 CA LEU A 115 -13.043 -13.363 1.100 1.00 0.00 C ATOM 1756 C LEU A 115 -12.081 -14.475 1.505 1.00 0.00 C ATOM 1757 O LEU A 115 -10.974 -14.212 1.976 1.00 0.00 O ATOM 1758 CB LEU A 115 -12.927 -13.095 -0.402 1.00 0.00 C ATOM 1759 CG LEU A 115 -14.212 -12.655 -1.106 1.00 0.00 C ATOM 1760 CD1 LEU A 115 -13.994 -12.570 -2.609 1.00 0.00 C ATOM 1761 CD2 LEU A 115 -15.351 -13.611 -0.784 1.00 0.00 C ATOM 0 H LEU A 115 -12.860 -11.285 1.309 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.059 -13.685 1.328 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -12.170 -12.326 -0.556 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -12.563 -14.002 -0.886 1.00 0.00 H new ATOM 0 HG LEU A 115 -14.482 -11.664 -0.742 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -14.918 -12.256 -3.094 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -13.208 -11.846 -2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -13.699 -13.548 -2.990 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -16.257 -13.282 -1.293 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.090 -14.615 -1.120 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -15.524 -13.622 0.292 1.00 0.00 H new ATOM 1773 N LYS A 116 -12.509 -15.719 1.317 1.00 0.00 N ATOM 1774 CA LYS A 116 -11.685 -16.872 1.659 1.00 0.00 C ATOM 1775 C LYS A 116 -10.212 -16.590 1.381 1.00 0.00 C ATOM 1776 O LYS A 116 -9.361 -16.764 2.253 1.00 0.00 O ATOM 1777 CB LYS A 116 -12.138 -18.101 0.867 1.00 0.00 C ATOM 1778 CG LYS A 116 -12.077 -17.911 -0.639 1.00 0.00 C ATOM 1779 CD LYS A 116 -12.890 -18.968 -1.368 1.00 0.00 C ATOM 1780 CE LYS A 116 -14.363 -18.596 -1.425 1.00 0.00 C ATOM 1781 NZ LYS A 116 -15.091 -19.371 -2.468 1.00 0.00 N ATOM 0 H LYS A 116 -13.423 -15.954 0.929 1.00 0.00 H new ATOM 0 HA LYS A 116 -11.804 -17.069 2.724 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -11.514 -18.951 1.143 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -13.160 -18.350 1.152 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -12.452 -16.920 -0.897 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -11.040 -17.956 -0.971 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -12.505 -19.091 -2.380 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -12.775 -19.928 -0.865 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -14.821 -18.777 -0.453 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -14.461 -17.530 -1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -16.092 -19.088 -2.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -14.670 -19.179 -3.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -15.020 -20.387 -2.258 1.00 0.00 H new ATOM 1795 N LYS A 117 -9.918 -16.152 0.162 1.00 0.00 N ATOM 1796 CA LYS A 117 -8.548 -15.842 -0.231 1.00 0.00 C ATOM 1797 C LYS A 117 -7.574 -16.871 0.335 1.00 0.00 C ATOM 1798 O LYS A 117 -6.558 -16.515 0.931 1.00 0.00 O ATOM 1799 CB LYS A 117 -8.162 -14.441 0.249 1.00 0.00 C ATOM 1800 CG LYS A 117 -8.661 -13.329 -0.658 1.00 0.00 C ATOM 1801 CD LYS A 117 -7.733 -12.126 -0.626 1.00 0.00 C ATOM 1802 CE LYS A 117 -6.524 -12.331 -1.526 1.00 0.00 C ATOM 1803 NZ LYS A 117 -5.472 -13.150 -0.863 1.00 0.00 N ATOM 0 H LYS A 117 -10.611 -16.003 -0.572 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.492 -15.874 -1.319 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -8.560 -14.287 1.252 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -7.076 -14.378 0.324 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.742 -13.700 -1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -9.661 -13.027 -0.348 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.277 -11.237 -0.943 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -7.401 -11.949 0.397 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.837 -12.820 -2.449 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -6.109 -11.362 -1.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -4.579 -12.617 -0.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -5.766 -13.372 0.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -5.334 -14.034 -1.394 1.00 0.00 H new ATOM 1817 N SER A 118 -7.892 -18.148 0.144 1.00 0.00 N ATOM 1818 CA SER A 118 -7.046 -19.228 0.637 1.00 0.00 C ATOM 1819 C SER A 118 -5.570 -18.852 0.537 1.00 0.00 C ATOM 1820 O SER A 118 -5.082 -18.487 -0.533 1.00 0.00 O ATOM 1821 CB SER A 118 -7.311 -20.512 -0.150 1.00 0.00 C ATOM 1822 OG SER A 118 -6.853 -21.650 0.560 1.00 0.00 O ATOM 0 H SER A 118 -8.729 -18.459 -0.349 1.00 0.00 H new ATOM 0 HA SER A 118 -7.290 -19.396 1.686 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.379 -20.608 -0.347 1.00 0.00 H new ATOM 0 HB3 SER A 118 -6.812 -20.458 -1.118 1.00 0.00 H new ATOM 0 HG SER A 118 -7.036 -22.458 0.036 1.00 0.00 H new ATOM 1828 N LYS A 119 -4.865 -18.944 1.659 1.00 0.00 N ATOM 1829 CA LYS A 119 -3.445 -18.615 1.700 1.00 0.00 C ATOM 1830 C LYS A 119 -2.771 -19.264 2.905 1.00 0.00 C ATOM 1831 O LYS A 119 -3.425 -19.925 3.712 1.00 0.00 O ATOM 1832 CB LYS A 119 -3.253 -17.098 1.750 1.00 0.00 C ATOM 1833 CG LYS A 119 -3.238 -16.441 0.381 1.00 0.00 C ATOM 1834 CD LYS A 119 -2.402 -15.172 0.380 1.00 0.00 C ATOM 1835 CE LYS A 119 -1.798 -14.903 -0.989 1.00 0.00 C ATOM 1836 NZ LYS A 119 -2.745 -14.176 -1.880 1.00 0.00 N ATOM 0 H LYS A 119 -5.254 -19.244 2.553 1.00 0.00 H new ATOM 0 HA LYS A 119 -2.981 -19.004 0.793 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -4.053 -16.659 2.346 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -2.316 -16.876 2.261 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.840 -17.140 -0.355 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.258 -16.206 0.078 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -3.022 -14.326 0.678 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -1.606 -15.259 1.119 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -0.885 -14.318 -0.875 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -1.515 -15.848 -1.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -2.309 -14.042 -2.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -3.620 -14.729 -1.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -2.969 -13.249 -1.466 1.00 0.00 H new ATOM 1850 N ARG A 120 -1.462 -19.068 3.021 1.00 0.00 N ATOM 1851 CA ARG A 120 -0.700 -19.634 4.128 1.00 0.00 C ATOM 1852 C ARG A 120 -1.128 -19.015 5.455 1.00 0.00 C ATOM 1853 O ARG A 120 -1.509 -17.845 5.513 1.00 0.00 O ATOM 1854 CB ARG A 120 0.798 -19.414 3.909 1.00 0.00 C ATOM 1855 CG ARG A 120 1.392 -20.298 2.825 1.00 0.00 C ATOM 1856 CD ARG A 120 2.865 -20.576 3.078 1.00 0.00 C ATOM 1857 NE ARG A 120 3.583 -20.887 1.845 1.00 0.00 N ATOM 1858 CZ ARG A 120 3.856 -19.988 0.906 1.00 0.00 C ATOM 1859 NH1 ARG A 120 3.473 -18.728 1.060 1.00 0.00 N ATOM 1860 NH2 ARG A 120 4.513 -20.348 -0.189 1.00 0.00 N ATOM 0 H ARG A 120 -0.907 -18.522 2.362 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.901 -20.705 4.165 1.00 0.00 H new ATOM 0 HB2 ARG A 120 0.969 -18.370 3.648 1.00 0.00 H new ATOM 0 HB3 ARG A 120 1.324 -19.599 4.845 1.00 0.00 H new ATOM 0 HG2 ARG A 120 0.845 -21.240 2.782 1.00 0.00 H new ATOM 0 HG3 ARG A 120 1.273 -19.816 1.855 1.00 0.00 H new ATOM 0 HD2 ARG A 120 3.321 -19.708 3.554 1.00 0.00 H new ATOM 0 HD3 ARG A 120 2.962 -21.409 3.774 1.00 0.00 H new ATOM 0 HE ARG A 120 3.892 -21.848 1.697 1.00 0.00 H new ATOM 0 HH11 ARG A 120 2.968 -18.448 1.901 1.00 0.00 H new ATOM 0 HH12 ARG A 120 3.684 -18.039 0.338 1.00 0.00 H new ATOM 0 HH21 ARG A 120 4.809 -21.316 -0.311 1.00 0.00 H new ATOM 0 HH22 ARG A 120 4.722 -19.656 -0.909 1.00 0.00 H new ATOM 1874 N LYS A 121 -1.063 -19.807 6.520 1.00 0.00 N ATOM 1875 CA LYS A 121 -1.443 -19.338 7.847 1.00 0.00 C ATOM 1876 C LYS A 121 -0.212 -19.134 8.725 1.00 0.00 C ATOM 1877 O LYS A 121 0.281 -20.075 9.345 1.00 0.00 O ATOM 1878 CB LYS A 121 -2.395 -20.336 8.510 1.00 0.00 C ATOM 1879 CG LYS A 121 -3.857 -20.095 8.177 1.00 0.00 C ATOM 1880 CD LYS A 121 -4.267 -20.822 6.907 1.00 0.00 C ATOM 1881 CE LYS A 121 -5.680 -20.452 6.484 1.00 0.00 C ATOM 1882 NZ LYS A 121 -6.704 -21.235 7.229 1.00 0.00 N ATOM 0 H LYS A 121 -0.750 -20.777 6.490 1.00 0.00 H new ATOM 0 HA LYS A 121 -1.951 -18.380 7.735 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -2.122 -21.345 8.202 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.264 -20.287 9.591 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -4.480 -20.430 9.006 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -4.033 -19.026 8.058 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -3.570 -20.577 6.105 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.204 -21.898 7.066 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -5.843 -19.388 6.653 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -5.796 -20.626 5.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -7.654 -20.954 6.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -6.565 -22.250 7.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -6.610 -21.049 8.248 1.00 0.00 H new ATOM 1896 N GLU A 122 0.277 -17.899 8.772 1.00 0.00 N ATOM 1897 CA GLU A 122 1.450 -17.572 9.574 1.00 0.00 C ATOM 1898 C GLU A 122 1.042 -16.949 10.906 1.00 0.00 C ATOM 1899 O GLU A 122 1.814 -16.215 11.523 1.00 0.00 O ATOM 1900 CB GLU A 122 2.368 -16.616 8.811 1.00 0.00 C ATOM 1901 CG GLU A 122 1.753 -15.248 8.565 1.00 0.00 C ATOM 1902 CD GLU A 122 0.905 -15.207 7.309 1.00 0.00 C ATOM 1903 OE1 GLU A 122 1.212 -15.959 6.360 1.00 0.00 O ATOM 1904 OE2 GLU A 122 -0.067 -14.423 7.275 1.00 0.00 O ATOM 0 H GLU A 122 -0.121 -17.109 8.264 1.00 0.00 H new ATOM 0 HA GLU A 122 1.989 -18.498 9.775 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.296 -16.493 9.370 1.00 0.00 H new ATOM 0 HB3 GLU A 122 2.630 -17.065 7.853 1.00 0.00 H new ATOM 0 HG2 GLU A 122 1.140 -14.970 9.422 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.547 -14.505 8.487 1.00 0.00 H new ATOM 1911 N PHE A 123 -0.178 -17.245 11.342 1.00 0.00 N ATOM 1912 CA PHE A 123 -0.690 -16.713 12.599 1.00 0.00 C ATOM 1913 C PHE A 123 -0.294 -17.607 13.770 1.00 0.00 C ATOM 1914 O PHE A 123 0.234 -18.702 13.577 1.00 0.00 O ATOM 1915 CB PHE A 123 -2.213 -16.580 12.538 1.00 0.00 C ATOM 1916 CG PHE A 123 -2.692 -15.665 11.447 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -2.463 -14.300 11.520 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -3.369 -16.169 10.349 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -2.903 -13.456 10.517 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -3.811 -15.330 9.343 1.00 0.00 C ATOM 1921 CZ PHE A 123 -3.576 -13.972 9.427 1.00 0.00 C ATOM 0 H PHE A 123 -0.830 -17.850 10.843 1.00 0.00 H new ATOM 0 HA PHE A 123 -0.251 -15.727 12.752 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -2.650 -17.568 12.391 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -2.576 -16.210 13.497 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -1.935 -13.891 12.369 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -3.554 -17.231 10.278 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -2.720 -12.394 10.586 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.339 -15.736 8.493 1.00 0.00 H new ATOM 0 HZ PHE A 123 -3.918 -13.314 8.642 1.00 0.00 H new ATOM 1931 N GLN A 124 -0.551 -17.131 14.984 1.00 0.00 N ATOM 1932 CA GLN A 124 -0.220 -17.887 16.187 1.00 0.00 C ATOM 1933 C GLN A 124 -0.947 -17.321 17.403 1.00 0.00 C ATOM 1934 O GLN A 124 -1.550 -16.250 17.335 1.00 0.00 O ATOM 1935 CB GLN A 124 1.290 -17.868 16.426 1.00 0.00 C ATOM 1936 CG GLN A 124 1.846 -16.479 16.699 1.00 0.00 C ATOM 1937 CD GLN A 124 3.346 -16.484 16.920 1.00 0.00 C ATOM 1938 OE1 GLN A 124 3.822 -16.751 18.024 1.00 0.00 O ATOM 1939 NE2 GLN A 124 4.100 -16.188 15.868 1.00 0.00 N ATOM 0 H GLN A 124 -0.987 -16.226 15.161 1.00 0.00 H new ATOM 0 HA GLN A 124 -0.545 -18.917 16.040 1.00 0.00 H new ATOM 0 HB2 GLN A 124 1.524 -18.516 17.270 1.00 0.00 H new ATOM 0 HB3 GLN A 124 1.793 -18.287 15.554 1.00 0.00 H new ATOM 0 HG2 GLN A 124 1.608 -15.825 15.860 1.00 0.00 H new ATOM 0 HG3 GLN A 124 1.354 -16.061 17.578 1.00 0.00 H new ATOM 0 HE21 GLN A 124 3.663 -15.973 14.972 1.00 0.00 H new ATOM 0 HE22 GLN A 124 5.116 -16.176 15.956 1.00 0.00 H new ATOM 1948 N SER A 125 -0.885 -18.047 18.514 1.00 0.00 N ATOM 1949 CA SER A 125 -1.541 -17.620 19.744 1.00 0.00 C ATOM 1950 C SER A 125 -0.753 -16.501 20.419 1.00 0.00 C ATOM 1951 O SER A 125 0.477 -16.490 20.395 1.00 0.00 O ATOM 1952 CB SER A 125 -1.693 -18.802 20.703 1.00 0.00 C ATOM 1953 OG SER A 125 -2.672 -18.533 21.692 1.00 0.00 O ATOM 0 H SER A 125 -0.387 -18.934 18.588 1.00 0.00 H new ATOM 0 HA SER A 125 -2.530 -17.241 19.487 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.972 -19.695 20.144 1.00 0.00 H new ATOM 0 HB3 SER A 125 -0.736 -19.012 21.181 1.00 0.00 H new ATOM 0 HG SER A 125 -2.752 -19.304 22.292 1.00 0.00 H new ATOM 1959 N GLY A 126 -1.472 -15.559 21.022 1.00 0.00 N ATOM 1960 CA GLY A 126 -0.825 -14.448 21.695 1.00 0.00 C ATOM 1961 C GLY A 126 -1.772 -13.291 21.945 1.00 0.00 C ATOM 1962 O GLY A 126 -2.395 -12.761 21.025 1.00 0.00 O ATOM 0 H GLY A 126 -2.491 -15.546 21.056 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.417 -14.791 22.646 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.015 -14.102 21.093 1.00 0.00 H new ATOM 1966 N PRO A 127 -1.890 -12.882 23.217 1.00 0.00 N ATOM 1967 CA PRO A 127 -2.767 -11.777 23.615 1.00 0.00 C ATOM 1968 C PRO A 127 -2.255 -10.426 23.125 1.00 0.00 C ATOM 1969 O PRO A 127 -2.900 -9.397 23.327 1.00 0.00 O ATOM 1970 CB PRO A 127 -2.741 -11.836 25.144 1.00 0.00 C ATOM 1971 CG PRO A 127 -1.444 -12.490 25.476 1.00 0.00 C ATOM 1972 CD PRO A 127 -1.177 -13.467 24.365 1.00 0.00 C ATOM 0 HA PRO A 127 -3.765 -11.875 23.188 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -2.805 -10.839 25.580 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -3.584 -12.408 25.532 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -0.643 -11.754 25.549 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -1.498 -12.999 26.438 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -0.110 -13.568 24.166 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -1.552 -14.462 24.606 1.00 0.00 H new ATOM 1980 N SER A 128 -1.092 -10.437 22.481 1.00 0.00 N ATOM 1981 CA SER A 128 -0.492 -9.212 21.966 1.00 0.00 C ATOM 1982 C SER A 128 -1.564 -8.260 21.444 1.00 0.00 C ATOM 1983 O SER A 128 -2.293 -8.582 20.506 1.00 0.00 O ATOM 1984 CB SER A 128 0.504 -9.537 20.852 1.00 0.00 C ATOM 1985 OG SER A 128 1.543 -8.574 20.800 1.00 0.00 O ATOM 0 H SER A 128 -0.547 -11.281 22.304 1.00 0.00 H new ATOM 0 HA SER A 128 0.036 -8.723 22.784 1.00 0.00 H new ATOM 0 HB2 SER A 128 0.929 -10.527 21.017 1.00 0.00 H new ATOM 0 HB3 SER A 128 -0.015 -9.569 19.894 1.00 0.00 H new ATOM 0 HG SER A 128 2.168 -8.805 20.081 1.00 0.00 H new ATOM 1991 N SER A 129 -1.653 -7.085 22.059 1.00 0.00 N ATOM 1992 CA SER A 129 -2.638 -6.087 21.660 1.00 0.00 C ATOM 1993 C SER A 129 -1.980 -4.961 20.868 1.00 0.00 C ATOM 1994 O SER A 129 -2.559 -4.433 19.920 1.00 0.00 O ATOM 1995 CB SER A 129 -3.343 -5.514 22.892 1.00 0.00 C ATOM 1996 OG SER A 129 -2.405 -5.096 23.868 1.00 0.00 O ATOM 0 H SER A 129 -1.055 -6.801 22.835 1.00 0.00 H new ATOM 0 HA SER A 129 -3.375 -6.575 21.022 1.00 0.00 H new ATOM 0 HB2 SER A 129 -3.967 -4.670 22.598 1.00 0.00 H new ATOM 0 HB3 SER A 129 -4.006 -6.267 23.319 1.00 0.00 H new ATOM 0 HG SER A 129 -2.880 -4.732 24.644 1.00 0.00 H new ATOM 2002 N GLY A 130 -0.764 -4.598 21.266 1.00 0.00 N ATOM 2003 CA GLY A 130 -0.046 -3.538 20.584 1.00 0.00 C ATOM 2004 C GLY A 130 -0.726 -2.191 20.729 1.00 0.00 C ATOM 2005 O GLY A 130 -0.161 -1.261 21.305 1.00 0.00 O ATOM 0 H GLY A 130 -0.264 -5.020 22.049 1.00 0.00 H new ATOM 0 HA2 GLY A 130 0.967 -3.475 20.982 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.042 -3.785 19.526 1.00 0.00 H new TER 2009 GLY A 130