USER MOD reduce.3.24.130724 H: found=0, std=0, add=1241, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1240 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 135 MET CE :methyl -165:sc=-0.00364 (180deg=-0.116) USER MOD Set 1.2: A 142 HIS : no HD1:sc= -0.816 X(o=-0.82,f=-1.1) USER MOD Set 2.1: A 103 GLN : amide:sc= -5.11! C(o=-5.1!,f=-6!) USER MOD Set 2.2: A 107 LYS NZ :NH3+ 166:sc= -0.0309 (180deg=-0.269) USER MOD Set 3.1: A 97 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 106 TYR OH : rot 76:sc= 0.478 USER MOD Set 4.1: A 33 GLN : amide:sc=-0.00418 X(o=-0.0042,f=0) USER MOD Set 4.2: A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 10 SER OG : rot 140:sc= 0.00124 USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.636 K(o=-0.64,f=-1.9!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 MET CE :methyl -126:sc= -1.35 (180deg=-6.32!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= -0.843 USER MOD Single : A 45 LYS NZ :NH3+ 138:sc= -0.0894 (180deg=-2.5!) USER MOD Single : A 53 THR OG1 : rot 99:sc= 1.23 USER MOD Single : A 57 THR OG1 : rot 73:sc= 0.0493 USER MOD Single : A 61 SER OG : rot -66:sc= 0.656 USER MOD Single : A 68 SER OG : rot -110:sc= -1.95 USER MOD Single : A 69 THR OG1 : rot -64:sc= 0.387 USER MOD Single : A 70 HIS : no HD1:sc= -0.975 X(o=-0.98,f=-1.4) USER MOD Single : A 75 MET CE :methyl 158:sc= -0.0746 (180deg=-0.485) USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -1.75 K(o=-1.8,f=-5.3!) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.193 K(o=-0.19,f=-2!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 MET CE :methyl 141:sc= -2.61 (180deg=-7.58!) USER MOD Single : A 92 LYS NZ :NH3+ -178:sc= 0.0163 (180deg=0.0159) USER MOD Single : A 95 GLN : amide:sc= -0.251 K(o=-0.25,f=-1.9!) USER MOD Single : A 96 GLN : amide:sc= -0.101 X(o=-0.1,f=-0.0082) USER MOD Single : A 99 MET CE :methyl 177:sc= -2.12 (180deg=-2.16) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= -2.71! USER MOD Single : A 104 GLN : amide:sc= 0.552 K(o=0.55,f=-4.3!) USER MOD Single : A 109 GLN : amide:sc= -2.5 K(o=-2.5,f=-4.2!) USER MOD Single : A 110 MET CE :methyl -138:sc= -1.46 (180deg=-2.71!) USER MOD Single : A 112 THR OG1 : rot -160:sc= -0.127 USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -2.68! X(o=-2.7!,f=-2.4) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN :FLIP amide:sc= 0.693 F(o=-3.3e-05,f=0.69) USER MOD Single : A 139 SER OG : rot 60:sc= 0.253 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot 180:sc= 0.0463 USER MOD Single : A 178 MET CE :methyl 166:sc=-0.00932 (180deg=-0.0523) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot -53:sc= 1.04 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 4 1.569 -3.603 -12.864 1.00 10.11 N ATOM 2 CA MET A 4 2.842 -3.389 -13.542 1.00 24.32 C ATOM 3 C MET A 4 3.359 -1.975 -13.296 1.00 32.31 C ATOM 4 O MET A 4 4.506 -1.785 -12.892 1.00 54.11 O ATOM 5 CB MET A 4 2.692 -3.636 -15.044 1.00 43.13 C ATOM 6 CG MET A 4 2.929 -5.082 -15.449 1.00 52.34 C ATOM 7 SD MET A 4 1.478 -5.837 -16.208 1.00 52.55 S ATOM 8 CE MET A 4 1.499 -7.456 -15.443 1.00 13.54 C ATOM 0 HA MET A 4 3.565 -4.096 -13.135 1.00 24.32 H new ATOM 0 HB2 MET A 4 1.690 -3.340 -15.354 1.00 43.13 H new ATOM 0 HB3 MET A 4 3.394 -2.997 -15.581 1.00 43.13 H new ATOM 0 HG2 MET A 4 3.765 -5.127 -16.147 1.00 52.34 H new ATOM 0 HG3 MET A 4 3.216 -5.659 -14.570 1.00 52.34 H new ATOM 0 HE1 MET A 4 0.659 -8.044 -15.813 1.00 13.54 H new ATOM 0 HE2 MET A 4 2.432 -7.962 -15.689 1.00 13.54 H new ATOM 0 HE3 MET A 4 1.418 -7.348 -14.361 1.00 13.54 H new ATOM 18 N ALA A 5 2.505 -0.987 -13.542 1.00 60.02 N ATOM 19 CA ALA A 5 2.875 0.409 -13.346 1.00 1.03 C ATOM 20 C ALA A 5 3.452 0.633 -11.952 1.00 1.00 C ATOM 21 O ALA A 5 3.081 -0.051 -10.999 1.00 53.32 O ATOM 22 CB ALA A 5 1.671 1.311 -13.572 1.00 11.12 C ATOM 0 H ALA A 5 1.552 -1.128 -13.877 1.00 60.02 H new ATOM 0 HA ALA A 5 3.645 0.661 -14.075 1.00 1.03 H new ATOM 0 HB1 ALA A 5 1.962 2.351 -13.422 1.00 11.12 H new ATOM 0 HB2 ALA A 5 1.304 1.180 -14.590 1.00 11.12 H new ATOM 0 HB3 ALA A 5 0.883 1.050 -12.866 1.00 11.12 H new ATOM 28 N ASN A 6 4.363 1.595 -11.841 1.00 73.21 N ATOM 29 CA ASN A 6 4.992 1.908 -10.563 1.00 60.22 C ATOM 30 C ASN A 6 5.823 3.183 -10.664 1.00 44.02 C ATOM 31 O ASN A 6 5.858 3.990 -9.734 1.00 41.03 O ATOM 32 CB ASN A 6 5.875 0.744 -10.108 1.00 3.54 C ATOM 33 CG ASN A 6 6.164 0.786 -8.619 1.00 52.04 C ATOM 34 OD1 ASN A 6 5.251 0.708 -7.797 1.00 25.55 O ATOM 35 ND2 ASN A 6 7.438 0.910 -8.267 1.00 42.22 N ATOM 0 H ASN A 6 4.682 2.171 -12.620 1.00 73.21 H new ATOM 0 HA ASN A 6 4.204 2.067 -9.827 1.00 60.22 H new ATOM 0 HB2 ASN A 6 5.385 -0.198 -10.354 1.00 3.54 H new ATOM 0 HB3 ASN A 6 6.815 0.768 -10.659 1.00 3.54 H new ATOM 0 HD21 ASN A 6 7.693 0.944 -7.280 1.00 42.22 H new ATOM 0 HD22 ASN A 6 8.161 0.971 -8.983 1.00 42.22 H new ATOM 42 N LEU A 7 6.492 3.359 -11.799 1.00 35.31 N ATOM 43 CA LEU A 7 7.323 4.536 -12.023 1.00 11.31 C ATOM 44 C LEU A 7 6.583 5.574 -12.861 1.00 71.10 C ATOM 45 O LEU A 7 7.201 6.374 -13.564 1.00 13.25 O ATOM 46 CB LEU A 7 8.627 4.140 -12.717 1.00 22.34 C ATOM 47 CG LEU A 7 9.668 3.442 -11.840 1.00 61.15 C ATOM 48 CD1 LEU A 7 10.774 2.846 -12.697 1.00 41.05 C ATOM 49 CD2 LEU A 7 10.245 4.414 -10.821 1.00 63.45 C ATOM 0 H LEU A 7 6.475 2.701 -12.578 1.00 35.31 H new ATOM 0 HA LEU A 7 7.554 4.976 -11.053 1.00 11.31 H new ATOM 0 HB2 LEU A 7 8.386 3.483 -13.553 1.00 22.34 H new ATOM 0 HB3 LEU A 7 9.079 5.038 -13.138 1.00 22.34 H new ATOM 0 HG LEU A 7 9.177 2.631 -11.301 1.00 61.15 H new ATOM 0 HD11 LEU A 7 11.505 2.354 -12.056 1.00 41.05 H new ATOM 0 HD12 LEU A 7 10.347 2.118 -13.387 1.00 41.05 H new ATOM 0 HD13 LEU A 7 11.263 3.639 -13.263 1.00 41.05 H new ATOM 0 HD21 LEU A 7 10.984 3.900 -10.206 1.00 63.45 H new ATOM 0 HD22 LEU A 7 10.721 5.246 -11.340 1.00 63.45 H new ATOM 0 HD23 LEU A 7 9.444 4.793 -10.186 1.00 63.45 H new ATOM 61 N ASP A 8 5.257 5.555 -12.780 1.00 40.44 N ATOM 62 CA ASP A 8 4.432 6.497 -13.529 1.00 23.31 C ATOM 63 C ASP A 8 3.865 7.574 -12.609 1.00 25.51 C ATOM 64 O ASP A 8 2.817 8.154 -12.889 1.00 53.22 O ATOM 65 CB ASP A 8 3.293 5.760 -14.235 1.00 11.11 C ATOM 66 CG ASP A 8 2.177 5.372 -13.284 1.00 44.33 C ATOM 67 OD1 ASP A 8 2.480 4.793 -12.220 1.00 52.13 O ATOM 68 OD2 ASP A 8 1.002 5.647 -13.605 1.00 11.23 O ATOM 0 H ASP A 8 4.730 4.898 -12.204 1.00 40.44 H new ATOM 0 HA ASP A 8 5.062 6.979 -14.277 1.00 23.31 H new ATOM 0 HB2 ASP A 8 2.889 6.393 -15.025 1.00 11.11 H new ATOM 0 HB3 ASP A 8 3.686 4.863 -14.714 1.00 11.11 H new ATOM 73 N ARG A 9 4.565 7.834 -11.510 1.00 25.13 N ATOM 74 CA ARG A 9 4.131 8.839 -10.547 1.00 52.02 C ATOM 75 C ARG A 9 4.952 10.117 -10.688 1.00 11.41 C ATOM 76 O ARG A 9 4.402 11.217 -10.743 1.00 1.42 O ATOM 77 CB ARG A 9 4.251 8.297 -9.122 1.00 24.12 C ATOM 78 CG ARG A 9 3.682 9.229 -8.065 1.00 51.43 C ATOM 79 CD ARG A 9 4.189 8.873 -6.676 1.00 53.45 C ATOM 80 NE ARG A 9 3.546 9.673 -5.637 1.00 53.45 N ATOM 81 CZ ARG A 9 3.915 10.911 -5.329 1.00 4.32 C ATOM 82 NH1 ARG A 9 4.918 11.488 -5.976 1.00 43.24 N ATOM 83 NH2 ARG A 9 3.281 11.575 -4.371 1.00 1.12 N ATOM 0 H ARG A 9 5.435 7.363 -11.264 1.00 25.13 H new ATOM 0 HA ARG A 9 3.086 9.074 -10.751 1.00 52.02 H new ATOM 0 HB2 ARG A 9 3.737 7.338 -9.063 1.00 24.12 H new ATOM 0 HB3 ARG A 9 5.302 8.110 -8.901 1.00 24.12 H new ATOM 0 HG2 ARG A 9 3.955 10.258 -8.300 1.00 51.43 H new ATOM 0 HG3 ARG A 9 2.593 9.177 -8.080 1.00 51.43 H new ATOM 0 HD2 ARG A 9 4.007 7.816 -6.484 1.00 53.45 H new ATOM 0 HD3 ARG A 9 5.268 9.024 -6.634 1.00 53.45 H new ATOM 0 HE ARG A 9 2.771 9.258 -5.120 1.00 53.45 H new ATOM 0 HH11 ARG A 9 5.409 10.981 -6.713 1.00 43.24 H new ATOM 0 HH12 ARG A 9 5.199 12.439 -5.737 1.00 43.24 H new ATOM 0 HH21 ARG A 9 2.509 11.135 -3.870 1.00 1.12 H new ATOM 0 HH22 ARG A 9 3.565 12.526 -4.135 1.00 1.12 H new ATOM 97 N SER A 10 6.271 9.964 -10.745 1.00 0.10 N ATOM 98 CA SER A 10 7.168 11.106 -10.875 1.00 4.13 C ATOM 99 C SER A 10 7.149 11.653 -12.299 1.00 13.54 C ATOM 100 O SER A 10 7.341 12.848 -12.518 1.00 45.45 O ATOM 101 CB SER A 10 8.594 10.708 -10.489 1.00 63.41 C ATOM 102 OG SER A 10 8.592 9.771 -9.425 1.00 41.33 O ATOM 0 H SER A 10 6.742 9.060 -10.703 1.00 0.10 H new ATOM 0 HA SER A 10 6.821 11.888 -10.199 1.00 4.13 H new ATOM 0 HB2 SER A 10 9.102 10.280 -11.353 1.00 63.41 H new ATOM 0 HB3 SER A 10 9.156 11.595 -10.196 1.00 63.41 H new ATOM 0 HG SER A 10 9.280 9.092 -9.586 1.00 41.33 H new ATOM 108 N ASN A 11 6.914 10.769 -13.263 1.00 1.14 N ATOM 109 CA ASN A 11 6.870 11.162 -14.666 1.00 55.33 C ATOM 110 C ASN A 11 5.802 12.227 -14.899 1.00 41.23 C ATOM 111 O ASN A 11 5.980 13.131 -15.717 1.00 31.45 O ATOM 112 CB ASN A 11 6.592 9.944 -15.550 1.00 44.51 C ATOM 113 CG ASN A 11 6.590 10.290 -17.027 1.00 3.13 C ATOM 114 OD1 ASN A 11 5.578 10.730 -17.571 1.00 53.31 O ATOM 115 ND2 ASN A 11 7.728 10.091 -17.682 1.00 50.43 N ATOM 0 H ASN A 11 6.751 9.776 -13.098 1.00 1.14 H new ATOM 0 HA ASN A 11 7.841 11.581 -14.931 1.00 55.33 H new ATOM 0 HB2 ASN A 11 7.346 9.180 -15.359 1.00 44.51 H new ATOM 0 HB3 ASN A 11 5.628 9.514 -15.279 1.00 44.51 H new ATOM 0 HD21 ASN A 11 7.788 10.305 -18.678 1.00 50.43 H new ATOM 0 HD22 ASN A 11 8.542 9.724 -17.190 1.00 50.43 H new ATOM 122 N ASP A 12 4.694 12.114 -14.175 1.00 50.34 N ATOM 123 CA ASP A 12 3.598 13.068 -14.301 1.00 70.04 C ATOM 124 C ASP A 12 3.795 14.250 -13.358 1.00 1.24 C ATOM 125 O ASP A 12 3.349 15.363 -13.637 1.00 53.11 O ATOM 126 CB ASP A 12 2.262 12.383 -14.009 1.00 52.41 C ATOM 127 CG ASP A 12 1.464 12.108 -15.269 1.00 4.51 C ATOM 128 OD1 ASP A 12 1.858 11.204 -16.035 1.00 41.02 O ATOM 129 OD2 ASP A 12 0.446 12.797 -15.488 1.00 42.11 O ATOM 0 H ASP A 12 4.531 11.372 -13.495 1.00 50.34 H new ATOM 0 HA ASP A 12 3.590 13.442 -15.325 1.00 70.04 H new ATOM 0 HB2 ASP A 12 2.445 11.444 -13.486 1.00 52.41 H new ATOM 0 HB3 ASP A 12 1.674 13.011 -13.340 1.00 52.41 H new ATOM 134 N LYS A 13 4.466 14.001 -12.238 1.00 14.32 N ATOM 135 CA LYS A 13 4.723 15.044 -11.252 1.00 32.14 C ATOM 136 C LYS A 13 5.713 16.071 -11.791 1.00 62.12 C ATOM 137 O LYS A 13 5.472 17.276 -11.724 1.00 14.22 O ATOM 138 CB LYS A 13 5.263 14.429 -9.958 1.00 51.33 C ATOM 139 CG LYS A 13 5.847 15.450 -8.997 1.00 41.24 C ATOM 140 CD LYS A 13 5.340 15.237 -7.581 1.00 52.11 C ATOM 141 CE LYS A 13 6.184 15.994 -6.567 1.00 31.41 C ATOM 142 NZ LYS A 13 5.629 15.882 -5.190 1.00 32.34 N ATOM 0 H LYS A 13 4.842 13.086 -11.991 1.00 14.32 H new ATOM 0 HA LYS A 13 3.781 15.550 -11.041 1.00 32.14 H new ATOM 0 HB2 LYS A 13 4.458 13.891 -9.458 1.00 51.33 H new ATOM 0 HB3 LYS A 13 6.030 13.696 -10.207 1.00 51.33 H new ATOM 0 HG2 LYS A 13 6.935 15.382 -9.009 1.00 41.24 H new ATOM 0 HG3 LYS A 13 5.587 16.455 -9.330 1.00 41.24 H new ATOM 0 HD2 LYS A 13 4.303 15.566 -7.511 1.00 52.11 H new ATOM 0 HD3 LYS A 13 5.353 14.173 -7.345 1.00 52.11 H new ATOM 0 HE2 LYS A 13 7.203 15.606 -6.581 1.00 31.41 H new ATOM 0 HE3 LYS A 13 6.239 17.045 -6.852 1.00 31.41 H new ATOM 0 HZ1 LYS A 13 6.232 16.411 -4.528 1.00 32.34 H new ATOM 0 HZ2 LYS A 13 4.666 16.275 -5.171 1.00 32.34 H new ATOM 0 HZ3 LYS A 13 5.600 14.881 -4.908 1.00 32.34 H new ATOM 156 N VAL A 14 6.828 15.586 -12.328 1.00 24.21 N ATOM 157 CA VAL A 14 7.854 16.462 -12.882 1.00 22.44 C ATOM 158 C VAL A 14 7.325 17.238 -14.082 1.00 74.42 C ATOM 159 O VAL A 14 7.686 18.395 -14.295 1.00 41.10 O ATOM 160 CB VAL A 14 9.101 15.665 -13.309 1.00 5.15 C ATOM 161 CG1 VAL A 14 8.738 14.624 -14.356 1.00 34.43 C ATOM 162 CG2 VAL A 14 10.179 16.603 -13.830 1.00 5.32 C ATOM 0 H VAL A 14 7.044 14.591 -12.391 1.00 24.21 H new ATOM 0 HA VAL A 14 8.131 17.162 -12.094 1.00 22.44 H new ATOM 0 HB VAL A 14 9.494 15.144 -12.436 1.00 5.15 H new ATOM 0 HG11 VAL A 14 9.632 14.071 -14.645 1.00 34.43 H new ATOM 0 HG12 VAL A 14 8.002 13.934 -13.943 1.00 34.43 H new ATOM 0 HG13 VAL A 14 8.319 15.120 -15.232 1.00 34.43 H new ATOM 0 HG21 VAL A 14 11.053 16.023 -14.127 1.00 5.32 H new ATOM 0 HG22 VAL A 14 9.798 17.153 -14.691 1.00 5.32 H new ATOM 0 HG23 VAL A 14 10.460 17.306 -13.046 1.00 5.32 H new ATOM 172 N TYR A 15 6.466 16.593 -14.864 1.00 73.10 N ATOM 173 CA TYR A 15 5.887 17.222 -16.045 1.00 60.24 C ATOM 174 C TYR A 15 4.860 18.279 -15.652 1.00 33.22 C ATOM 175 O TYR A 15 4.536 19.168 -16.438 1.00 45.23 O ATOM 176 CB TYR A 15 5.234 16.168 -16.941 1.00 53.34 C ATOM 177 CG TYR A 15 4.466 16.755 -18.105 1.00 23.51 C ATOM 178 CD1 TYR A 15 3.134 17.124 -17.968 1.00 33.21 C ATOM 179 CD2 TYR A 15 5.073 16.938 -19.341 1.00 41.21 C ATOM 180 CE1 TYR A 15 2.428 17.659 -19.028 1.00 43.22 C ATOM 181 CE2 TYR A 15 4.376 17.474 -20.406 1.00 51.24 C ATOM 182 CZ TYR A 15 3.054 17.833 -20.245 1.00 71.11 C ATOM 183 OH TYR A 15 2.356 18.366 -21.304 1.00 75.23 O ATOM 0 H TYR A 15 6.155 15.635 -14.701 1.00 73.10 H new ATOM 0 HA TYR A 15 6.691 17.711 -16.596 1.00 60.24 H new ATOM 0 HB2 TYR A 15 6.006 15.501 -17.325 1.00 53.34 H new ATOM 0 HB3 TYR A 15 4.558 15.560 -16.340 1.00 53.34 H new ATOM 0 HD1 TYR A 15 2.642 16.990 -17.016 1.00 33.21 H new ATOM 0 HD2 TYR A 15 6.107 16.656 -19.471 1.00 41.21 H new ATOM 0 HE1 TYR A 15 1.392 17.939 -18.905 1.00 43.22 H new ATOM 0 HE2 TYR A 15 4.864 17.611 -21.360 1.00 51.24 H new ATOM 0 HH TYR A 15 2.943 18.423 -22.087 1.00 75.23 H new ATOM 193 N GLU A 16 4.351 18.174 -14.428 1.00 61.31 N ATOM 194 CA GLU A 16 3.360 19.120 -13.929 1.00 42.25 C ATOM 195 C GLU A 16 4.036 20.309 -13.252 1.00 70.10 C ATOM 196 O GLU A 16 3.773 21.462 -13.591 1.00 34.21 O ATOM 197 CB GLU A 16 2.412 18.430 -12.946 1.00 65.13 C ATOM 198 CG GLU A 16 1.403 17.513 -13.616 1.00 62.41 C ATOM 199 CD GLU A 16 -0.005 18.075 -13.588 1.00 22.10 C ATOM 200 OE1 GLU A 16 -0.355 18.845 -14.506 1.00 72.14 O ATOM 201 OE2 GLU A 16 -0.756 17.744 -12.647 1.00 13.32 O ATOM 0 H GLU A 16 4.609 17.444 -13.764 1.00 61.31 H new ATOM 0 HA GLU A 16 2.785 19.487 -14.779 1.00 42.25 H new ATOM 0 HB2 GLU A 16 2.999 17.851 -12.233 1.00 65.13 H new ATOM 0 HB3 GLU A 16 1.877 19.190 -12.376 1.00 65.13 H new ATOM 0 HG2 GLU A 16 1.702 17.344 -14.650 1.00 62.41 H new ATOM 0 HG3 GLU A 16 1.413 16.543 -13.119 1.00 62.41 H new ATOM 208 N ASN A 17 4.908 20.018 -12.292 1.00 41.21 N ATOM 209 CA ASN A 17 5.621 21.062 -11.566 1.00 2.45 C ATOM 210 C ASN A 17 6.302 22.029 -12.530 1.00 75.13 C ATOM 211 O ASN A 17 6.228 23.246 -12.362 1.00 14.21 O ATOM 212 CB ASN A 17 6.661 20.442 -10.630 1.00 13.45 C ATOM 213 CG ASN A 17 6.025 19.716 -9.460 1.00 22.02 C ATOM 214 OD1 ASN A 17 5.208 18.814 -9.645 1.00 12.11 O ATOM 215 ND2 ASN A 17 6.399 20.107 -8.247 1.00 71.00 N ATOM 0 H ASN A 17 5.138 19.068 -11.999 1.00 41.21 H new ATOM 0 HA ASN A 17 4.894 21.619 -10.974 1.00 2.45 H new ATOM 0 HB2 ASN A 17 7.282 19.745 -11.192 1.00 13.45 H new ATOM 0 HB3 ASN A 17 7.320 21.225 -10.254 1.00 13.45 H new ATOM 0 HD21 ASN A 17 6.006 19.655 -7.422 1.00 71.00 H new ATOM 0 HD22 ASN A 17 7.080 20.859 -8.141 1.00 71.00 H new ATOM 222 N VAL A 18 6.964 21.478 -13.543 1.00 31.25 N ATOM 223 CA VAL A 18 7.656 22.290 -14.536 1.00 1.32 C ATOM 224 C VAL A 18 6.719 23.324 -15.150 1.00 0.11 C ATOM 225 O VAL A 18 7.159 24.367 -15.636 1.00 72.31 O ATOM 226 CB VAL A 18 8.249 21.419 -15.659 1.00 54.13 C ATOM 227 CG1 VAL A 18 9.398 20.575 -15.131 1.00 3.02 C ATOM 228 CG2 VAL A 18 7.171 20.540 -16.276 1.00 52.41 C ATOM 0 H VAL A 18 7.035 20.472 -13.697 1.00 31.25 H new ATOM 0 HA VAL A 18 8.467 22.802 -14.017 1.00 1.32 H new ATOM 0 HB VAL A 18 8.640 22.076 -16.436 1.00 54.13 H new ATOM 0 HG11 VAL A 18 9.804 19.967 -15.939 1.00 3.02 H new ATOM 0 HG12 VAL A 18 10.179 21.227 -14.740 1.00 3.02 H new ATOM 0 HG13 VAL A 18 9.036 19.925 -14.334 1.00 3.02 H new ATOM 0 HG21 VAL A 18 7.607 19.931 -17.068 1.00 52.41 H new ATOM 0 HG22 VAL A 18 6.749 19.890 -15.510 1.00 52.41 H new ATOM 0 HG23 VAL A 18 6.384 21.168 -16.693 1.00 52.41 H new ATOM 238 N THR A 19 5.423 23.029 -15.124 1.00 51.24 N ATOM 239 CA THR A 19 4.422 23.932 -15.679 1.00 5.41 C ATOM 240 C THR A 19 3.914 24.906 -14.622 1.00 21.34 C ATOM 241 O THR A 19 3.848 26.112 -14.855 1.00 32.21 O ATOM 242 CB THR A 19 3.227 23.156 -16.263 1.00 0.21 C ATOM 243 OG1 THR A 19 3.650 21.858 -16.694 1.00 74.24 O ATOM 244 CG2 THR A 19 2.612 23.910 -17.433 1.00 20.43 C ATOM 0 H THR A 19 5.042 22.171 -14.724 1.00 51.24 H new ATOM 0 HA THR A 19 4.909 24.490 -16.479 1.00 5.41 H new ATOM 0 HB THR A 19 2.473 23.051 -15.483 1.00 0.21 H new ATOM 0 HG1 THR A 19 2.884 21.370 -17.063 1.00 74.24 H new ATOM 0 HG21 THR A 19 1.770 23.343 -17.829 1.00 20.43 H new ATOM 0 HG22 THR A 19 2.265 24.886 -17.095 1.00 20.43 H new ATOM 0 HG23 THR A 19 3.360 24.042 -18.215 1.00 20.43 H new ATOM 252 N GLY A 20 3.556 24.374 -13.457 1.00 23.52 N ATOM 253 CA GLY A 20 3.059 25.210 -12.380 1.00 51.35 C ATOM 254 C GLY A 20 3.963 26.394 -12.101 1.00 5.10 C ATOM 255 O GLY A 20 3.519 27.543 -12.118 1.00 72.45 O ATOM 0 H GLY A 20 3.601 23.378 -13.240 1.00 23.52 H new ATOM 0 HA2 GLY A 20 2.062 25.570 -12.634 1.00 51.35 H new ATOM 0 HA3 GLY A 20 2.960 24.611 -11.475 1.00 51.35 H new ATOM 259 N LEU A 21 5.236 26.116 -11.841 1.00 20.43 N ATOM 260 CA LEU A 21 6.206 27.167 -11.554 1.00 62.32 C ATOM 261 C LEU A 21 6.178 28.243 -12.635 1.00 13.25 C ATOM 262 O LEU A 21 6.331 29.430 -12.347 1.00 51.40 O ATOM 263 CB LEU A 21 7.612 26.574 -11.445 1.00 43.35 C ATOM 264 CG LEU A 21 8.150 25.887 -12.701 1.00 42.42 C ATOM 265 CD1 LEU A 21 8.953 26.867 -13.543 1.00 25.32 C ATOM 266 CD2 LEU A 21 8.999 24.681 -12.327 1.00 44.30 C ATOM 0 H LEU A 21 5.620 25.171 -11.823 1.00 20.43 H new ATOM 0 HA LEU A 21 5.937 27.626 -10.603 1.00 62.32 H new ATOM 0 HB2 LEU A 21 8.301 27.372 -11.168 1.00 43.35 H new ATOM 0 HB3 LEU A 21 7.618 25.851 -10.629 1.00 43.35 H new ATOM 0 HG LEU A 21 7.303 25.540 -13.293 1.00 42.42 H new ATOM 0 HD11 LEU A 21 9.328 26.360 -14.432 1.00 25.32 H new ATOM 0 HD12 LEU A 21 8.315 27.699 -13.841 1.00 25.32 H new ATOM 0 HD13 LEU A 21 9.793 27.245 -12.960 1.00 25.32 H new ATOM 0 HD21 LEU A 21 9.373 24.205 -13.233 1.00 44.30 H new ATOM 0 HD22 LEU A 21 9.840 25.004 -11.713 1.00 44.30 H new ATOM 0 HD23 LEU A 21 8.393 23.969 -11.767 1.00 44.30 H new ATOM 278 N VAL A 22 5.978 27.820 -13.879 1.00 4.40 N ATOM 279 CA VAL A 22 5.926 28.748 -15.002 1.00 41.25 C ATOM 280 C VAL A 22 4.703 29.654 -14.911 1.00 70.40 C ATOM 281 O VAL A 22 4.786 30.856 -15.161 1.00 45.23 O ATOM 282 CB VAL A 22 5.897 27.999 -16.348 1.00 44.20 C ATOM 283 CG1 VAL A 22 5.780 28.981 -17.504 1.00 0.34 C ATOM 284 CG2 VAL A 22 7.136 27.130 -16.500 1.00 65.00 C ATOM 0 H VAL A 22 5.849 26.841 -14.134 1.00 4.40 H new ATOM 0 HA VAL A 22 6.829 29.356 -14.952 1.00 41.25 H new ATOM 0 HB VAL A 22 5.021 27.350 -16.364 1.00 44.20 H new ATOM 0 HG11 VAL A 22 5.761 28.433 -18.446 1.00 0.34 H new ATOM 0 HG12 VAL A 22 4.860 29.557 -17.401 1.00 0.34 H new ATOM 0 HG13 VAL A 22 6.635 29.657 -17.495 1.00 0.34 H new ATOM 0 HG21 VAL A 22 7.099 26.608 -17.456 1.00 65.00 H new ATOM 0 HG22 VAL A 22 8.027 27.757 -16.463 1.00 65.00 H new ATOM 0 HG23 VAL A 22 7.171 26.401 -15.690 1.00 65.00 H new ATOM 294 N LYS A 23 3.566 29.068 -14.550 1.00 41.12 N ATOM 295 CA LYS A 23 2.324 29.821 -14.423 1.00 51.02 C ATOM 296 C LYS A 23 2.517 31.044 -13.532 1.00 25.31 C ATOM 297 O LYS A 23 2.066 32.140 -13.860 1.00 52.31 O ATOM 298 CB LYS A 23 1.219 28.930 -13.851 1.00 63.53 C ATOM 299 CG LYS A 23 1.025 27.634 -14.619 1.00 73.25 C ATOM 300 CD LYS A 23 -0.413 27.149 -14.540 1.00 32.01 C ATOM 301 CE LYS A 23 -0.657 26.332 -13.280 1.00 50.12 C ATOM 302 NZ LYS A 23 -2.036 26.526 -12.752 1.00 23.03 N ATOM 0 H LYS A 23 3.479 28.074 -14.340 1.00 41.12 H new ATOM 0 HA LYS A 23 2.031 30.160 -15.417 1.00 51.02 H new ATOM 0 HB2 LYS A 23 1.454 28.696 -12.813 1.00 63.53 H new ATOM 0 HB3 LYS A 23 0.281 29.485 -13.848 1.00 63.53 H new ATOM 0 HG2 LYS A 23 1.303 27.783 -15.662 1.00 73.25 H new ATOM 0 HG3 LYS A 23 1.690 26.869 -14.218 1.00 73.25 H new ATOM 0 HD2 LYS A 23 -1.088 28.005 -14.557 1.00 32.01 H new ATOM 0 HD3 LYS A 23 -0.643 26.544 -15.417 1.00 32.01 H new ATOM 0 HE2 LYS A 23 -0.496 25.276 -13.495 1.00 50.12 H new ATOM 0 HE3 LYS A 23 0.068 26.616 -12.517 1.00 50.12 H new ATOM 0 HZ1 LYS A 23 -2.163 25.953 -11.894 1.00 23.03 H new ATOM 0 HZ2 LYS A 23 -2.182 27.530 -12.523 1.00 23.03 H new ATOM 0 HZ3 LYS A 23 -2.728 26.231 -13.471 1.00 23.03 H new ATOM 316 N ALA A 24 3.193 30.847 -12.404 1.00 53.42 N ATOM 317 CA ALA A 24 3.449 31.935 -11.468 1.00 71.20 C ATOM 318 C ALA A 24 4.390 32.970 -12.074 1.00 4.24 C ATOM 319 O ALA A 24 4.184 34.175 -11.924 1.00 73.43 O ATOM 320 CB ALA A 24 4.026 31.389 -10.170 1.00 52.02 C ATOM 0 H ALA A 24 3.573 29.945 -12.117 1.00 53.42 H new ATOM 0 HA ALA A 24 2.501 32.427 -11.252 1.00 71.20 H new ATOM 0 HB1 ALA A 24 4.212 32.212 -9.480 1.00 52.02 H new ATOM 0 HB2 ALA A 24 3.317 30.693 -9.721 1.00 52.02 H new ATOM 0 HB3 ALA A 24 4.962 30.871 -10.378 1.00 52.02 H new ATOM 326 N VAL A 25 5.426 32.494 -12.757 1.00 61.51 N ATOM 327 CA VAL A 25 6.400 33.378 -13.386 1.00 13.23 C ATOM 328 C VAL A 25 5.711 34.424 -14.256 1.00 31.42 C ATOM 329 O VAL A 25 6.216 35.533 -14.428 1.00 3.34 O ATOM 330 CB VAL A 25 7.402 32.588 -14.248 1.00 74.21 C ATOM 331 CG1 VAL A 25 8.406 33.528 -14.897 1.00 2.04 C ATOM 332 CG2 VAL A 25 8.109 31.534 -13.410 1.00 63.44 C ATOM 0 H VAL A 25 5.613 31.500 -12.889 1.00 61.51 H new ATOM 0 HA VAL A 25 6.940 33.877 -12.581 1.00 13.23 H new ATOM 0 HB VAL A 25 6.852 32.080 -15.041 1.00 74.21 H new ATOM 0 HG11 VAL A 25 9.106 32.952 -15.502 1.00 2.04 H new ATOM 0 HG12 VAL A 25 7.879 34.241 -15.532 1.00 2.04 H new ATOM 0 HG13 VAL A 25 8.953 34.066 -14.123 1.00 2.04 H new ATOM 0 HG21 VAL A 25 8.814 30.985 -14.035 1.00 63.44 H new ATOM 0 HG22 VAL A 25 8.647 32.018 -12.595 1.00 63.44 H new ATOM 0 HG23 VAL A 25 7.374 30.843 -12.999 1.00 63.44 H new ATOM 342 N ILE A 26 4.555 34.062 -14.802 1.00 11.10 N ATOM 343 CA ILE A 26 3.796 34.970 -15.653 1.00 72.32 C ATOM 344 C ILE A 26 2.904 35.886 -14.822 1.00 71.12 C ATOM 345 O ILE A 26 3.033 37.108 -14.876 1.00 11.44 O ATOM 346 CB ILE A 26 2.923 34.199 -16.661 1.00 62.32 C ATOM 347 CG1 ILE A 26 3.762 33.156 -17.402 1.00 64.14 C ATOM 348 CG2 ILE A 26 2.274 35.161 -17.645 1.00 24.01 C ATOM 349 CD1 ILE A 26 2.971 32.343 -18.403 1.00 15.13 C ATOM 0 H ILE A 26 4.124 33.147 -14.670 1.00 11.10 H new ATOM 0 HA ILE A 26 4.522 35.572 -16.199 1.00 72.32 H new ATOM 0 HB ILE A 26 2.134 33.682 -16.115 1.00 62.32 H new ATOM 0 HG12 ILE A 26 4.578 33.660 -17.920 1.00 64.14 H new ATOM 0 HG13 ILE A 26 4.214 32.482 -16.674 1.00 64.14 H new ATOM 0 HG21 ILE A 26 1.660 34.601 -18.351 1.00 24.01 H new ATOM 0 HG22 ILE A 26 1.648 35.869 -17.102 1.00 24.01 H new ATOM 0 HG23 ILE A 26 3.048 35.703 -18.188 1.00 24.01 H new ATOM 0 HD11 ILE A 26 3.630 31.624 -18.890 1.00 15.13 H new ATOM 0 HD12 ILE A 26 2.171 31.811 -17.888 1.00 15.13 H new ATOM 0 HD13 ILE A 26 2.541 33.007 -19.153 1.00 15.13 H new ATOM 361 N GLU A 27 2.001 35.285 -14.054 1.00 14.54 N ATOM 362 CA GLU A 27 1.088 36.048 -13.210 1.00 51.42 C ATOM 363 C GLU A 27 1.854 37.030 -12.328 1.00 42.03 C ATOM 364 O GLU A 27 1.610 38.236 -12.366 1.00 32.51 O ATOM 365 CB GLU A 27 0.255 35.106 -12.339 1.00 20.11 C ATOM 366 CG GLU A 27 -1.196 34.995 -12.777 1.00 23.21 C ATOM 367 CD GLU A 27 -2.130 34.681 -11.625 1.00 35.20 C ATOM 368 OE1 GLU A 27 -1.632 34.402 -10.515 1.00 1.24 O ATOM 369 OE2 GLU A 27 -3.361 34.714 -11.835 1.00 13.14 O ATOM 0 H GLU A 27 1.882 34.274 -13.999 1.00 14.54 H new ATOM 0 HA GLU A 27 0.421 36.614 -13.860 1.00 51.42 H new ATOM 0 HB2 GLU A 27 0.707 34.114 -12.355 1.00 20.11 H new ATOM 0 HB3 GLU A 27 0.288 35.455 -11.307 1.00 20.11 H new ATOM 0 HG2 GLU A 27 -1.503 35.931 -13.244 1.00 23.21 H new ATOM 0 HG3 GLU A 27 -1.285 34.216 -13.534 1.00 23.21 H new ATOM 376 N MET A 28 2.782 36.504 -11.535 1.00 73.10 N ATOM 377 CA MET A 28 3.584 37.333 -10.644 1.00 4.42 C ATOM 378 C MET A 28 4.262 38.462 -11.415 1.00 30.22 C ATOM 379 O MET A 28 4.250 39.615 -10.984 1.00 72.03 O ATOM 380 CB MET A 28 4.638 36.483 -9.931 1.00 75.22 C ATOM 381 CG MET A 28 4.046 35.383 -9.065 1.00 13.25 C ATOM 382 SD MET A 28 5.199 34.790 -7.811 1.00 55.33 S ATOM 383 CE MET A 28 6.493 34.102 -8.840 1.00 73.35 C ATOM 0 H MET A 28 2.997 35.508 -11.492 1.00 73.10 H new ATOM 0 HA MET A 28 2.918 37.772 -9.901 1.00 4.42 H new ATOM 0 HB2 MET A 28 5.295 36.034 -10.675 1.00 75.22 H new ATOM 0 HB3 MET A 28 5.256 37.131 -9.309 1.00 75.22 H new ATOM 0 HG2 MET A 28 3.145 35.755 -8.578 1.00 13.25 H new ATOM 0 HG3 MET A 28 3.744 34.549 -9.699 1.00 13.25 H new ATOM 0 HE1 MET A 28 6.679 33.068 -8.548 1.00 73.35 H new ATOM 0 HE2 MET A 28 6.183 34.134 -9.884 1.00 73.35 H new ATOM 0 HE3 MET A 28 7.406 34.684 -8.715 1.00 73.35 H new ATOM 393 N SER A 29 4.852 38.122 -12.556 1.00 25.40 N ATOM 394 CA SER A 29 5.539 39.106 -13.385 1.00 32.24 C ATOM 395 C SER A 29 4.574 40.192 -13.850 1.00 13.13 C ATOM 396 O SER A 29 4.991 41.278 -14.252 1.00 21.00 O ATOM 397 CB SER A 29 6.181 38.426 -14.595 1.00 73.33 C ATOM 398 OG SER A 29 6.446 39.362 -15.625 1.00 41.22 O ATOM 0 H SER A 29 4.868 37.172 -12.928 1.00 25.40 H new ATOM 0 HA SER A 29 6.319 39.571 -12.783 1.00 32.24 H new ATOM 0 HB2 SER A 29 7.109 37.940 -14.293 1.00 73.33 H new ATOM 0 HB3 SER A 29 5.520 37.645 -14.970 1.00 73.33 H new ATOM 0 HG SER A 29 6.858 38.903 -16.387 1.00 41.22 H new ATOM 404 N SER A 30 3.280 39.890 -13.791 1.00 45.53 N ATOM 405 CA SER A 30 2.255 40.839 -14.210 1.00 33.33 C ATOM 406 C SER A 30 2.056 41.924 -13.156 1.00 41.22 C ATOM 407 O SER A 30 2.078 43.116 -13.464 1.00 2.23 O ATOM 408 CB SER A 30 0.933 40.112 -14.466 1.00 12.45 C ATOM 409 OG SER A 30 0.176 40.769 -15.468 1.00 20.41 O ATOM 0 H SER A 30 2.917 38.997 -13.458 1.00 45.53 H new ATOM 0 HA SER A 30 2.587 41.312 -15.134 1.00 33.33 H new ATOM 0 HB2 SER A 30 1.132 39.085 -14.771 1.00 12.45 H new ATOM 0 HB3 SER A 30 0.356 40.064 -13.543 1.00 12.45 H new ATOM 0 HG SER A 30 -0.663 40.284 -15.615 1.00 20.41 H new ATOM 415 N LYS A 31 1.862 41.503 -11.911 1.00 71.12 N ATOM 416 CA LYS A 31 1.660 42.437 -10.810 1.00 23.34 C ATOM 417 C LYS A 31 2.946 42.621 -10.011 1.00 4.44 C ATOM 418 O LYS A 31 2.914 43.040 -8.853 1.00 41.00 O ATOM 419 CB LYS A 31 0.543 41.939 -9.890 1.00 20.21 C ATOM 420 CG LYS A 31 0.737 40.509 -9.417 1.00 33.42 C ATOM 421 CD LYS A 31 -0.340 40.098 -8.427 1.00 14.13 C ATOM 422 CE LYS A 31 -0.366 38.591 -8.224 1.00 71.22 C ATOM 423 NZ LYS A 31 -0.009 38.212 -6.829 1.00 15.53 N ATOM 0 H LYS A 31 1.840 40.520 -11.639 1.00 71.12 H new ATOM 0 HA LYS A 31 1.373 43.400 -11.231 1.00 23.34 H new ATOM 0 HB2 LYS A 31 0.480 42.595 -9.022 1.00 20.21 H new ATOM 0 HB3 LYS A 31 -0.409 42.013 -10.415 1.00 20.21 H new ATOM 0 HG2 LYS A 31 0.720 39.836 -10.274 1.00 33.42 H new ATOM 0 HG3 LYS A 31 1.718 40.409 -8.952 1.00 33.42 H new ATOM 0 HD2 LYS A 31 -0.164 40.592 -7.471 1.00 14.13 H new ATOM 0 HD3 LYS A 31 -1.313 40.435 -8.786 1.00 14.13 H new ATOM 0 HE2 LYS A 31 -1.359 38.210 -8.461 1.00 71.22 H new ATOM 0 HE3 LYS A 31 0.330 38.119 -8.918 1.00 71.22 H new ATOM 0 HZ1 LYS A 31 -0.038 37.177 -6.732 1.00 15.53 H new ATOM 0 HZ2 LYS A 31 0.949 38.553 -6.611 1.00 15.53 H new ATOM 0 HZ3 LYS A 31 -0.688 38.641 -6.168 1.00 15.53 H new ATOM 437 N ILE A 32 4.076 42.308 -10.636 1.00 1.11 N ATOM 438 CA ILE A 32 5.373 42.442 -9.983 1.00 55.42 C ATOM 439 C ILE A 32 5.651 43.894 -9.607 1.00 32.21 C ATOM 440 O ILE A 32 6.186 44.175 -8.535 1.00 14.01 O ATOM 441 CB ILE A 32 6.512 41.930 -10.884 1.00 30.23 C ATOM 442 CG1 ILE A 32 7.861 42.093 -10.179 1.00 75.24 C ATOM 443 CG2 ILE A 32 6.510 42.669 -12.213 1.00 52.33 C ATOM 444 CD1 ILE A 32 8.746 40.870 -10.279 1.00 51.41 C ATOM 0 H ILE A 32 4.120 41.960 -11.594 1.00 1.11 H new ATOM 0 HA ILE A 32 5.336 41.835 -9.078 1.00 55.42 H new ATOM 0 HB ILE A 32 6.351 40.870 -11.081 1.00 30.23 H new ATOM 0 HG12 ILE A 32 8.385 42.947 -10.608 1.00 75.24 H new ATOM 0 HG13 ILE A 32 7.687 42.321 -9.127 1.00 75.24 H new ATOM 0 HG21 ILE A 32 7.321 42.295 -12.838 1.00 52.33 H new ATOM 0 HG22 ILE A 32 5.558 42.507 -12.718 1.00 52.33 H new ATOM 0 HG23 ILE A 32 6.650 43.736 -12.036 1.00 52.33 H new ATOM 0 HD11 ILE A 32 9.685 41.057 -9.757 1.00 51.41 H new ATOM 0 HD12 ILE A 32 8.241 40.018 -9.824 1.00 51.41 H new ATOM 0 HD13 ILE A 32 8.950 40.653 -11.328 1.00 51.41 H new ATOM 456 N GLN A 33 5.282 44.811 -10.496 1.00 24.24 N ATOM 457 CA GLN A 33 5.492 46.234 -10.256 1.00 35.23 C ATOM 458 C GLN A 33 4.721 46.697 -9.024 1.00 11.11 C ATOM 459 O GLN A 33 5.296 47.169 -8.043 1.00 41.30 O ATOM 460 CB GLN A 33 5.061 47.047 -11.477 1.00 54.23 C ATOM 461 CG GLN A 33 6.225 47.544 -12.319 1.00 10.53 C ATOM 462 CD GLN A 33 5.821 48.643 -13.283 1.00 24.24 C ATOM 463 OE1 GLN A 33 5.797 48.441 -14.497 1.00 32.20 O ATOM 464 NE2 GLN A 33 5.502 49.814 -12.745 1.00 51.33 N ATOM 0 H GLN A 33 4.837 44.594 -11.388 1.00 24.24 H new ATOM 0 HA GLN A 33 6.555 46.394 -10.078 1.00 35.23 H new ATOM 0 HB2 GLN A 33 4.409 46.434 -12.099 1.00 54.23 H new ATOM 0 HB3 GLN A 33 4.473 47.902 -11.144 1.00 54.23 H new ATOM 0 HG2 GLN A 33 7.012 47.914 -11.662 1.00 10.53 H new ATOM 0 HG3 GLN A 33 6.645 46.709 -12.881 1.00 10.53 H new ATOM 0 HE21 GLN A 33 5.536 49.936 -11.733 1.00 51.33 H new ATOM 0 HE22 GLN A 33 5.223 50.591 -13.344 1.00 51.33 H new ATOM 473 N PRO A 34 3.388 46.561 -9.073 1.00 75.54 N ATOM 474 CA PRO A 34 2.509 46.959 -7.969 1.00 44.45 C ATOM 475 C PRO A 34 2.656 46.050 -6.755 1.00 33.44 C ATOM 476 O PRO A 34 2.093 46.320 -5.694 1.00 23.42 O ATOM 477 CB PRO A 34 1.106 46.831 -8.568 1.00 64.30 C ATOM 478 CG PRO A 34 1.249 45.822 -9.655 1.00 3.10 C ATOM 479 CD PRO A 34 2.635 46.006 -10.211 1.00 35.53 C ATOM 0 HA PRO A 34 2.741 47.959 -7.604 1.00 44.45 H new ATOM 0 HB2 PRO A 34 0.384 46.506 -7.819 1.00 64.30 H new ATOM 0 HB3 PRO A 34 0.753 47.786 -8.958 1.00 64.30 H new ATOM 0 HG2 PRO A 34 1.114 44.811 -9.270 1.00 3.10 H new ATOM 0 HG3 PRO A 34 0.495 45.972 -10.428 1.00 3.10 H new ATOM 0 HD2 PRO A 34 3.060 45.062 -10.552 1.00 35.53 H new ATOM 0 HD3 PRO A 34 2.639 46.684 -11.064 1.00 35.53 H new ATOM 487 N ALA A 35 3.415 44.971 -6.917 1.00 31.12 N ATOM 488 CA ALA A 35 3.637 44.023 -5.832 1.00 71.22 C ATOM 489 C ALA A 35 4.002 44.744 -4.539 1.00 34.31 C ATOM 490 O ALA A 35 5.106 45.265 -4.381 1.00 14.23 O ATOM 491 CB ALA A 35 4.727 43.032 -6.212 1.00 44.12 C ATOM 0 H ALA A 35 3.886 44.732 -7.789 1.00 31.12 H new ATOM 0 HA ALA A 35 2.708 43.478 -5.663 1.00 71.22 H new ATOM 0 HB1 ALA A 35 4.882 42.330 -5.393 1.00 44.12 H new ATOM 0 HB2 ALA A 35 4.426 42.486 -7.106 1.00 44.12 H new ATOM 0 HB3 ALA A 35 5.654 43.569 -6.410 1.00 44.12 H new ATOM 497 N PRO A 36 3.053 44.776 -3.591 1.00 24.12 N ATOM 498 CA PRO A 36 3.252 45.431 -2.294 1.00 63.44 C ATOM 499 C PRO A 36 4.246 44.682 -1.413 1.00 61.21 C ATOM 500 O PRO A 36 4.634 43.549 -1.698 1.00 65.22 O ATOM 501 CB PRO A 36 1.856 45.406 -1.667 1.00 24.44 C ATOM 502 CG PRO A 36 1.172 44.250 -2.311 1.00 21.44 C ATOM 503 CD PRO A 36 1.714 44.175 -3.711 1.00 44.01 C ATOM 0 HA PRO A 36 3.668 46.433 -2.402 1.00 63.44 H new ATOM 0 HB2 PRO A 36 1.910 45.282 -0.585 1.00 24.44 H new ATOM 0 HB3 PRO A 36 1.321 46.337 -1.854 1.00 24.44 H new ATOM 0 HG2 PRO A 36 1.370 43.327 -1.766 1.00 21.44 H new ATOM 0 HG3 PRO A 36 0.091 44.391 -2.318 1.00 21.44 H new ATOM 0 HD2 PRO A 36 1.766 43.146 -4.067 1.00 44.01 H new ATOM 0 HD3 PRO A 36 1.088 44.725 -4.414 1.00 44.01 H new ATOM 511 N PRO A 37 4.669 45.327 -0.316 1.00 13.22 N ATOM 512 CA PRO A 37 5.622 44.740 0.630 1.00 22.01 C ATOM 513 C PRO A 37 5.017 43.586 1.422 1.00 11.45 C ATOM 514 O PRO A 37 5.738 42.764 1.986 1.00 33.15 O ATOM 515 CB PRO A 37 5.963 45.907 1.560 1.00 23.23 C ATOM 516 CG PRO A 37 4.780 46.808 1.487 1.00 53.43 C ATOM 517 CD PRO A 37 4.248 46.680 0.086 1.00 34.22 C ATOM 0 HA PRO A 37 6.488 44.313 0.124 1.00 22.01 H new ATOM 0 HB2 PRO A 37 6.136 45.563 2.580 1.00 23.23 H new ATOM 0 HB3 PRO A 37 6.870 46.418 1.238 1.00 23.23 H new ATOM 0 HG2 PRO A 37 4.025 46.521 2.219 1.00 53.43 H new ATOM 0 HG3 PRO A 37 5.060 47.838 1.705 1.00 53.43 H new ATOM 0 HD2 PRO A 37 3.164 46.789 0.056 1.00 34.22 H new ATOM 0 HD3 PRO A 37 4.663 47.443 -0.573 1.00 34.22 H new ATOM 525 N GLU A 38 3.689 43.533 1.460 1.00 61.50 N ATOM 526 CA GLU A 38 2.988 42.479 2.184 1.00 22.23 C ATOM 527 C GLU A 38 2.818 41.239 1.311 1.00 20.11 C ATOM 528 O GLU A 38 2.648 40.130 1.817 1.00 41.21 O ATOM 529 CB GLU A 38 1.620 42.976 2.655 1.00 11.20 C ATOM 530 CG GLU A 38 1.696 44.162 3.602 1.00 21.22 C ATOM 531 CD GLU A 38 1.497 43.764 5.052 1.00 41.01 C ATOM 532 OE1 GLU A 38 1.802 42.603 5.395 1.00 24.40 O ATOM 533 OE2 GLU A 38 1.036 44.613 5.843 1.00 43.22 O ATOM 0 H GLU A 38 3.078 44.207 0.999 1.00 61.50 H new ATOM 0 HA GLU A 38 3.588 42.210 3.053 1.00 22.23 H new ATOM 0 HB2 GLU A 38 1.025 43.254 1.785 1.00 11.20 H new ATOM 0 HB3 GLU A 38 1.097 42.159 3.151 1.00 11.20 H new ATOM 0 HG2 GLU A 38 2.665 44.648 3.492 1.00 21.22 H new ATOM 0 HG3 GLU A 38 0.938 44.894 3.323 1.00 21.22 H new ATOM 540 N GLU A 39 2.865 41.437 -0.003 1.00 34.53 N ATOM 541 CA GLU A 39 2.714 40.335 -0.946 1.00 61.21 C ATOM 542 C GLU A 39 4.073 39.869 -1.460 1.00 43.32 C ATOM 543 O GLU A 39 4.196 38.783 -2.027 1.00 21.14 O ATOM 544 CB GLU A 39 1.830 40.757 -2.121 1.00 14.31 C ATOM 545 CG GLU A 39 0.372 40.960 -1.743 1.00 73.54 C ATOM 546 CD GLU A 39 -0.350 39.652 -1.483 1.00 73.21 C ATOM 547 OE1 GLU A 39 -0.132 38.690 -2.249 1.00 3.02 O ATOM 548 OE2 GLU A 39 -1.134 39.591 -0.513 1.00 32.43 O ATOM 0 H GLU A 39 3.006 42.349 -0.438 1.00 34.53 H new ATOM 0 HA GLU A 39 2.238 39.506 -0.423 1.00 61.21 H new ATOM 0 HB2 GLU A 39 2.219 41.683 -2.544 1.00 14.31 H new ATOM 0 HB3 GLU A 39 1.892 39.999 -2.902 1.00 14.31 H new ATOM 0 HG2 GLU A 39 0.315 41.586 -0.852 1.00 73.54 H new ATOM 0 HG3 GLU A 39 -0.136 41.498 -2.543 1.00 73.54 H new ATOM 555 N TYR A 40 5.091 40.699 -1.259 1.00 51.12 N ATOM 556 CA TYR A 40 6.441 40.375 -1.705 1.00 31.04 C ATOM 557 C TYR A 40 7.076 39.325 -0.798 1.00 5.41 C ATOM 558 O TYR A 40 7.769 38.421 -1.265 1.00 41.44 O ATOM 559 CB TYR A 40 7.308 41.635 -1.731 1.00 21.31 C ATOM 560 CG TYR A 40 7.956 41.896 -3.072 1.00 21.22 C ATOM 561 CD1 TYR A 40 7.202 41.909 -4.239 1.00 1.11 C ATOM 562 CD2 TYR A 40 9.322 42.128 -3.172 1.00 42.20 C ATOM 563 CE1 TYR A 40 7.790 42.147 -5.466 1.00 72.54 C ATOM 564 CE2 TYR A 40 9.918 42.368 -4.395 1.00 21.01 C ATOM 565 CZ TYR A 40 9.148 42.376 -5.539 1.00 71.11 C ATOM 566 OH TYR A 40 9.738 42.613 -6.759 1.00 61.15 O ATOM 0 H TYR A 40 5.007 41.601 -0.790 1.00 51.12 H new ATOM 0 HA TYR A 40 6.376 39.967 -2.713 1.00 31.04 H new ATOM 0 HB2 TYR A 40 6.694 42.494 -1.460 1.00 21.31 H new ATOM 0 HB3 TYR A 40 8.085 41.547 -0.972 1.00 21.31 H new ATOM 0 HD1 TYR A 40 6.138 41.730 -4.186 1.00 1.11 H new ATOM 0 HD2 TYR A 40 9.928 42.121 -2.278 1.00 42.20 H new ATOM 0 HE1 TYR A 40 7.189 42.154 -6.364 1.00 72.54 H new ATOM 0 HE2 TYR A 40 10.981 42.548 -4.455 1.00 21.01 H new ATOM 0 HH TYR A 40 10.700 42.756 -6.635 1.00 61.15 H new ATOM 576 N VAL A 41 6.835 39.452 0.503 1.00 12.11 N ATOM 577 CA VAL A 41 7.381 38.515 1.477 1.00 30.30 C ATOM 578 C VAL A 41 7.071 37.074 1.087 1.00 72.11 C ATOM 579 O VAL A 41 7.965 36.244 0.919 1.00 75.05 O ATOM 580 CB VAL A 41 6.825 38.784 2.888 1.00 22.10 C ATOM 581 CG1 VAL A 41 6.748 37.492 3.687 1.00 24.03 C ATOM 582 CG2 VAL A 41 7.679 39.816 3.609 1.00 40.35 C ATOM 0 H VAL A 41 6.265 40.195 0.907 1.00 12.11 H new ATOM 0 HA VAL A 41 8.461 38.662 1.486 1.00 30.30 H new ATOM 0 HB VAL A 41 5.816 39.184 2.792 1.00 22.10 H new ATOM 0 HG11 VAL A 41 6.353 37.702 4.681 1.00 24.03 H new ATOM 0 HG12 VAL A 41 6.091 36.787 3.177 1.00 24.03 H new ATOM 0 HG13 VAL A 41 7.745 37.060 3.776 1.00 24.03 H new ATOM 0 HG21 VAL A 41 7.272 39.994 4.604 1.00 40.35 H new ATOM 0 HG22 VAL A 41 8.701 39.446 3.696 1.00 40.35 H new ATOM 0 HG23 VAL A 41 7.677 40.748 3.044 1.00 40.35 H new ATOM 592 N PRO A 42 5.773 36.767 0.939 1.00 45.35 N ATOM 593 CA PRO A 42 5.315 35.426 0.565 1.00 13.01 C ATOM 594 C PRO A 42 5.664 35.075 -0.877 1.00 74.41 C ATOM 595 O PRO A 42 5.843 33.905 -1.215 1.00 31.14 O ATOM 596 CB PRO A 42 3.797 35.508 0.743 1.00 14.03 C ATOM 597 CG PRO A 42 3.473 36.953 0.578 1.00 62.21 C ATOM 598 CD PRO A 42 4.655 37.707 1.123 1.00 35.43 C ATOM 0 HA PRO A 42 5.788 34.651 1.168 1.00 13.01 H new ATOM 0 HB2 PRO A 42 3.278 34.899 0.003 1.00 14.03 H new ATOM 0 HB3 PRO A 42 3.493 35.144 1.724 1.00 14.03 H new ATOM 0 HG2 PRO A 42 3.304 37.198 -0.471 1.00 62.21 H new ATOM 0 HG3 PRO A 42 2.562 37.213 1.117 1.00 62.21 H new ATOM 0 HD2 PRO A 42 4.821 38.639 0.583 1.00 35.43 H new ATOM 0 HD3 PRO A 42 4.517 37.967 2.173 1.00 35.43 H new ATOM 606 N MET A 43 5.759 36.095 -1.723 1.00 75.15 N ATOM 607 CA MET A 43 6.088 35.893 -3.130 1.00 31.44 C ATOM 608 C MET A 43 7.314 34.997 -3.277 1.00 41.55 C ATOM 609 O MET A 43 7.260 33.957 -3.933 1.00 42.14 O ATOM 610 CB MET A 43 6.338 37.237 -3.816 1.00 12.15 C ATOM 611 CG MET A 43 5.533 37.427 -5.091 1.00 45.32 C ATOM 612 SD MET A 43 3.755 37.457 -4.793 1.00 44.14 S ATOM 613 CE MET A 43 3.366 39.148 -5.237 1.00 41.22 C ATOM 0 H MET A 43 5.613 37.070 -1.460 1.00 75.15 H new ATOM 0 HA MET A 43 5.241 35.402 -3.609 1.00 31.44 H new ATOM 0 HB2 MET A 43 6.097 38.041 -3.121 1.00 12.15 H new ATOM 0 HB3 MET A 43 7.399 37.325 -4.049 1.00 12.15 H new ATOM 0 HG2 MET A 43 5.833 38.359 -5.570 1.00 45.32 H new ATOM 0 HG3 MET A 43 5.767 36.622 -5.787 1.00 45.32 H new ATOM 0 HE1 MET A 43 2.298 39.322 -5.105 1.00 41.22 H new ATOM 0 HE2 MET A 43 3.927 39.830 -4.598 1.00 41.22 H new ATOM 0 HE3 MET A 43 3.636 39.322 -6.279 1.00 41.22 H new ATOM 623 N VAL A 44 8.419 35.409 -2.664 1.00 22.12 N ATOM 624 CA VAL A 44 9.659 34.644 -2.727 1.00 33.33 C ATOM 625 C VAL A 44 9.435 33.198 -2.297 1.00 14.32 C ATOM 626 O VAL A 44 10.094 32.283 -2.789 1.00 24.20 O ATOM 627 CB VAL A 44 10.750 35.269 -1.838 1.00 30.14 C ATOM 628 CG1 VAL A 44 10.421 35.066 -0.366 1.00 42.33 C ATOM 629 CG2 VAL A 44 12.112 34.681 -2.174 1.00 21.02 C ATOM 0 H VAL A 44 8.481 36.268 -2.118 1.00 22.12 H new ATOM 0 HA VAL A 44 9.991 34.664 -3.765 1.00 33.33 H new ATOM 0 HB VAL A 44 10.784 36.341 -2.034 1.00 30.14 H new ATOM 0 HG11 VAL A 44 11.203 35.514 0.247 1.00 42.33 H new ATOM 0 HG12 VAL A 44 9.466 35.539 -0.138 1.00 42.33 H new ATOM 0 HG13 VAL A 44 10.358 33.999 -0.151 1.00 42.33 H new ATOM 0 HG21 VAL A 44 12.871 35.134 -1.536 1.00 21.02 H new ATOM 0 HG22 VAL A 44 12.094 33.604 -2.008 1.00 21.02 H new ATOM 0 HG23 VAL A 44 12.348 34.883 -3.219 1.00 21.02 H new ATOM 639 N LYS A 45 8.498 32.999 -1.375 1.00 44.42 N ATOM 640 CA LYS A 45 8.184 31.665 -0.879 1.00 21.04 C ATOM 641 C LYS A 45 7.732 30.754 -2.015 1.00 52.04 C ATOM 642 O LYS A 45 8.162 29.605 -2.110 1.00 43.22 O ATOM 643 CB LYS A 45 7.094 31.741 0.193 1.00 62.31 C ATOM 644 CG LYS A 45 7.419 30.949 1.448 1.00 40.30 C ATOM 645 CD LYS A 45 7.831 31.861 2.591 1.00 5.42 C ATOM 646 CE LYS A 45 9.333 32.107 2.595 1.00 74.43 C ATOM 647 NZ LYS A 45 9.827 32.502 3.943 1.00 72.13 N ATOM 0 H LYS A 45 7.943 33.746 -0.957 1.00 44.42 H new ATOM 0 HA LYS A 45 9.089 31.246 -0.440 1.00 21.04 H new ATOM 0 HB2 LYS A 45 6.934 32.785 0.463 1.00 62.31 H new ATOM 0 HB3 LYS A 45 6.157 31.373 -0.226 1.00 62.31 H new ATOM 0 HG2 LYS A 45 6.550 30.362 1.745 1.00 40.30 H new ATOM 0 HG3 LYS A 45 8.222 30.243 1.236 1.00 40.30 H new ATOM 0 HD2 LYS A 45 7.306 32.812 2.506 1.00 5.42 H new ATOM 0 HD3 LYS A 45 7.532 31.415 3.540 1.00 5.42 H new ATOM 0 HE2 LYS A 45 9.850 31.204 2.269 1.00 74.43 H new ATOM 0 HE3 LYS A 45 9.575 32.890 1.876 1.00 74.43 H new ATOM 0 HZ1 LYS A 45 10.723 32.012 4.142 1.00 72.13 H new ATOM 0 HZ2 LYS A 45 9.981 33.530 3.969 1.00 72.13 H new ATOM 0 HZ3 LYS A 45 9.122 32.240 4.662 1.00 72.13 H new ATOM 661 N GLU A 46 6.863 31.276 -2.876 1.00 32.53 N ATOM 662 CA GLU A 46 6.354 30.508 -4.006 1.00 72.12 C ATOM 663 C GLU A 46 7.488 30.100 -4.942 1.00 41.51 C ATOM 664 O GLU A 46 7.637 28.926 -5.281 1.00 53.44 O ATOM 665 CB GLU A 46 5.311 31.321 -4.775 1.00 54.32 C ATOM 666 CG GLU A 46 3.960 31.391 -4.082 1.00 25.54 C ATOM 667 CD GLU A 46 3.402 30.019 -3.753 1.00 43.45 C ATOM 668 OE1 GLU A 46 2.842 29.373 -4.663 1.00 70.01 O ATOM 669 OE2 GLU A 46 3.526 29.593 -2.586 1.00 64.12 O ATOM 0 H GLU A 46 6.498 32.226 -2.812 1.00 32.53 H new ATOM 0 HA GLU A 46 5.885 29.604 -3.616 1.00 72.12 H new ATOM 0 HB2 GLU A 46 5.688 32.333 -4.921 1.00 54.32 H new ATOM 0 HB3 GLU A 46 5.180 30.884 -5.765 1.00 54.32 H new ATOM 0 HG2 GLU A 46 4.056 31.970 -3.163 1.00 25.54 H new ATOM 0 HG3 GLU A 46 3.255 31.922 -4.721 1.00 25.54 H new ATOM 676 N VAL A 47 8.286 31.080 -5.357 1.00 20.54 N ATOM 677 CA VAL A 47 9.407 30.824 -6.253 1.00 4.22 C ATOM 678 C VAL A 47 10.411 29.868 -5.619 1.00 21.25 C ATOM 679 O VAL A 47 10.874 28.924 -6.257 1.00 60.23 O ATOM 680 CB VAL A 47 10.130 32.130 -6.634 1.00 54.02 C ATOM 681 CG1 VAL A 47 11.152 31.874 -7.731 1.00 2.21 C ATOM 682 CG2 VAL A 47 9.125 33.187 -7.067 1.00 10.22 C ATOM 0 H VAL A 47 8.176 32.057 -5.087 1.00 20.54 H new ATOM 0 HA VAL A 47 8.994 30.369 -7.153 1.00 4.22 H new ATOM 0 HB VAL A 47 10.660 32.502 -5.757 1.00 54.02 H new ATOM 0 HG11 VAL A 47 11.653 32.808 -7.987 1.00 2.21 H new ATOM 0 HG12 VAL A 47 11.889 31.151 -7.380 1.00 2.21 H new ATOM 0 HG13 VAL A 47 10.648 31.479 -8.613 1.00 2.21 H new ATOM 0 HG21 VAL A 47 9.652 34.103 -7.333 1.00 10.22 H new ATOM 0 HG22 VAL A 47 8.567 32.826 -7.931 1.00 10.22 H new ATOM 0 HG23 VAL A 47 8.435 33.390 -6.248 1.00 10.22 H new ATOM 692 N GLY A 48 10.743 30.119 -4.356 1.00 22.13 N ATOM 693 CA GLY A 48 11.690 29.271 -3.655 1.00 41.11 C ATOM 694 C GLY A 48 11.257 27.819 -3.627 1.00 64.31 C ATOM 695 O GLY A 48 12.092 26.914 -3.662 1.00 23.43 O ATOM 0 H GLY A 48 10.373 30.894 -3.806 1.00 22.13 H new ATOM 0 HA2 GLY A 48 12.666 29.347 -4.135 1.00 41.11 H new ATOM 0 HA3 GLY A 48 11.809 29.631 -2.633 1.00 41.11 H new ATOM 699 N LEU A 49 9.950 27.594 -3.563 1.00 32.23 N ATOM 700 CA LEU A 49 9.407 26.240 -3.528 1.00 41.12 C ATOM 701 C LEU A 49 9.706 25.500 -4.828 1.00 41.22 C ATOM 702 O LEU A 49 10.195 24.371 -4.813 1.00 1.11 O ATOM 703 CB LEU A 49 7.897 26.281 -3.287 1.00 61.10 C ATOM 704 CG LEU A 49 7.453 26.382 -1.827 1.00 40.34 C ATOM 705 CD1 LEU A 49 6.070 27.008 -1.732 1.00 43.23 C ATOM 706 CD2 LEU A 49 7.466 25.010 -1.169 1.00 52.15 C ATOM 0 H LEU A 49 9.246 28.331 -3.534 1.00 32.23 H new ATOM 0 HA LEU A 49 9.885 25.704 -2.708 1.00 41.12 H new ATOM 0 HB2 LEU A 49 7.485 27.131 -3.831 1.00 61.10 H new ATOM 0 HB3 LEU A 49 7.456 25.383 -3.719 1.00 61.10 H new ATOM 0 HG LEU A 49 8.157 27.023 -1.297 1.00 40.34 H new ATOM 0 HD11 LEU A 49 5.771 27.072 -0.686 1.00 43.23 H new ATOM 0 HD12 LEU A 49 6.093 28.008 -2.165 1.00 43.23 H new ATOM 0 HD13 LEU A 49 5.354 26.393 -2.277 1.00 43.23 H new ATOM 0 HD21 LEU A 49 7.147 25.101 -0.131 1.00 52.15 H new ATOM 0 HD22 LEU A 49 6.785 24.345 -1.700 1.00 52.15 H new ATOM 0 HD23 LEU A 49 8.475 24.599 -1.204 1.00 52.15 H new ATOM 718 N ALA A 50 9.411 26.146 -5.952 1.00 33.33 N ATOM 719 CA ALA A 50 9.652 25.551 -7.260 1.00 72.14 C ATOM 720 C ALA A 50 11.134 25.254 -7.464 1.00 34.22 C ATOM 721 O ALA A 50 11.500 24.201 -7.988 1.00 41.22 O ATOM 722 CB ALA A 50 9.140 26.469 -8.360 1.00 52.41 C ATOM 0 H ALA A 50 9.005 27.081 -5.982 1.00 33.33 H new ATOM 0 HA ALA A 50 9.109 24.607 -7.307 1.00 72.14 H new ATOM 0 HB1 ALA A 50 9.327 26.012 -9.332 1.00 52.41 H new ATOM 0 HB2 ALA A 50 8.069 26.627 -8.233 1.00 52.41 H new ATOM 0 HB3 ALA A 50 9.657 27.427 -8.304 1.00 52.41 H new ATOM 728 N LEU A 51 11.982 26.187 -7.047 1.00 11.31 N ATOM 729 CA LEU A 51 13.425 26.026 -7.184 1.00 62.30 C ATOM 730 C LEU A 51 13.925 24.858 -6.339 1.00 42.40 C ATOM 731 O LEU A 51 14.506 23.906 -6.860 1.00 1.20 O ATOM 732 CB LEU A 51 14.144 27.312 -6.773 1.00 54.21 C ATOM 733 CG LEU A 51 14.208 28.413 -7.833 1.00 23.43 C ATOM 734 CD1 LEU A 51 13.445 29.644 -7.371 1.00 13.01 C ATOM 735 CD2 LEU A 51 15.655 28.766 -8.147 1.00 13.45 C ATOM 0 H LEU A 51 11.695 27.063 -6.611 1.00 11.31 H new ATOM 0 HA LEU A 51 13.644 25.814 -8.231 1.00 62.30 H new ATOM 0 HB2 LEU A 51 13.649 27.715 -5.889 1.00 54.21 H new ATOM 0 HB3 LEU A 51 15.163 27.057 -6.480 1.00 54.21 H new ATOM 0 HG LEU A 51 13.739 28.042 -8.744 1.00 23.43 H new ATOM 0 HD11 LEU A 51 13.502 30.416 -8.138 1.00 13.01 H new ATOM 0 HD12 LEU A 51 12.402 29.381 -7.197 1.00 13.01 H new ATOM 0 HD13 LEU A 51 13.884 30.018 -6.446 1.00 13.01 H new ATOM 0 HD21 LEU A 51 15.682 29.551 -8.903 1.00 13.45 H new ATOM 0 HD22 LEU A 51 16.149 29.118 -7.241 1.00 13.45 H new ATOM 0 HD23 LEU A 51 16.172 27.883 -8.522 1.00 13.45 H new ATOM 747 N ARG A 52 13.694 24.938 -5.033 1.00 15.32 N ATOM 748 CA ARG A 52 14.120 23.888 -4.116 1.00 15.03 C ATOM 749 C ARG A 52 13.532 22.540 -4.523 1.00 21.24 C ATOM 750 O ARG A 52 14.244 21.538 -4.603 1.00 2.22 O ATOM 751 CB ARG A 52 13.698 24.229 -2.685 1.00 44.01 C ATOM 752 CG ARG A 52 14.230 23.256 -1.645 1.00 74.25 C ATOM 753 CD ARG A 52 13.118 22.390 -1.073 1.00 52.50 C ATOM 754 NE ARG A 52 12.124 23.182 -0.352 1.00 63.13 N ATOM 755 CZ ARG A 52 11.258 22.664 0.512 1.00 44.12 C ATOM 756 NH1 ARG A 52 11.264 21.362 0.762 1.00 64.03 N ATOM 757 NH2 ARG A 52 10.384 23.449 1.128 1.00 5.44 N ATOM 0 H ARG A 52 13.214 25.719 -4.586 1.00 15.32 H new ATOM 0 HA ARG A 52 15.207 23.820 -4.161 1.00 15.03 H new ATOM 0 HB2 ARG A 52 14.046 25.233 -2.442 1.00 44.01 H new ATOM 0 HB3 ARG A 52 12.610 24.247 -2.631 1.00 44.01 H new ATOM 0 HG2 ARG A 52 14.992 22.621 -2.096 1.00 74.25 H new ATOM 0 HG3 ARG A 52 14.712 23.810 -0.840 1.00 74.25 H new ATOM 0 HD2 ARG A 52 12.631 21.845 -1.881 1.00 52.50 H new ATOM 0 HD3 ARG A 52 13.547 21.647 -0.401 1.00 52.50 H new ATOM 0 HE ARG A 52 12.093 24.187 -0.521 1.00 63.13 H new ATOM 0 HH11 ARG A 52 11.935 20.755 0.290 1.00 64.03 H new ATOM 0 HH12 ARG A 52 10.598 20.967 1.426 1.00 64.03 H new ATOM 0 HH21 ARG A 52 10.376 24.451 0.938 1.00 5.44 H new ATOM 0 HH22 ARG A 52 9.719 23.050 1.791 1.00 5.44 H new ATOM 771 N THR A 53 12.228 22.521 -4.778 1.00 54.24 N ATOM 772 CA THR A 53 11.544 21.297 -5.175 1.00 72.21 C ATOM 773 C THR A 53 12.099 20.758 -6.489 1.00 14.23 C ATOM 774 O THR A 53 12.270 19.549 -6.653 1.00 54.42 O ATOM 775 CB THR A 53 10.028 21.524 -5.326 1.00 33.42 C ATOM 776 OG1 THR A 53 9.475 21.981 -4.087 1.00 2.35 O ATOM 777 CG2 THR A 53 9.329 20.243 -5.756 1.00 61.40 C ATOM 0 H THR A 53 11.624 23.340 -4.717 1.00 54.24 H new ATOM 0 HA THR A 53 11.718 20.568 -4.384 1.00 72.21 H new ATOM 0 HB THR A 53 9.872 22.281 -6.095 1.00 33.42 H new ATOM 0 HG1 THR A 53 9.367 22.955 -4.116 1.00 2.35 H new ATOM 0 HG21 THR A 53 8.259 20.428 -5.856 1.00 61.40 H new ATOM 0 HG22 THR A 53 9.731 19.913 -6.714 1.00 61.40 H new ATOM 0 HG23 THR A 53 9.495 19.469 -5.007 1.00 61.40 H new ATOM 785 N LEU A 54 12.379 21.661 -7.422 1.00 1.34 N ATOM 786 CA LEU A 54 12.916 21.277 -8.722 1.00 62.52 C ATOM 787 C LEU A 54 14.137 20.377 -8.562 1.00 65.24 C ATOM 788 O LEU A 54 14.284 19.379 -9.270 1.00 32.02 O ATOM 789 CB LEU A 54 13.287 22.521 -9.531 1.00 64.41 C ATOM 790 CG LEU A 54 12.235 23.014 -10.525 1.00 63.41 C ATOM 791 CD1 LEU A 54 12.610 24.386 -11.063 1.00 25.30 C ATOM 792 CD2 LEU A 54 12.071 22.019 -11.665 1.00 31.32 C ATOM 0 H LEU A 54 12.243 22.665 -7.302 1.00 1.34 H new ATOM 0 HA LEU A 54 12.145 20.721 -9.256 1.00 62.52 H new ATOM 0 HB2 LEU A 54 13.507 23.330 -8.835 1.00 64.41 H new ATOM 0 HB3 LEU A 54 14.206 22.313 -10.079 1.00 64.41 H new ATOM 0 HG LEU A 54 11.282 23.099 -10.003 1.00 63.41 H new ATOM 0 HD11 LEU A 54 11.850 24.720 -11.769 1.00 25.30 H new ATOM 0 HD12 LEU A 54 12.676 25.095 -10.238 1.00 25.30 H new ATOM 0 HD13 LEU A 54 13.574 24.328 -11.569 1.00 25.30 H new ATOM 0 HD21 LEU A 54 11.318 22.386 -12.363 1.00 31.32 H new ATOM 0 HD22 LEU A 54 13.022 21.902 -12.185 1.00 31.32 H new ATOM 0 HD23 LEU A 54 11.755 21.056 -11.265 1.00 31.32 H new ATOM 804 N LEU A 55 15.011 20.735 -7.628 1.00 30.53 N ATOM 805 CA LEU A 55 16.219 19.958 -7.373 1.00 5.24 C ATOM 806 C LEU A 55 15.885 18.486 -7.154 1.00 41.12 C ATOM 807 O LEU A 55 16.506 17.604 -7.746 1.00 62.10 O ATOM 808 CB LEU A 55 16.957 20.512 -6.152 1.00 71.02 C ATOM 809 CG LEU A 55 18.474 20.649 -6.290 1.00 14.14 C ATOM 810 CD1 LEU A 55 18.983 21.808 -5.447 1.00 43.00 C ATOM 811 CD2 LEU A 55 19.165 19.353 -5.891 1.00 54.21 C ATOM 0 H LEU A 55 14.906 21.558 -7.035 1.00 30.53 H new ATOM 0 HA LEU A 55 16.864 20.038 -8.248 1.00 5.24 H new ATOM 0 HB2 LEU A 55 16.544 21.493 -5.917 1.00 71.02 H new ATOM 0 HB3 LEU A 55 16.747 19.865 -5.301 1.00 71.02 H new ATOM 0 HG LEU A 55 18.708 20.855 -7.334 1.00 14.14 H new ATOM 0 HD11 LEU A 55 20.064 21.891 -5.557 1.00 43.00 H new ATOM 0 HD12 LEU A 55 18.513 22.734 -5.779 1.00 43.00 H new ATOM 0 HD13 LEU A 55 18.738 21.632 -4.400 1.00 43.00 H new ATOM 0 HD21 LEU A 55 20.244 19.469 -5.995 1.00 54.21 H new ATOM 0 HD22 LEU A 55 18.924 19.116 -4.855 1.00 54.21 H new ATOM 0 HD23 LEU A 55 18.823 18.544 -6.537 1.00 54.21 H new ATOM 823 N ALA A 56 14.898 18.229 -6.302 1.00 62.11 N ATOM 824 CA ALA A 56 14.478 16.864 -6.009 1.00 1.30 C ATOM 825 C ALA A 56 13.695 16.269 -7.174 1.00 32.21 C ATOM 826 O ALA A 56 13.885 15.107 -7.535 1.00 62.10 O ATOM 827 CB ALA A 56 13.644 16.831 -4.737 1.00 74.42 C ATOM 0 H ALA A 56 14.374 18.948 -5.803 1.00 62.11 H new ATOM 0 HA ALA A 56 15.372 16.258 -5.860 1.00 1.30 H new ATOM 0 HB1 ALA A 56 13.337 15.806 -4.530 1.00 74.42 H new ATOM 0 HB2 ALA A 56 14.237 17.208 -3.903 1.00 74.42 H new ATOM 0 HB3 ALA A 56 12.760 17.456 -4.865 1.00 74.42 H new ATOM 833 N THR A 57 12.812 17.072 -7.759 1.00 75.22 N ATOM 834 CA THR A 57 11.998 16.624 -8.882 1.00 72.42 C ATOM 835 C THR A 57 12.868 16.088 -10.013 1.00 25.52 C ATOM 836 O THR A 57 12.778 14.915 -10.377 1.00 53.24 O ATOM 837 CB THR A 57 11.114 17.762 -9.426 1.00 3.44 C ATOM 838 OG1 THR A 57 10.579 18.527 -8.340 1.00 55.41 O ATOM 839 CG2 THR A 57 9.978 17.209 -10.272 1.00 70.10 C ATOM 0 H THR A 57 12.642 18.036 -7.473 1.00 75.22 H new ATOM 0 HA THR A 57 11.359 15.824 -8.508 1.00 72.42 H new ATOM 0 HB THR A 57 11.732 18.404 -10.053 1.00 3.44 H new ATOM 0 HG1 THR A 57 11.290 19.071 -7.942 1.00 55.41 H new ATOM 0 HG21 THR A 57 9.368 18.032 -10.645 1.00 70.10 H new ATOM 0 HG22 THR A 57 10.389 16.652 -11.114 1.00 70.10 H new ATOM 0 HG23 THR A 57 9.361 16.546 -9.665 1.00 70.10 H new ATOM 847 N VAL A 58 13.713 16.953 -10.564 1.00 43.03 N ATOM 848 CA VAL A 58 14.602 16.566 -11.653 1.00 24.40 C ATOM 849 C VAL A 58 15.485 15.390 -11.250 1.00 21.13 C ATOM 850 O VAL A 58 15.792 14.522 -12.067 1.00 33.42 O ATOM 851 CB VAL A 58 15.498 17.740 -12.091 1.00 22.42 C ATOM 852 CG1 VAL A 58 16.356 18.218 -10.930 1.00 4.52 C ATOM 853 CG2 VAL A 58 16.365 17.335 -13.274 1.00 12.51 C ATOM 0 H VAL A 58 13.801 17.927 -10.274 1.00 43.03 H new ATOM 0 HA VAL A 58 13.968 16.271 -12.489 1.00 24.40 H new ATOM 0 HB VAL A 58 14.859 18.566 -12.404 1.00 22.42 H new ATOM 0 HG11 VAL A 58 16.982 19.048 -11.258 1.00 4.52 H new ATOM 0 HG12 VAL A 58 15.713 18.549 -10.115 1.00 4.52 H new ATOM 0 HG13 VAL A 58 16.989 17.400 -10.584 1.00 4.52 H new ATOM 0 HG21 VAL A 58 16.992 18.176 -13.571 1.00 12.51 H new ATOM 0 HG22 VAL A 58 16.997 16.494 -12.991 1.00 12.51 H new ATOM 0 HG23 VAL A 58 15.728 17.045 -14.110 1.00 12.51 H new ATOM 863 N ASP A 59 15.890 15.368 -9.985 1.00 3.32 N ATOM 864 CA ASP A 59 16.737 14.298 -9.471 1.00 62.24 C ATOM 865 C ASP A 59 16.083 12.937 -9.687 1.00 62.42 C ATOM 866 O ASP A 59 16.768 11.934 -9.889 1.00 54.24 O ATOM 867 CB ASP A 59 17.020 14.511 -7.984 1.00 1.44 C ATOM 868 CG ASP A 59 17.995 13.492 -7.427 1.00 52.04 C ATOM 869 OD1 ASP A 59 18.831 12.986 -8.204 1.00 41.03 O ATOM 870 OD2 ASP A 59 17.921 13.200 -6.215 1.00 73.53 O ATOM 0 H ASP A 59 15.645 16.079 -9.296 1.00 3.32 H new ATOM 0 HA ASP A 59 17.679 14.320 -10.018 1.00 62.24 H new ATOM 0 HB2 ASP A 59 17.421 15.513 -7.834 1.00 1.44 H new ATOM 0 HB3 ASP A 59 16.084 14.456 -7.428 1.00 1.44 H new ATOM 875 N GLU A 60 14.755 12.910 -9.641 1.00 71.15 N ATOM 876 CA GLU A 60 14.009 11.671 -9.830 1.00 64.02 C ATOM 877 C GLU A 60 13.784 11.392 -11.313 1.00 52.34 C ATOM 878 O GLU A 60 13.536 10.254 -11.711 1.00 53.24 O ATOM 879 CB GLU A 60 12.665 11.743 -9.103 1.00 71.13 C ATOM 880 CG GLU A 60 11.960 10.401 -8.994 1.00 12.45 C ATOM 881 CD GLU A 60 11.542 10.077 -7.573 1.00 35.24 C ATOM 882 OE1 GLU A 60 11.095 10.999 -6.859 1.00 50.35 O ATOM 883 OE2 GLU A 60 11.661 8.899 -7.174 1.00 52.12 O ATOM 0 H GLU A 60 14.174 13.731 -9.475 1.00 71.15 H new ATOM 0 HA GLU A 60 14.597 10.855 -9.410 1.00 64.02 H new ATOM 0 HB2 GLU A 60 12.824 12.143 -8.102 1.00 71.13 H new ATOM 0 HB3 GLU A 60 12.015 12.444 -9.627 1.00 71.13 H new ATOM 0 HG2 GLU A 60 11.079 10.404 -9.636 1.00 12.45 H new ATOM 0 HG3 GLU A 60 12.621 9.616 -9.363 1.00 12.45 H new ATOM 890 N SER A 61 13.871 12.440 -12.126 1.00 43.24 N ATOM 891 CA SER A 61 13.673 12.310 -13.565 1.00 54.22 C ATOM 892 C SER A 61 14.869 11.625 -14.219 1.00 53.11 C ATOM 893 O SER A 61 14.747 11.024 -15.287 1.00 44.14 O ATOM 894 CB SER A 61 13.450 13.686 -14.197 1.00 21.30 C ATOM 895 OG SER A 61 14.665 14.222 -14.693 1.00 33.34 O ATOM 0 H SER A 61 14.077 13.389 -11.813 1.00 43.24 H new ATOM 0 HA SER A 61 12.789 11.694 -13.731 1.00 54.22 H new ATOM 0 HB2 SER A 61 12.727 13.604 -15.008 1.00 21.30 H new ATOM 0 HB3 SER A 61 13.024 14.365 -13.458 1.00 21.30 H new ATOM 0 HG SER A 61 15.270 14.409 -13.945 1.00 33.34 H new ATOM 901 N LEU A 62 16.024 11.720 -13.570 1.00 61.04 N ATOM 902 CA LEU A 62 17.244 11.110 -14.087 1.00 61.23 C ATOM 903 C LEU A 62 17.015 9.641 -14.431 1.00 3.42 C ATOM 904 O LEU A 62 17.162 9.216 -15.577 1.00 51.40 O ATOM 905 CB LEU A 62 18.374 11.236 -13.064 1.00 20.21 C ATOM 906 CG LEU A 62 19.502 12.203 -13.425 1.00 12.20 C ATOM 907 CD1 LEU A 62 20.393 12.458 -12.219 1.00 63.54 C ATOM 908 CD2 LEU A 62 20.318 11.660 -14.589 1.00 51.40 C ATOM 0 H LEU A 62 16.141 12.213 -12.685 1.00 61.04 H new ATOM 0 HA LEU A 62 17.527 11.638 -14.998 1.00 61.23 H new ATOM 0 HB2 LEU A 62 17.943 11.551 -12.114 1.00 20.21 H new ATOM 0 HB3 LEU A 62 18.806 10.248 -12.906 1.00 20.21 H new ATOM 0 HG LEU A 62 19.059 13.151 -13.730 1.00 12.20 H new ATOM 0 HD11 LEU A 62 21.190 13.148 -12.495 1.00 63.54 H new ATOM 0 HD12 LEU A 62 19.800 12.892 -11.414 1.00 63.54 H new ATOM 0 HD13 LEU A 62 20.828 11.517 -11.883 1.00 63.54 H new ATOM 0 HD21 LEU A 62 21.116 12.361 -14.832 1.00 51.40 H new ATOM 0 HD22 LEU A 62 20.751 10.699 -14.313 1.00 51.40 H new ATOM 0 HD23 LEU A 62 19.672 11.531 -15.457 1.00 51.40 H new ATOM 920 N PRO A 63 16.645 8.847 -13.416 1.00 31.32 N ATOM 921 CA PRO A 63 16.385 7.414 -13.586 1.00 51.12 C ATOM 922 C PRO A 63 15.116 7.147 -14.388 1.00 35.33 C ATOM 923 O PRO A 63 15.099 6.296 -15.277 1.00 74.41 O ATOM 924 CB PRO A 63 16.227 6.909 -12.150 1.00 32.01 C ATOM 925 CG PRO A 63 15.787 8.103 -11.375 1.00 32.32 C ATOM 926 CD PRO A 63 16.451 9.286 -12.024 1.00 30.44 C ATOM 0 HA PRO A 63 17.181 6.918 -14.141 1.00 51.12 H new ATOM 0 HB2 PRO A 63 15.492 6.106 -12.091 1.00 32.01 H new ATOM 0 HB3 PRO A 63 17.166 6.511 -11.765 1.00 32.01 H new ATOM 0 HG2 PRO A 63 14.702 8.204 -11.397 1.00 32.32 H new ATOM 0 HG3 PRO A 63 16.078 8.018 -10.328 1.00 32.32 H new ATOM 0 HD2 PRO A 63 15.827 10.178 -11.967 1.00 30.44 H new ATOM 0 HD3 PRO A 63 17.399 9.529 -11.543 1.00 30.44 H new ATOM 934 N VAL A 64 14.054 7.879 -14.067 1.00 55.14 N ATOM 935 CA VAL A 64 12.780 7.722 -14.759 1.00 34.11 C ATOM 936 C VAL A 64 12.963 7.794 -16.271 1.00 35.23 C ATOM 937 O VAL A 64 12.285 7.092 -17.023 1.00 40.33 O ATOM 938 CB VAL A 64 11.768 8.799 -14.323 1.00 70.45 C ATOM 939 CG1 VAL A 64 10.507 8.721 -15.171 1.00 20.54 C ATOM 940 CG2 VAL A 64 11.437 8.652 -12.846 1.00 4.01 C ATOM 0 H VAL A 64 14.051 8.587 -13.332 1.00 55.14 H new ATOM 0 HA VAL A 64 12.392 6.740 -14.490 1.00 34.11 H new ATOM 0 HB VAL A 64 12.219 9.780 -14.475 1.00 70.45 H new ATOM 0 HG11 VAL A 64 9.804 9.489 -14.849 1.00 20.54 H new ATOM 0 HG12 VAL A 64 10.763 8.880 -16.219 1.00 20.54 H new ATOM 0 HG13 VAL A 64 10.050 7.738 -15.054 1.00 20.54 H new ATOM 0 HG21 VAL A 64 10.721 9.421 -12.555 1.00 4.01 H new ATOM 0 HG22 VAL A 64 11.005 7.667 -12.666 1.00 4.01 H new ATOM 0 HG23 VAL A 64 12.347 8.762 -12.256 1.00 4.01 H new ATOM 950 N LEU A 65 13.882 8.646 -16.710 1.00 25.51 N ATOM 951 CA LEU A 65 14.156 8.809 -18.133 1.00 40.44 C ATOM 952 C LEU A 65 15.456 8.113 -18.522 1.00 23.13 C ATOM 953 O LEU A 65 16.317 7.840 -17.685 1.00 1.12 O ATOM 954 CB LEU A 65 14.234 10.295 -18.490 1.00 74.12 C ATOM 955 CG LEU A 65 12.898 10.995 -18.743 1.00 40.04 C ATOM 956 CD1 LEU A 65 12.206 10.401 -19.960 1.00 60.32 C ATOM 957 CD2 LEU A 65 12.003 10.896 -17.517 1.00 32.52 C ATOM 0 H LEU A 65 14.450 9.235 -16.101 1.00 25.51 H new ATOM 0 HA LEU A 65 13.339 8.349 -18.689 1.00 40.44 H new ATOM 0 HB2 LEU A 65 14.747 10.816 -17.682 1.00 74.12 H new ATOM 0 HB3 LEU A 65 14.852 10.402 -19.381 1.00 74.12 H new ATOM 0 HG LEU A 65 13.094 12.049 -18.940 1.00 40.04 H new ATOM 0 HD11 LEU A 65 11.257 10.912 -20.124 1.00 60.32 H new ATOM 0 HD12 LEU A 65 12.842 10.525 -20.837 1.00 60.32 H new ATOM 0 HD13 LEU A 65 12.023 9.340 -19.792 1.00 60.32 H new ATOM 0 HD21 LEU A 65 11.057 11.400 -17.716 1.00 32.52 H new ATOM 0 HD22 LEU A 65 11.815 9.847 -17.288 1.00 32.52 H new ATOM 0 HD23 LEU A 65 12.495 11.370 -16.668 1.00 32.52 H new ATOM 969 N PRO A 66 15.605 7.819 -19.822 1.00 41.30 N ATOM 970 CA PRO A 66 16.799 7.153 -20.352 1.00 11.44 C ATOM 971 C PRO A 66 18.030 8.053 -20.313 1.00 55.02 C ATOM 972 O PRO A 66 17.964 9.226 -20.679 1.00 40.10 O ATOM 973 CB PRO A 66 16.415 6.834 -21.799 1.00 13.44 C ATOM 974 CG PRO A 66 15.377 7.845 -22.146 1.00 74.24 C ATOM 975 CD PRO A 66 14.620 8.115 -20.875 1.00 53.25 C ATOM 0 HA PRO A 66 17.070 6.275 -19.766 1.00 11.44 H new ATOM 0 HB2 PRO A 66 17.277 6.907 -22.463 1.00 13.44 H new ATOM 0 HB3 PRO A 66 16.027 5.820 -21.891 1.00 13.44 H new ATOM 0 HG2 PRO A 66 15.834 8.757 -22.529 1.00 74.24 H new ATOM 0 HG3 PRO A 66 14.712 7.470 -22.924 1.00 74.24 H new ATOM 0 HD2 PRO A 66 14.276 9.148 -20.824 1.00 53.25 H new ATOM 0 HD3 PRO A 66 13.738 7.480 -20.790 1.00 53.25 H new ATOM 983 N ALA A 67 19.151 7.495 -19.868 1.00 52.33 N ATOM 984 CA ALA A 67 20.397 8.247 -19.785 1.00 31.13 C ATOM 985 C ALA A 67 20.747 8.880 -21.127 1.00 0.30 C ATOM 986 O ALA A 67 20.817 8.196 -22.148 1.00 20.23 O ATOM 987 CB ALA A 67 21.527 7.344 -19.314 1.00 64.12 C ATOM 0 H ALA A 67 19.222 6.525 -19.560 1.00 52.33 H new ATOM 0 HA ALA A 67 20.261 9.049 -19.060 1.00 31.13 H new ATOM 0 HB1 ALA A 67 22.452 7.918 -19.256 1.00 64.12 H new ATOM 0 HB2 ALA A 67 21.286 6.944 -18.329 1.00 64.12 H new ATOM 0 HB3 ALA A 67 21.654 6.522 -20.019 1.00 64.12 H new ATOM 993 N SER A 68 20.965 10.191 -21.118 1.00 43.45 N ATOM 994 CA SER A 68 21.304 10.918 -22.337 1.00 33.13 C ATOM 995 C SER A 68 21.464 12.409 -22.054 1.00 34.45 C ATOM 996 O SER A 68 22.284 13.087 -22.674 1.00 33.44 O ATOM 997 CB SER A 68 20.226 10.702 -23.401 1.00 13.14 C ATOM 998 OG SER A 68 19.007 10.279 -22.814 1.00 3.05 O ATOM 0 H SER A 68 20.913 10.772 -20.281 1.00 43.45 H new ATOM 0 HA SER A 68 22.254 10.533 -22.708 1.00 33.13 H new ATOM 0 HB2 SER A 68 20.065 11.628 -23.953 1.00 13.14 H new ATOM 0 HB3 SER A 68 20.565 9.956 -24.120 1.00 13.14 H new ATOM 0 HG SER A 68 18.839 9.342 -23.048 1.00 3.05 H new ATOM 1004 N THR A 69 20.673 12.914 -21.111 1.00 62.24 N ATOM 1005 CA THR A 69 20.725 14.324 -20.746 1.00 33.44 C ATOM 1006 C THR A 69 21.274 14.506 -19.335 1.00 72.03 C ATOM 1007 O THR A 69 20.957 15.483 -18.656 1.00 52.24 O ATOM 1008 CB THR A 69 19.333 14.977 -20.831 1.00 15.32 C ATOM 1009 OG1 THR A 69 19.437 16.385 -20.588 1.00 75.32 O ATOM 1010 CG2 THR A 69 18.379 14.353 -19.823 1.00 60.02 C ATOM 0 H THR A 69 19.990 12.367 -20.587 1.00 62.24 H new ATOM 0 HA THR A 69 21.391 14.811 -21.458 1.00 33.44 H new ATOM 0 HB THR A 69 18.938 14.809 -21.833 1.00 15.32 H new ATOM 0 HG1 THR A 69 19.746 16.537 -19.670 1.00 75.32 H new ATOM 0 HG21 THR A 69 17.402 14.831 -19.902 1.00 60.02 H new ATOM 0 HG22 THR A 69 18.279 13.287 -20.028 1.00 60.02 H new ATOM 0 HG23 THR A 69 18.771 14.494 -18.816 1.00 60.02 H new ATOM 1018 N HIS A 70 22.100 13.560 -18.900 1.00 34.32 N ATOM 1019 CA HIS A 70 22.694 13.617 -17.569 1.00 44.32 C ATOM 1020 C HIS A 70 23.476 14.914 -17.379 1.00 62.32 C ATOM 1021 O HIS A 70 23.319 15.602 -16.371 1.00 0.40 O ATOM 1022 CB HIS A 70 23.614 12.416 -17.346 1.00 51.22 C ATOM 1023 CG HIS A 70 24.602 12.205 -18.451 1.00 44.34 C ATOM 1024 ND1 HIS A 70 25.874 12.739 -18.436 1.00 31.32 N ATOM 1025 CD2 HIS A 70 24.501 11.513 -19.610 1.00 32.52 C ATOM 1026 CE1 HIS A 70 26.511 12.385 -19.538 1.00 20.44 C ATOM 1027 NE2 HIS A 70 25.700 11.640 -20.267 1.00 31.32 N ATOM 0 H HIS A 70 22.373 12.745 -19.449 1.00 34.32 H new ATOM 0 HA HIS A 70 21.888 13.588 -16.836 1.00 44.32 H new ATOM 0 HB2 HIS A 70 24.153 12.551 -16.408 1.00 51.22 H new ATOM 0 HB3 HIS A 70 23.006 11.518 -17.237 1.00 51.22 H new ATOM 0 HD2 HIS A 70 23.638 10.963 -19.954 1.00 32.52 H new ATOM 0 HE1 HIS A 70 27.523 12.658 -19.798 1.00 20.44 H new ATOM 0 HE2 HIS A 70 25.927 11.226 -21.171 1.00 31.32 H new ATOM 1035 N ARG A 71 24.319 15.239 -18.354 1.00 52.21 N ATOM 1036 CA ARG A 71 25.126 16.451 -18.293 1.00 3.51 C ATOM 1037 C ARG A 71 24.256 17.670 -17.997 1.00 64.20 C ATOM 1038 O ARG A 71 24.479 18.380 -17.017 1.00 64.31 O ATOM 1039 CB ARG A 71 25.878 16.656 -19.609 1.00 62.03 C ATOM 1040 CG ARG A 71 27.275 17.228 -19.430 1.00 61.44 C ATOM 1041 CD ARG A 71 27.292 18.733 -19.642 1.00 0.54 C ATOM 1042 NE ARG A 71 28.571 19.197 -20.173 1.00 52.31 N ATOM 1043 CZ ARG A 71 28.982 18.956 -21.413 1.00 41.50 C ATOM 1044 NH1 ARG A 71 28.219 18.261 -22.245 1.00 11.11 N ATOM 1045 NH2 ARG A 71 30.159 19.412 -21.823 1.00 51.13 N ATOM 0 H ARG A 71 24.461 14.680 -19.195 1.00 52.21 H new ATOM 0 HA ARG A 71 25.848 16.336 -17.484 1.00 3.51 H new ATOM 0 HB2 ARG A 71 25.950 15.701 -20.129 1.00 62.03 H new ATOM 0 HB3 ARG A 71 25.300 17.324 -20.248 1.00 62.03 H new ATOM 0 HG2 ARG A 71 27.639 16.996 -18.429 1.00 61.44 H new ATOM 0 HG3 ARG A 71 27.957 16.752 -20.135 1.00 61.44 H new ATOM 0 HD2 ARG A 71 26.492 19.011 -20.328 1.00 0.54 H new ATOM 0 HD3 ARG A 71 27.089 19.235 -18.696 1.00 0.54 H new ATOM 0 HE ARG A 71 29.182 19.735 -19.558 1.00 52.31 H new ATOM 0 HH11 ARG A 71 27.313 17.910 -21.934 1.00 11.11 H new ATOM 0 HH12 ARG A 71 28.537 18.078 -23.197 1.00 11.11 H new ATOM 0 HH21 ARG A 71 30.748 19.948 -21.186 1.00 51.13 H new ATOM 0 HH22 ARG A 71 30.474 19.227 -22.775 1.00 51.13 H new ATOM 1059 N GLU A 72 23.266 17.905 -18.852 1.00 35.34 N ATOM 1060 CA GLU A 72 22.364 19.038 -18.682 1.00 33.13 C ATOM 1061 C GLU A 72 21.773 19.057 -17.275 1.00 2.13 C ATOM 1062 O GLU A 72 21.912 20.040 -16.546 1.00 20.45 O ATOM 1063 CB GLU A 72 21.239 18.983 -19.718 1.00 2.11 C ATOM 1064 CG GLU A 72 21.447 19.925 -20.892 1.00 60.11 C ATOM 1065 CD GLU A 72 20.157 20.237 -21.625 1.00 13.32 C ATOM 1066 OE1 GLU A 72 19.078 20.102 -21.011 1.00 54.13 O ATOM 1067 OE2 GLU A 72 20.227 20.618 -22.812 1.00 72.33 O ATOM 0 H GLU A 72 23.068 17.327 -19.669 1.00 35.34 H new ATOM 0 HA GLU A 72 22.939 19.952 -18.829 1.00 33.13 H new ATOM 0 HB2 GLU A 72 21.151 17.963 -20.092 1.00 2.11 H new ATOM 0 HB3 GLU A 72 20.295 19.226 -19.230 1.00 2.11 H new ATOM 0 HG2 GLU A 72 21.891 20.854 -20.534 1.00 60.11 H new ATOM 0 HG3 GLU A 72 22.158 19.480 -21.588 1.00 60.11 H new ATOM 1074 N ILE A 73 21.114 17.966 -16.901 1.00 61.43 N ATOM 1075 CA ILE A 73 20.503 17.857 -15.582 1.00 70.44 C ATOM 1076 C ILE A 73 21.518 18.141 -14.481 1.00 3.21 C ATOM 1077 O ILE A 73 21.189 18.748 -13.462 1.00 61.31 O ATOM 1078 CB ILE A 73 19.896 16.459 -15.357 1.00 10.20 C ATOM 1079 CG1 ILE A 73 18.811 16.177 -16.398 1.00 32.31 C ATOM 1080 CG2 ILE A 73 19.329 16.349 -13.949 1.00 61.25 C ATOM 1081 CD1 ILE A 73 17.613 17.094 -16.287 1.00 4.31 C ATOM 0 H ILE A 73 20.989 17.145 -17.493 1.00 61.43 H new ATOM 0 HA ILE A 73 19.707 18.601 -15.540 1.00 70.44 H new ATOM 0 HB ILE A 73 20.683 15.714 -15.470 1.00 10.20 H new ATOM 0 HG12 ILE A 73 19.241 16.274 -17.395 1.00 32.31 H new ATOM 0 HG13 ILE A 73 18.479 15.144 -16.294 1.00 32.31 H new ATOM 0 HG21 ILE A 73 18.904 15.356 -13.805 1.00 61.25 H new ATOM 0 HG22 ILE A 73 20.125 16.512 -13.222 1.00 61.25 H new ATOM 0 HG23 ILE A 73 18.552 17.100 -13.810 1.00 61.25 H new ATOM 0 HD11 ILE A 73 16.885 16.836 -17.056 1.00 4.31 H new ATOM 0 HD12 ILE A 73 17.158 16.980 -15.303 1.00 4.31 H new ATOM 0 HD13 ILE A 73 17.932 18.127 -16.422 1.00 4.31 H new ATOM 1093 N GLU A 74 22.754 17.700 -14.694 1.00 42.43 N ATOM 1094 CA GLU A 74 23.818 17.909 -13.719 1.00 40.11 C ATOM 1095 C GLU A 74 24.048 19.398 -13.475 1.00 34.23 C ATOM 1096 O GLU A 74 24.045 19.858 -12.333 1.00 72.33 O ATOM 1097 CB GLU A 74 25.115 17.254 -14.198 1.00 61.21 C ATOM 1098 CG GLU A 74 25.465 15.978 -13.450 1.00 1.51 C ATOM 1099 CD GLU A 74 25.807 16.231 -11.994 1.00 52.23 C ATOM 1100 OE1 GLU A 74 26.351 17.314 -11.693 1.00 14.43 O ATOM 1101 OE2 GLU A 74 25.531 15.347 -11.157 1.00 60.43 O ATOM 0 H GLU A 74 23.043 17.196 -15.532 1.00 42.43 H new ATOM 0 HA GLU A 74 23.511 17.447 -12.780 1.00 40.11 H new ATOM 0 HB2 GLU A 74 25.028 17.030 -15.261 1.00 61.21 H new ATOM 0 HB3 GLU A 74 25.933 17.966 -14.088 1.00 61.21 H new ATOM 0 HG2 GLU A 74 24.625 15.286 -13.507 1.00 1.51 H new ATOM 0 HG3 GLU A 74 26.311 15.495 -13.939 1.00 1.51 H new ATOM 1108 N MET A 75 24.247 20.145 -14.556 1.00 13.14 N ATOM 1109 CA MET A 75 24.477 21.582 -14.459 1.00 23.20 C ATOM 1110 C MET A 75 23.199 22.312 -14.059 1.00 61.12 C ATOM 1111 O MET A 75 23.248 23.398 -13.483 1.00 41.32 O ATOM 1112 CB MET A 75 24.995 22.128 -15.791 1.00 72.42 C ATOM 1113 CG MET A 75 23.982 22.035 -16.921 1.00 33.14 C ATOM 1114 SD MET A 75 24.452 23.016 -18.358 1.00 43.22 S ATOM 1115 CE MET A 75 26.157 22.509 -18.571 1.00 0.22 C ATOM 0 H MET A 75 24.254 19.780 -15.508 1.00 13.14 H new ATOM 0 HA MET A 75 25.228 21.753 -13.688 1.00 23.20 H new ATOM 0 HB2 MET A 75 25.285 23.170 -15.659 1.00 72.42 H new ATOM 0 HB3 MET A 75 25.894 21.580 -16.074 1.00 72.42 H new ATOM 0 HG2 MET A 75 23.870 20.992 -17.219 1.00 33.14 H new ATOM 0 HG3 MET A 75 23.009 22.369 -16.560 1.00 33.14 H new ATOM 0 HE1 MET A 75 26.468 22.701 -19.598 1.00 0.22 H new ATOM 0 HE2 MET A 75 26.792 23.073 -17.888 1.00 0.22 H new ATOM 0 HE3 MET A 75 26.249 21.444 -18.357 1.00 0.22 H new ATOM 1125 N ALA A 76 22.056 21.708 -14.369 1.00 4.10 N ATOM 1126 CA ALA A 76 20.766 22.300 -14.040 1.00 52.42 C ATOM 1127 C ALA A 76 20.567 22.380 -12.530 1.00 73.34 C ATOM 1128 O ALA A 76 19.954 23.320 -12.025 1.00 71.32 O ATOM 1129 CB ALA A 76 19.640 21.503 -14.682 1.00 22.32 C ATOM 0 H ALA A 76 21.998 20.809 -14.848 1.00 4.10 H new ATOM 0 HA ALA A 76 20.749 23.315 -14.436 1.00 52.42 H new ATOM 0 HB1 ALA A 76 18.682 21.957 -14.428 1.00 22.32 H new ATOM 0 HB2 ALA A 76 19.766 21.503 -15.765 1.00 22.32 H new ATOM 0 HB3 ALA A 76 19.665 20.477 -14.314 1.00 22.32 H new ATOM 1135 N GLN A 77 21.088 21.387 -11.817 1.00 33.04 N ATOM 1136 CA GLN A 77 20.965 21.345 -10.364 1.00 62.13 C ATOM 1137 C GLN A 77 21.663 22.540 -9.724 1.00 42.32 C ATOM 1138 O GLN A 77 21.019 23.403 -9.127 1.00 33.20 O ATOM 1139 CB GLN A 77 21.555 20.043 -9.819 1.00 73.01 C ATOM 1140 CG GLN A 77 20.633 18.845 -9.977 1.00 71.40 C ATOM 1141 CD GLN A 77 21.231 17.570 -9.415 1.00 0.12 C ATOM 1142 OE1 GLN A 77 22.451 17.421 -9.345 1.00 44.42 O ATOM 1143 NE2 GLN A 77 20.373 16.642 -9.009 1.00 74.55 N ATOM 0 H GLN A 77 21.599 20.602 -12.221 1.00 33.04 H new ATOM 0 HA GLN A 77 19.905 21.389 -10.113 1.00 62.13 H new ATOM 0 HB2 GLN A 77 22.495 19.838 -10.331 1.00 73.01 H new ATOM 0 HB3 GLN A 77 21.789 20.174 -8.763 1.00 73.01 H new ATOM 0 HG2 GLN A 77 19.688 19.050 -9.475 1.00 71.40 H new ATOM 0 HG3 GLN A 77 20.408 18.701 -11.034 1.00 71.40 H new ATOM 0 HE21 GLN A 77 19.369 16.807 -9.085 1.00 74.55 H new ATOM 0 HE22 GLN A 77 20.717 15.764 -8.621 1.00 74.55 H new ATOM 1152 N LYS A 78 22.985 22.586 -9.852 1.00 71.52 N ATOM 1153 CA LYS A 78 23.772 23.675 -9.288 1.00 0.35 C ATOM 1154 C LYS A 78 23.288 25.024 -9.811 1.00 23.11 C ATOM 1155 O LYS A 78 23.207 25.999 -9.063 1.00 33.25 O ATOM 1156 CB LYS A 78 25.254 23.488 -9.622 1.00 13.22 C ATOM 1157 CG LYS A 78 26.139 24.611 -9.109 1.00 62.15 C ATOM 1158 CD LYS A 78 26.833 25.338 -10.249 1.00 64.20 C ATOM 1159 CE LYS A 78 27.968 24.508 -10.830 1.00 4.42 C ATOM 1160 NZ LYS A 78 29.185 25.330 -11.079 1.00 10.43 N ATOM 0 H LYS A 78 23.534 21.880 -10.342 1.00 71.52 H new ATOM 0 HA LYS A 78 23.645 23.658 -8.206 1.00 0.35 H new ATOM 0 HB2 LYS A 78 25.597 22.544 -9.199 1.00 13.22 H new ATOM 0 HB3 LYS A 78 25.367 23.412 -10.703 1.00 13.22 H new ATOM 0 HG2 LYS A 78 25.537 25.318 -8.538 1.00 62.15 H new ATOM 0 HG3 LYS A 78 26.886 24.205 -8.427 1.00 62.15 H new ATOM 0 HD2 LYS A 78 26.109 25.565 -11.032 1.00 64.20 H new ATOM 0 HD3 LYS A 78 27.224 26.290 -9.890 1.00 64.20 H new ATOM 0 HE2 LYS A 78 28.212 23.696 -10.145 1.00 4.42 H new ATOM 0 HE3 LYS A 78 27.642 24.050 -11.764 1.00 4.42 H new ATOM 0 HZ1 LYS A 78 29.935 24.728 -11.475 1.00 10.43 H new ATOM 0 HZ2 LYS A 78 28.959 26.090 -11.752 1.00 10.43 H new ATOM 0 HZ3 LYS A 78 29.511 25.747 -10.184 1.00 10.43 H new ATOM 1174 N LEU A 79 22.967 25.073 -11.099 1.00 63.30 N ATOM 1175 CA LEU A 79 22.490 26.302 -11.722 1.00 55.04 C ATOM 1176 C LEU A 79 21.305 26.878 -10.954 1.00 33.35 C ATOM 1177 O LEU A 79 21.285 28.063 -10.618 1.00 71.14 O ATOM 1178 CB LEU A 79 22.090 26.038 -13.175 1.00 52.43 C ATOM 1179 CG LEU A 79 21.441 27.209 -13.916 1.00 24.41 C ATOM 1180 CD1 LEU A 79 21.808 27.175 -15.391 1.00 42.54 C ATOM 1181 CD2 LEU A 79 19.930 27.180 -13.739 1.00 62.13 C ATOM 0 H LEU A 79 23.028 24.276 -11.732 1.00 63.30 H new ATOM 0 HA LEU A 79 23.301 27.029 -11.701 1.00 55.04 H new ATOM 0 HB2 LEU A 79 22.980 25.733 -13.726 1.00 52.43 H new ATOM 0 HB3 LEU A 79 21.399 25.195 -13.193 1.00 52.43 H new ATOM 0 HG LEU A 79 21.818 28.139 -13.490 1.00 24.41 H new ATOM 0 HD11 LEU A 79 21.338 28.015 -15.902 1.00 42.54 H new ATOM 0 HD12 LEU A 79 22.890 27.245 -15.498 1.00 42.54 H new ATOM 0 HD13 LEU A 79 21.459 26.241 -15.831 1.00 42.54 H new ATOM 0 HD21 LEU A 79 19.485 28.020 -14.273 1.00 62.13 H new ATOM 0 HD22 LEU A 79 19.535 26.246 -14.138 1.00 62.13 H new ATOM 0 HD23 LEU A 79 19.686 27.253 -12.679 1.00 62.13 H new ATOM 1193 N LEU A 80 20.319 26.031 -10.675 1.00 4.30 N ATOM 1194 CA LEU A 80 19.131 26.455 -9.943 1.00 31.02 C ATOM 1195 C LEU A 80 19.511 27.095 -8.611 1.00 71.32 C ATOM 1196 O LEU A 80 18.982 28.142 -8.242 1.00 4.33 O ATOM 1197 CB LEU A 80 18.204 25.262 -9.702 1.00 52.24 C ATOM 1198 CG LEU A 80 16.775 25.406 -10.227 1.00 51.34 C ATOM 1199 CD1 LEU A 80 16.731 25.164 -11.728 1.00 73.21 C ATOM 1200 CD2 LEU A 80 15.841 24.448 -9.503 1.00 22.23 C ATOM 0 H LEU A 80 20.319 25.047 -10.945 1.00 4.30 H new ATOM 0 HA LEU A 80 18.609 27.198 -10.546 1.00 31.02 H new ATOM 0 HB2 LEU A 80 18.652 24.381 -10.162 1.00 52.24 H new ATOM 0 HB3 LEU A 80 18.158 25.074 -8.629 1.00 52.24 H new ATOM 0 HG LEU A 80 16.439 26.425 -10.034 1.00 51.34 H new ATOM 0 HD11 LEU A 80 15.706 25.271 -12.084 1.00 73.21 H new ATOM 0 HD12 LEU A 80 17.368 25.891 -12.233 1.00 73.21 H new ATOM 0 HD13 LEU A 80 17.087 24.157 -11.945 1.00 73.21 H new ATOM 0 HD21 LEU A 80 14.829 24.565 -9.890 1.00 22.23 H new ATOM 0 HD22 LEU A 80 16.175 23.423 -9.664 1.00 22.23 H new ATOM 0 HD23 LEU A 80 15.849 24.669 -8.436 1.00 22.23 H new ATOM 1212 N ASN A 81 20.432 26.458 -7.896 1.00 63.41 N ATOM 1213 CA ASN A 81 20.885 26.966 -6.606 1.00 33.50 C ATOM 1214 C ASN A 81 21.313 28.426 -6.716 1.00 64.42 C ATOM 1215 O ASN A 81 20.710 29.308 -6.106 1.00 53.24 O ATOM 1216 CB ASN A 81 22.046 26.120 -6.080 1.00 61.41 C ATOM 1217 CG ASN A 81 21.654 24.671 -5.863 1.00 63.33 C ATOM 1218 OD1 ASN A 81 21.924 23.811 -6.702 1.00 24.11 O ATOM 1219 ND2 ASN A 81 21.014 24.394 -4.733 1.00 54.05 N ATOM 0 H ASN A 81 20.879 25.589 -8.188 1.00 63.41 H new ATOM 0 HA ASN A 81 20.052 26.902 -5.906 1.00 33.50 H new ATOM 0 HB2 ASN A 81 22.875 26.167 -6.786 1.00 61.41 H new ATOM 0 HB3 ASN A 81 22.403 26.542 -5.140 1.00 61.41 H new ATOM 0 HD21 ASN A 81 20.725 23.437 -4.532 1.00 54.05 H new ATOM 0 HD22 ASN A 81 20.811 25.139 -4.066 1.00 54.05 H new ATOM 1226 N SER A 82 22.359 28.672 -7.499 1.00 2.14 N ATOM 1227 CA SER A 82 22.871 30.024 -7.687 1.00 2.42 C ATOM 1228 C SER A 82 21.754 30.974 -8.108 1.00 2.51 C ATOM 1229 O SER A 82 21.639 32.084 -7.588 1.00 2.42 O ATOM 1230 CB SER A 82 23.984 30.030 -8.737 1.00 33.21 C ATOM 1231 OG SER A 82 25.110 29.294 -8.291 1.00 12.43 O ATOM 0 H SER A 82 22.868 27.953 -8.013 1.00 2.14 H new ATOM 0 HA SER A 82 23.277 30.367 -6.736 1.00 2.42 H new ATOM 0 HB2 SER A 82 23.612 29.603 -9.668 1.00 33.21 H new ATOM 0 HB3 SER A 82 24.279 31.057 -8.953 1.00 33.21 H new ATOM 0 HG SER A 82 25.806 29.312 -8.980 1.00 12.43 H new ATOM 1237 N ASP A 83 20.934 30.530 -9.053 1.00 54.24 N ATOM 1238 CA ASP A 83 19.824 31.339 -9.545 1.00 43.20 C ATOM 1239 C ASP A 83 18.912 31.765 -8.399 1.00 5.24 C ATOM 1240 O ASP A 83 18.505 32.924 -8.313 1.00 55.35 O ATOM 1241 CB ASP A 83 19.022 30.562 -10.589 1.00 72.25 C ATOM 1242 CG ASP A 83 19.240 31.086 -11.995 1.00 54.41 C ATOM 1243 OD1 ASP A 83 20.385 31.009 -12.487 1.00 22.12 O ATOM 1244 OD2 ASP A 83 18.264 31.574 -12.604 1.00 24.52 O ATOM 0 H ASP A 83 21.016 29.614 -9.494 1.00 54.24 H new ATOM 0 HA ASP A 83 20.238 32.235 -10.009 1.00 43.20 H new ATOM 0 HB2 ASP A 83 19.303 29.510 -10.549 1.00 72.25 H new ATOM 0 HB3 ASP A 83 17.961 30.618 -10.344 1.00 72.25 H new ATOM 1249 N LEU A 84 18.596 30.821 -7.520 1.00 15.04 N ATOM 1250 CA LEU A 84 17.731 31.098 -6.378 1.00 34.21 C ATOM 1251 C LEU A 84 18.224 32.316 -5.603 1.00 63.52 C ATOM 1252 O LEU A 84 17.496 33.293 -5.433 1.00 72.43 O ATOM 1253 CB LEU A 84 17.669 29.881 -5.453 1.00 0.22 C ATOM 1254 CG LEU A 84 16.769 30.017 -4.224 1.00 41.10 C ATOM 1255 CD1 LEU A 84 15.375 30.468 -4.631 1.00 11.23 C ATOM 1256 CD2 LEU A 84 16.705 28.702 -3.462 1.00 31.42 C ATOM 0 H LEU A 84 18.925 29.857 -7.576 1.00 15.04 H new ATOM 0 HA LEU A 84 16.731 31.312 -6.755 1.00 34.21 H new ATOM 0 HB2 LEU A 84 17.329 29.024 -6.035 1.00 0.22 H new ATOM 0 HB3 LEU A 84 18.680 29.655 -5.115 1.00 0.22 H new ATOM 0 HG LEU A 84 17.196 30.774 -3.566 1.00 41.10 H new ATOM 0 HD11 LEU A 84 14.749 30.559 -3.744 1.00 11.23 H new ATOM 0 HD12 LEU A 84 15.437 31.434 -5.132 1.00 11.23 H new ATOM 0 HD13 LEU A 84 14.939 29.735 -5.309 1.00 11.23 H new ATOM 0 HD21 LEU A 84 16.060 28.817 -2.591 1.00 31.42 H new ATOM 0 HD22 LEU A 84 16.302 27.925 -4.111 1.00 31.42 H new ATOM 0 HD23 LEU A 84 17.707 28.420 -3.137 1.00 31.42 H new ATOM 1268 N ALA A 85 19.467 32.250 -5.138 1.00 24.05 N ATOM 1269 CA ALA A 85 20.060 33.349 -4.385 1.00 20.51 C ATOM 1270 C ALA A 85 19.930 34.666 -5.142 1.00 62.22 C ATOM 1271 O ALA A 85 19.633 35.704 -4.552 1.00 71.14 O ATOM 1272 CB ALA A 85 21.522 33.053 -4.083 1.00 13.14 C ATOM 0 H ALA A 85 20.083 31.448 -5.269 1.00 24.05 H new ATOM 0 HA ALA A 85 19.519 33.446 -3.444 1.00 20.51 H new ATOM 0 HB1 ALA A 85 21.952 33.882 -3.521 1.00 13.14 H new ATOM 0 HB2 ALA A 85 21.594 32.139 -3.494 1.00 13.14 H new ATOM 0 HB3 ALA A 85 22.068 32.927 -5.018 1.00 13.14 H new ATOM 1278 N GLU A 86 20.156 34.615 -6.451 1.00 51.23 N ATOM 1279 CA GLU A 86 20.065 35.806 -7.288 1.00 3.11 C ATOM 1280 C GLU A 86 18.706 36.481 -7.128 1.00 71.14 C ATOM 1281 O GLU A 86 18.594 37.705 -7.210 1.00 61.15 O ATOM 1282 CB GLU A 86 20.298 35.444 -8.756 1.00 70.12 C ATOM 1283 CG GLU A 86 19.059 35.592 -9.623 1.00 70.43 C ATOM 1284 CD GLU A 86 19.276 35.097 -11.040 1.00 60.50 C ATOM 1285 OE1 GLU A 86 20.072 35.721 -11.772 1.00 22.22 O ATOM 1286 OE2 GLU A 86 18.649 34.084 -11.416 1.00 62.05 O ATOM 0 H GLU A 86 20.403 33.763 -6.954 1.00 51.23 H new ATOM 0 HA GLU A 86 20.838 36.504 -6.967 1.00 3.11 H new ATOM 0 HB2 GLU A 86 21.089 36.078 -9.157 1.00 70.12 H new ATOM 0 HB3 GLU A 86 20.652 34.415 -8.816 1.00 70.12 H new ATOM 0 HG2 GLU A 86 18.236 35.039 -9.171 1.00 70.43 H new ATOM 0 HG3 GLU A 86 18.762 36.640 -9.650 1.00 70.43 H new ATOM 1293 N LEU A 87 17.675 35.675 -6.901 1.00 20.43 N ATOM 1294 CA LEU A 87 16.322 36.192 -6.730 1.00 11.30 C ATOM 1295 C LEU A 87 16.155 36.838 -5.358 1.00 40.23 C ATOM 1296 O LEU A 87 15.834 38.022 -5.254 1.00 41.50 O ATOM 1297 CB LEU A 87 15.299 35.069 -6.905 1.00 31.50 C ATOM 1298 CG LEU A 87 15.288 34.378 -8.269 1.00 75.31 C ATOM 1299 CD1 LEU A 87 14.144 33.379 -8.352 1.00 55.22 C ATOM 1300 CD2 LEU A 87 15.183 35.405 -9.387 1.00 1.45 C ATOM 0 H LEU A 87 17.750 34.660 -6.831 1.00 20.43 H new ATOM 0 HA LEU A 87 16.152 36.952 -7.492 1.00 11.30 H new ATOM 0 HB2 LEU A 87 15.482 34.315 -6.140 1.00 31.50 H new ATOM 0 HB3 LEU A 87 14.306 35.477 -6.719 1.00 31.50 H new ATOM 0 HG LEU A 87 16.226 33.836 -8.387 1.00 75.31 H new ATOM 0 HD11 LEU A 87 14.152 32.897 -9.330 1.00 55.22 H new ATOM 0 HD12 LEU A 87 14.263 32.624 -7.574 1.00 55.22 H new ATOM 0 HD13 LEU A 87 13.196 33.899 -8.211 1.00 55.22 H new ATOM 0 HD21 LEU A 87 15.177 34.895 -10.350 1.00 1.45 H new ATOM 0 HD22 LEU A 87 14.261 35.975 -9.272 1.00 1.45 H new ATOM 0 HD23 LEU A 87 16.036 36.082 -9.341 1.00 1.45 H new ATOM 1312 N ILE A 88 16.377 36.053 -4.309 1.00 51.25 N ATOM 1313 CA ILE A 88 16.254 36.550 -2.945 1.00 22.14 C ATOM 1314 C ILE A 88 17.136 37.774 -2.724 1.00 12.40 C ATOM 1315 O ILE A 88 16.791 38.669 -1.953 1.00 24.34 O ATOM 1316 CB ILE A 88 16.631 35.468 -1.916 1.00 23.33 C ATOM 1317 CG1 ILE A 88 15.765 34.222 -2.112 1.00 53.12 C ATOM 1318 CG2 ILE A 88 16.481 36.007 -0.501 1.00 33.40 C ATOM 1319 CD1 ILE A 88 16.116 33.088 -1.176 1.00 23.53 C ATOM 0 H ILE A 88 16.643 35.071 -4.378 1.00 51.25 H new ATOM 0 HA ILE A 88 15.209 36.827 -2.803 1.00 22.14 H new ATOM 0 HB ILE A 88 17.674 35.190 -2.069 1.00 23.33 H new ATOM 0 HG12 ILE A 88 14.719 34.491 -1.968 1.00 53.12 H new ATOM 0 HG13 ILE A 88 15.866 33.877 -3.141 1.00 53.12 H new ATOM 0 HG21 ILE A 88 16.751 35.230 0.215 1.00 33.40 H new ATOM 0 HG22 ILE A 88 17.137 36.867 -0.368 1.00 33.40 H new ATOM 0 HG23 ILE A 88 15.447 36.310 -0.335 1.00 33.40 H new ATOM 0 HD11 ILE A 88 15.462 32.239 -1.372 1.00 23.53 H new ATOM 0 HD12 ILE A 88 17.153 32.792 -1.336 1.00 23.53 H new ATOM 0 HD13 ILE A 88 15.987 33.415 -0.144 1.00 23.53 H new ATOM 1331 N ASN A 89 18.275 37.808 -3.409 1.00 15.14 N ATOM 1332 CA ASN A 89 19.206 38.924 -3.289 1.00 13.15 C ATOM 1333 C ASN A 89 18.563 40.222 -3.767 1.00 45.54 C ATOM 1334 O ASN A 89 18.332 41.141 -2.981 1.00 35.32 O ATOM 1335 CB ASN A 89 20.477 38.644 -4.093 1.00 34.30 C ATOM 1336 CG ASN A 89 21.558 37.987 -3.256 1.00 54.21 C ATOM 1337 OD1 ASN A 89 21.345 37.671 -2.085 1.00 64.34 O ATOM 1338 ND2 ASN A 89 22.725 37.780 -3.854 1.00 72.25 N ATOM 0 H ASN A 89 18.575 37.076 -4.053 1.00 15.14 H new ATOM 0 HA ASN A 89 19.468 39.035 -2.237 1.00 13.15 H new ATOM 0 HB2 ASN A 89 20.234 38.000 -4.938 1.00 34.30 H new ATOM 0 HB3 ASN A 89 20.857 39.579 -4.504 1.00 34.30 H new ATOM 0 HD21 ASN A 89 23.490 37.343 -3.341 1.00 72.25 H new ATOM 0 HD22 ASN A 89 22.856 38.058 -4.826 1.00 72.25 H new ATOM 1345 N LYS A 90 18.278 40.292 -5.063 1.00 74.22 N ATOM 1346 CA LYS A 90 17.660 41.476 -5.649 1.00 22.14 C ATOM 1347 C LYS A 90 16.310 41.763 -5.000 1.00 32.41 C ATOM 1348 O LYS A 90 15.963 42.917 -4.750 1.00 64.31 O ATOM 1349 CB LYS A 90 17.484 41.291 -7.158 1.00 1.34 C ATOM 1350 CG LYS A 90 18.745 40.824 -7.864 1.00 74.23 C ATOM 1351 CD LYS A 90 19.082 41.713 -9.049 1.00 41.22 C ATOM 1352 CE LYS A 90 19.532 40.895 -10.250 1.00 3.22 C ATOM 1353 NZ LYS A 90 20.176 41.745 -11.290 1.00 74.30 N ATOM 0 H LYS A 90 18.465 39.542 -5.728 1.00 74.22 H new ATOM 0 HA LYS A 90 18.318 42.326 -5.468 1.00 22.14 H new ATOM 0 HB2 LYS A 90 16.688 40.568 -7.337 1.00 1.34 H new ATOM 0 HB3 LYS A 90 17.161 42.235 -7.596 1.00 1.34 H new ATOM 0 HG2 LYS A 90 19.578 40.823 -7.161 1.00 74.23 H new ATOM 0 HG3 LYS A 90 18.613 39.797 -8.204 1.00 74.23 H new ATOM 0 HD2 LYS A 90 18.209 42.307 -9.319 1.00 41.22 H new ATOM 0 HD3 LYS A 90 19.870 42.412 -8.768 1.00 41.22 H new ATOM 0 HE2 LYS A 90 20.233 40.126 -9.924 1.00 3.22 H new ATOM 0 HE3 LYS A 90 18.673 40.381 -10.682 1.00 3.22 H new ATOM 0 HZ1 LYS A 90 20.469 41.151 -12.092 1.00 74.30 H new ATOM 0 HZ2 LYS A 90 19.499 42.463 -11.620 1.00 74.30 H new ATOM 0 HZ3 LYS A 90 21.010 42.216 -10.886 1.00 74.30 H new ATOM 1367 N MET A 91 15.552 40.705 -4.728 1.00 64.24 N ATOM 1368 CA MET A 91 14.241 40.844 -4.106 1.00 31.11 C ATOM 1369 C MET A 91 14.359 41.489 -2.729 1.00 34.35 C ATOM 1370 O MET A 91 13.712 42.498 -2.447 1.00 32.34 O ATOM 1371 CB MET A 91 13.562 39.478 -3.986 1.00 41.12 C ATOM 1372 CG MET A 91 12.060 39.563 -3.768 1.00 41.11 C ATOM 1373 SD MET A 91 11.566 39.022 -2.120 1.00 52.55 S ATOM 1374 CE MET A 91 11.797 40.533 -1.185 1.00 73.53 C ATOM 0 H MET A 91 15.824 39.743 -4.929 1.00 64.24 H new ATOM 0 HA MET A 91 13.632 41.489 -4.739 1.00 31.11 H new ATOM 0 HB2 MET A 91 13.758 38.903 -4.891 1.00 41.12 H new ATOM 0 HB3 MET A 91 14.011 38.930 -3.158 1.00 41.12 H new ATOM 0 HG2 MET A 91 11.732 40.591 -3.922 1.00 41.11 H new ATOM 0 HG3 MET A 91 11.553 38.951 -4.514 1.00 41.11 H new ATOM 0 HE1 MET A 91 10.991 40.638 -0.459 1.00 73.53 H new ATOM 0 HE2 MET A 91 12.753 40.495 -0.663 1.00 73.53 H new ATOM 0 HE3 MET A 91 11.788 41.386 -1.864 1.00 73.53 H new ATOM 1384 N LYS A 92 15.188 40.900 -1.873 1.00 71.05 N ATOM 1385 CA LYS A 92 15.392 41.417 -0.525 1.00 73.14 C ATOM 1386 C LYS A 92 15.854 42.870 -0.564 1.00 52.11 C ATOM 1387 O LYS A 92 15.545 43.655 0.334 1.00 75.33 O ATOM 1388 CB LYS A 92 16.420 40.563 0.220 1.00 11.33 C ATOM 1389 CG LYS A 92 15.861 39.247 0.732 1.00 61.11 C ATOM 1390 CD LYS A 92 15.415 39.356 2.180 1.00 22.34 C ATOM 1391 CE LYS A 92 13.970 38.916 2.353 1.00 35.41 C ATOM 1392 NZ LYS A 92 13.680 38.500 3.753 1.00 32.14 N ATOM 0 H LYS A 92 15.730 40.063 -2.090 1.00 71.05 H new ATOM 0 HA LYS A 92 14.440 41.371 0.003 1.00 73.14 H new ATOM 0 HB2 LYS A 92 17.259 40.358 -0.445 1.00 11.33 H new ATOM 0 HB3 LYS A 92 16.812 41.134 1.062 1.00 11.33 H new ATOM 0 HG2 LYS A 92 15.017 38.944 0.112 1.00 61.11 H new ATOM 0 HG3 LYS A 92 16.619 38.469 0.641 1.00 61.11 H new ATOM 0 HD2 LYS A 92 16.061 38.742 2.808 1.00 22.34 H new ATOM 0 HD3 LYS A 92 15.526 40.386 2.519 1.00 22.34 H new ATOM 0 HE2 LYS A 92 13.306 39.733 2.072 1.00 35.41 H new ATOM 0 HE3 LYS A 92 13.759 38.087 1.677 1.00 35.41 H new ATOM 0 HZ1 LYS A 92 12.694 38.175 3.822 1.00 32.14 H new ATOM 0 HZ2 LYS A 92 14.319 37.726 4.025 1.00 32.14 H new ATOM 0 HZ3 LYS A 92 13.823 39.308 4.392 1.00 32.14 H new ATOM 1406 N LEU A 93 16.594 43.223 -1.609 1.00 23.10 N ATOM 1407 CA LEU A 93 17.098 44.583 -1.765 1.00 51.15 C ATOM 1408 C LEU A 93 15.953 45.564 -1.998 1.00 44.14 C ATOM 1409 O LEU A 93 15.815 46.553 -1.279 1.00 55.15 O ATOM 1410 CB LEU A 93 18.088 44.651 -2.930 1.00 34.31 C ATOM 1411 CG LEU A 93 19.450 43.998 -2.692 1.00 34.31 C ATOM 1412 CD1 LEU A 93 20.137 43.699 -4.015 1.00 40.22 C ATOM 1413 CD2 LEU A 93 20.325 44.890 -1.824 1.00 15.13 C ATOM 0 H LEU A 93 16.858 42.587 -2.361 1.00 23.10 H new ATOM 0 HA LEU A 93 17.610 44.862 -0.844 1.00 51.15 H new ATOM 0 HB2 LEU A 93 17.629 44.180 -3.799 1.00 34.31 H new ATOM 0 HB3 LEU A 93 18.249 45.699 -3.183 1.00 34.31 H new ATOM 0 HG LEU A 93 19.293 43.056 -2.167 1.00 34.31 H new ATOM 0 HD11 LEU A 93 21.105 43.235 -3.826 1.00 40.22 H new ATOM 0 HD12 LEU A 93 19.517 43.021 -4.602 1.00 40.22 H new ATOM 0 HD13 LEU A 93 20.282 44.627 -4.568 1.00 40.22 H new ATOM 0 HD21 LEU A 93 21.290 44.409 -1.665 1.00 15.13 H new ATOM 0 HD22 LEU A 93 20.474 45.848 -2.322 1.00 15.13 H new ATOM 0 HD23 LEU A 93 19.838 45.053 -0.862 1.00 15.13 H new ATOM 1425 N ALA A 94 15.135 45.282 -3.007 1.00 32.35 N ATOM 1426 CA ALA A 94 14.000 46.137 -3.331 1.00 73.44 C ATOM 1427 C ALA A 94 13.146 46.408 -2.097 1.00 72.34 C ATOM 1428 O ALA A 94 12.697 47.532 -1.877 1.00 44.45 O ATOM 1429 CB ALA A 94 13.158 45.502 -4.429 1.00 3.21 C ATOM 0 H ALA A 94 15.237 44.468 -3.614 1.00 32.35 H new ATOM 0 HA ALA A 94 14.386 47.091 -3.689 1.00 73.44 H new ATOM 0 HB1 ALA A 94 12.314 46.151 -4.661 1.00 3.21 H new ATOM 0 HB2 ALA A 94 13.768 45.366 -5.322 1.00 3.21 H new ATOM 0 HB3 ALA A 94 12.789 44.534 -4.091 1.00 3.21 H new ATOM 1435 N GLN A 95 12.925 45.370 -1.297 1.00 12.12 N ATOM 1436 CA GLN A 95 12.123 45.498 -0.086 1.00 31.53 C ATOM 1437 C GLN A 95 12.689 46.577 0.831 1.00 22.21 C ATOM 1438 O GLN A 95 11.947 47.246 1.549 1.00 33.32 O ATOM 1439 CB GLN A 95 12.065 44.161 0.656 1.00 74.23 C ATOM 1440 CG GLN A 95 10.655 43.736 1.034 1.00 0.15 C ATOM 1441 CD GLN A 95 10.608 42.971 2.342 1.00 34.41 C ATOM 1442 OE1 GLN A 95 11.644 42.627 2.912 1.00 51.23 O ATOM 1443 NE2 GLN A 95 9.401 42.699 2.826 1.00 63.20 N ATOM 0 H GLN A 95 13.289 44.432 -1.465 1.00 12.12 H new ATOM 0 HA GLN A 95 11.114 45.788 -0.378 1.00 31.53 H new ATOM 0 HB2 GLN A 95 12.513 43.388 0.031 1.00 74.23 H new ATOM 0 HB3 GLN A 95 12.670 44.230 1.560 1.00 74.23 H new ATOM 0 HG2 GLN A 95 10.021 44.620 1.111 1.00 0.15 H new ATOM 0 HG3 GLN A 95 10.241 43.115 0.239 1.00 0.15 H new ATOM 0 HE21 GLN A 95 8.569 43.003 2.321 1.00 63.20 H new ATOM 0 HE22 GLN A 95 9.307 42.186 3.703 1.00 63.20 H new ATOM 1452 N GLN A 96 14.008 46.740 0.801 1.00 71.40 N ATOM 1453 CA GLN A 96 14.673 47.737 1.631 1.00 41.33 C ATOM 1454 C GLN A 96 14.850 49.047 0.870 1.00 11.42 C ATOM 1455 O GLN A 96 15.067 50.100 1.470 1.00 2.41 O ATOM 1456 CB GLN A 96 16.034 47.217 2.098 1.00 14.52 C ATOM 1457 CG GLN A 96 16.012 45.761 2.532 1.00 30.31 C ATOM 1458 CD GLN A 96 16.715 45.536 3.856 1.00 32.34 C ATOM 1459 OE1 GLN A 96 16.194 44.855 4.741 1.00 43.32 O ATOM 1460 NE2 GLN A 96 17.905 46.108 4.000 1.00 34.51 N ATOM 0 H GLN A 96 14.637 46.195 0.211 1.00 71.40 H new ATOM 0 HA GLN A 96 14.046 47.925 2.502 1.00 41.33 H new ATOM 0 HB2 GLN A 96 16.756 47.336 1.290 1.00 14.52 H new ATOM 0 HB3 GLN A 96 16.382 47.830 2.929 1.00 14.52 H new ATOM 0 HG2 GLN A 96 14.978 45.425 2.612 1.00 30.31 H new ATOM 0 HG3 GLN A 96 16.487 45.150 1.764 1.00 30.31 H new ATOM 0 HE21 GLN A 96 18.299 46.664 3.241 1.00 34.51 H new ATOM 0 HE22 GLN A 96 18.425 45.991 4.870 1.00 34.51 H new ATOM 1469 N TYR A 97 14.756 48.975 -0.453 1.00 30.12 N ATOM 1470 CA TYR A 97 14.909 50.155 -1.296 1.00 35.24 C ATOM 1471 C TYR A 97 13.551 50.769 -1.623 1.00 41.52 C ATOM 1472 O TYR A 97 13.344 51.300 -2.715 1.00 34.14 O ATOM 1473 CB TYR A 97 15.642 49.793 -2.588 1.00 61.21 C ATOM 1474 CG TYR A 97 17.128 49.583 -2.402 1.00 71.35 C ATOM 1475 CD1 TYR A 97 17.945 50.614 -1.957 1.00 43.12 C ATOM 1476 CD2 TYR A 97 17.714 48.352 -2.672 1.00 22.03 C ATOM 1477 CE1 TYR A 97 19.303 50.427 -1.787 1.00 63.30 C ATOM 1478 CE2 TYR A 97 19.071 48.155 -2.503 1.00 21.01 C ATOM 1479 CZ TYR A 97 19.861 49.195 -2.061 1.00 4.40 C ATOM 1480 OH TYR A 97 21.214 49.004 -1.891 1.00 54.33 O ATOM 0 H TYR A 97 14.575 48.112 -0.965 1.00 30.12 H new ATOM 0 HA TYR A 97 15.498 50.890 -0.747 1.00 35.24 H new ATOM 0 HB2 TYR A 97 15.204 48.885 -3.002 1.00 61.21 H new ATOM 0 HB3 TYR A 97 15.484 50.585 -3.320 1.00 61.21 H new ATOM 0 HD1 TYR A 97 17.511 51.579 -1.740 1.00 43.12 H new ATOM 0 HD2 TYR A 97 17.098 47.536 -3.020 1.00 22.03 H new ATOM 0 HE1 TYR A 97 19.924 51.240 -1.442 1.00 63.30 H new ATOM 0 HE2 TYR A 97 19.511 47.192 -2.716 1.00 21.01 H new ATOM 0 HH TYR A 97 21.446 48.081 -2.126 1.00 54.33 H new ATOM 1490 N VAL A 98 12.629 50.694 -0.669 1.00 10.43 N ATOM 1491 CA VAL A 98 11.291 51.244 -0.853 1.00 43.30 C ATOM 1492 C VAL A 98 11.124 52.551 -0.085 1.00 74.34 C ATOM 1493 O VAL A 98 10.396 53.445 -0.515 1.00 13.44 O ATOM 1494 CB VAL A 98 10.208 50.250 -0.395 1.00 73.13 C ATOM 1495 CG1 VAL A 98 8.826 50.876 -0.509 1.00 1.05 C ATOM 1496 CG2 VAL A 98 10.288 48.965 -1.206 1.00 32.03 C ATOM 0 H VAL A 98 12.784 50.258 0.240 1.00 10.43 H new ATOM 0 HA VAL A 98 11.171 51.435 -1.919 1.00 43.30 H new ATOM 0 HB VAL A 98 10.384 50.004 0.652 1.00 73.13 H new ATOM 0 HG11 VAL A 98 8.074 50.159 -0.181 1.00 1.05 H new ATOM 0 HG12 VAL A 98 8.777 51.766 0.118 1.00 1.05 H new ATOM 0 HG13 VAL A 98 8.636 51.152 -1.546 1.00 1.05 H new ATOM 0 HG21 VAL A 98 9.516 48.274 -0.869 1.00 32.03 H new ATOM 0 HG22 VAL A 98 10.138 49.191 -2.262 1.00 32.03 H new ATOM 0 HG23 VAL A 98 11.268 48.509 -1.069 1.00 32.03 H new ATOM 1506 N MET A 99 11.803 52.653 1.052 1.00 13.54 N ATOM 1507 CA MET A 99 11.730 53.852 1.880 1.00 41.24 C ATOM 1508 C MET A 99 12.483 55.008 1.229 1.00 42.20 C ATOM 1509 O MET A 99 12.260 56.173 1.560 1.00 40.31 O ATOM 1510 CB MET A 99 12.303 53.573 3.270 1.00 1.45 C ATOM 1511 CG MET A 99 11.760 54.498 4.348 1.00 70.10 C ATOM 1512 SD MET A 99 13.066 55.333 5.269 1.00 14.13 S ATOM 1513 CE MET A 99 13.905 56.208 3.950 1.00 34.54 C ATOM 0 H MET A 99 12.410 51.921 1.422 1.00 13.54 H new ATOM 0 HA MET A 99 10.681 54.133 1.977 1.00 41.24 H new ATOM 0 HB2 MET A 99 12.084 52.541 3.544 1.00 1.45 H new ATOM 0 HB3 MET A 99 13.388 53.669 3.233 1.00 1.45 H new ATOM 0 HG2 MET A 99 11.111 55.244 3.888 1.00 70.10 H new ATOM 0 HG3 MET A 99 11.144 53.922 5.039 1.00 70.10 H new ATOM 0 HE1 MET A 99 14.707 56.815 4.369 1.00 34.54 H new ATOM 0 HE2 MET A 99 14.324 55.489 3.246 1.00 34.54 H new ATOM 0 HE3 MET A 99 13.195 56.852 3.432 1.00 34.54 H new ATOM 1523 N THR A 100 13.377 54.679 0.301 1.00 10.14 N ATOM 1524 CA THR A 100 14.164 55.689 -0.394 1.00 52.43 C ATOM 1525 C THR A 100 13.432 56.203 -1.629 1.00 33.40 C ATOM 1526 O THR A 100 12.891 57.309 -1.627 1.00 22.51 O ATOM 1527 CB THR A 100 15.538 55.137 -0.819 1.00 11.53 C ATOM 1528 OG1 THR A 100 16.289 54.752 0.338 1.00 63.23 O ATOM 1529 CG2 THR A 100 16.316 56.176 -1.613 1.00 24.45 C ATOM 0 H THR A 100 13.574 53.720 0.014 1.00 10.14 H new ATOM 0 HA THR A 100 14.312 56.511 0.306 1.00 52.43 H new ATOM 0 HB THR A 100 15.376 54.265 -1.453 1.00 11.53 H new ATOM 0 HG1 THR A 100 17.161 54.400 0.060 1.00 63.23 H new ATOM 0 HG21 THR A 100 17.283 55.764 -1.902 1.00 24.45 H new ATOM 0 HG22 THR A 100 15.754 56.446 -2.507 1.00 24.45 H new ATOM 0 HG23 THR A 100 16.469 57.063 -0.999 1.00 24.45 H new ATOM 1537 N SER A 101 13.417 55.392 -2.682 1.00 44.03 N ATOM 1538 CA SER A 101 12.754 55.766 -3.926 1.00 15.03 C ATOM 1539 C SER A 101 12.931 54.681 -4.984 1.00 15.14 C ATOM 1540 O SER A 101 12.049 54.458 -5.814 1.00 72.52 O ATOM 1541 CB SER A 101 13.307 57.095 -4.444 1.00 74.11 C ATOM 1542 OG SER A 101 14.606 57.340 -3.934 1.00 52.21 O ATOM 0 H SER A 101 13.856 54.472 -2.699 1.00 44.03 H new ATOM 0 HA SER A 101 11.689 55.879 -3.721 1.00 15.03 H new ATOM 0 HB2 SER A 101 13.337 57.080 -5.533 1.00 74.11 H new ATOM 0 HB3 SER A 101 12.640 57.907 -4.155 1.00 74.11 H new ATOM 0 HG SER A 101 14.938 58.194 -4.281 1.00 52.21 H new ATOM 1548 N LEU A 102 14.076 54.010 -4.947 1.00 62.33 N ATOM 1549 CA LEU A 102 14.371 52.947 -5.902 1.00 50.14 C ATOM 1550 C LEU A 102 13.594 51.679 -5.563 1.00 53.35 C ATOM 1551 O LEU A 102 14.177 50.670 -5.169 1.00 71.35 O ATOM 1552 CB LEU A 102 15.872 52.650 -5.918 1.00 15.30 C ATOM 1553 CG LEU A 102 16.796 53.858 -5.765 1.00 43.44 C ATOM 1554 CD1 LEU A 102 18.252 53.434 -5.883 1.00 41.50 C ATOM 1555 CD2 LEU A 102 16.463 54.920 -6.803 1.00 55.12 C ATOM 0 H LEU A 102 14.816 54.183 -4.266 1.00 62.33 H new ATOM 0 HA LEU A 102 14.063 53.286 -6.891 1.00 50.14 H new ATOM 0 HB2 LEU A 102 16.091 51.946 -5.115 1.00 15.30 H new ATOM 0 HB3 LEU A 102 16.113 52.150 -6.856 1.00 15.30 H new ATOM 0 HG LEU A 102 16.642 54.286 -4.774 1.00 43.44 H new ATOM 0 HD11 LEU A 102 18.895 54.307 -5.772 1.00 41.50 H new ATOM 0 HD12 LEU A 102 18.484 52.710 -5.102 1.00 41.50 H new ATOM 0 HD13 LEU A 102 18.421 52.981 -6.860 1.00 41.50 H new ATOM 0 HD21 LEU A 102 17.131 55.772 -6.679 1.00 55.12 H new ATOM 0 HD22 LEU A 102 16.588 54.504 -7.803 1.00 55.12 H new ATOM 0 HD23 LEU A 102 15.431 55.246 -6.672 1.00 55.12 H new ATOM 1567 N GLN A 103 12.275 51.739 -5.722 1.00 4.43 N ATOM 1568 CA GLN A 103 11.419 50.595 -5.434 1.00 10.04 C ATOM 1569 C GLN A 103 11.176 49.767 -6.691 1.00 21.30 C ATOM 1570 O GLN A 103 11.701 48.662 -6.828 1.00 33.01 O ATOM 1571 CB GLN A 103 10.084 51.064 -4.852 1.00 23.23 C ATOM 1572 CG GLN A 103 9.000 49.998 -4.880 1.00 5.21 C ATOM 1573 CD GLN A 103 8.100 50.049 -3.661 1.00 51.45 C ATOM 1574 OE1 GLN A 103 7.802 49.022 -3.052 1.00 33.10 O ATOM 1575 NE2 GLN A 103 7.661 51.249 -3.299 1.00 41.23 N ATOM 0 H GLN A 103 11.777 52.567 -6.048 1.00 4.43 H new ATOM 0 HA GLN A 103 11.927 49.968 -4.701 1.00 10.04 H new ATOM 0 HB2 GLN A 103 10.239 51.386 -3.822 1.00 23.23 H new ATOM 0 HB3 GLN A 103 9.740 51.935 -5.410 1.00 23.23 H new ATOM 0 HG2 GLN A 103 8.396 50.123 -5.779 1.00 5.21 H new ATOM 0 HG3 GLN A 103 9.465 49.014 -4.943 1.00 5.21 H new ATOM 0 HE21 GLN A 103 7.933 52.074 -3.833 1.00 41.23 H new ATOM 0 HE22 GLN A 103 7.052 51.345 -2.487 1.00 41.23 H new ATOM 1584 N GLN A 104 10.378 50.308 -7.605 1.00 53.23 N ATOM 1585 CA GLN A 104 10.065 49.618 -8.851 1.00 30.31 C ATOM 1586 C GLN A 104 11.339 49.185 -9.568 1.00 64.40 C ATOM 1587 O GLN A 104 11.349 48.185 -10.285 1.00 64.22 O ATOM 1588 CB GLN A 104 9.233 50.520 -9.764 1.00 3.10 C ATOM 1589 CG GLN A 104 9.791 51.928 -9.900 1.00 63.44 C ATOM 1590 CD GLN A 104 9.082 52.926 -9.007 1.00 74.14 C ATOM 1591 OE1 GLN A 104 9.319 52.975 -7.800 1.00 72.21 O ATOM 1592 NE2 GLN A 104 8.205 53.730 -9.597 1.00 75.45 N ATOM 0 H GLN A 104 9.936 51.222 -7.507 1.00 53.23 H new ATOM 0 HA GLN A 104 9.486 48.727 -8.608 1.00 30.31 H new ATOM 0 HB2 GLN A 104 9.172 50.065 -10.753 1.00 3.10 H new ATOM 0 HB3 GLN A 104 8.216 50.577 -9.376 1.00 3.10 H new ATOM 0 HG2 GLN A 104 10.853 51.919 -9.656 1.00 63.44 H new ATOM 0 HG3 GLN A 104 9.705 52.250 -10.938 1.00 63.44 H new ATOM 0 HE21 GLN A 104 8.039 53.655 -10.601 1.00 75.45 H new ATOM 0 HE22 GLN A 104 7.697 54.422 -9.046 1.00 75.45 H new ATOM 1601 N GLU A 105 12.412 49.945 -9.369 1.00 71.43 N ATOM 1602 CA GLU A 105 13.691 49.639 -9.999 1.00 22.12 C ATOM 1603 C GLU A 105 14.085 48.185 -9.752 1.00 43.43 C ATOM 1604 O GLU A 105 13.999 47.347 -10.650 1.00 30.34 O ATOM 1605 CB GLU A 105 14.782 50.572 -9.468 1.00 32.51 C ATOM 1606 CG GLU A 105 14.814 51.925 -10.157 1.00 54.32 C ATOM 1607 CD GLU A 105 16.181 52.579 -10.097 1.00 33.40 C ATOM 1608 OE1 GLU A 105 17.189 51.843 -10.052 1.00 51.33 O ATOM 1609 OE2 GLU A 105 16.242 53.826 -10.095 1.00 13.12 O ATOM 0 H GLU A 105 12.421 50.776 -8.777 1.00 71.43 H new ATOM 0 HA GLU A 105 13.584 49.791 -11.073 1.00 22.12 H new ATOM 0 HB2 GLU A 105 14.632 50.722 -8.399 1.00 32.51 H new ATOM 0 HB3 GLU A 105 15.752 50.089 -9.589 1.00 32.51 H new ATOM 0 HG2 GLU A 105 14.519 51.805 -11.199 1.00 54.32 H new ATOM 0 HG3 GLU A 105 14.080 52.583 -9.692 1.00 54.32 H new ATOM 1616 N TYR A 106 14.518 47.895 -8.531 1.00 4.34 N ATOM 1617 CA TYR A 106 14.929 46.545 -8.166 1.00 31.41 C ATOM 1618 C TYR A 106 13.848 45.530 -8.528 1.00 2.33 C ATOM 1619 O TYR A 106 14.138 44.363 -8.789 1.00 72.44 O ATOM 1620 CB TYR A 106 15.235 46.469 -6.669 1.00 72.41 C ATOM 1621 CG TYR A 106 16.640 46.900 -6.316 1.00 1.35 C ATOM 1622 CD1 TYR A 106 16.951 48.243 -6.137 1.00 61.22 C ATOM 1623 CD2 TYR A 106 17.657 45.966 -6.161 1.00 11.32 C ATOM 1624 CE1 TYR A 106 18.234 48.642 -5.815 1.00 13.12 C ATOM 1625 CE2 TYR A 106 18.942 46.356 -5.837 1.00 51.31 C ATOM 1626 CZ TYR A 106 19.225 47.695 -5.665 1.00 44.23 C ATOM 1627 OH TYR A 106 20.505 48.088 -5.344 1.00 74.12 O ATOM 0 H TYR A 106 14.594 48.577 -7.776 1.00 4.34 H new ATOM 0 HA TYR A 106 15.832 46.303 -8.727 1.00 31.41 H new ATOM 0 HB2 TYR A 106 14.525 47.096 -6.129 1.00 72.41 H new ATOM 0 HB3 TYR A 106 15.081 45.446 -6.327 1.00 72.41 H new ATOM 0 HD1 TYR A 106 16.177 48.987 -6.252 1.00 61.22 H new ATOM 0 HD2 TYR A 106 17.439 44.917 -6.296 1.00 11.32 H new ATOM 0 HE1 TYR A 106 18.459 49.690 -5.682 1.00 13.12 H new ATOM 0 HE2 TYR A 106 19.721 45.617 -5.719 1.00 51.31 H new ATOM 0 HH TYR A 106 20.544 48.334 -4.396 1.00 74.12 H new ATOM 1637 N LYS A 107 12.600 45.985 -8.541 1.00 11.21 N ATOM 1638 CA LYS A 107 11.473 45.121 -8.872 1.00 64.32 C ATOM 1639 C LYS A 107 11.520 44.705 -10.339 1.00 31.41 C ATOM 1640 O LYS A 107 11.249 43.552 -10.677 1.00 43.11 O ATOM 1641 CB LYS A 107 10.152 45.834 -8.575 1.00 23.51 C ATOM 1642 CG LYS A 107 9.561 45.478 -7.222 1.00 13.53 C ATOM 1643 CD LYS A 107 8.882 46.676 -6.578 1.00 50.03 C ATOM 1644 CE LYS A 107 8.401 46.355 -5.171 1.00 64.03 C ATOM 1645 NZ LYS A 107 9.536 46.071 -4.249 1.00 73.22 N ATOM 0 H LYS A 107 12.343 46.948 -8.326 1.00 11.21 H new ATOM 0 HA LYS A 107 11.541 44.225 -8.255 1.00 64.32 H new ATOM 0 HB2 LYS A 107 10.312 46.911 -8.620 1.00 23.51 H new ATOM 0 HB3 LYS A 107 9.431 45.585 -9.354 1.00 23.51 H new ATOM 0 HG2 LYS A 107 8.839 44.670 -7.340 1.00 13.53 H new ATOM 0 HG3 LYS A 107 10.349 45.109 -6.565 1.00 13.53 H new ATOM 0 HD2 LYS A 107 9.578 47.514 -6.543 1.00 50.03 H new ATOM 0 HD3 LYS A 107 8.036 46.989 -7.190 1.00 50.03 H new ATOM 0 HE2 LYS A 107 7.821 47.193 -4.785 1.00 64.03 H new ATOM 0 HE3 LYS A 107 7.734 45.493 -5.203 1.00 64.03 H new ATOM 0 HZ1 LYS A 107 9.198 46.091 -3.266 1.00 73.22 H new ATOM 0 HZ2 LYS A 107 9.929 45.132 -4.461 1.00 73.22 H new ATOM 0 HZ3 LYS A 107 10.275 46.792 -4.376 1.00 73.22 H new ATOM 1659 N LYS A 108 11.866 45.650 -11.207 1.00 31.54 N ATOM 1660 CA LYS A 108 11.951 45.381 -12.637 1.00 51.23 C ATOM 1661 C LYS A 108 13.032 44.346 -12.933 1.00 55.24 C ATOM 1662 O LYS A 108 12.735 43.236 -13.374 1.00 22.14 O ATOM 1663 CB LYS A 108 12.244 46.674 -13.403 1.00 20.52 C ATOM 1664 CG LYS A 108 10.995 47.406 -13.860 1.00 13.41 C ATOM 1665 CD LYS A 108 10.648 47.072 -15.301 1.00 51.31 C ATOM 1666 CE LYS A 108 9.257 47.566 -15.668 1.00 71.25 C ATOM 1667 NZ LYS A 108 8.333 46.440 -15.977 1.00 74.24 N ATOM 0 H LYS A 108 12.092 46.609 -10.944 1.00 31.54 H new ATOM 0 HA LYS A 108 10.991 44.981 -12.964 1.00 51.23 H new ATOM 0 HB2 LYS A 108 12.832 47.337 -12.768 1.00 20.52 H new ATOM 0 HB3 LYS A 108 12.857 46.440 -14.273 1.00 20.52 H new ATOM 0 HG2 LYS A 108 10.159 47.140 -13.213 1.00 13.41 H new ATOM 0 HG3 LYS A 108 11.146 48.481 -13.761 1.00 13.41 H new ATOM 0 HD2 LYS A 108 11.383 47.523 -15.967 1.00 51.31 H new ATOM 0 HD3 LYS A 108 10.703 45.994 -15.449 1.00 51.31 H new ATOM 0 HE2 LYS A 108 8.851 48.153 -14.844 1.00 71.25 H new ATOM 0 HE3 LYS A 108 9.323 48.229 -16.531 1.00 71.25 H new ATOM 0 HZ1 LYS A 108 7.396 46.818 -16.222 1.00 74.24 H new ATOM 0 HZ2 LYS A 108 8.707 45.894 -16.779 1.00 74.24 H new ATOM 0 HZ3 LYS A 108 8.250 45.821 -15.146 1.00 74.24 H new ATOM 1681 N GLN A 109 14.284 44.718 -12.688 1.00 33.23 N ATOM 1682 CA GLN A 109 15.407 43.820 -12.928 1.00 5.22 C ATOM 1683 C GLN A 109 15.182 42.473 -12.250 1.00 62.41 C ATOM 1684 O GLN A 109 15.661 41.442 -12.723 1.00 34.15 O ATOM 1685 CB GLN A 109 16.707 44.449 -12.421 1.00 33.51 C ATOM 1686 CG GLN A 109 16.550 45.192 -11.104 1.00 53.34 C ATOM 1687 CD GLN A 109 16.608 46.698 -11.274 1.00 64.40 C ATOM 1688 OE1 GLN A 109 16.056 47.249 -12.227 1.00 24.40 O ATOM 1689 NE2 GLN A 109 17.279 47.372 -10.348 1.00 5.32 N ATOM 0 H GLN A 109 14.546 45.634 -12.324 1.00 33.23 H new ATOM 0 HA GLN A 109 15.485 43.656 -14.003 1.00 5.22 H new ATOM 0 HB2 GLN A 109 17.456 43.667 -12.300 1.00 33.51 H new ATOM 0 HB3 GLN A 109 17.085 45.139 -13.175 1.00 33.51 H new ATOM 0 HG2 GLN A 109 15.599 44.918 -10.647 1.00 53.34 H new ATOM 0 HG3 GLN A 109 17.336 44.877 -10.417 1.00 53.34 H new ATOM 0 HE21 GLN A 109 17.721 46.874 -9.575 1.00 5.32 H new ATOM 0 HE22 GLN A 109 17.353 48.387 -10.409 1.00 5.32 H new ATOM 1698 N MET A 110 14.451 42.489 -11.140 1.00 63.23 N ATOM 1699 CA MET A 110 14.162 41.267 -10.398 1.00 42.22 C ATOM 1700 C MET A 110 13.339 40.300 -11.243 1.00 20.21 C ATOM 1701 O MET A 110 13.671 39.119 -11.354 1.00 24.12 O ATOM 1702 CB MET A 110 13.415 41.596 -9.104 1.00 60.33 C ATOM 1703 CG MET A 110 12.764 40.386 -8.454 1.00 71.45 C ATOM 1704 SD MET A 110 13.955 39.100 -8.031 1.00 73.44 S ATOM 1705 CE MET A 110 12.858 37.758 -7.578 1.00 53.22 C ATOM 0 H MET A 110 14.048 43.334 -10.735 1.00 63.23 H new ATOM 0 HA MET A 110 15.110 40.789 -10.150 1.00 42.22 H new ATOM 0 HB2 MET A 110 14.111 42.048 -8.397 1.00 60.33 H new ATOM 0 HB3 MET A 110 12.648 42.341 -9.316 1.00 60.33 H new ATOM 0 HG2 MET A 110 12.240 40.701 -7.552 1.00 71.45 H new ATOM 0 HG3 MET A 110 12.015 39.974 -9.130 1.00 71.45 H new ATOM 0 HE1 MET A 110 13.242 37.259 -6.689 1.00 53.22 H new ATOM 0 HE2 MET A 110 11.864 38.155 -7.371 1.00 53.22 H new ATOM 0 HE3 MET A 110 12.799 37.043 -8.399 1.00 53.22 H new ATOM 1715 N LEU A 111 12.264 40.807 -11.836 1.00 61.02 N ATOM 1716 CA LEU A 111 11.393 39.987 -12.671 1.00 52.32 C ATOM 1717 C LEU A 111 12.186 39.309 -13.784 1.00 34.55 C ATOM 1718 O LEU A 111 11.928 38.155 -14.130 1.00 51.35 O ATOM 1719 CB LEU A 111 10.278 40.844 -13.274 1.00 33.24 C ATOM 1720 CG LEU A 111 10.593 41.512 -14.613 1.00 23.54 C ATOM 1721 CD1 LEU A 111 10.276 40.572 -15.766 1.00 13.15 C ATOM 1722 CD2 LEU A 111 9.819 42.814 -14.755 1.00 20.14 C ATOM 0 H LEU A 111 11.974 41.782 -11.754 1.00 61.02 H new ATOM 0 HA LEU A 111 10.950 39.214 -12.042 1.00 52.32 H new ATOM 0 HB2 LEU A 111 9.395 40.218 -13.402 1.00 33.24 H new ATOM 0 HB3 LEU A 111 10.016 41.621 -12.556 1.00 33.24 H new ATOM 0 HG LEU A 111 11.658 41.742 -14.641 1.00 23.54 H new ATOM 0 HD11 LEU A 111 10.506 41.064 -16.711 1.00 13.15 H new ATOM 0 HD12 LEU A 111 10.876 39.667 -15.673 1.00 13.15 H new ATOM 0 HD13 LEU A 111 9.218 40.310 -15.742 1.00 13.15 H new ATOM 0 HD21 LEU A 111 10.056 43.275 -15.714 1.00 20.14 H new ATOM 0 HD22 LEU A 111 8.750 42.609 -14.705 1.00 20.14 H new ATOM 0 HD23 LEU A 111 10.096 43.492 -13.948 1.00 20.14 H new ATOM 1734 N THR A 112 13.154 40.031 -14.339 1.00 31.21 N ATOM 1735 CA THR A 112 13.985 39.499 -15.411 1.00 24.31 C ATOM 1736 C THR A 112 14.678 38.211 -14.982 1.00 23.54 C ATOM 1737 O THR A 112 14.564 37.182 -15.647 1.00 61.30 O ATOM 1738 CB THR A 112 15.051 40.518 -15.854 1.00 5.51 C ATOM 1739 OG1 THR A 112 14.711 41.823 -15.372 1.00 43.32 O ATOM 1740 CG2 THR A 112 15.175 40.548 -17.370 1.00 11.31 C ATOM 0 H THR A 112 13.382 40.986 -14.063 1.00 31.21 H new ATOM 0 HA THR A 112 13.322 39.290 -16.250 1.00 24.31 H new ATOM 0 HB THR A 112 16.009 40.214 -15.433 1.00 5.51 H new ATOM 0 HG1 THR A 112 15.186 42.500 -15.898 1.00 43.32 H new ATOM 0 HG21 THR A 112 15.934 41.275 -17.659 1.00 11.31 H new ATOM 0 HG22 THR A 112 15.463 39.561 -17.731 1.00 11.31 H new ATOM 0 HG23 THR A 112 14.217 40.830 -17.808 1.00 11.31 H new ATOM 1748 N ALA A 113 15.396 38.274 -13.865 1.00 43.10 N ATOM 1749 CA ALA A 113 16.105 37.111 -13.346 1.00 4.44 C ATOM 1750 C ALA A 113 15.175 35.909 -13.226 1.00 50.21 C ATOM 1751 O ALA A 113 15.506 34.810 -13.669 1.00 21.34 O ATOM 1752 CB ALA A 113 16.730 37.434 -11.996 1.00 64.33 C ATOM 0 H ALA A 113 15.502 39.118 -13.302 1.00 43.10 H new ATOM 0 HA ALA A 113 16.897 36.855 -14.050 1.00 4.44 H new ATOM 0 HB1 ALA A 113 17.256 36.557 -11.620 1.00 64.33 H new ATOM 0 HB2 ALA A 113 17.434 38.259 -12.109 1.00 64.33 H new ATOM 0 HB3 ALA A 113 15.948 37.718 -11.292 1.00 64.33 H new ATOM 1758 N ALA A 114 14.010 36.126 -12.625 1.00 31.05 N ATOM 1759 CA ALA A 114 13.031 35.060 -12.448 1.00 42.22 C ATOM 1760 C ALA A 114 12.590 34.492 -13.793 1.00 24.33 C ATOM 1761 O ALA A 114 12.352 33.290 -13.922 1.00 41.41 O ATOM 1762 CB ALA A 114 11.828 35.572 -11.669 1.00 64.24 C ATOM 0 H ALA A 114 13.721 37.030 -12.252 1.00 31.05 H new ATOM 0 HA ALA A 114 13.502 34.257 -11.881 1.00 42.22 H new ATOM 0 HB1 ALA A 114 11.105 34.766 -11.544 1.00 64.24 H new ATOM 0 HB2 ALA A 114 12.152 35.924 -10.689 1.00 64.24 H new ATOM 0 HB3 ALA A 114 11.364 36.394 -12.215 1.00 64.24 H new ATOM 1768 N HIS A 115 12.483 35.362 -14.792 1.00 1.14 N ATOM 1769 CA HIS A 115 12.070 34.946 -16.127 1.00 64.03 C ATOM 1770 C HIS A 115 12.942 33.800 -16.633 1.00 10.31 C ATOM 1771 O HIS A 115 12.443 32.721 -16.951 1.00 14.44 O ATOM 1772 CB HIS A 115 12.145 36.125 -17.098 1.00 14.34 C ATOM 1773 CG HIS A 115 10.994 36.187 -18.054 1.00 51.12 C ATOM 1774 ND1 HIS A 115 11.001 35.560 -19.282 1.00 65.21 N ATOM 1775 CD2 HIS A 115 9.794 36.806 -17.957 1.00 31.32 C ATOM 1776 CE1 HIS A 115 9.857 35.791 -19.899 1.00 53.24 C ATOM 1777 NE2 HIS A 115 9.106 36.545 -19.116 1.00 71.42 N ATOM 0 H HIS A 115 12.677 36.359 -14.702 1.00 1.14 H new ATOM 0 HA HIS A 115 11.039 34.597 -16.069 1.00 64.03 H new ATOM 0 HB2 HIS A 115 12.183 37.053 -16.528 1.00 14.34 H new ATOM 0 HB3 HIS A 115 13.074 36.060 -17.664 1.00 14.34 H new ATOM 0 HD2 HIS A 115 9.443 37.396 -17.123 1.00 31.32 H new ATOM 0 HE1 HIS A 115 9.582 35.426 -20.877 1.00 53.24 H new ATOM 0 HE2 HIS A 115 8.168 36.879 -19.337 1.00 71.42 H new ATOM 1785 N ALA A 116 14.247 34.043 -16.705 1.00 54.24 N ATOM 1786 CA ALA A 116 15.187 33.032 -17.171 1.00 62.31 C ATOM 1787 C ALA A 116 15.073 31.754 -16.346 1.00 10.51 C ATOM 1788 O ALA A 116 15.253 30.651 -16.863 1.00 33.12 O ATOM 1789 CB ALA A 116 16.609 33.570 -17.120 1.00 3.11 C ATOM 0 H ALA A 116 14.677 34.931 -16.446 1.00 54.24 H new ATOM 0 HA ALA A 116 14.939 32.790 -18.204 1.00 62.31 H new ATOM 0 HB1 ALA A 116 17.301 32.804 -17.471 1.00 3.11 H new ATOM 0 HB2 ALA A 116 16.688 34.450 -17.758 1.00 3.11 H new ATOM 0 HB3 ALA A 116 16.859 33.842 -16.094 1.00 3.11 H new ATOM 1795 N LEU A 117 14.774 31.911 -15.061 1.00 61.30 N ATOM 1796 CA LEU A 117 14.637 30.769 -14.163 1.00 55.12 C ATOM 1797 C LEU A 117 13.583 29.794 -14.679 1.00 43.15 C ATOM 1798 O LEU A 117 13.868 28.617 -14.900 1.00 53.43 O ATOM 1799 CB LEU A 117 14.264 31.243 -12.757 1.00 72.03 C ATOM 1800 CG LEU A 117 14.785 30.389 -11.601 1.00 20.10 C ATOM 1801 CD1 LEU A 117 14.164 30.834 -10.286 1.00 53.12 C ATOM 1802 CD2 LEU A 117 14.501 28.916 -11.856 1.00 33.24 C ATOM 0 H LEU A 117 14.622 32.817 -14.618 1.00 61.30 H new ATOM 0 HA LEU A 117 15.596 30.252 -14.124 1.00 55.12 H new ATOM 0 HB2 LEU A 117 14.635 32.260 -12.628 1.00 72.03 H new ATOM 0 HB3 LEU A 117 13.177 31.289 -12.687 1.00 72.03 H new ATOM 0 HG LEU A 117 15.864 30.524 -11.533 1.00 20.10 H new ATOM 0 HD11 LEU A 117 14.547 30.215 -9.475 1.00 53.12 H new ATOM 0 HD12 LEU A 117 14.419 31.877 -10.098 1.00 53.12 H new ATOM 0 HD13 LEU A 117 13.080 30.730 -10.342 1.00 53.12 H new ATOM 0 HD21 LEU A 117 14.879 28.323 -11.023 1.00 33.24 H new ATOM 0 HD22 LEU A 117 13.426 28.764 -11.952 1.00 33.24 H new ATOM 0 HD23 LEU A 117 14.995 28.604 -12.776 1.00 33.24 H new ATOM 1814 N ALA A 118 12.366 30.293 -14.872 1.00 24.23 N ATOM 1815 CA ALA A 118 11.272 29.467 -15.366 1.00 72.02 C ATOM 1816 C ALA A 118 11.684 28.702 -16.620 1.00 11.35 C ATOM 1817 O ALA A 118 11.392 27.514 -16.758 1.00 44.31 O ATOM 1818 CB ALA A 118 10.048 30.326 -15.648 1.00 42.23 C ATOM 0 H ALA A 118 12.114 31.265 -14.694 1.00 24.23 H new ATOM 0 HA ALA A 118 11.022 28.739 -14.594 1.00 72.02 H new ATOM 0 HB1 ALA A 118 9.238 29.696 -16.016 1.00 42.23 H new ATOM 0 HB2 ALA A 118 9.733 30.822 -14.730 1.00 42.23 H new ATOM 0 HB3 ALA A 118 10.295 31.076 -16.400 1.00 42.23 H new ATOM 1824 N VAL A 119 12.363 29.391 -17.531 1.00 42.31 N ATOM 1825 CA VAL A 119 12.816 28.777 -18.773 1.00 72.43 C ATOM 1826 C VAL A 119 13.616 27.508 -18.499 1.00 75.02 C ATOM 1827 O VAL A 119 13.442 26.494 -19.175 1.00 74.13 O ATOM 1828 CB VAL A 119 13.682 29.748 -19.597 1.00 55.13 C ATOM 1829 CG1 VAL A 119 14.236 29.054 -20.832 1.00 20.32 C ATOM 1830 CG2 VAL A 119 12.878 30.980 -19.984 1.00 54.24 C ATOM 0 H VAL A 119 12.612 30.375 -17.432 1.00 42.31 H new ATOM 0 HA VAL A 119 11.923 28.524 -19.345 1.00 72.43 H new ATOM 0 HB VAL A 119 14.523 30.068 -18.982 1.00 55.13 H new ATOM 0 HG11 VAL A 119 14.845 29.756 -21.401 1.00 20.32 H new ATOM 0 HG12 VAL A 119 14.849 28.205 -20.528 1.00 20.32 H new ATOM 0 HG13 VAL A 119 13.412 28.703 -21.453 1.00 20.32 H new ATOM 0 HG21 VAL A 119 13.505 31.656 -20.566 1.00 54.24 H new ATOM 0 HG22 VAL A 119 12.017 30.680 -20.581 1.00 54.24 H new ATOM 0 HG23 VAL A 119 12.535 31.489 -19.083 1.00 54.24 H new ATOM 1840 N ASP A 120 14.492 27.572 -17.503 1.00 61.40 N ATOM 1841 CA ASP A 120 15.319 26.427 -17.138 1.00 15.05 C ATOM 1842 C ASP A 120 14.455 25.261 -16.668 1.00 34.15 C ATOM 1843 O ASP A 120 14.537 24.158 -17.206 1.00 63.34 O ATOM 1844 CB ASP A 120 16.311 26.817 -16.041 1.00 60.01 C ATOM 1845 CG ASP A 120 17.685 26.216 -16.263 1.00 71.23 C ATOM 1846 OD1 ASP A 120 18.513 26.861 -16.940 1.00 1.32 O ATOM 1847 OD2 ASP A 120 17.932 25.100 -15.760 1.00 44.21 O ATOM 0 H ASP A 120 14.648 28.404 -16.934 1.00 61.40 H new ATOM 0 HA ASP A 120 15.872 26.113 -18.023 1.00 15.05 H new ATOM 0 HB2 ASP A 120 16.395 27.903 -16.000 1.00 60.01 H new ATOM 0 HB3 ASP A 120 15.927 26.491 -15.075 1.00 60.01 H new ATOM 1852 N ALA A 121 13.627 25.513 -15.659 1.00 11.22 N ATOM 1853 CA ALA A 121 12.747 24.485 -15.117 1.00 3.01 C ATOM 1854 C ALA A 121 11.950 23.805 -16.225 1.00 13.33 C ATOM 1855 O ALA A 121 11.695 22.602 -16.172 1.00 31.10 O ATOM 1856 CB ALA A 121 11.809 25.086 -14.081 1.00 31.33 C ATOM 0 H ALA A 121 13.547 26.421 -15.200 1.00 11.22 H new ATOM 0 HA ALA A 121 13.366 23.729 -14.634 1.00 3.01 H new ATOM 0 HB1 ALA A 121 11.158 24.307 -13.685 1.00 31.33 H new ATOM 0 HB2 ALA A 121 12.393 25.519 -13.269 1.00 31.33 H new ATOM 0 HB3 ALA A 121 11.203 25.864 -14.546 1.00 31.33 H new ATOM 1862 N LYS A 122 11.557 24.583 -17.227 1.00 50.55 N ATOM 1863 CA LYS A 122 10.788 24.057 -18.349 1.00 43.32 C ATOM 1864 C LYS A 122 11.678 23.245 -19.285 1.00 33.43 C ATOM 1865 O LYS A 122 11.295 22.168 -19.740 1.00 20.31 O ATOM 1866 CB LYS A 122 10.127 25.201 -19.122 1.00 64.23 C ATOM 1867 CG LYS A 122 8.610 25.145 -19.112 1.00 34.32 C ATOM 1868 CD LYS A 122 8.064 24.572 -20.409 1.00 32.41 C ATOM 1869 CE LYS A 122 8.209 23.058 -20.454 1.00 52.22 C ATOM 1870 NZ LYS A 122 6.887 22.376 -20.521 1.00 53.23 N ATOM 0 H LYS A 122 11.758 25.581 -17.285 1.00 50.55 H new ATOM 0 HA LYS A 122 10.014 23.401 -17.951 1.00 43.32 H new ATOM 0 HB2 LYS A 122 10.450 26.151 -18.695 1.00 64.23 H new ATOM 0 HB3 LYS A 122 10.476 25.180 -20.154 1.00 64.23 H new ATOM 0 HG2 LYS A 122 8.273 24.535 -18.274 1.00 34.32 H new ATOM 0 HG3 LYS A 122 8.209 26.147 -18.959 1.00 34.32 H new ATOM 0 HD2 LYS A 122 7.013 24.841 -20.513 1.00 32.41 H new ATOM 0 HD3 LYS A 122 8.591 25.014 -21.254 1.00 32.41 H new ATOM 0 HE2 LYS A 122 8.807 22.776 -21.320 1.00 52.22 H new ATOM 0 HE3 LYS A 122 8.748 22.718 -19.570 1.00 52.22 H new ATOM 0 HZ1 LYS A 122 7.029 21.346 -20.550 1.00 53.23 H new ATOM 0 HZ2 LYS A 122 6.325 22.625 -19.682 1.00 53.23 H new ATOM 0 HZ3 LYS A 122 6.382 22.680 -21.378 1.00 53.23 H new ATOM 1884 N ASN A 123 12.867 23.767 -19.566 1.00 11.42 N ATOM 1885 CA ASN A 123 13.811 23.089 -20.446 1.00 41.15 C ATOM 1886 C ASN A 123 14.203 21.728 -19.879 1.00 52.12 C ATOM 1887 O ASN A 123 14.695 20.860 -20.602 1.00 14.13 O ATOM 1888 CB ASN A 123 15.061 23.949 -20.648 1.00 35.10 C ATOM 1889 CG ASN A 123 14.757 25.251 -21.365 1.00 23.54 C ATOM 1890 OD1 ASN A 123 13.699 25.404 -21.975 1.00 2.11 O ATOM 1891 ND2 ASN A 123 15.688 26.196 -21.294 1.00 34.54 N ATOM 0 H ASN A 123 13.200 24.658 -19.197 1.00 11.42 H new ATOM 0 HA ASN A 123 13.324 22.935 -21.409 1.00 41.15 H new ATOM 0 HB2 ASN A 123 15.509 24.167 -19.679 1.00 35.10 H new ATOM 0 HB3 ASN A 123 15.798 23.386 -21.220 1.00 35.10 H new ATOM 0 HD21 ASN A 123 15.541 27.093 -21.757 1.00 34.54 H new ATOM 0 HD22 ASN A 123 16.550 26.025 -20.777 1.00 34.54 H new ATOM 1898 N LEU A 124 13.981 21.548 -18.582 1.00 1.22 N ATOM 1899 CA LEU A 124 14.310 20.292 -17.916 1.00 51.34 C ATOM 1900 C LEU A 124 13.718 19.106 -18.670 1.00 32.43 C ATOM 1901 O LEU A 124 14.445 18.303 -19.255 1.00 64.45 O ATOM 1902 CB LEU A 124 13.795 20.305 -16.476 1.00 54.32 C ATOM 1903 CG LEU A 124 14.440 21.329 -15.542 1.00 0.05 C ATOM 1904 CD1 LEU A 124 13.928 21.152 -14.121 1.00 32.04 C ATOM 1905 CD2 LEU A 124 15.956 21.207 -15.583 1.00 3.41 C ATOM 0 H LEU A 124 13.575 22.256 -17.970 1.00 1.22 H new ATOM 0 HA LEU A 124 15.395 20.188 -17.905 1.00 51.34 H new ATOM 0 HB2 LEU A 124 12.721 20.488 -16.497 1.00 54.32 H new ATOM 0 HB3 LEU A 124 13.941 19.312 -16.050 1.00 54.32 H new ATOM 0 HG LEU A 124 14.166 22.327 -15.884 1.00 0.05 H new ATOM 0 HD11 LEU A 124 14.398 21.889 -13.470 1.00 32.04 H new ATOM 0 HD12 LEU A 124 12.847 21.290 -14.104 1.00 32.04 H new ATOM 0 HD13 LEU A 124 14.172 20.150 -13.769 1.00 32.04 H new ATOM 0 HD21 LEU A 124 16.399 21.943 -14.912 1.00 3.41 H new ATOM 0 HD22 LEU A 124 16.249 20.206 -15.267 1.00 3.41 H new ATOM 0 HD23 LEU A 124 16.308 21.384 -16.599 1.00 3.41 H new ATOM 1917 N LEU A 125 12.394 19.002 -18.652 1.00 74.25 N ATOM 1918 CA LEU A 125 11.702 17.914 -19.336 1.00 44.12 C ATOM 1919 C LEU A 125 11.726 18.119 -20.848 1.00 22.45 C ATOM 1920 O LEU A 125 11.703 17.156 -21.615 1.00 24.14 O ATOM 1921 CB LEU A 125 10.257 17.815 -18.846 1.00 73.53 C ATOM 1922 CG LEU A 125 9.654 16.409 -18.813 1.00 45.42 C ATOM 1923 CD1 LEU A 125 8.542 16.329 -17.779 1.00 5.41 C ATOM 1924 CD2 LEU A 125 9.135 16.019 -20.189 1.00 54.52 C ATOM 0 H LEU A 125 11.778 19.657 -18.171 1.00 74.25 H new ATOM 0 HA LEU A 125 12.222 16.984 -19.106 1.00 44.12 H new ATOM 0 HB2 LEU A 125 10.206 18.234 -17.841 1.00 73.53 H new ATOM 0 HB3 LEU A 125 9.634 18.441 -19.485 1.00 73.53 H new ATOM 0 HG LEU A 125 10.437 15.705 -18.529 1.00 45.42 H new ATOM 0 HD11 LEU A 125 8.125 15.322 -17.770 1.00 5.41 H new ATOM 0 HD12 LEU A 125 8.944 16.564 -16.793 1.00 5.41 H new ATOM 0 HD13 LEU A 125 7.758 17.044 -18.031 1.00 5.41 H new ATOM 0 HD21 LEU A 125 8.710 15.016 -20.147 1.00 54.52 H new ATOM 0 HD22 LEU A 125 8.367 16.726 -20.502 1.00 54.52 H new ATOM 0 HD23 LEU A 125 9.956 16.035 -20.906 1.00 54.52 H new ATOM 1936 N ASP A 126 11.774 19.378 -21.268 1.00 64.31 N ATOM 1937 CA ASP A 126 11.805 19.709 -22.688 1.00 70.10 C ATOM 1938 C ASP A 126 12.997 19.049 -23.374 1.00 74.55 C ATOM 1939 O ASP A 126 12.871 18.503 -24.471 1.00 51.20 O ATOM 1940 CB ASP A 126 11.867 21.225 -22.879 1.00 13.23 C ATOM 1941 CG ASP A 126 11.222 21.672 -24.176 1.00 12.32 C ATOM 1942 OD1 ASP A 126 10.063 21.281 -24.428 1.00 54.41 O ATOM 1943 OD2 ASP A 126 11.876 22.414 -24.938 1.00 72.12 O ATOM 0 H ASP A 126 11.792 20.186 -20.646 1.00 64.31 H new ATOM 0 HA ASP A 126 10.890 19.330 -23.144 1.00 70.10 H new ATOM 0 HB2 ASP A 126 11.369 21.714 -22.042 1.00 13.23 H new ATOM 0 HB3 ASP A 126 12.908 21.548 -22.864 1.00 13.23 H new ATOM 1948 N VAL A 127 14.154 19.103 -22.722 1.00 75.51 N ATOM 1949 CA VAL A 127 15.368 18.510 -23.269 1.00 61.12 C ATOM 1950 C VAL A 127 15.326 16.989 -23.179 1.00 61.41 C ATOM 1951 O VAL A 127 15.387 16.295 -24.195 1.00 31.35 O ATOM 1952 CB VAL A 127 16.622 19.022 -22.536 1.00 41.22 C ATOM 1953 CG1 VAL A 127 17.873 18.356 -23.088 1.00 61.03 C ATOM 1954 CG2 VAL A 127 16.722 20.536 -22.646 1.00 54.20 C ATOM 0 H VAL A 127 14.276 19.552 -21.814 1.00 75.51 H new ATOM 0 HA VAL A 127 15.421 18.808 -24.316 1.00 61.12 H new ATOM 0 HB VAL A 127 16.536 18.762 -21.481 1.00 41.22 H new ATOM 0 HG11 VAL A 127 18.749 18.730 -22.558 1.00 61.03 H new ATOM 0 HG12 VAL A 127 17.801 17.277 -22.952 1.00 61.03 H new ATOM 0 HG13 VAL A 127 17.967 18.583 -24.150 1.00 61.03 H new ATOM 0 HG21 VAL A 127 17.614 20.881 -22.123 1.00 54.20 H new ATOM 0 HG22 VAL A 127 16.785 20.821 -23.696 1.00 54.20 H new ATOM 0 HG23 VAL A 127 15.839 20.992 -22.198 1.00 54.20 H new ATOM 1964 N ILE A 128 15.221 16.477 -21.957 1.00 63.45 N ATOM 1965 CA ILE A 128 15.169 15.037 -21.735 1.00 24.00 C ATOM 1966 C ILE A 128 14.088 14.387 -22.592 1.00 25.11 C ATOM 1967 O ILE A 128 14.182 13.209 -22.939 1.00 53.52 O ATOM 1968 CB ILE A 128 14.904 14.705 -20.255 1.00 12.33 C ATOM 1969 CG1 ILE A 128 15.367 13.282 -19.937 1.00 40.12 C ATOM 1970 CG2 ILE A 128 13.426 14.872 -19.931 1.00 65.25 C ATOM 1971 CD1 ILE A 128 15.768 13.085 -18.492 1.00 41.40 C ATOM 0 H ILE A 128 15.170 17.037 -21.106 1.00 63.45 H new ATOM 0 HA ILE A 128 16.143 14.639 -22.019 1.00 24.00 H new ATOM 0 HB ILE A 128 15.473 15.398 -19.635 1.00 12.33 H new ATOM 0 HG12 ILE A 128 14.565 12.585 -20.181 1.00 40.12 H new ATOM 0 HG13 ILE A 128 16.213 13.032 -20.577 1.00 40.12 H new ATOM 0 HG21 ILE A 128 13.254 14.634 -18.881 1.00 65.25 H new ATOM 0 HG22 ILE A 128 13.126 15.902 -20.123 1.00 65.25 H new ATOM 0 HG23 ILE A 128 12.838 14.200 -20.556 1.00 65.25 H new ATOM 0 HD11 ILE A 128 16.085 12.053 -18.340 1.00 41.40 H new ATOM 0 HD12 ILE A 128 16.591 13.757 -18.248 1.00 41.40 H new ATOM 0 HD13 ILE A 128 14.918 13.303 -17.846 1.00 41.40 H new ATOM 1983 N ASP A 129 13.064 15.162 -22.931 1.00 3.12 N ATOM 1984 CA ASP A 129 11.966 14.663 -23.750 1.00 40.12 C ATOM 1985 C ASP A 129 12.488 14.070 -25.056 1.00 14.44 C ATOM 1986 O ASP A 129 11.916 13.119 -25.588 1.00 3.14 O ATOM 1987 CB ASP A 129 10.972 15.787 -24.047 1.00 73.42 C ATOM 1988 CG ASP A 129 9.979 15.410 -25.129 1.00 50.14 C ATOM 1989 OD1 ASP A 129 10.311 15.574 -26.322 1.00 2.13 O ATOM 1990 OD2 ASP A 129 8.869 14.952 -24.784 1.00 3.30 O ATOM 0 H ASP A 129 12.971 16.138 -22.651 1.00 3.12 H new ATOM 0 HA ASP A 129 11.457 13.876 -23.193 1.00 40.12 H new ATOM 0 HB2 ASP A 129 10.432 16.041 -23.135 1.00 73.42 H new ATOM 0 HB3 ASP A 129 11.518 16.679 -24.354 1.00 73.42 H new ATOM 1995 N GLN A 130 13.575 14.640 -25.566 1.00 14.34 N ATOM 1996 CA GLN A 130 14.171 14.169 -26.810 1.00 25.03 C ATOM 1997 C GLN A 130 14.779 12.781 -26.631 1.00 13.54 C ATOM 1998 O GLN A 130 14.904 12.020 -27.589 1.00 64.01 O ATOM 1999 CB GLN A 130 15.243 15.150 -27.290 1.00 31.55 C ATOM 2000 CG GLN A 130 14.679 16.359 -28.017 1.00 14.54 C ATOM 2001 CD GLN A 130 15.705 17.459 -28.204 1.00 2.14 C ATOM 2002 OE1 GLN A 130 16.798 17.223 -28.721 1.00 14.13 O ATOM 2003 NE2 GLN A 130 15.359 18.670 -27.783 1.00 42.20 N ATOM 0 H GLN A 130 14.060 15.428 -25.137 1.00 14.34 H new ATOM 0 HA GLN A 130 13.383 14.107 -27.560 1.00 25.03 H new ATOM 0 HB2 GLN A 130 15.823 15.490 -26.432 1.00 31.55 H new ATOM 0 HB3 GLN A 130 15.932 14.627 -27.953 1.00 31.55 H new ATOM 0 HG2 GLN A 130 14.303 16.049 -28.992 1.00 14.54 H new ATOM 0 HG3 GLN A 130 13.830 16.751 -27.457 1.00 14.54 H new ATOM 0 HE21 GLN A 130 14.443 18.821 -27.360 1.00 42.20 H new ATOM 0 HE22 GLN A 130 16.009 19.450 -27.882 1.00 42.20 H new ATOM 2012 N ALA A 131 15.154 12.460 -25.397 1.00 20.10 N ATOM 2013 CA ALA A 131 15.747 11.164 -25.092 1.00 74.52 C ATOM 2014 C ALA A 131 14.701 10.055 -25.147 1.00 53.25 C ATOM 2015 O ALA A 131 14.850 9.084 -25.889 1.00 43.02 O ATOM 2016 CB ALA A 131 16.412 11.196 -23.724 1.00 63.15 C ATOM 0 H ALA A 131 15.058 13.080 -24.593 1.00 20.10 H new ATOM 0 HA ALA A 131 16.504 10.952 -25.847 1.00 74.52 H new ATOM 0 HB1 ALA A 131 16.850 10.221 -23.510 1.00 63.15 H new ATOM 0 HB2 ALA A 131 17.194 11.955 -23.717 1.00 63.15 H new ATOM 0 HB3 ALA A 131 15.668 11.434 -22.963 1.00 63.15 H new ATOM 2022 N ARG A 132 13.642 10.207 -24.358 1.00 25.31 N ATOM 2023 CA ARG A 132 12.573 9.217 -24.316 1.00 14.10 C ATOM 2024 C ARG A 132 12.038 8.934 -25.717 1.00 44.30 C ATOM 2025 O ARG A 132 11.786 7.783 -26.076 1.00 41.43 O ATOM 2026 CB ARG A 132 11.436 9.701 -23.413 1.00 42.35 C ATOM 2027 CG ARG A 132 11.042 11.149 -23.655 1.00 14.23 C ATOM 2028 CD ARG A 132 9.801 11.528 -22.861 1.00 2.22 C ATOM 2029 NE ARG A 132 8.808 12.207 -23.689 1.00 10.34 N ATOM 2030 CZ ARG A 132 8.032 11.582 -24.567 1.00 45.25 C ATOM 2031 NH1 ARG A 132 8.135 10.271 -24.732 1.00 33.53 N ATOM 2032 NH2 ARG A 132 7.152 12.269 -25.284 1.00 0.31 N ATOM 0 H ARG A 132 13.502 11.006 -23.740 1.00 25.31 H new ATOM 0 HA ARG A 132 12.984 8.293 -23.909 1.00 14.10 H new ATOM 0 HB2 ARG A 132 10.564 9.065 -23.568 1.00 42.35 H new ATOM 0 HB3 ARG A 132 11.735 9.584 -22.371 1.00 42.35 H new ATOM 0 HG2 ARG A 132 11.868 11.804 -23.376 1.00 14.23 H new ATOM 0 HG3 ARG A 132 10.857 11.304 -24.718 1.00 14.23 H new ATOM 0 HD2 ARG A 132 9.359 10.630 -22.428 1.00 2.22 H new ATOM 0 HD3 ARG A 132 10.085 12.175 -22.031 1.00 2.22 H new ATOM 0 HE ARG A 132 8.705 13.217 -23.587 1.00 10.34 H new ATOM 0 HH11 ARG A 132 8.811 9.740 -24.184 1.00 33.53 H new ATOM 0 HH12 ARG A 132 7.538 9.793 -25.407 1.00 33.53 H new ATOM 0 HH21 ARG A 132 7.071 13.278 -25.161 1.00 0.31 H new ATOM 0 HH22 ARG A 132 6.557 11.788 -25.958 1.00 0.31 H new ATOM 2046 N LEU A 133 11.868 9.991 -26.504 1.00 31.11 N ATOM 2047 CA LEU A 133 11.363 9.857 -27.866 1.00 61.10 C ATOM 2048 C LEU A 133 12.412 9.225 -28.776 1.00 33.24 C ATOM 2049 O LEU A 133 12.100 8.358 -29.593 1.00 12.14 O ATOM 2050 CB LEU A 133 10.952 11.224 -28.415 1.00 43.24 C ATOM 2051 CG LEU A 133 9.481 11.603 -28.242 1.00 60.31 C ATOM 2052 CD1 LEU A 133 9.317 13.115 -28.226 1.00 22.43 C ATOM 2053 CD2 LEU A 133 8.638 10.985 -29.348 1.00 15.02 C ATOM 0 H LEU A 133 12.072 10.950 -26.222 1.00 31.11 H new ATOM 0 HA LEU A 133 10.490 9.205 -27.841 1.00 61.10 H new ATOM 0 HB2 LEU A 133 11.562 11.986 -27.930 1.00 43.24 H new ATOM 0 HB3 LEU A 133 11.191 11.253 -29.478 1.00 43.24 H new ATOM 0 HG LEU A 133 9.135 11.211 -27.286 1.00 60.31 H new ATOM 0 HD11 LEU A 133 8.263 13.365 -28.102 1.00 22.43 H new ATOM 0 HD12 LEU A 133 9.889 13.534 -27.399 1.00 22.43 H new ATOM 0 HD13 LEU A 133 9.680 13.530 -29.166 1.00 22.43 H new ATOM 0 HD21 LEU A 133 7.594 11.265 -29.209 1.00 15.02 H new ATOM 0 HD22 LEU A 133 8.985 11.347 -30.316 1.00 15.02 H new ATOM 0 HD23 LEU A 133 8.730 9.899 -29.312 1.00 15.02 H new ATOM 2065 N LYS A 134 13.657 9.663 -28.627 1.00 64.33 N ATOM 2066 CA LYS A 134 14.754 9.138 -29.432 1.00 42.22 C ATOM 2067 C LYS A 134 14.843 7.621 -29.308 1.00 71.50 C ATOM 2068 O LYS A 134 15.253 6.935 -30.244 1.00 23.00 O ATOM 2069 CB LYS A 134 16.078 9.774 -29.003 1.00 24.11 C ATOM 2070 CG LYS A 134 17.296 9.141 -29.653 1.00 62.34 C ATOM 2071 CD LYS A 134 18.204 10.188 -30.275 1.00 5.41 C ATOM 2072 CE LYS A 134 19.669 9.902 -29.980 1.00 51.02 C ATOM 2073 NZ LYS A 134 20.515 11.116 -30.144 1.00 4.33 N ATOM 0 H LYS A 134 13.932 10.380 -27.956 1.00 64.33 H new ATOM 0 HA LYS A 134 14.558 9.388 -30.475 1.00 42.22 H new ATOM 0 HB2 LYS A 134 16.057 10.836 -29.247 1.00 24.11 H new ATOM 0 HB3 LYS A 134 16.174 9.698 -27.920 1.00 24.11 H new ATOM 0 HG2 LYS A 134 17.852 8.572 -28.908 1.00 62.34 H new ATOM 0 HG3 LYS A 134 16.975 8.435 -30.419 1.00 62.34 H new ATOM 0 HD2 LYS A 134 18.047 10.213 -31.353 1.00 5.41 H new ATOM 0 HD3 LYS A 134 17.940 11.174 -29.892 1.00 5.41 H new ATOM 0 HE2 LYS A 134 19.768 9.525 -28.962 1.00 51.02 H new ATOM 0 HE3 LYS A 134 20.027 9.117 -30.646 1.00 51.02 H new ATOM 0 HZ1 LYS A 134 21.506 10.880 -29.934 1.00 4.33 H new ATOM 0 HZ2 LYS A 134 20.441 11.461 -31.122 1.00 4.33 H new ATOM 0 HZ3 LYS A 134 20.190 11.857 -29.490 1.00 4.33 H new ATOM 2087 N MET A 135 14.454 7.103 -28.147 1.00 63.44 N ATOM 2088 CA MET A 135 14.488 5.665 -27.903 1.00 12.30 C ATOM 2089 C MET A 135 13.218 4.996 -28.419 1.00 51.33 C ATOM 2090 O MET A 135 13.278 4.083 -29.243 1.00 54.11 O ATOM 2091 CB MET A 135 14.655 5.384 -26.408 1.00 53.34 C ATOM 2092 CG MET A 135 14.566 3.909 -26.054 1.00 33.12 C ATOM 2093 SD MET A 135 13.234 3.553 -24.892 1.00 31.04 S ATOM 2094 CE MET A 135 13.821 4.408 -23.432 1.00 1.25 C ATOM 0 H MET A 135 14.112 7.657 -27.361 1.00 63.44 H new ATOM 0 HA MET A 135 15.340 5.250 -28.441 1.00 12.30 H new ATOM 0 HB2 MET A 135 15.620 5.771 -26.079 1.00 53.34 H new ATOM 0 HB3 MET A 135 13.889 5.929 -25.856 1.00 53.34 H new ATOM 0 HG2 MET A 135 14.413 3.329 -26.964 1.00 33.12 H new ATOM 0 HG3 MET A 135 15.514 3.584 -25.625 1.00 33.12 H new ATOM 0 HE1 MET A 135 13.258 4.071 -22.562 1.00 1.25 H new ATOM 0 HE2 MET A 135 14.879 4.193 -23.285 1.00 1.25 H new ATOM 0 HE3 MET A 135 13.683 5.482 -23.559 1.00 1.25 H new ATOM 2104 N ILE A 136 12.071 5.456 -27.930 1.00 4.21 N ATOM 2105 CA ILE A 136 10.788 4.902 -28.343 1.00 41.12 C ATOM 2106 C ILE A 136 10.629 4.956 -29.859 1.00 34.32 C ATOM 2107 O ILE A 136 10.490 3.924 -30.516 1.00 24.24 O ATOM 2108 CB ILE A 136 9.614 5.653 -27.688 1.00 34.41 C ATOM 2109 CG1 ILE A 136 9.726 5.588 -26.163 1.00 40.43 C ATOM 2110 CG2 ILE A 136 8.287 5.069 -28.152 1.00 24.13 C ATOM 2111 CD1 ILE A 136 8.896 6.634 -25.452 1.00 31.33 C ATOM 0 H ILE A 136 12.004 6.211 -27.247 1.00 4.21 H new ATOM 0 HA ILE A 136 10.772 3.863 -28.015 1.00 41.12 H new ATOM 0 HB ILE A 136 9.655 6.699 -27.993 1.00 34.41 H new ATOM 0 HG12 ILE A 136 9.416 4.599 -25.826 1.00 40.43 H new ATOM 0 HG13 ILE A 136 10.771 5.709 -25.878 1.00 40.43 H new ATOM 0 HG21 ILE A 136 7.467 5.610 -27.681 1.00 24.13 H new ATOM 0 HG22 ILE A 136 8.208 5.161 -29.235 1.00 24.13 H new ATOM 0 HG23 ILE A 136 8.235 4.017 -27.873 1.00 24.13 H new ATOM 0 HD11 ILE A 136 9.023 6.529 -24.375 1.00 31.33 H new ATOM 0 HD12 ILE A 136 9.221 7.628 -25.761 1.00 31.33 H new ATOM 0 HD13 ILE A 136 7.845 6.500 -25.708 1.00 31.33 H new ATOM 2123 N SER A 137 10.651 6.166 -30.408 1.00 74.23 N ATOM 2124 CA SER A 137 10.507 6.355 -31.847 1.00 35.20 C ATOM 2125 C SER A 137 11.800 5.999 -32.574 1.00 11.12 C ATOM 2126 O SER A 137 12.480 6.871 -33.115 1.00 34.05 O ATOM 2127 CB SER A 137 10.116 7.801 -32.156 1.00 54.21 C ATOM 2128 OG SER A 137 8.765 8.050 -31.808 1.00 74.22 O ATOM 0 H SER A 137 10.767 7.030 -29.879 1.00 74.23 H new ATOM 0 HA SER A 137 9.718 5.690 -32.199 1.00 35.20 H new ATOM 0 HB2 SER A 137 10.767 8.482 -31.608 1.00 54.21 H new ATOM 0 HB3 SER A 137 10.264 8.002 -33.217 1.00 54.21 H new ATOM 0 HG SER A 137 8.541 8.982 -32.014 1.00 74.22 H new ATOM 2134 N GLN A 138 12.132 4.712 -32.581 1.00 44.33 N ATOM 2135 CA GLN A 138 13.344 4.241 -33.241 1.00 25.12 C ATOM 2136 C GLN A 138 13.472 2.725 -33.126 1.00 41.44 C ATOM 2137 O GLN A 138 13.530 2.020 -34.133 1.00 75.33 O ATOM 2138 CB GLN A 138 14.576 4.916 -32.634 1.00 31.41 C ATOM 2139 CG GLN A 138 15.256 5.898 -33.573 1.00 40.43 C ATOM 2140 CD GLN A 138 16.757 5.960 -33.366 1.00 55.44 C ATOM 2141 OE1 GLN A 138 17.510 5.809 -34.449 1.00 3.52 O flip ATOM 2142 NE2 GLN A 138 17.233 6.142 -32.246 1.00 25.21 N flip ATOM 0 H GLN A 138 11.580 3.978 -32.138 1.00 44.33 H new ATOM 0 HA GLN A 138 13.278 4.503 -34.297 1.00 25.12 H new ATOM 0 HB2 GLN A 138 14.282 5.440 -31.725 1.00 31.41 H new ATOM 0 HB3 GLN A 138 15.293 4.149 -32.342 1.00 31.41 H new ATOM 0 HG2 GLN A 138 15.047 5.613 -34.604 1.00 40.43 H new ATOM 0 HG3 GLN A 138 14.831 6.891 -33.424 1.00 40.43 H new ATOM 0 HE21 GLN A 138 16.616 6.253 -31.441 1.00 25.21 H new ATOM 0 HE22 GLN A 138 18.245 6.182 -32.122 1.00 25.21 H new ATOM 2151 N SER A 139 13.516 2.232 -31.893 1.00 64.41 N ATOM 2152 CA SER A 139 13.642 0.800 -31.647 1.00 74.20 C ATOM 2153 C SER A 139 13.608 0.501 -30.151 1.00 74.44 C ATOM 2154 O SER A 139 14.173 1.241 -29.346 1.00 70.42 O ATOM 2155 CB SER A 139 14.941 0.268 -32.256 1.00 34.14 C ATOM 2156 OG SER A 139 14.680 -0.530 -33.397 1.00 74.21 O ATOM 0 H SER A 139 13.466 2.802 -31.049 1.00 64.41 H new ATOM 0 HA SER A 139 12.797 0.300 -32.119 1.00 74.20 H new ATOM 0 HB2 SER A 139 15.585 1.103 -32.532 1.00 34.14 H new ATOM 0 HB3 SER A 139 15.481 -0.319 -31.513 1.00 34.14 H new ATOM 0 HG SER A 139 14.218 0.008 -34.074 1.00 74.21 H new ATOM 2162 N ARG A 140 12.940 -0.590 -29.787 1.00 42.45 N ATOM 2163 CA ARG A 140 12.831 -0.987 -28.389 1.00 75.11 C ATOM 2164 C ARG A 140 12.075 0.065 -27.583 1.00 33.14 C ATOM 2165 O ARG A 140 12.650 0.796 -26.776 1.00 41.24 O ATOM 2166 CB ARG A 140 14.220 -1.204 -27.788 1.00 64.41 C ATOM 2167 CG ARG A 140 14.240 -2.207 -26.646 1.00 61.20 C ATOM 2168 CD ARG A 140 14.442 -3.626 -27.154 1.00 71.21 C ATOM 2169 NE ARG A 140 13.328 -4.500 -26.795 1.00 1.21 N ATOM 2170 CZ ARG A 140 13.065 -5.647 -27.411 1.00 42.34 C ATOM 2171 NH1 ARG A 140 13.833 -6.056 -28.412 1.00 75.31 N ATOM 2172 NH2 ARG A 140 12.033 -6.387 -27.027 1.00 2.32 N ATOM 0 H ARG A 140 12.467 -1.214 -30.441 1.00 42.45 H new ATOM 0 HA ARG A 140 12.274 -1.923 -28.346 1.00 75.11 H new ATOM 0 HB2 ARG A 140 14.896 -1.545 -28.572 1.00 64.41 H new ATOM 0 HB3 ARG A 140 14.604 -0.249 -27.429 1.00 64.41 H new ATOM 0 HG2 ARG A 140 15.039 -1.951 -25.950 1.00 61.20 H new ATOM 0 HG3 ARG A 140 13.303 -2.148 -26.092 1.00 61.20 H new ATOM 0 HD2 ARG A 140 14.556 -3.610 -28.238 1.00 71.21 H new ATOM 0 HD3 ARG A 140 15.367 -4.030 -26.742 1.00 71.21 H new ATOM 0 HE ARG A 140 12.718 -4.214 -26.029 1.00 1.21 H new ATOM 0 HH11 ARG A 140 14.627 -5.489 -28.710 1.00 75.31 H new ATOM 0 HH12 ARG A 140 13.630 -6.937 -28.884 1.00 75.31 H new ATOM 0 HH21 ARG A 140 11.440 -6.075 -26.258 1.00 2.32 H new ATOM 0 HH22 ARG A 140 11.832 -7.268 -27.501 1.00 2.32 H new ATOM 2186 N PRO A 141 10.754 0.145 -27.804 1.00 22.50 N ATOM 2187 CA PRO A 141 9.891 1.103 -27.108 1.00 2.43 C ATOM 2188 C PRO A 141 9.722 0.765 -25.631 1.00 22.15 C ATOM 2189 O PRO A 141 9.205 -0.297 -25.282 1.00 10.12 O ATOM 2190 CB PRO A 141 8.554 0.975 -27.842 1.00 2.51 C ATOM 2191 CG PRO A 141 8.566 -0.400 -28.414 1.00 44.13 C ATOM 2192 CD PRO A 141 10.002 -0.696 -28.751 1.00 12.33 C ATOM 0 HA PRO A 141 10.306 2.111 -27.123 1.00 2.43 H new ATOM 0 HB2 PRO A 141 7.714 1.113 -27.161 1.00 2.51 H new ATOM 0 HB3 PRO A 141 8.458 1.728 -28.624 1.00 2.51 H new ATOM 0 HG2 PRO A 141 8.176 -1.124 -27.698 1.00 44.13 H new ATOM 0 HG3 PRO A 141 7.937 -0.459 -29.302 1.00 44.13 H new ATOM 0 HD2 PRO A 141 10.235 -1.753 -28.623 1.00 12.33 H new ATOM 0 HD3 PRO A 141 10.233 -0.442 -29.785 1.00 12.33 H new ATOM 2200 N HIS A 142 10.161 1.674 -24.766 1.00 2.02 N ATOM 2201 CA HIS A 142 10.057 1.472 -23.325 1.00 62.30 C ATOM 2202 C HIS A 142 10.506 2.718 -22.568 1.00 22.44 C ATOM 2203 O HIS A 142 10.859 2.614 -21.394 1.00 34.13 O ATOM 2204 CB HIS A 142 10.898 0.269 -22.896 1.00 31.03 C ATOM 2205 CG HIS A 142 12.370 0.471 -23.080 1.00 5.12 C ATOM 2206 ND1 HIS A 142 13.091 -0.126 -24.092 1.00 43.04 N ATOM 2207 CD2 HIS A 142 13.258 1.211 -22.374 1.00 55.24 C ATOM 2208 CE1 HIS A 142 14.358 0.237 -24.001 1.00 23.42 C ATOM 2209 NE2 HIS A 142 14.486 1.048 -22.967 1.00 13.43 N ATOM 0 H HIS A 142 10.592 2.558 -25.038 1.00 2.02 H new ATOM 0 HA HIS A 142 9.012 1.280 -23.084 1.00 62.30 H new ATOM 0 HB2 HIS A 142 10.698 0.052 -21.847 1.00 31.03 H new ATOM 0 HB3 HIS A 142 10.585 -0.605 -23.468 1.00 31.03 H new ATOM 0 HD2 HIS A 142 13.041 1.816 -21.506 1.00 55.24 H new ATOM 0 HE1 HIS A 142 15.154 -0.076 -24.660 1.00 23.42 H new ATOM 0 HE2 HIS A 142 15.356 1.483 -22.659 1.00 13.43 H new ATOM 2217 N SER A 169 26.262 21.043 0.956 1.00 35.12 N ATOM 2218 CA SER A 169 26.652 22.140 0.079 1.00 50.13 C ATOM 2219 C SER A 169 25.424 22.867 -0.462 1.00 22.31 C ATOM 2220 O SER A 169 25.141 24.001 -0.077 1.00 62.13 O ATOM 2221 CB SER A 169 27.500 21.616 -1.081 1.00 45.15 C ATOM 2222 OG SER A 169 28.875 21.587 -0.736 1.00 55.30 O ATOM 0 HA SER A 169 27.243 22.846 0.662 1.00 50.13 H new ATOM 0 HB2 SER A 169 27.169 20.614 -1.354 1.00 45.15 H new ATOM 0 HB3 SER A 169 27.355 22.249 -1.957 1.00 45.15 H new ATOM 0 HG SER A 169 29.395 21.247 -1.494 1.00 55.30 H new ATOM 2228 N ALA A 170 24.699 22.204 -1.357 1.00 14.04 N ATOM 2229 CA ALA A 170 23.500 22.785 -1.949 1.00 61.44 C ATOM 2230 C ALA A 170 22.394 22.939 -0.911 1.00 51.12 C ATOM 2231 O ALA A 170 21.846 24.027 -0.729 1.00 72.22 O ATOM 2232 CB ALA A 170 23.019 21.930 -3.113 1.00 24.35 C ATOM 0 H ALA A 170 24.921 21.265 -1.688 1.00 14.04 H new ATOM 0 HA ALA A 170 23.753 23.778 -2.321 1.00 61.44 H new ATOM 0 HB1 ALA A 170 22.123 22.375 -3.546 1.00 24.35 H new ATOM 0 HB2 ALA A 170 23.800 21.876 -3.872 1.00 24.35 H new ATOM 0 HB3 ALA A 170 22.789 20.926 -2.756 1.00 24.35 H new ATOM 2238 N THR A 171 22.069 21.843 -0.232 1.00 54.41 N ATOM 2239 CA THR A 171 21.026 21.857 0.787 1.00 63.25 C ATOM 2240 C THR A 171 21.291 22.936 1.830 1.00 24.22 C ATOM 2241 O THR A 171 20.363 23.452 2.452 1.00 0.15 O ATOM 2242 CB THR A 171 20.913 20.492 1.492 1.00 2.55 C ATOM 2243 OG1 THR A 171 22.172 19.811 1.446 1.00 73.10 O ATOM 2244 CG2 THR A 171 19.841 19.633 0.840 1.00 32.12 C ATOM 0 H THR A 171 22.513 20.935 -0.369 1.00 54.41 H new ATOM 0 HA THR A 171 20.087 22.073 0.277 1.00 63.25 H new ATOM 0 HB THR A 171 20.633 20.667 2.531 1.00 2.55 H new ATOM 0 HG1 THR A 171 22.092 18.945 1.898 1.00 73.10 H new ATOM 0 HG21 THR A 171 19.780 18.674 1.355 1.00 32.12 H new ATOM 0 HG22 THR A 171 18.879 20.141 0.904 1.00 32.12 H new ATOM 0 HG23 THR A 171 20.095 19.467 -0.207 1.00 32.12 H new ATOM 2252 N ARG A 172 22.563 23.273 2.017 1.00 64.45 N ATOM 2253 CA ARG A 172 22.950 24.291 2.986 1.00 61.41 C ATOM 2254 C ARG A 172 22.363 25.648 2.612 1.00 14.31 C ATOM 2255 O ARG A 172 21.717 26.302 3.431 1.00 73.25 O ATOM 2256 CB ARG A 172 24.474 24.389 3.073 1.00 2.14 C ATOM 2257 CG ARG A 172 25.007 24.337 4.496 1.00 43.02 C ATOM 2258 CD ARG A 172 24.614 25.577 5.284 1.00 70.32 C ATOM 2259 NE ARG A 172 25.457 25.768 6.461 1.00 64.43 N ATOM 2260 CZ ARG A 172 25.158 26.599 7.452 1.00 2.42 C ATOM 2261 NH1 ARG A 172 24.042 27.313 7.409 1.00 14.01 N ATOM 2262 NH2 ARG A 172 25.976 26.718 8.490 1.00 4.10 N ATOM 0 H ARG A 172 23.343 22.856 1.510 1.00 64.45 H new ATOM 0 HA ARG A 172 22.555 23.999 3.959 1.00 61.41 H new ATOM 0 HB2 ARG A 172 24.915 23.575 2.499 1.00 2.14 H new ATOM 0 HB3 ARG A 172 24.797 25.320 2.607 1.00 2.14 H new ATOM 0 HG2 ARG A 172 24.622 23.449 4.997 1.00 43.02 H new ATOM 0 HG3 ARG A 172 26.093 24.246 4.476 1.00 43.02 H new ATOM 0 HD2 ARG A 172 24.687 26.454 4.640 1.00 70.32 H new ATOM 0 HD3 ARG A 172 23.572 25.494 5.594 1.00 70.32 H new ATOM 0 HE ARG A 172 26.323 25.233 6.525 1.00 64.43 H new ATOM 0 HH11 ARG A 172 23.410 27.225 6.613 1.00 14.01 H new ATOM 0 HH12 ARG A 172 23.815 27.951 8.172 1.00 14.01 H new ATOM 0 HH21 ARG A 172 26.836 26.171 8.527 1.00 4.10 H new ATOM 0 HH22 ARG A 172 25.745 27.357 9.251 1.00 4.10 H new ATOM 2276 N GLU A 173 22.592 26.065 1.371 1.00 44.51 N ATOM 2277 CA GLU A 173 22.087 27.346 0.890 1.00 33.12 C ATOM 2278 C GLU A 173 20.573 27.433 1.063 1.00 21.24 C ATOM 2279 O GLU A 173 20.050 28.429 1.566 1.00 63.44 O ATOM 2280 CB GLU A 173 22.455 27.545 -0.582 1.00 31.24 C ATOM 2281 CG GLU A 173 23.864 28.072 -0.790 1.00 44.45 C ATOM 2282 CD GLU A 173 23.996 28.900 -2.054 1.00 63.35 C ATOM 2283 OE1 GLU A 173 23.015 29.576 -2.426 1.00 41.54 O ATOM 2284 OE2 GLU A 173 25.082 28.870 -2.672 1.00 33.04 O ATOM 0 H GLU A 173 23.124 25.535 0.681 1.00 44.51 H new ATOM 0 HA GLU A 173 22.550 28.135 1.482 1.00 33.12 H new ATOM 0 HB2 GLU A 173 22.350 26.595 -1.106 1.00 31.24 H new ATOM 0 HB3 GLU A 173 21.746 28.238 -1.035 1.00 31.24 H new ATOM 0 HG2 GLU A 173 24.152 28.678 0.069 1.00 44.45 H new ATOM 0 HG3 GLU A 173 24.559 27.233 -0.835 1.00 44.45 H new ATOM 2291 N LEU A 174 19.875 26.384 0.644 1.00 75.32 N ATOM 2292 CA LEU A 174 18.420 26.340 0.751 1.00 3.14 C ATOM 2293 C LEU A 174 17.976 26.527 2.198 1.00 35.24 C ATOM 2294 O LEU A 174 16.978 27.195 2.470 1.00 2.54 O ATOM 2295 CB LEU A 174 17.889 25.012 0.210 1.00 72.02 C ATOM 2296 CG LEU A 174 18.353 24.626 -1.195 1.00 61.10 C ATOM 2297 CD1 LEU A 174 17.716 23.314 -1.626 1.00 53.23 C ATOM 2298 CD2 LEU A 174 18.026 25.732 -2.188 1.00 34.13 C ATOM 0 H LEU A 174 20.292 25.552 0.227 1.00 75.32 H new ATOM 0 HA LEU A 174 18.011 27.156 0.156 1.00 3.14 H new ATOM 0 HB2 LEU A 174 18.182 24.219 0.898 1.00 72.02 H new ATOM 0 HB3 LEU A 174 16.800 25.051 0.213 1.00 72.02 H new ATOM 0 HG LEU A 174 19.435 24.492 -1.175 1.00 61.10 H new ATOM 0 HD11 LEU A 174 18.058 23.055 -2.628 1.00 53.23 H new ATOM 0 HD12 LEU A 174 18.002 22.525 -0.930 1.00 53.23 H new ATOM 0 HD13 LEU A 174 16.631 23.420 -1.629 1.00 53.23 H new ATOM 0 HD21 LEU A 174 18.364 25.440 -3.182 1.00 34.13 H new ATOM 0 HD22 LEU A 174 16.949 25.899 -2.205 1.00 34.13 H new ATOM 0 HD23 LEU A 174 18.531 26.650 -1.889 1.00 34.13 H new ATOM 2310 N ASP A 175 18.723 25.934 3.123 1.00 72.53 N ATOM 2311 CA ASP A 175 18.408 26.037 4.543 1.00 74.02 C ATOM 2312 C ASP A 175 18.707 27.439 5.065 1.00 32.31 C ATOM 2313 O ASP A 175 17.869 28.059 5.718 1.00 12.41 O ATOM 2314 CB ASP A 175 19.203 25.002 5.340 1.00 35.22 C ATOM 2315 CG ASP A 175 18.560 23.629 5.309 1.00 13.14 C ATOM 2316 OD1 ASP A 175 17.500 23.485 4.664 1.00 23.14 O ATOM 2317 OD2 ASP A 175 19.115 22.699 5.931 1.00 45.20 O ATOM 0 H ASP A 175 19.551 25.377 2.915 1.00 72.53 H new ATOM 0 HA ASP A 175 17.343 25.841 4.669 1.00 74.02 H new ATOM 0 HB2 ASP A 175 20.214 24.936 4.937 1.00 35.22 H new ATOM 0 HB3 ASP A 175 19.293 25.335 6.374 1.00 35.22 H new ATOM 2322 N GLU A 176 19.907 27.930 4.773 1.00 22.12 N ATOM 2323 CA GLU A 176 20.317 29.258 5.216 1.00 73.34 C ATOM 2324 C GLU A 176 19.374 30.327 4.671 1.00 45.33 C ATOM 2325 O GLU A 176 18.750 31.067 5.432 1.00 33.12 O ATOM 2326 CB GLU A 176 21.750 29.549 4.768 1.00 44.24 C ATOM 2327 CG GLU A 176 22.530 30.412 5.745 1.00 11.43 C ATOM 2328 CD GLU A 176 23.624 31.216 5.070 1.00 50.32 C ATOM 2329 OE1 GLU A 176 23.341 32.349 4.627 1.00 5.12 O ATOM 2330 OE2 GLU A 176 24.763 30.712 4.984 1.00 23.33 O ATOM 0 H GLU A 176 20.612 27.429 4.232 1.00 22.12 H new ATOM 0 HA GLU A 176 20.274 29.280 6.305 1.00 73.34 H new ATOM 0 HB2 GLU A 176 22.277 28.605 4.629 1.00 44.24 H new ATOM 0 HB3 GLU A 176 21.725 30.045 3.798 1.00 44.24 H new ATOM 0 HG2 GLU A 176 21.844 31.092 6.251 1.00 11.43 H new ATOM 0 HG3 GLU A 176 22.972 29.776 6.512 1.00 11.43 H new ATOM 2337 N LEU A 177 19.278 30.404 3.348 1.00 31.10 N ATOM 2338 CA LEU A 177 18.413 31.383 2.699 1.00 13.15 C ATOM 2339 C LEU A 177 16.993 31.305 3.251 1.00 11.34 C ATOM 2340 O LEU A 177 16.336 32.327 3.448 1.00 41.30 O ATOM 2341 CB LEU A 177 18.397 31.156 1.187 1.00 41.52 C ATOM 2342 CG LEU A 177 19.426 31.948 0.379 1.00 51.32 C ATOM 2343 CD1 LEU A 177 19.423 31.500 -1.074 1.00 40.14 C ATOM 2344 CD2 LEU A 177 19.148 33.441 0.479 1.00 43.10 C ATOM 0 H LEU A 177 19.789 29.800 2.704 1.00 31.10 H new ATOM 0 HA LEU A 177 18.810 32.376 2.907 1.00 13.15 H new ATOM 0 HB2 LEU A 177 18.555 30.094 0.997 1.00 41.52 H new ATOM 0 HB3 LEU A 177 17.403 31.402 0.813 1.00 41.52 H new ATOM 0 HG LEU A 177 20.414 31.754 0.796 1.00 51.32 H new ATOM 0 HD11 LEU A 177 20.161 32.075 -1.633 1.00 40.14 H new ATOM 0 HD12 LEU A 177 19.671 30.440 -1.128 1.00 40.14 H new ATOM 0 HD13 LEU A 177 18.435 31.664 -1.503 1.00 40.14 H new ATOM 0 HD21 LEU A 177 19.890 33.989 -0.102 1.00 43.10 H new ATOM 0 HD22 LEU A 177 18.153 33.653 0.088 1.00 43.10 H new ATOM 0 HD23 LEU A 177 19.202 33.752 1.522 1.00 43.10 H new ATOM 2356 N MET A 178 16.527 30.086 3.501 1.00 14.12 N ATOM 2357 CA MET A 178 15.186 29.876 4.034 1.00 35.42 C ATOM 2358 C MET A 178 15.001 30.622 5.352 1.00 72.13 C ATOM 2359 O MET A 178 13.926 31.153 5.629 1.00 2.51 O ATOM 2360 CB MET A 178 14.924 28.382 4.239 1.00 13.33 C ATOM 2361 CG MET A 178 14.191 27.729 3.079 1.00 60.21 C ATOM 2362 SD MET A 178 12.482 27.318 3.480 1.00 72.42 S ATOM 2363 CE MET A 178 12.236 25.864 2.463 1.00 31.31 C ATOM 0 H MET A 178 17.058 29.229 3.343 1.00 14.12 H new ATOM 0 HA MET A 178 14.470 30.268 3.312 1.00 35.42 H new ATOM 0 HB2 MET A 178 15.875 27.872 4.390 1.00 13.33 H new ATOM 0 HB3 MET A 178 14.341 28.245 5.150 1.00 13.33 H new ATOM 0 HG2 MET A 178 14.207 28.400 2.220 1.00 60.21 H new ATOM 0 HG3 MET A 178 14.719 26.822 2.785 1.00 60.21 H new ATOM 0 HE1 MET A 178 11.328 25.349 2.778 1.00 31.31 H new ATOM 0 HE2 MET A 178 12.140 26.162 1.419 1.00 31.31 H new ATOM 0 HE3 MET A 178 13.089 25.195 2.572 1.00 31.31 H new ATOM 2373 N ALA A 179 16.055 30.657 6.160 1.00 64.23 N ATOM 2374 CA ALA A 179 16.009 31.339 7.447 1.00 42.32 C ATOM 2375 C ALA A 179 15.841 32.844 7.265 1.00 74.13 C ATOM 2376 O ALA A 179 15.063 33.481 7.975 1.00 42.52 O ATOM 2377 CB ALA A 179 17.268 31.040 8.248 1.00 14.41 C ATOM 0 H ALA A 179 16.952 30.221 5.946 1.00 64.23 H new ATOM 0 HA ALA A 179 15.145 30.967 7.997 1.00 42.32 H new ATOM 0 HB1 ALA A 179 17.220 31.556 9.207 1.00 14.41 H new ATOM 0 HB2 ALA A 179 17.345 29.966 8.417 1.00 14.41 H new ATOM 0 HB3 ALA A 179 18.142 31.384 7.694 1.00 14.41 H new ATOM 2383 N SER A 180 16.574 33.406 6.309 1.00 25.43 N ATOM 2384 CA SER A 180 16.509 34.837 6.037 1.00 23.31 C ATOM 2385 C SER A 180 15.095 35.250 5.641 1.00 2.51 C ATOM 2386 O SER A 180 14.670 36.377 5.899 1.00 2.51 O ATOM 2387 CB SER A 180 17.492 35.211 4.926 1.00 4.34 C ATOM 2388 OG SER A 180 17.116 36.426 4.301 1.00 64.02 O ATOM 0 H SER A 180 17.220 32.892 5.710 1.00 25.43 H new ATOM 0 HA SER A 180 16.783 35.369 6.948 1.00 23.31 H new ATOM 0 HB2 SER A 180 18.495 35.307 5.341 1.00 4.34 H new ATOM 0 HB3 SER A 180 17.529 34.413 4.184 1.00 4.34 H new ATOM 0 HG SER A 180 17.761 36.644 3.596 1.00 64.02 H new ATOM 2394 N LEU A 181 14.371 34.331 5.013 1.00 52.11 N ATOM 2395 CA LEU A 181 13.004 34.599 4.580 1.00 35.42 C ATOM 2396 C LEU A 181 12.005 34.239 5.676 1.00 64.41 C ATOM 2397 O LEU A 181 10.909 34.795 5.738 1.00 71.43 O ATOM 2398 CB LEU A 181 12.687 33.811 3.307 1.00 2.35 C ATOM 2399 CG LEU A 181 13.704 33.935 2.172 1.00 75.33 C ATOM 2400 CD1 LEU A 181 13.467 32.858 1.124 1.00 31.23 C ATOM 2401 CD2 LEU A 181 13.634 35.318 1.542 1.00 42.30 C ATOM 0 H LEU A 181 14.707 33.394 4.792 1.00 52.11 H new ATOM 0 HA LEU A 181 12.918 35.665 4.371 1.00 35.42 H new ATOM 0 HB2 LEU A 181 12.592 32.757 3.570 1.00 2.35 H new ATOM 0 HB3 LEU A 181 11.715 34.136 2.935 1.00 2.35 H new ATOM 0 HG LEU A 181 14.702 33.797 2.587 1.00 75.33 H new ATOM 0 HD11 LEU A 181 14.200 32.961 0.324 1.00 31.23 H new ATOM 0 HD12 LEU A 181 13.568 31.875 1.583 1.00 31.23 H new ATOM 0 HD13 LEU A 181 12.463 32.965 0.713 1.00 31.23 H new ATOM 0 HD21 LEU A 181 14.365 35.388 0.736 1.00 42.30 H new ATOM 0 HD22 LEU A 181 12.634 35.485 1.141 1.00 42.30 H new ATOM 0 HD23 LEU A 181 13.853 36.073 2.297 1.00 42.30 H new ATOM 2413 N SER A 182 12.394 33.306 6.540 1.00 13.30 N ATOM 2414 CA SER A 182 11.532 32.871 7.633 1.00 24.31 C ATOM 2415 C SER A 182 11.367 33.979 8.669 1.00 75.24 C ATOM 2416 O SER A 182 10.258 34.253 9.128 1.00 12.21 O ATOM 2417 CB SER A 182 12.109 31.619 8.297 1.00 31.20 C ATOM 2418 OG SER A 182 13.165 31.951 9.181 1.00 23.12 O ATOM 0 H SER A 182 13.299 32.838 6.504 1.00 13.30 H new ATOM 0 HA SER A 182 10.552 32.636 7.219 1.00 24.31 H new ATOM 0 HB2 SER A 182 11.323 31.099 8.844 1.00 31.20 H new ATOM 0 HB3 SER A 182 12.473 30.933 7.532 1.00 31.20 H new ATOM 0 HG SER A 182 13.826 32.499 8.709 1.00 23.12 H new ATOM 2424 N ASP A 183 12.477 34.612 9.031 1.00 33.22 N ATOM 2425 CA ASP A 183 12.456 35.691 10.012 1.00 40.13 C ATOM 2426 C ASP A 183 13.297 36.872 9.537 1.00 12.34 C ATOM 2427 O ASP A 183 12.791 37.781 8.877 1.00 3.45 O ATOM 2428 CB ASP A 183 12.972 35.192 11.362 1.00 34.23 C ATOM 2429 CG ASP A 183 12.217 35.797 12.530 1.00 41.13 C ATOM 2430 OD1 ASP A 183 10.981 35.626 12.591 1.00 64.30 O ATOM 2431 OD2 ASP A 183 12.862 36.442 13.382 1.00 24.55 O ATOM 0 H ASP A 183 13.403 34.397 8.660 1.00 33.22 H new ATOM 0 HA ASP A 183 11.425 36.025 10.127 1.00 40.13 H new ATOM 0 HB2 ASP A 183 12.887 34.106 11.401 1.00 34.23 H new ATOM 0 HB3 ASP A 183 14.031 35.432 11.454 1.00 34.23 H new TER 2436 ASP A 183